----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 12:22:33]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [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 6.499414543043749 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): *1 Na 0.60322739915318 0.30020245671071 0.11548218761907 22.990 *2 Na 0.32483462857847 0.94480681953145 0.11445871846078 22.990 3 Na 0.39677260084682 0.80020245671071 0.38451781238093 22.990 *4 Na 0.93753998591808 0.70228742448309 0.92869214726900 22.990 5 Na 0.39677260084682 0.69979754328929 0.88451781238093 22.990 6 Na 0.67516537142153 0.44480681953145 0.38554128153922 22.990 7 Na 0.93753998591808 0.79771257551691 0.42869214726900 22.990 8 Na 0.06246001408191 0.20228742448309 0.57130785273100 22.990 9 Na 0.32483462857847 0.55519318046855 0.61445871846078 22.990 10 Na 0.06246001408191 0.29771257551691 0.07130785273100 22.990 11 Na 0.60322739915318 0.19979754328929 0.61548218761907 22.990 12 Na 0.67516537142153 0.05519318046855 0.88554128153922 22.990 *13 Y 0.09457725699999 0.37273018404615 0.82796633354245 88.906 14 Y 0.90542274300001 0.87273018404615 0.67203366645755 88.906 15 Y 0.09457725699999 0.12726981595385 0.32796633354245 88.906 16 Y 0.90542274300001 0.62726981595385 0.17203366645755 88.906 *17 B 0.16776986508132 0.44183189668267 0.37960184242388 10.811 18 B 0.16776986508132 0.05816810331733 0.87960184242388 10.811 19 B 0.83223013491868 0.55816810331733 0.62039815757612 10.811 *20 B 0.36290993700122 0.91165665505800 0.62364095181889 10.811 21 B 0.36290993700122 0.58834334494200 0.12364095181889 10.811 22 B 0.63709006299878 0.41165665505800 0.87635904818111 10.811 23 B 0.83223013491868 0.94183189668267 0.12039815757612 10.811 24 B 0.63709006299878 0.08834334494200 0.37635904818111 10.811 *25 O 0.25202132895160 0.50787239958790 0.00917056835096 15.999 26 O 0.74797867104840 0.00787239958790 0.49082943164904 15.999 *27 O 0.73281044255062 0.83471287156810 0.02289774855949 15.999 *28 O 0.76468939420514 0.31076876299228 0.84129193008949 15.999 *29 O 0.07403485238681 0.11686843095724 0.75534983678889 15.999 30 O 0.25202132895160 0.99212760041210 0.50917056835096 15.999 *31 O 0.85868597176696 0.10020214728063 0.10649982377904 15.999 32 O 0.26718955744938 0.33471287156809 0.47710225144051 15.999 *33 O 0.39859072942561 0.43338649565716 0.79846814369917 15.999 34 O 0.23531060579487 0.68923123700772 0.15870806991051 15.999 35 O 0.14131402823304 0.89979785271937 0.89350017622096 15.999 36 O 0.92596514761319 0.88313156904276 0.24465016321111 15.999 37 O 0.76468939420514 0.18923123700772 0.34129193008949 15.999 38 O 0.60140927057439 0.56661350434284 0.20153185630083 15.999 39 O 0.14131402823304 0.60020214728063 0.39350017622096 15.999 40 O 0.92596514761319 0.61686843095724 0.74465016321111 15.999 41 O 0.60140927057439 0.93338649565716 0.70153185630083 15.999 42 O 0.74797867104840 0.49212760041210 0.99082943164904 15.999 43 O 0.85868597176696 0.39979785271937 0.60649982377904 15.999 44 O 0.73281044255062 0.66528712843190 0.52289774855949 15.999 45 O 0.23531060579487 0.81076876299228 0.65870806991051 15.999 46 O 0.07403485238681 0.38313156904276 0.25534983678889 15.999 47 O 0.26718955744938 0.16528712843190 0.97710225144051 15.999 48 O 0.39859072942561 0.06661350434284 0.29846814369917 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.499414543043749 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): *1 Na 0.60322739915318 0.30020245671071 0.11548218761907 22.990 > 1 *2 Na 0.32483462857847 0.94480681953145 0.11445871846078 22.990 > 2 3 Na 0.39677260084682 0.80020245671071 0.38451781238093 22.990 > 3 *4 Na 0.93753998591808 0.70228742448309 0.92869214726900 22.990 > 4 5 Na 0.39677260084682 0.69979754328929 0.88451781238093 22.990 > 5 6 Na 0.67516537142153 0.44480681953145 0.38554128153922 22.990 > 6 7 Na 0.93753998591808 0.79771257551691 0.42869214726900 22.990 > 7 8 Na 0.06246001408191 0.20228742448309 0.57130785273100 22.990 > 8 9 Na 0.32483462857847 0.55519318046855 0.61445871846078 22.990 > 9 10 Na 0.06246001408191 0.29771257551691 0.07130785273100 22.990 > 10 11 Na 0.60322739915318 0.19979754328929 0.61548218761907 22.990 > 11 12 Na 0.67516537142153 0.05519318046855 0.88554128153922 22.990 > 12 *13 Y 0.09457725699999 0.37273018404615 0.82796633354245 88.906 > 13 14 Y 0.90542274300001 0.87273018404615 0.67203366645755 88.906 > 14 15 Y 0.09457725699999 0.12726981595385 0.32796633354245 88.906 > 15 16 Y 0.90542274300001 0.62726981595385 0.17203366645755 88.906 > 16 *17 B 0.16776986508132 0.44183189668267 0.37960184242388 10.811 > 17 18 B 0.16776986508132 0.05816810331733 0.87960184242388 10.811 > 18 19 B 0.83223013491868 0.55816810331733 0.62039815757612 10.811 > 19 *20 B 0.36290993700122 0.91165665505800 0.62364095181889 10.811 > 20 21 B 0.36290993700122 0.58834334494200 0.12364095181889 10.811 > 21 22 B 0.63709006299878 0.41165665505800 0.87635904818111 10.811 > 22 23 B 0.83223013491868 0.94183189668267 0.12039815757612 10.811 > 23 24 B 0.63709006299878 0.08834334494200 0.37635904818111 10.811 > 24 *25 O 0.25202132895160 0.50787239958790 0.00917056835096 15.999 > 25 26 O 0.74797867104840 0.00787239958790 0.49082943164904 15.999 > 26 *27 O 0.73281044255062 0.83471287156810 0.02289774855949 15.999 > 27 *28 O 0.76468939420514 0.31076876299228 0.84129193008949 15.999 > 28 *29 O 0.07403485238681 0.11686843095724 0.75534983678889 15.999 > 29 30 O 0.25202132895160 0.99212760041210 0.50917056835096 15.999 > 30 *31 O 0.85868597176696 0.10020214728063 0.10649982377904 15.999 > 31 32 O 0.26718955744938 0.33471287156809 0.47710225144051 15.999 > 32 *33 O 0.39859072942561 0.43338649565716 0.79846814369917 15.999 > 33 34 O 0.23531060579487 0.68923123700772 0.15870806991051 15.999 > 34 35 O 0.14131402823304 0.89979785271937 0.89350017622096 15.999 > 35 36 O 0.92596514761319 0.88313156904276 0.24465016321111 15.999 > 36 37 O 0.76468939420514 0.18923123700772 0.34129193008949 15.999 > 37 38 O 0.60140927057439 0.56661350434284 0.20153185630083 15.999 > 38 39 O 0.14131402823304 0.60020214728063 0.39350017622096 15.999 > 39 40 O 0.92596514761319 0.61686843095724 0.74465016321111 15.999 > 40 41 O 0.60140927057439 0.93338649565716 0.70153185630083 15.999 > 41 42 O 0.74797867104840 0.49212760041210 0.99082943164904 15.999 > 42 43 O 0.85868597176696 0.39979785271937 0.60649982377904 15.999 > 43 44 O 0.73281044255062 0.66528712843190 0.52289774855949 15.999 > 44 45 O 0.23531060579487 0.81076876299228 0.65870806991051 15.999 > 45 46 O 0.07403485238681 0.38313156904276 0.25534983678889 15.999 > 46 47 O 0.26718955744938 0.16528712843190 0.97710225144051 15.999 > 47 48 O 0.39859072942561 0.06661350434284 0.29846814369917 15.999 > 48 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.998829086087499 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): *1 Na 0.30161369957659 0.30020245671071 0.11548218761907 22.990 > 1 2 Na 0.80161369957659 0.30020245671071 0.11548218761907 22.990 > 1 *3 Na 0.16241731428924 0.94480681953145 0.11445871846078 22.990 > 2 4 Na 0.66241731428924 0.94480681953145 0.11445871846078 22.990 > 2 5 Na 0.19838630042341 0.80020245671071 0.38451781238093 22.990 > 3 6 Na 0.69838630042341 0.80020245671071 0.38451781238093 22.990 > 3 *7 Na 0.46876999295904 0.70228742448309 0.92869214726900 22.990 > 4 8 Na 0.96876999295904 0.70228742448309 0.92869214726900 22.990 > 4 9 Na 0.19838630042341 0.69979754328929 0.88451781238093 22.990 > 5 10 Na 0.69838630042341 0.69979754328929 0.88451781238093 22.990 > 5 11 Na 0.33758268571076 0.44480681953145 0.38554128153922 22.990 > 6 12 Na 0.83758268571076 0.44480681953145 0.38554128153922 22.990 > 6 13 Na 0.46876999295904 0.79771257551691 0.42869214726900 22.990 > 7 14 Na 0.96876999295904 0.79771257551691 0.42869214726900 22.990 > 7 15 Na 0.03123000704096 0.20228742448309 0.57130785273100 22.990 > 8 16 Na 0.53123000704096 0.20228742448309 0.57130785273100 22.990 > 8 17 Na 0.16241731428924 0.55519318046855 0.61445871846078 22.990 > 9 18 Na 0.66241731428924 0.55519318046855 0.61445871846078 22.990 > 9 19 Na 0.03123000704096 0.29771257551691 0.07130785273100 22.990 > 10 20 Na 0.53123000704096 0.29771257551691 0.07130785273100 22.990 > 10 21 Na 0.30161369957659 0.19979754328929 0.61548218761907 22.990 > 11 22 Na 0.80161369957659 0.19979754328929 0.61548218761907 22.990 > 11 23 Na 0.33758268571076 0.05519318046855 0.88554128153922 22.990 > 12 24 Na 0.83758268571076 0.05519318046855 0.88554128153922 22.990 > 12 *25 Y 0.04728862849999 0.37273018404615 0.82796633354245 88.906 > 13 26 Y 0.54728862849999 0.37273018404615 0.82796633354245 88.906 > 13 27 Y 0.45271137150001 0.87273018404615 0.67203366645755 88.906 > 14 28 Y 0.95271137150001 0.87273018404615 0.67203366645755 88.906 > 14 29 Y 0.04728862849999 0.12726981595385 0.32796633354245 88.906 > 15 30 Y 0.54728862849999 0.12726981595385 0.32796633354245 88.906 > 15 31 Y 0.45271137150001 0.62726981595385 0.17203366645755 88.906 > 16 32 Y 0.95271137150001 0.62726981595385 0.17203366645755 88.906 > 16 *33 B 0.08388493254066 0.44183189668267 0.37960184242388 10.811 > 17 34 B 0.58388493254066 0.44183189668267 0.37960184242388 10.811 > 17 35 B 0.08388493254066 0.05816810331733 0.87960184242388 10.811 > 18 36 B 0.58388493254066 0.05816810331733 0.87960184242388 10.811 > 18 37 B 0.41611506745934 0.55816810331733 0.62039815757612 10.811 > 19 38 B 0.91611506745934 0.55816810331733 0.62039815757612 10.811 > 19 *39 B 0.18145496850061 0.91165665505800 0.62364095181889 10.811 > 20 40 B 0.68145496850061 0.91165665505800 0.62364095181889 10.811 > 20 41 B 0.18145496850061 0.58834334494200 0.12364095181889 10.811 > 21 42 B 0.68145496850061 0.58834334494200 0.12364095181889 10.811 > 21 43 B 0.31854503149939 0.41165665505800 0.87635904818111 10.811 > 22 44 B 0.81854503149939 0.41165665505800 0.87635904818111 10.811 > 22 45 B 0.41611506745934 0.94183189668267 0.12039815757612 10.811 > 23 46 B 0.91611506745934 0.94183189668267 0.12039815757612 10.811 > 23 47 B 0.31854503149939 0.08834334494200 0.37635904818111 10.811 > 24 48 B 0.81854503149939 0.08834334494200 0.37635904818111 10.811 > 24 *49 O 0.12601066447580 0.50787239958790 0.00917056835096 15.999 > 25 50 O 0.62601066447580 0.50787239958790 0.00917056835096 15.999 > 25 51 O 0.37398933552420 0.00787239958790 0.49082943164904 15.999 > 26 52 O 0.87398933552420 0.00787239958790 0.49082943164904 15.999 > 26 *53 O 0.36640522127531 0.83471287156810 0.02289774855949 15.999 > 27 54 O 0.86640522127531 0.83471287156810 0.02289774855949 15.999 > 27 *55 O 0.38234469710257 0.31076876299228 0.84129193008949 15.999 > 28 56 O 0.88234469710257 0.31076876299228 0.84129193008949 15.999 > 28 *57 O 0.03701742619341 0.11686843095724 0.75534983678889 15.999 > 29 58 O 0.53701742619341 0.11686843095724 0.75534983678889 15.999 > 29 59 O 0.12601066447580 0.99212760041210 0.50917056835096 15.999 > 30 60 O 0.62601066447580 0.99212760041210 0.50917056835096 15.999 > 30 *61 O 0.42934298588348 0.10020214728063 0.10649982377904 15.999 > 31 62 O 0.92934298588348 0.10020214728063 0.10649982377904 15.999 > 31 63 O 0.13359477872469 0.33471287156809 0.47710225144051 15.999 > 32 64 O 0.63359477872469 0.33471287156809 0.47710225144051 15.999 > 32 *65 O 0.19929536471281 0.43338649565716 0.79846814369917 15.999 > 33 66 O 0.69929536471281 0.43338649565716 0.79846814369917 15.999 > 33 67 O 0.11765530289743 0.68923123700772 0.15870806991051 15.999 > 34 68 O 0.61765530289743 0.68923123700772 0.15870806991051 15.999 > 34 69 O 0.07065701411652 0.89979785271937 0.89350017622096 15.999 > 35 70 O 0.57065701411652 0.89979785271937 0.89350017622096 15.999 > 35 71 O 0.46298257380659 0.88313156904276 0.24465016321111 15.999 > 36 72 O 0.96298257380659 0.88313156904276 0.24465016321111 15.999 > 36 73 O 0.38234469710257 0.18923123700772 0.34129193008949 15.999 > 37 74 O 0.88234469710257 0.18923123700772 0.34129193008949 15.999 > 37 75 O 0.30070463528719 0.56661350434284 0.20153185630083 15.999 > 38 76 O 0.80070463528719 0.56661350434284 0.20153185630083 15.999 > 38 77 O 0.07065701411652 0.60020214728063 0.39350017622096 15.999 > 39 78 O 0.57065701411652 0.60020214728063 0.39350017622096 15.999 > 39 79 O 0.46298257380659 0.61686843095724 0.74465016321111 15.999 > 40 80 O 0.96298257380659 0.61686843095724 0.74465016321111 15.999 > 40 81 O 0.30070463528719 0.93338649565716 0.70153185630083 15.999 > 41 82 O 0.80070463528719 0.93338649565716 0.70153185630083 15.999 > 41 83 O 0.37398933552420 0.49212760041210 0.99082943164904 15.999 > 42 84 O 0.87398933552420 0.49212760041210 0.99082943164904 15.999 > 42 85 O 0.42934298588348 0.39979785271937 0.60649982377904 15.999 > 43 86 O 0.92934298588348 0.39979785271937 0.60649982377904 15.999 > 43 87 O 0.36640522127531 0.66528712843190 0.52289774855949 15.999 > 44 88 O 0.86640522127531 0.66528712843190 0.52289774855949 15.999 > 44 89 O 0.11765530289743 0.81076876299228 0.65870806991051 15.999 > 45 90 O 0.61765530289743 0.81076876299228 0.65870806991051 15.999 > 45 91 O 0.03701742619341 0.38313156904276 0.25534983678889 15.999 > 46 92 O 0.53701742619341 0.38313156904276 0.25534983678889 15.999 > 46 93 O 0.13359477872469 0.16528712843190 0.97710225144051 15.999 > 47 94 O 0.63359477872469 0.16528712843190 0.97710225144051 15.999 > 47 95 O 0.19929536471281 0.06661350434284 0.29846814369917 15.999 > 48 96 O 0.69929536471281 0.06661350434284 0.29846814369917 15.999 > 48 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7619921 0.0000000 0.0385749 0.0000000 2.8242100 0.0000000 0.0385722 0.0000000 2.8309280 -------------------------- Born effective charges -------------------------- 1 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 2 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 3 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 4 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 5 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 6 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 7 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 8 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 9 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 10 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 11 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 12 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 13 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 14 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 15 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 16 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 17 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 18 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 19 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 20 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 21 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 22 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 23 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 24 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 25 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 26 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 27 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 28 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 29 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 30 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 31 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 32 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 33 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 34 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 35 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 36 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 37 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 38 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 39 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 40 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 41 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 42 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 43 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 44 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 45 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 46 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 47 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 48 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 288/288 Permutation basis: 20880/20880 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5328 Number of blocks in projector: 5328 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: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 46 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 230 eigenvectors found. (2) Complementary block size: 42 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1152 / 1152 (1) 138 eigenvectors found. (1) Complementary block size: 60 (1) Compute compressed projector. (1) Use standard solver. (1) 36 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 46 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 230 eigenvectors found. (2) Complementary block size: 42 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1152 / 1152 (1) 138 eigenvectors found. (1) Complementary block size: 60 (1) Compute compressed projector. (1) Use standard solver. (1) 36 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (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: 1000 / 1152 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1152 / 1152 (1) 143 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. Tree of FC basis block matrices: - (5328, 5221), data: False |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (1152, 1129), data: False |-- (1152, 28), data: (1152, 51) @ (51, 28) |-- (152, 143), data: True |-- (500, 481), data: False |-- (500, 15), data: (500, 34) @ (34, 15) |-- (250, 235), data: True |-- (250, 231), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 229), data: True |-- (250, 227), data: True |-- (1152, 1128), data: False |-- (1152, 36), data: (1152, 60) @ (60, 36) |-- (152, 138), data: True |-- (500, 478), data: False |-- (500, 20), data: (500, 42) @ (42, 20) |-- (250, 230), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 22), data: (500, 46) @ (46, 22) |-- (250, 228), data: True |-- (250, 226), data: True |-- (1152, 1128), data: False |-- (1152, 36), data: (1152, 60) @ (60, 36) |-- (152, 138), data: True |-- (500, 478), data: False |-- (500, 20), data: (500, 42) @ (42, 20) |-- (250, 230), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 22), data: (500, 46) @ (46, 22) |-- (250, 228), data: True |-- (250, 226), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 1440 - Time: 1.281 Solver_block: 200 / 1440 - Time: 1.141 Solver_block: 300 / 1440 - Time: 1.064 Solver_block: 400 / 1440 - Time: 1.253 Solver_block: 500 / 1440 - Time: 1.123 Solver_block: 600 / 1440 - Time: 1.067 Solver_block: 700 / 1440 - Time: 1.062 Solver_block: 800 / 1440 - Time: 1.064 Solver_block: 900 / 1440 - Time: 1.562 Solver_block: 1000 / 1440 - Time: 1.113 Solver_block: 1100 / 1440 - Time: 1.105 Solver_block: 1200 / 1440 - Time: 1.494 Solver_block: 1300 / 1440 - Time: 1.615 Solver_block: 1400 / 1440 - Time: 1.196 Solver_block: 1440 / 1440 - Time: 0.599 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 18.454 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 288/288 Permutation basis: 20880/20880 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5328 Number of blocks in projector: 5328 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: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 46 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 230 eigenvectors found. (2) Complementary block size: 42 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1152 / 1152 (1) 138 eigenvectors found. (1) Complementary block size: 60 (1) Compute compressed projector. (1) Use standard solver. (1) 36 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (2) Block: 250 / 500 (2) 226 eigenvectors found. (2) Block: 500 / 500 (2) 228 eigenvectors found. (2) Complementary block size: 46 (2) Compute compressed projector. (2) Use standard solver. (2) 22 eigenvectors found. (1) 476 eigenvectors found. (1) Block: 1000 / 1152 (2) Block: 250 / 500 (2) 228 eigenvectors found. (2) Block: 500 / 500 (2) 230 eigenvectors found. (2) Complementary block size: 42 (2) Compute compressed projector. (2) Use standard solver. (2) 20 eigenvectors found. (1) 478 eigenvectors found. (1) Block: 1152 / 1152 (1) 138 eigenvectors found. (1) Complementary block size: 60 (1) Compute compressed projector. (1) Use standard solver. (1) 36 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1152 Use submatrix version of eigh solver. (1) Block: 500 / 1152 (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: 1000 / 1152 (2) Block: 250 / 500 (2) 231 eigenvectors found. (2) Block: 500 / 500 (2) 235 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 15 eigenvectors found. (1) 481 eigenvectors found. (1) Block: 1152 / 1152 (1) 143 eigenvectors found. (1) Complementary block size: 51 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 624 Use submatrix version of eigh solver. (1) Block: 500 / 624 (2) Block: 250 / 500 (2) 238 eigenvectors found. (2) Block: 500 / 500 (2) 240 eigenvectors found. (2) Complementary block size: 22 (2) Compute compressed projector. (2) Use standard solver. (2) 10 eigenvectors found. (1) 488 eigenvectors found. (1) Block: 624 / 624 (1) 112 eigenvectors found. (1) Complementary block size: 24 (1) Compute compressed projector. (1) Use standard solver. (1) 12 eigenvectors found. Tree of FC basis block matrices: - (5328, 5221), data: False |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (624, 612), data: False |-- (624, 12), data: (624, 24) @ (24, 12) |-- (124, 112), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (1152, 1129), data: False |-- (1152, 28), data: (1152, 51) @ (51, 28) |-- (152, 143), data: True |-- (500, 481), data: False |-- (500, 15), data: (500, 34) @ (34, 15) |-- (250, 235), data: True |-- (250, 231), data: True |-- (500, 477), data: False |-- (500, 21), data: (500, 44) @ (44, 21) |-- (250, 229), data: True |-- (250, 227), data: True |-- (1152, 1128), data: False |-- (1152, 36), data: (1152, 60) @ (60, 36) |-- (152, 138), data: True |-- (500, 478), data: False |-- (500, 20), data: (500, 42) @ (42, 20) |-- (250, 230), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 22), data: (500, 46) @ (46, 22) |-- (250, 228), data: True |-- (250, 226), data: True |-- (1152, 1128), data: False |-- (1152, 36), data: (1152, 60) @ (60, 36) |-- (152, 138), data: True |-- (500, 478), data: False |-- (500, 20), data: (500, 42) @ (42, 20) |-- (250, 230), data: True |-- (250, 228), data: True |-- (500, 476), data: False |-- (500, 22), data: (500, 46) @ (46, 22) |-- (250, 228), data: True |-- (250, 226), 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 12:23:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:23:54]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.499414543043749 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): 1 Na 0.60322739915318 0.30020245671071 0.11548218761907 22.990 2 Na 0.32483462857847 0.94480681953145 0.11445871846078 22.990 3 Na 0.39677260084682 0.80020245671071 0.38451781238093 22.990 4 Na 0.93753998591808 0.70228742448309 0.92869214726900 22.990 5 Na 0.39677260084682 0.69979754328929 0.88451781238093 22.990 6 Na 0.67516537142153 0.44480681953145 0.38554128153922 22.990 7 Na 0.93753998591808 0.79771257551691 0.42869214726900 22.990 8 Na 0.06246001408191 0.20228742448309 0.57130785273100 22.990 9 Na 0.32483462857847 0.55519318046855 0.61445871846078 22.990 10 Na 0.06246001408191 0.29771257551691 0.07130785273100 22.990 11 Na 0.60322739915318 0.19979754328929 0.61548218761907 22.990 12 Na 0.67516537142153 0.05519318046855 0.88554128153922 22.990 13 Y 0.09457725699999 0.37273018404615 0.82796633354245 88.906 14 Y 0.90542274300001 0.87273018404615 0.67203366645755 88.906 15 Y 0.09457725699999 0.12726981595385 0.32796633354245 88.906 16 Y 0.90542274300001 0.62726981595385 0.17203366645755 88.906 17 B 0.16776986508132 0.44183189668267 0.37960184242388 10.811 18 B 0.16776986508132 0.05816810331733 0.87960184242388 10.811 19 B 0.83223013491868 0.55816810331733 0.62039815757612 10.811 20 B 0.36290993700122 0.91165665505800 0.62364095181889 10.811 21 B 0.36290993700122 0.58834334494200 0.12364095181889 10.811 22 B 0.63709006299878 0.41165665505800 0.87635904818111 10.811 23 B 0.83223013491868 0.94183189668267 0.12039815757612 10.811 24 B 0.63709006299878 0.08834334494200 0.37635904818111 10.811 25 O 0.25202132895160 0.50787239958790 0.00917056835096 15.999 26 O 0.74797867104840 0.00787239958790 0.49082943164904 15.999 27 O 0.73281044255062 0.83471287156810 0.02289774855949 15.999 28 O 0.76468939420514 0.31076876299228 0.84129193008949 15.999 29 O 0.07403485238681 0.11686843095724 0.75534983678889 15.999 30 O 0.25202132895160 0.99212760041210 0.50917056835096 15.999 31 O 0.85868597176696 0.10020214728063 0.10649982377904 15.999 32 O 0.26718955744938 0.33471287156809 0.47710225144051 15.999 33 O 0.39859072942561 0.43338649565716 0.79846814369917 15.999 34 O 0.23531060579487 0.68923123700772 0.15870806991051 15.999 35 O 0.14131402823304 0.89979785271937 0.89350017622096 15.999 36 O 0.92596514761319 0.88313156904276 0.24465016321111 15.999 37 O 0.76468939420514 0.18923123700772 0.34129193008949 15.999 38 O 0.60140927057439 0.56661350434284 0.20153185630083 15.999 39 O 0.14131402823304 0.60020214728063 0.39350017622096 15.999 40 O 0.92596514761319 0.61686843095724 0.74465016321111 15.999 41 O 0.60140927057439 0.93338649565716 0.70153185630083 15.999 42 O 0.74797867104840 0.49212760041210 0.99082943164904 15.999 43 O 0.85868597176696 0.39979785271937 0.60649982377904 15.999 44 O 0.73281044255062 0.66528712843190 0.52289774855949 15.999 45 O 0.23531060579487 0.81076876299228 0.65870806991051 15.999 46 O 0.07403485238681 0.38313156904276 0.25534983678889 15.999 47 O 0.26718955744938 0.16528712843190 0.97710225144051 15.999 48 O 0.39859072942561 0.06661350434284 0.29846814369917 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.998829086087499 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): 1 Na 0.30161369957659 0.30020245671071 0.11548218761907 22.990 > 1 2 Na 0.80161369957659 0.30020245671071 0.11548218761907 22.990 > 1 3 Na 0.16241731428924 0.94480681953145 0.11445871846078 22.990 > 3 4 Na 0.66241731428924 0.94480681953145 0.11445871846078 22.990 > 3 5 Na 0.19838630042341 0.80020245671071 0.38451781238093 22.990 > 5 6 Na 0.69838630042341 0.80020245671071 0.38451781238093 22.990 > 5 7 Na 0.46876999295904 0.70228742448309 0.92869214726900 22.990 > 7 8 Na 0.96876999295904 0.70228742448309 0.92869214726900 22.990 > 7 9 Na 0.19838630042341 0.69979754328929 0.88451781238093 22.990 > 9 10 Na 0.69838630042341 0.69979754328929 0.88451781238093 22.990 > 9 11 Na 0.33758268571076 0.44480681953145 0.38554128153922 22.990 > 11 12 Na 0.83758268571076 0.44480681953145 0.38554128153922 22.990 > 11 13 Na 0.46876999295904 0.79771257551691 0.42869214726900 22.990 > 13 14 Na 0.96876999295904 0.79771257551691 0.42869214726900 22.990 > 13 15 Na 0.03123000704096 0.20228742448309 0.57130785273100 22.990 > 15 16 Na 0.53123000704096 0.20228742448309 0.57130785273100 22.990 > 15 17 Na 0.16241731428924 0.55519318046855 0.61445871846078 22.990 > 17 18 Na 0.66241731428924 0.55519318046855 0.61445871846078 22.990 > 17 19 Na 0.03123000704096 0.29771257551691 0.07130785273100 22.990 > 19 20 Na 0.53123000704096 0.29771257551691 0.07130785273100 22.990 > 19 21 Na 0.30161369957659 0.19979754328929 0.61548218761907 22.990 > 21 22 Na 0.80161369957659 0.19979754328929 0.61548218761907 22.990 > 21 23 Na 0.33758268571076 0.05519318046855 0.88554128153922 22.990 > 23 24 Na 0.83758268571076 0.05519318046855 0.88554128153922 22.990 > 23 25 Y 0.04728862849999 0.37273018404615 0.82796633354245 88.906 > 25 26 Y 0.54728862849999 0.37273018404615 0.82796633354245 88.906 > 25 27 Y 0.45271137150001 0.87273018404615 0.67203366645755 88.906 > 27 28 Y 0.95271137150001 0.87273018404615 0.67203366645755 88.906 > 27 29 Y 0.04728862849999 0.12726981595385 0.32796633354245 88.906 > 29 30 Y 0.54728862849999 0.12726981595385 0.32796633354245 88.906 > 29 31 Y 0.45271137150001 0.62726981595385 0.17203366645755 88.906 > 31 32 Y 0.95271137150001 0.62726981595385 0.17203366645755 88.906 > 31 33 B 0.08388493254066 0.44183189668267 0.37960184242388 10.811 > 33 34 B 0.58388493254066 0.44183189668267 0.37960184242388 10.811 > 33 35 B 0.08388493254066 0.05816810331733 0.87960184242388 10.811 > 35 36 B 0.58388493254066 0.05816810331733 0.87960184242388 10.811 > 35 37 B 0.41611506745934 0.55816810331733 0.62039815757612 10.811 > 37 38 B 0.91611506745934 0.55816810331733 0.62039815757612 10.811 > 37 39 B 0.18145496850061 0.91165665505800 0.62364095181889 10.811 > 39 40 B 0.68145496850061 0.91165665505800 0.62364095181889 10.811 > 39 41 B 0.18145496850061 0.58834334494200 0.12364095181889 10.811 > 41 42 B 0.68145496850061 0.58834334494200 0.12364095181889 10.811 > 41 43 B 0.31854503149939 0.41165665505800 0.87635904818111 10.811 > 43 44 B 0.81854503149939 0.41165665505800 0.87635904818111 10.811 > 43 45 B 0.41611506745934 0.94183189668267 0.12039815757612 10.811 > 45 46 B 0.91611506745934 0.94183189668267 0.12039815757612 10.811 > 45 47 B 0.31854503149939 0.08834334494200 0.37635904818111 10.811 > 47 48 B 0.81854503149939 0.08834334494200 0.37635904818111 10.811 > 47 49 O 0.12601066447580 0.50787239958790 0.00917056835096 15.999 > 49 50 O 0.62601066447580 0.50787239958790 0.00917056835096 15.999 > 49 51 O 0.37398933552420 0.00787239958790 0.49082943164904 15.999 > 51 52 O 0.87398933552420 0.00787239958790 0.49082943164904 15.999 > 51 53 O 0.36640522127531 0.83471287156810 0.02289774855949 15.999 > 53 54 O 0.86640522127531 0.83471287156810 0.02289774855949 15.999 > 53 55 O 0.38234469710257 0.31076876299228 0.84129193008949 15.999 > 55 56 O 0.88234469710257 0.31076876299228 0.84129193008949 15.999 > 55 57 O 0.03701742619341 0.11686843095724 0.75534983678889 15.999 > 57 58 O 0.53701742619341 0.11686843095724 0.75534983678889 15.999 > 57 59 O 0.12601066447580 0.99212760041210 0.50917056835096 15.999 > 59 60 O 0.62601066447580 0.99212760041210 0.50917056835096 15.999 > 59 61 O 0.42934298588348 0.10020214728063 0.10649982377904 15.999 > 61 62 O 0.92934298588348 0.10020214728063 0.10649982377904 15.999 > 61 63 O 0.13359477872469 0.33471287156809 0.47710225144051 15.999 > 63 64 O 0.63359477872469 0.33471287156809 0.47710225144051 15.999 > 63 65 O 0.19929536471281 0.43338649565716 0.79846814369917 15.999 > 65 66 O 0.69929536471281 0.43338649565716 0.79846814369917 15.999 > 65 67 O 0.11765530289743 0.68923123700772 0.15870806991051 15.999 > 67 68 O 0.61765530289743 0.68923123700772 0.15870806991051 15.999 > 67 69 O 0.07065701411652 0.89979785271937 0.89350017622096 15.999 > 69 70 O 0.57065701411652 0.89979785271937 0.89350017622096 15.999 > 69 71 O 0.46298257380659 0.88313156904276 0.24465016321111 15.999 > 71 72 O 0.96298257380659 0.88313156904276 0.24465016321111 15.999 > 71 73 O 0.38234469710257 0.18923123700772 0.34129193008949 15.999 > 73 74 O 0.88234469710257 0.18923123700772 0.34129193008949 15.999 > 73 75 O 0.30070463528719 0.56661350434284 0.20153185630083 15.999 > 75 76 O 0.80070463528719 0.56661350434284 0.20153185630083 15.999 > 75 77 O 0.07065701411652 0.60020214728063 0.39350017622096 15.999 > 77 78 O 0.57065701411652 0.60020214728063 0.39350017622096 15.999 > 77 79 O 0.46298257380659 0.61686843095724 0.74465016321111 15.999 > 79 80 O 0.96298257380659 0.61686843095724 0.74465016321111 15.999 > 79 81 O 0.30070463528719 0.93338649565716 0.70153185630083 15.999 > 81 82 O 0.80070463528719 0.93338649565716 0.70153185630083 15.999 > 81 83 O 0.37398933552420 0.49212760041210 0.99082943164904 15.999 > 83 84 O 0.87398933552420 0.49212760041210 0.99082943164904 15.999 > 83 85 O 0.42934298588348 0.39979785271937 0.60649982377904 15.999 > 85 86 O 0.92934298588348 0.39979785271937 0.60649982377904 15.999 > 85 87 O 0.36640522127531 0.66528712843190 0.52289774855949 15.999 > 87 88 O 0.86640522127531 0.66528712843190 0.52289774855949 15.999 > 87 89 O 0.11765530289743 0.81076876299228 0.65870806991051 15.999 > 89 90 O 0.61765530289743 0.81076876299228 0.65870806991051 15.999 > 89 91 O 0.03701742619341 0.38313156904276 0.25534983678889 15.999 > 91 92 O 0.53701742619341 0.38313156904276 0.25534983678889 15.999 > 91 93 O 0.13359477872469 0.16528712843190 0.97710225144051 15.999 > 93 94 O 0.63359477872469 0.16528712843190 0.97710225144051 15.999 > 93 95 O 0.19929536471281 0.06661350434284 0.29846814369917 15.999 > 95 96 O 0.69929536471281 0.06661350434284 0.29846814369917 15.999 > 95 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.7619921 0.0000000 0.0385749 0.0000000 2.8242100 0.0000000 0.0385722 0.0000000 2.8309280 -------------------------- Born effective charges -------------------------- 1 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 2 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 3 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 4 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 5 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 6 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 7 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 8 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 9 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 10 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 11 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 12 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 13 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 14 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 15 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 16 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 17 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 18 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 19 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 20 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 21 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 22 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 23 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 24 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 25 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 26 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 27 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 28 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 29 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 30 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 31 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 32 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 33 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 34 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 35 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 36 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 37 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 38 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 39 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 40 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 41 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 42 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 43 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 44 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 45 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 46 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 47 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 48 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 ---------------------------------------------------------------------------- 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Computing fc3[ 3, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Computing fc3[ 7, 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Computing fc3[ 39, 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Computing fc3[ 57, 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] 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] [-0.0048 0.0000 0.0088] [ 0.0048 0.0000 -0.0088] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 12:24:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 12:24:38]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [ 1. 0. -0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.499414543043749 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): 1 Na 0.60322739915318 0.30020245671071 0.11548218761907 22.990 2 Na 0.32483462857847 0.94480681953145 0.11445871846078 22.990 3 Na 0.39677260084682 0.80020245671071 0.38451781238093 22.990 4 Na 0.93753998591808 0.70228742448309 0.92869214726900 22.990 5 Na 0.39677260084682 0.69979754328929 0.88451781238093 22.990 6 Na 0.67516537142153 0.44480681953145 0.38554128153922 22.990 7 Na 0.93753998591808 0.79771257551691 0.42869214726900 22.990 8 Na 0.06246001408191 0.20228742448309 0.57130785273100 22.990 9 Na 0.32483462857847 0.55519318046855 0.61445871846078 22.990 10 Na 0.06246001408191 0.29771257551691 0.07130785273100 22.990 11 Na 0.60322739915318 0.19979754328929 0.61548218761907 22.990 12 Na 0.67516537142153 0.05519318046855 0.88554128153922 22.990 13 Y 0.09457725699999 0.37273018404615 0.82796633354245 88.906 14 Y 0.90542274300001 0.87273018404615 0.67203366645755 88.906 15 Y 0.09457725699999 0.12726981595385 0.32796633354245 88.906 16 Y 0.90542274300001 0.62726981595385 0.17203366645755 88.906 17 B 0.16776986508132 0.44183189668267 0.37960184242388 10.811 18 B 0.16776986508132 0.05816810331733 0.87960184242388 10.811 19 B 0.83223013491868 0.55816810331733 0.62039815757612 10.811 20 B 0.36290993700122 0.91165665505800 0.62364095181889 10.811 21 B 0.36290993700122 0.58834334494200 0.12364095181889 10.811 22 B 0.63709006299878 0.41165665505800 0.87635904818111 10.811 23 B 0.83223013491868 0.94183189668267 0.12039815757612 10.811 24 B 0.63709006299878 0.08834334494200 0.37635904818111 10.811 25 O 0.25202132895160 0.50787239958790 0.00917056835096 15.999 26 O 0.74797867104840 0.00787239958790 0.49082943164904 15.999 27 O 0.73281044255062 0.83471287156810 0.02289774855949 15.999 28 O 0.76468939420514 0.31076876299228 0.84129193008949 15.999 29 O 0.07403485238681 0.11686843095724 0.75534983678889 15.999 30 O 0.25202132895160 0.99212760041210 0.50917056835096 15.999 31 O 0.85868597176696 0.10020214728063 0.10649982377904 15.999 32 O 0.26718955744938 0.33471287156809 0.47710225144051 15.999 33 O 0.39859072942561 0.43338649565716 0.79846814369917 15.999 34 O 0.23531060579487 0.68923123700772 0.15870806991051 15.999 35 O 0.14131402823304 0.89979785271937 0.89350017622096 15.999 36 O 0.92596514761319 0.88313156904276 0.24465016321111 15.999 37 O 0.76468939420514 0.18923123700772 0.34129193008949 15.999 38 O 0.60140927057439 0.56661350434284 0.20153185630083 15.999 39 O 0.14131402823304 0.60020214728063 0.39350017622096 15.999 40 O 0.92596514761319 0.61686843095724 0.74465016321111 15.999 41 O 0.60140927057439 0.93338649565716 0.70153185630083 15.999 42 O 0.74797867104840 0.49212760041210 0.99082943164904 15.999 43 O 0.85868597176696 0.39979785271937 0.60649982377904 15.999 44 O 0.73281044255062 0.66528712843190 0.52289774855949 15.999 45 O 0.23531060579487 0.81076876299228 0.65870806991051 15.999 46 O 0.07403485238681 0.38313156904276 0.25534983678889 15.999 47 O 0.26718955744938 0.16528712843190 0.97710225144051 15.999 48 O 0.39859072942561 0.06661350434284 0.29846814369917 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.998829086087499 0.000000000000000 0.000000000000000 b 0.000000000000000 8.478842739999999 0.000000000000000 c -5.742533295737719 0.000000000000000 10.559856111128326 Atomic positions (fractional): 1 Na 0.30161369957659 0.30020245671071 0.11548218761907 22.990 > 1 2 Na 0.80161369957659 0.30020245671071 0.11548218761907 22.990 > 1 3 Na 0.16241731428924 0.94480681953145 0.11445871846078 22.990 > 3 4 Na 0.66241731428924 0.94480681953145 0.11445871846078 22.990 > 3 5 Na 0.19838630042341 0.80020245671071 0.38451781238093 22.990 > 5 6 Na 0.69838630042341 0.80020245671071 0.38451781238093 22.990 > 5 7 Na 0.46876999295904 0.70228742448309 0.92869214726900 22.990 > 7 8 Na 0.96876999295904 0.70228742448309 0.92869214726900 22.990 > 7 9 Na 0.19838630042341 0.69979754328929 0.88451781238093 22.990 > 9 10 Na 0.69838630042341 0.69979754328929 0.88451781238093 22.990 > 9 11 Na 0.33758268571076 0.44480681953145 0.38554128153922 22.990 > 11 12 Na 0.83758268571076 0.44480681953145 0.38554128153922 22.990 > 11 13 Na 0.46876999295904 0.79771257551691 0.42869214726900 22.990 > 13 14 Na 0.96876999295904 0.79771257551691 0.42869214726900 22.990 > 13 15 Na 0.03123000704096 0.20228742448309 0.57130785273100 22.990 > 15 16 Na 0.53123000704096 0.20228742448309 0.57130785273100 22.990 > 15 17 Na 0.16241731428924 0.55519318046855 0.61445871846078 22.990 > 17 18 Na 0.66241731428924 0.55519318046855 0.61445871846078 22.990 > 17 19 Na 0.03123000704096 0.29771257551691 0.07130785273100 22.990 > 19 20 Na 0.53123000704096 0.29771257551691 0.07130785273100 22.990 > 19 21 Na 0.30161369957659 0.19979754328929 0.61548218761907 22.990 > 21 22 Na 0.80161369957659 0.19979754328929 0.61548218761907 22.990 > 21 23 Na 0.33758268571076 0.05519318046855 0.88554128153922 22.990 > 23 24 Na 0.83758268571076 0.05519318046855 0.88554128153922 22.990 > 23 25 Y 0.04728862849999 0.37273018404615 0.82796633354245 88.906 > 25 26 Y 0.54728862849999 0.37273018404615 0.82796633354245 88.906 > 25 27 Y 0.45271137150001 0.87273018404615 0.67203366645755 88.906 > 27 28 Y 0.95271137150001 0.87273018404615 0.67203366645755 88.906 > 27 29 Y 0.04728862849999 0.12726981595385 0.32796633354245 88.906 > 29 30 Y 0.54728862849999 0.12726981595385 0.32796633354245 88.906 > 29 31 Y 0.45271137150001 0.62726981595385 0.17203366645755 88.906 > 31 32 Y 0.95271137150001 0.62726981595385 0.17203366645755 88.906 > 31 33 B 0.08388493254066 0.44183189668267 0.37960184242388 10.811 > 33 34 B 0.58388493254066 0.44183189668267 0.37960184242388 10.811 > 33 35 B 0.08388493254066 0.05816810331733 0.87960184242388 10.811 > 35 36 B 0.58388493254066 0.05816810331733 0.87960184242388 10.811 > 35 37 B 0.41611506745934 0.55816810331733 0.62039815757612 10.811 > 37 38 B 0.91611506745934 0.55816810331733 0.62039815757612 10.811 > 37 39 B 0.18145496850061 0.91165665505800 0.62364095181889 10.811 > 39 40 B 0.68145496850061 0.91165665505800 0.62364095181889 10.811 > 39 41 B 0.18145496850061 0.58834334494200 0.12364095181889 10.811 > 41 42 B 0.68145496850061 0.58834334494200 0.12364095181889 10.811 > 41 43 B 0.31854503149939 0.41165665505800 0.87635904818111 10.811 > 43 44 B 0.81854503149939 0.41165665505800 0.87635904818111 10.811 > 43 45 B 0.41611506745934 0.94183189668267 0.12039815757612 10.811 > 45 46 B 0.91611506745934 0.94183189668267 0.12039815757612 10.811 > 45 47 B 0.31854503149939 0.08834334494200 0.37635904818111 10.811 > 47 48 B 0.81854503149939 0.08834334494200 0.37635904818111 10.811 > 47 49 O 0.12601066447580 0.50787239958790 0.00917056835096 15.999 > 49 50 O 0.62601066447580 0.50787239958790 0.00917056835096 15.999 > 49 51 O 0.37398933552420 0.00787239958790 0.49082943164904 15.999 > 51 52 O 0.87398933552420 0.00787239958790 0.49082943164904 15.999 > 51 53 O 0.36640522127531 0.83471287156810 0.02289774855949 15.999 > 53 54 O 0.86640522127531 0.83471287156810 0.02289774855949 15.999 > 53 55 O 0.38234469710257 0.31076876299228 0.84129193008949 15.999 > 55 56 O 0.88234469710257 0.31076876299228 0.84129193008949 15.999 > 55 57 O 0.03701742619341 0.11686843095724 0.75534983678889 15.999 > 57 58 O 0.53701742619341 0.11686843095724 0.75534983678889 15.999 > 57 59 O 0.12601066447580 0.99212760041210 0.50917056835096 15.999 > 59 60 O 0.62601066447580 0.99212760041210 0.50917056835096 15.999 > 59 61 O 0.42934298588348 0.10020214728063 0.10649982377904 15.999 > 61 62 O 0.92934298588348 0.10020214728063 0.10649982377904 15.999 > 61 63 O 0.13359477872469 0.33471287156809 0.47710225144051 15.999 > 63 64 O 0.63359477872469 0.33471287156809 0.47710225144051 15.999 > 63 65 O 0.19929536471281 0.43338649565716 0.79846814369917 15.999 > 65 66 O 0.69929536471281 0.43338649565716 0.79846814369917 15.999 > 65 67 O 0.11765530289743 0.68923123700772 0.15870806991051 15.999 > 67 68 O 0.61765530289743 0.68923123700772 0.15870806991051 15.999 > 67 69 O 0.07065701411652 0.89979785271937 0.89350017622096 15.999 > 69 70 O 0.57065701411652 0.89979785271937 0.89350017622096 15.999 > 69 71 O 0.46298257380659 0.88313156904276 0.24465016321111 15.999 > 71 72 O 0.96298257380659 0.88313156904276 0.24465016321111 15.999 > 71 73 O 0.38234469710257 0.18923123700772 0.34129193008949 15.999 > 73 74 O 0.88234469710257 0.18923123700772 0.34129193008949 15.999 > 73 75 O 0.30070463528719 0.56661350434284 0.20153185630083 15.999 > 75 76 O 0.80070463528719 0.56661350434284 0.20153185630083 15.999 > 75 77 O 0.07065701411652 0.60020214728063 0.39350017622096 15.999 > 77 78 O 0.57065701411652 0.60020214728063 0.39350017622096 15.999 > 77 79 O 0.46298257380659 0.61686843095724 0.74465016321111 15.999 > 79 80 O 0.96298257380659 0.61686843095724 0.74465016321111 15.999 > 79 81 O 0.30070463528719 0.93338649565716 0.70153185630083 15.999 > 81 82 O 0.80070463528719 0.93338649565716 0.70153185630083 15.999 > 81 83 O 0.37398933552420 0.49212760041210 0.99082943164904 15.999 > 83 84 O 0.87398933552420 0.49212760041210 0.99082943164904 15.999 > 83 85 O 0.42934298588348 0.39979785271937 0.60649982377904 15.999 > 85 86 O 0.92934298588348 0.39979785271937 0.60649982377904 15.999 > 85 87 O 0.36640522127531 0.66528712843190 0.52289774855949 15.999 > 87 88 O 0.86640522127531 0.66528712843190 0.52289774855949 15.999 > 87 89 O 0.11765530289743 0.81076876299228 0.65870806991051 15.999 > 89 90 O 0.61765530289743 0.81076876299228 0.65870806991051 15.999 > 89 91 O 0.03701742619341 0.38313156904276 0.25534983678889 15.999 > 91 92 O 0.53701742619341 0.38313156904276 0.25534983678889 15.999 > 91 93 O 0.13359477872469 0.16528712843190 0.97710225144051 15.999 > 93 94 O 0.63359477872469 0.16528712843190 0.97710225144051 15.999 > 93 95 O 0.19929536471281 0.06661350434284 0.29846814369917 15.999 > 95 96 O 0.69929536471281 0.06661350434284 0.29846814369917 15.999 > 95 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.7619921 0.0000000 0.0385749 0.0000000 2.8242100 0.0000000 0.0385722 0.0000000 2.8309280 -------------------------- Born effective charges -------------------------- 1 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 2 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 3 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 4 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 5 Na 1.0422773 0.0001646 0.0646021 -0.0351191 1.1355073 -0.0873773 0.1379392 -0.0801760 1.1053191 6 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 7 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 8 Na 1.0099814 -0.0055013 -0.0728811 -0.0216975 1.0810595 0.0928188 -0.1456863 0.0554929 1.0857449 9 Na 1.0876842 -0.0025641 -0.0276161 -0.0297240 1.0692689 0.0557980 -0.0421406 -0.0171172 1.1427629 10 Na 1.0099814 0.0055013 -0.0728811 0.0216975 1.0810595 -0.0928188 -0.1456863 -0.0554929 1.0857449 11 Na 1.0422773 -0.0001646 0.0646021 0.0351191 1.1355073 0.0873773 0.1379392 0.0801760 1.1053191 12 Na 1.0876842 0.0025641 -0.0276161 0.0297240 1.0692689 -0.0557980 -0.0421406 0.0171172 1.1427629 13 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 14 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 15 Y 3.6444345 -0.2848158 -0.0355981 0.1025649 3.7376628 0.1960477 0.0496684 -0.0010718 3.4139253 16 Y 3.6444345 0.2848158 -0.0355981 -0.1025649 3.7376628 -0.1960477 0.0496684 0.0010718 3.4139253 17 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 18 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 19 B 0.3882178 -0.2757743 0.0032560 -0.3234686 2.5305881 -0.2094567 0.0092299 -0.3102894 2.0769718 20 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 21 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 22 B 2.7212135 -1.0614903 0.6001238 -0.6593179 1.2411069 0.8320679 0.4221310 0.8846443 2.3040194 23 B 0.3882178 0.2757743 0.0032560 0.3234686 2.5305881 0.2094567 0.0092299 0.3102894 2.0769718 24 B 2.7212135 1.0614903 0.6001238 0.6593179 1.2411069 -0.8320679 0.4221310 -0.8846443 2.3040194 25 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 26 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 27 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 28 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 29 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 30 O -1.3112117 -0.0663458 -0.1308326 -0.0619720 -1.5122647 0.8695321 -0.0729451 0.9438760 -2.6005456 31 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 32 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 33 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 34 O -2.7160570 0.4767702 0.2181130 0.4024590 -1.5217953 -0.2008363 0.3314080 -0.3012071 -1.3334584 35 O -0.9967284 -0.1535823 -0.0260405 -0.2596462 -2.2348174 0.0149414 -0.0534004 -0.0741090 -1.6893119 36 O -0.9380037 -0.1121893 0.0368775 -0.1137351 -2.3406557 -0.1441133 0.0067833 -0.2605025 -1.9960783 37 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 38 O -2.9127451 0.0118511 -0.4934741 -0.0219814 -1.1222695 -0.0211014 -0.5471291 0.0094270 -1.6043070 39 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 40 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 41 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 42 O -1.3112117 0.0663458 -0.1308326 0.0619720 -1.5122647 -0.8695321 -0.0729451 -0.9438760 -2.6005456 43 O -0.9967284 0.1535823 -0.0260405 0.2596462 -2.2348174 -0.0149414 -0.0534004 0.0741090 -1.6893119 44 O -1.0190629 0.0066816 -0.1365298 -0.0072713 -2.0633909 0.1982597 -0.0958582 0.3628345 -1.9050422 45 O -2.7160570 -0.4767702 0.2181130 -0.4024590 -1.5217953 0.2008363 0.3314080 0.3012071 -1.3334584 46 O -0.9380037 0.1121893 0.0368775 0.1137351 -2.3406557 0.1441133 0.0067833 0.2605025 -1.9960783 47 O -1.0190629 -0.0066816 -0.1365298 0.0072713 -2.0633909 -0.1982597 -0.0958582 -0.3628345 -1.9050422 48 O -2.9127451 -0.0118511 -0.4934741 0.0219814 -1.1222695 0.0211014 -0.5471291 -0.0094270 -1.6043070 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx) Max drift of fc2: -0.00000000 (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 6 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: 0.50, Number of G-points: 303, Lambda: 0.09 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 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 1.870 ( 0.000 0.000 0.000) 0.000 1.959 ( 0.000 0.000 0.000) 0.000 2.010 ( 0.000 0.000 0.000) 0.000 2.073 ( 0.000 0.000 0.000) 0.000 2.202 ( 0.000 0.000 0.000) 0.000 2.330 ( 0.000 0.000 0.000) 0.000 2.342 ( 0.000 0.000 0.000) 0.000 2.606 ( 0.000 0.000 0.000) 0.000 2.884 ( 0.000 0.000 0.000) 0.000 2.919 ( 0.000 0.000 0.000) 0.000 3.089 ( 0.000 0.000 0.000) 0.000 3.089 ( 0.000 0.000 0.000) 0.000 3.337 ( 0.000 0.000 0.000) 0.000 3.586 ( 0.000 0.000 0.000) 0.000 3.747 ( 0.000 0.000 0.000) 0.000 3.796 ( 0.000 0.000 0.000) 0.000 3.965 ( 0.000 0.000 0.000) 0.000 4.080 ( 0.000 0.000 0.000) 0.000 4.171 ( 0.000 0.000 0.000) 0.000 4.207 ( 0.000 0.000 0.000) 0.000 4.526 ( 0.000 0.000 0.000) 0.000 4.595 ( 0.000 0.000 0.000) 0.000 4.610 ( 0.000 0.000 0.000) 0.000 4.754 ( 0.000 0.000 0.000) 0.000 4.794 ( 0.000 0.000 0.000) 0.000 4.830 ( 0.000 0.000 0.000) 0.000 4.846 ( 0.000 0.000 0.000) 0.000 4.875 ( 0.000 0.000 0.000) 0.000 4.978 ( 0.000 0.000 0.000) 0.000 5.105 ( 0.000 0.000 0.000) 0.000 5.108 ( 0.000 0.000 0.000) 0.000 5.160 ( 0.000 0.000 0.000) 0.000 5.372 ( 0.000 0.000 0.000) 0.000 5.409 ( 0.000 0.000 0.000) 0.000 5.452 ( 0.000 0.000 0.000) 0.000 5.466 ( 0.000 0.000 0.000) 0.000 5.634 ( 0.000 0.000 0.000) 0.000 5.724 ( 0.000 0.000 0.000) 0.000 5.732 ( 0.000 0.000 0.000) 0.000 5.753 ( 0.000 0.000 0.000) 0.000 5.873 ( 0.000 0.000 0.000) 0.000 6.046 ( 0.000 0.000 0.000) 0.000 6.052 ( 0.000 0.000 0.000) 0.000 6.055 ( 0.000 0.000 0.000) 0.000 6.114 ( 0.000 0.000 0.000) 0.000 6.123 ( 0.000 0.000 0.000) 0.000 6.309 ( 0.000 0.000 0.000) 0.000 6.319 ( 0.000 0.000 0.000) 0.000 6.396 ( 0.000 0.000 0.000) 0.000 6.428 ( 0.000 0.000 0.000) 0.000 6.538 ( 0.000 0.000 0.000) 0.000 6.679 ( 0.000 0.000 0.000) 0.000 6.679 ( 0.000 0.000 0.000) 0.000 6.685 ( 0.000 0.000 0.000) 0.000 6.719 ( 0.000 0.000 0.000) 0.000 6.930 ( 0.000 0.000 0.000) 0.000 6.937 ( 0.000 0.000 0.000) 0.000 6.952 ( 0.000 0.000 0.000) 0.000 7.032 ( 0.000 0.000 0.000) 0.000 7.150 ( 0.000 0.000 0.000) 0.000 7.193 ( 0.000 0.000 0.000) 0.000 7.269 ( 0.000 0.000 0.000) 0.000 7.276 ( 0.000 0.000 0.000) 0.000 7.348 ( 0.000 0.000 0.000) 0.000 7.478 ( 0.000 0.000 0.000) 0.000 7.665 ( 0.000 0.000 0.000) 0.000 7.727 ( 0.000 0.000 0.000) 0.000 7.916 ( 0.000 0.000 0.000) 0.000 7.921 ( 0.000 0.000 0.000) 0.000 8.156 ( 0.000 0.000 0.000) 0.000 8.164 ( 0.000 0.000 0.000) 0.000 8.353 ( 0.000 0.000 0.000) 0.000 8.452 ( 0.000 0.000 0.000) 0.000 8.548 ( 0.000 0.000 0.000) 0.000 8.606 ( 0.000 0.000 0.000) 0.000 8.609 ( 0.000 0.000 0.000) 0.000 8.736 ( 0.000 0.000 0.000) 0.000 8.871 ( 0.000 0.000 0.000) 0.000 8.893 ( 0.000 0.000 0.000) 0.000 9.043 ( 0.000 0.000 0.000) 0.000 9.084 ( 0.000 0.000 0.000) 0.000 9.268 ( 0.000 0.000 0.000) 0.000 9.280 ( 0.000 0.000 0.000) 0.000 9.379 ( 0.000 0.000 0.000) 0.000 9.596 ( 0.000 0.000 0.000) 0.000 9.922 ( 0.000 0.000 0.000) 0.000 10.095 ( 0.000 0.000 0.000) 0.000 10.143 ( 0.000 0.000 0.000) 0.000 10.220 ( 0.000 0.000 0.000) 0.000 10.242 ( 0.000 0.000 0.000) 0.000 10.260 ( 0.000 0.000 0.000) 0.000 10.375 ( 0.000 0.000 0.000) 0.000 10.624 ( 0.000 0.000 0.000) 0.000 16.349 ( 0.000 0.000 0.000) 0.000 16.353 ( 0.000 0.000 0.000) 0.000 16.857 ( 0.000 0.000 0.000) 0.000 16.864 ( 0.000 0.000 0.000) 0.000 17.541 ( 0.000 0.000 0.000) 0.000 17.551 ( 0.000 0.000 0.000) 0.000 17.589 ( 0.000 0.000 0.000) 0.000 17.642 ( 0.000 0.000 0.000) 0.000 17.790 ( 0.000 0.000 0.000) 0.000 17.822 ( 0.000 0.000 0.000) 0.000 17.828 ( 0.000 0.000 0.000) 0.000 18.084 ( 0.000 0.000 0.000) 0.000 18.379 ( 0.000 0.000 0.000) 0.000 18.392 ( 0.000 0.000 0.000) 0.000 19.380 ( 0.000 0.000 0.000) 0.000 19.532 ( 0.000 0.000 0.000) 0.000 21.232 ( 0.000 0.000 0.000) 0.000 21.250 ( 0.000 0.000 0.000) 0.000 21.421 ( 0.000 0.000 0.000) 0.000 21.436 ( 0.000 0.000 0.000) 0.000 21.919 ( 0.000 0.000 0.000) 0.000 21.922 ( 0.000 0.000 0.000) 0.000 21.994 ( 0.000 0.000 0.000) 0.000 22.051 ( 0.000 0.000 0.000) 0.000 26.930 ( 0.000 0.000 0.000) 0.000 27.013 ( 0.000 0.000 0.000) 0.000 27.124 ( 0.000 0.000 0.000) 0.000 27.168 ( 0.000 0.000 0.000) 0.000 27.673 ( 0.000 0.000 0.000) 0.000 27.707 ( 0.000 0.000 0.000) 0.000 27.791 ( 0.000 0.000 0.000) 0.000 27.818 ( 0.000 0.000 0.000) 0.000 35.559 ( 0.000 0.000 0.000) 0.000 35.794 ( 0.000 0.000 0.000) 0.000 35.955 ( 0.000 0.000 0.000) 0.000 36.041 ( 0.000 0.000 0.000) 0.000 36.257 ( 0.000 0.000 0.000) 0.000 36.334 ( 0.000 0.000 0.000) 0.000 36.353 ( 0.000 0.000 0.000) 0.000 36.555 ( 0.000 0.000 0.000) 0.000 36.862 ( 0.000 0.000 0.000) 0.000 36.945 ( 0.000 0.000 0.000) 0.000 37.572 ( 0.000 0.000 0.000) 0.000 38.084 ( 0.000 0.000 0.000) 0.000 39.388 ( 0.000 0.000 0.000) 0.000 39.623 ( 0.000 0.000 0.000) 0.000 40.300 ( 0.000 0.000 0.000) 0.000 40.929 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.276 ( 7.314 0.000 16.990) 18.497 0.421 ( 11.374 0.000 27.842) 30.075 1.065 ( 46.115 0.000 18.469) 49.676 1.868 ( 1.788 0.000 -2.237) 2.863 1.978 ( 3.712 0.000 -2.003) 4.218 2.037 ( 2.327 0.000 2.901) 3.719 2.190 ( 2.563 0.000 -9.033) 9.390 2.233 ( 4.670 0.000 -5.551) 7.254 2.553 ( 10.672 0.000 -18.193) 21.092 2.575 ( 8.833 0.000 9.041) 12.640 2.697 ( 10.805 0.000 0.487) 10.816 2.952 ( 4.595 0.000 -1.996) 5.010 2.979 ( 9.618 0.000 1.693) 9.766 3.173 ( 3.586 0.000 8.441) 9.172 3.194 ( 7.572 0.000 6.307) 9.855 3.403 ( 7.167 0.000 -0.433) 7.180 3.609 ( 0.705 0.000 -2.268) 2.375 3.778 ( 0.316 0.000 6.923) 6.930 3.807 ( 2.856 0.000 -0.860) 2.983 4.005 ( -0.398 0.000 3.396) 3.419 4.095 ( -7.883 0.000 3.876) 8.784 4.175 ( -5.510 0.000 2.748) 6.157 4.225 ( 3.537 0.000 6.916) 7.768 4.334 ( -13.415 0.000 -4.161) 14.045 4.500 ( -17.174 0.000 -4.710) 17.808 4.572 ( -5.048 0.000 -2.194) 5.504 4.607 ( 0.060 0.000 2.267) 2.268 4.663 ( -7.702 0.000 -4.472) 8.906 4.785 ( -2.462 0.000 -8.573) 8.919 4.868 ( 0.872 0.000 3.244) 3.359 4.960 ( 2.913 0.000 0.180) 2.919 5.069 ( 5.429 0.000 1.946) 5.767 5.181 ( 1.844 0.000 5.140) 5.461 5.255 ( 12.021 0.000 -1.791) 12.154 5.263 ( 3.753 0.000 -0.024) 3.753 5.347 ( -0.003 0.000 -2.243) 2.243 5.363 ( 0.227 0.000 0.983) 1.008 5.538 ( 5.987 0.000 -0.989) 6.069 5.551 ( 0.402 0.000 -5.517) 5.531 5.603 ( 0.646 0.000 0.244) 0.691 5.746 ( 1.599 0.000 -1.696) 2.331 5.748 ( 1.512 0.000 0.030) 1.513 5.840 ( 0.327 0.000 1.397) 1.434 5.849 ( -2.037 0.000 0.778) 2.181 6.032 ( -5.483 0.000 -3.420) 6.462 6.035 ( -3.709 0.000 2.096) 4.261 6.038 ( -0.838 0.000 -0.882) 1.216 6.093 ( 2.637 0.000 2.274) 3.482 6.174 ( 2.111 0.000 4.991) 5.419 6.263 ( -3.990 0.000 -2.349) 4.630 6.316 ( -0.087 0.000 0.837) 0.842 6.411 ( -2.784 0.000 2.888) 4.011 6.459 ( -5.251 0.000 0.006) 5.251 6.664 ( -3.925 0.000 3.439) 5.218 6.671 ( -4.900 0.000 3.684) 6.131 6.710 ( 2.980 0.000 2.088) 3.638 6.720 ( 2.015 0.000 -5.824) 6.163 6.736 ( 2.264 0.000 -14.031) 14.213 6.917 ( -0.367 0.000 -5.064) 5.077 6.945 ( -0.004 0.000 -12.955) 12.955 7.007 ( 0.561 0.000 -4.043) 4.081 7.024 ( 5.817 0.000 -8.711) 10.474 7.131 ( 1.422 0.000 -6.863) 7.009 7.141 ( 5.491 0.000 -5.483) 7.760 7.326 ( 4.249 0.000 4.884) 6.473 7.424 ( 5.635 0.000 7.662) 9.511 7.506 ( 7.568 0.000 5.406) 9.300 7.564 ( 3.198 0.000 3.771) 4.945 7.640 ( 4.286 0.000 -6.656) 7.917 7.883 ( 7.933 0.000 -13.786) 15.905 7.951 ( 1.608 0.000 0.796) 1.794 7.961 ( -5.298 0.000 15.928) 16.786 8.170 ( 4.265 0.000 -4.188) 5.977 8.216 ( 3.002 0.000 4.905) 5.751 8.355 ( -1.864 0.000 6.205) 6.479 8.389 ( -5.186 0.000 -1.519) 5.403 8.603 ( -1.004 0.000 -0.045) 1.005 8.609 ( 5.128 0.000 -1.116) 5.249 8.751 ( -1.767 0.000 -1.366) 2.234 8.753 ( 0.352 0.000 1.946) 1.978 8.890 ( -1.010 0.000 4.599) 4.709 8.903 ( -6.685 0.000 4.570) 8.098 9.076 ( 0.645 0.000 -3.194) 3.259 9.119 ( 2.128 0.000 3.654) 4.229 9.276 ( 0.267 0.000 1.226) 1.254 9.302 ( -0.331 0.000 -10.764) 10.769 9.562 ( -3.832 0.000 0.511) 3.866 9.590 ( -8.449 0.000 15.722) 17.849 10.090 ( -1.045 0.000 1.237) 1.619 10.124 ( -0.034 0.000 -2.153) 2.154 10.202 ( -1.848 0.000 1.866) 2.626 10.283 ( 6.877 0.000 1.247) 6.989 10.367 ( 8.507 0.000 -0.167) 8.509 10.436 ( 2.349 0.000 0.895) 2.514 10.755 ( 8.981 0.000 13.076) 15.863 11.996 ( 13.154 0.000 -37.558) 39.795 16.364 ( 1.519 0.000 -0.370) 1.563 16.365 ( 1.457 0.000 0.673) 1.605 16.848 ( -1.453 0.000 0.782) 1.650 16.851 ( -1.451 0.000 0.037) 1.451 17.550 ( 0.812 0.000 0.431) 0.919 17.581 ( -1.382 0.000 1.951) 2.391 17.600 ( 0.384 0.000 1.188) 1.249 17.626 ( -1.634 0.000 -0.336) 1.668 17.784 ( -1.526 0.000 -0.848) 1.746 17.803 ( -1.543 0.000 -1.332) 2.038 17.823 ( -1.943 0.000 2.376) 3.069 18.063 ( -2.797 0.000 0.516) 2.844 18.381 ( 0.334 0.000 -0.326) 0.466 18.391 ( 0.034 0.000 -0.377) 0.379 19.404 ( -4.379 0.000 4.897) 6.570 19.494 ( -3.798 0.000 -0.661) 3.855 21.256 ( 0.726 0.000 0.072) 0.730 21.405 ( 0.255 0.000 -4.711) 4.718 21.426 ( 0.401 0.000 0.132) 0.422 21.474 ( 4.338 0.000 -5.312) 6.858 21.922 ( 0.403 0.000 -0.035) 0.405 21.930 ( 0.810 0.000 0.088) 0.815 22.036 ( 4.441 0.000 -7.998) 9.148 22.062 ( 0.978 0.000 0.503) 1.099 26.935 ( 0.169 0.000 0.417) 0.450 27.002 ( -0.542 0.000 -1.048) 1.180 27.133 ( 0.362 0.000 0.970) 1.035 27.164 ( -0.268 0.000 -0.331) 0.426 27.668 ( -1.095 0.000 0.527) 1.215 27.705 ( -0.577 0.000 0.610) 0.840 27.777 ( -1.244 0.000 -0.576) 1.371 27.820 ( -0.047 0.000 0.216) 0.221 35.588 ( 1.055 0.000 3.314) 3.478 35.760 ( -3.403 0.000 1.161) 3.595 35.995 ( -2.641 0.000 -3.966) 4.765 36.113 ( -20.352 0.000 29.185) 35.580 36.218 ( -2.851 0.000 -3.010) 4.146 36.386 ( 5.152 0.000 -1.011) 5.250 36.403 ( 2.442 0.000 4.428) 5.056 36.656 ( 7.753 0.000 -2.676) 8.202 36.868 ( -0.538 0.000 1.696) 1.779 37.509 ( -4.519 0.000 -4.541) 6.406 38.121 ( 3.260 0.000 2.763) 4.274 39.256 ( -5.986 0.000 3.627) 6.999 39.470 ( 3.061 0.000 7.496) 8.097 39.658 ( 4.706 0.000 -1.735) 5.015 40.267 ( -4.346 0.000 1.439) 4.578 41.002 ( -5.652 0.000 -1.333) 5.807 ======================= Grid point 2 (3/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( 10.933 0.000 15.670) 19.107 0.892 ( 16.518 0.000 20.690) 26.475 1.711 ( 12.982 0.000 6.340) 14.447 1.897 ( 1.660 0.000 1.550) 2.271 2.081 ( 12.312 0.000 -5.199) 13.364 2.176 ( 8.537 0.000 -7.716) 11.507 2.249 ( 9.570 0.000 -3.189) 10.087 2.291 ( 8.778 0.000 0.524) 8.794 2.665 ( 17.043 0.000 2.814) 17.273 2.796 ( 6.956 0.000 8.884) 11.283 2.890 ( 5.712 0.000 5.706) 8.074 3.023 ( 6.978 0.000 -5.033) 8.604 3.214 ( 13.437 0.000 2.856) 13.737 3.271 ( 0.957 0.000 2.528) 2.703 3.412 ( 8.690 0.000 7.301) 11.350 3.585 ( 8.614 0.000 10.038) 13.228 3.600 ( 2.393 0.000 -4.629) 5.211 3.833 ( -0.624 0.000 -0.273) 0.682 3.902 ( 0.041 0.000 12.804) 12.804 3.974 ( -3.906 0.000 0.732) 3.974 4.025 ( -3.237 0.000 2.414) 4.038 4.079 ( -9.844 0.000 1.425) 9.947 4.141 ( -1.001 0.000 -0.938) 1.372 4.167 ( -13.704 0.000 -1.835) 13.826 4.354 ( 3.117 0.000 5.117) 5.992 4.439 ( -5.478 0.000 -3.008) 6.249 4.475 ( -7.895 0.000 -7.849) 11.133 4.638 ( -0.370 0.000 5.464) 5.477 4.700 ( 1.280 0.000 -6.455) 6.580 4.901 ( -3.217 0.000 4.611) 5.622 4.957 ( 1.738 0.000 -6.785) 7.004 5.137 ( 2.267 0.000 -1.403) 2.666 5.205 ( -5.439 0.000 5.029) 7.407 5.267 ( 0.852 0.000 0.620) 1.054 5.332 ( 0.550 0.000 -5.475) 5.502 5.414 ( -5.996 0.000 3.769) 7.082 5.431 ( 4.712 0.000 -2.632) 5.397 5.513 ( 12.680 0.000 -2.102) 12.853 5.581 ( -0.264 0.000 -6.792) 6.797 5.615 ( 3.753 0.000 -1.484) 4.036 5.675 ( -1.180 0.000 -11.870) 11.929 5.792 ( 2.954 0.000 1.797) 3.458 5.854 ( 1.181 0.000 -0.348) 1.231 5.879 ( -3.718 0.000 3.470) 5.086 5.895 ( -4.461 0.000 -2.920) 5.331 5.967 ( -3.893 0.000 -0.365) 3.910 6.038 ( 0.477 0.000 0.360) 0.598 6.177 ( 0.472 0.000 -3.420) 3.453 6.192 ( 4.760 0.000 2.198) 5.243 6.257 ( -0.727 0.000 7.820) 7.854 6.346 ( 3.265 0.000 -0.122) 3.268 6.387 ( -0.943 0.000 -2.632) 2.796 6.421 ( -0.740 0.000 5.475) 5.525 6.577 ( -8.078 0.000 3.810) 8.931 6.597 ( -3.117 0.000 -14.028) 14.370 6.639 ( -4.190 0.000 8.047) 9.073 6.709 ( 2.297 0.000 -4.150) 4.743 6.752 ( 0.172 0.000 -10.409) 10.410 6.821 ( -4.492 0.000 -2.224) 5.012 6.879 ( -0.697 0.000 -1.333) 1.504 6.934 ( 4.240 0.000 -4.983) 6.543 7.030 ( 5.986 0.000 -9.948) 11.610 7.225 ( 5.655 0.000 -1.729) 5.913 7.238 ( 12.154 0.000 -5.559) 13.365 7.488 ( 6.583 0.000 4.099) 7.755 7.522 ( 4.015 0.000 -7.932) 8.890 7.563 ( 1.714 0.000 1.946) 2.593 7.623 ( 1.970 0.000 5.276) 5.632 7.804 ( 7.712 0.000 7.563) 10.802 7.857 ( 5.183 0.000 -16.105) 16.918 7.957 ( 1.437 0.000 -5.253) 5.446 8.039 ( -0.397 0.000 9.895) 9.903 8.235 ( 5.921 0.000 -1.308) 6.063 8.281 ( -3.411 0.000 -1.325) 3.659 8.331 ( 1.159 0.000 7.539) 7.627 8.420 ( 1.280 0.000 6.654) 6.777 8.573 ( -1.587 0.000 -0.036) 1.587 8.600 ( -2.227 0.000 -2.937) 3.686 8.758 ( 2.358 0.000 -2.006) 3.096 8.760 ( -2.982 0.000 3.070) 4.280 8.889 ( -0.089 0.000 6.737) 6.738 8.902 ( -0.139 0.000 2.035) 2.039 9.056 ( 0.962 0.000 -3.139) 3.283 9.152 ( 0.218 0.000 -0.919) 0.945 9.237 ( 2.171 0.000 -7.777) 8.074 9.298 ( -0.168 0.000 2.888) 2.893 9.506 ( -2.058 0.000 0.112) 2.061 9.600 ( -2.090 0.000 5.856) 6.218 10.088 ( -0.563 0.000 1.188) 1.314 10.114 ( 0.573 0.000 -1.042) 1.189 10.230 ( 2.202 0.000 4.344) 4.870 10.438 ( 1.635 0.000 2.238) 2.772 10.492 ( 13.865 0.000 -2.802) 14.145 10.530 ( 10.242 0.000 -0.017) 10.242 11.096 ( 9.744 0.000 20.070) 22.310 11.814 ( -2.605 0.000 -20.490) 20.654 16.401 ( 3.354 0.000 -0.503) 3.392 16.412 ( 3.031 0.000 1.071) 3.214 16.818 ( -2.707 0.000 0.471) 2.748 16.821 ( -2.841 0.000 1.137) 3.061 17.559 ( -1.405 0.000 -0.422) 1.467 17.573 ( -0.512 0.000 -0.435) 0.672 17.600 ( 0.464 0.000 0.319) 0.563 17.621 ( 1.061 0.000 0.557) 1.199 17.743 ( -1.745 0.000 -1.448) 2.268 17.743 ( -3.282 0.000 -2.513) 4.134 17.807 ( -2.686 0.000 2.781) 3.866 18.000 ( -4.751 0.000 0.243) 4.757 18.384 ( 0.470 0.000 -0.558) 0.729 18.387 ( 0.082 0.000 -0.614) 0.619 19.364 ( -3.985 0.000 2.163) 4.534 19.406 ( -5.115 0.000 -0.992) 5.210 21.278 ( 1.560 0.000 0.581) 1.664 21.365 ( -0.659 0.000 -2.795) 2.872 21.433 ( 0.278 0.000 -0.052) 0.282 21.494 ( 2.099 0.000 -2.220) 3.056 21.931 ( 0.649 0.000 -0.022) 0.649 21.947 ( 1.043 0.000 0.085) 1.046 22.038 ( 1.949 0.000 -3.376) 3.899 22.091 ( 1.482 0.000 0.955) 1.763 26.945 ( 0.571 0.000 0.448) 0.725 26.981 ( -0.568 0.000 -1.112) 1.249 27.148 ( 0.218 0.000 0.894) 0.920 27.154 ( -0.471 0.000 -0.532) 0.711 27.654 ( -0.850 0.000 0.374) 0.929 27.700 ( -0.737 0.000 1.006) 1.248 27.744 ( -1.523 0.000 -0.861) 1.750 27.816 ( -0.641 0.000 0.106) 0.650 35.610 ( -2.506 0.000 2.789) 3.749 35.768 ( 1.974 0.000 5.397) 5.747 35.899 ( -3.473 0.000 -4.426) 5.626 36.027 ( -13.733 0.000 14.916) 20.275 36.124 ( -3.658 0.000 -3.630) 5.153 36.417 ( -1.106 0.000 -3.477) 3.648 36.488 ( 1.725 0.000 5.073) 5.359 36.785 ( 9.040 0.000 -1.655) 9.190 36.863 ( -2.337 0.000 1.771) 2.932 37.364 ( -4.755 0.000 -6.454) 8.016 38.263 ( 9.584 0.000 4.194) 10.462 39.197 ( -1.699 0.000 -2.126) 2.722 39.615 ( 6.909 0.000 5.243) 8.674 39.730 ( 6.621 0.000 -5.440) 8.569 40.201 ( -5.827 0.000 4.836) 7.573 40.848 ( -8.977 0.000 -4.380) 9.989 ======================= Grid point 3 (4/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.914 ( 11.152 0.000 12.236) 16.556 1.342 ( 15.975 0.000 14.812) 21.785 1.865 ( 5.054 0.000 2.836) 5.795 1.932 ( 0.876 0.000 0.097) 0.881 2.186 ( 4.644 0.000 -9.231) 10.333 2.263 ( 12.354 0.000 -3.305) 12.788 2.327 ( -1.501 0.000 -4.631) 4.868 2.403 ( 7.344 0.000 2.214) 7.671 2.934 ( 1.453 0.000 3.305) 3.610 2.994 ( -0.534 0.000 10.540) 10.554 3.081 ( 15.589 0.000 4.407) 16.200 3.086 ( 5.196 0.000 -4.661) 6.980 3.331 ( 5.377 0.000 2.689) 6.012 3.430 ( 7.533 0.000 3.939) 8.501 3.535 ( -1.518 0.000 -2.296) 2.752 3.625 ( 2.694 0.000 0.799) 2.810 3.763 ( -2.751 0.000 6.813) 7.348 3.786 ( -10.062 0.000 0.737) 10.089 3.852 ( 4.446 0.000 5.696) 7.226 3.918 ( -1.670 0.000 1.882) 2.516 3.981 ( -0.726 0.000 1.322) 1.508 4.048 ( -0.254 0.000 4.983) 4.990 4.166 ( 0.967 0.000 -1.198) 1.539 4.177 ( -2.465 0.000 -0.791) 2.589 4.321 ( 5.198 0.000 2.989) 5.996 4.355 ( 0.508 0.000 -4.194) 4.225 4.460 ( 1.798 0.000 5.791) 6.064 4.709 ( 6.852 0.000 -3.798) 7.834 4.720 ( 1.862 0.000 10.791) 10.951 4.826 ( -8.326 0.000 3.316) 8.962 4.923 ( 2.952 0.000 -8.823) 9.304 5.107 ( -0.589 0.000 -9.138) 9.157 5.167 ( -4.253 0.000 6.678) 7.918 5.237 ( -3.747 0.000 -2.381) 4.439 5.298 ( 0.836 0.000 3.255) 3.361 5.399 ( -1.823 0.000 2.305) 2.939 5.459 ( 3.331 0.000 -4.938) 5.957 5.479 ( 0.523 0.000 -11.237) 11.250 5.560 ( -3.408 0.000 -6.595) 7.424 5.605 ( -4.414 0.000 -1.242) 4.586 5.648 ( 1.509 0.000 0.844) 1.729 5.745 ( -3.978 0.000 -2.723) 4.821 5.844 ( -0.599 0.000 4.922) 4.959 5.875 ( -1.082 0.000 1.320) 1.706 5.892 ( 2.555 0.000 1.743) 3.093 5.934 ( 2.269 0.000 -3.399) 4.087 6.056 ( 0.743 0.000 1.647) 1.807 6.213 ( -3.441 0.000 -3.099) 4.631 6.238 ( 8.627 0.000 -4.196) 9.594 6.257 ( -1.847 0.000 -9.220) 9.404 6.370 ( 0.649 0.000 -3.239) 3.304 6.397 ( 3.733 0.000 -4.621) 5.940 6.424 ( -2.594 0.000 -1.741) 3.124 6.484 ( 1.912 0.000 4.174) 4.591 6.514 ( -3.884 0.000 4.824) 6.193 6.572 ( -4.847 0.000 -7.712) 9.109 6.659 ( -3.900 0.000 2.533) 4.651 6.736 ( 3.314 0.000 0.028) 3.314 6.741 ( -1.102 0.000 2.524) 2.754 6.858 ( -1.785 0.000 1.487) 2.324 7.045 ( 5.018 0.000 -7.563) 9.076 7.058 ( 6.242 0.000 2.654) 6.783 7.254 ( -1.388 0.000 -1.878) 2.335 7.371 ( 8.353 0.000 -5.616) 10.065 7.514 ( 4.670 0.000 -6.596) 8.082 7.566 ( 0.621 0.000 6.158) 6.190 7.577 ( 0.746 0.000 -3.445) 3.525 7.764 ( 3.824 0.000 2.158) 4.391 7.808 ( 9.268 0.000 -14.158) 16.922 7.860 ( -7.242 0.000 4.405) 8.477 7.929 ( 2.278 0.000 -10.524) 10.767 8.123 ( 1.157 0.000 6.607) 6.708 8.297 ( 1.910 0.000 8.004) 8.229 8.310 ( 1.980 0.000 0.899) 2.175 8.388 ( -0.478 0.000 4.568) 4.593 8.436 ( 0.485 0.000 -5.788) 5.809 8.573 ( 1.261 0.000 -0.692) 1.439 8.610 ( -0.502 0.000 9.931) 9.944 8.747 ( 0.411 0.000 2.741) 2.772 8.759 ( 1.904 0.000 -3.771) 4.225 8.938 ( 1.043 0.000 2.583) 2.786 8.986 ( 2.977 0.000 4.538) 5.427 9.047 ( 0.723 0.000 -2.013) 2.139 9.124 ( -0.017 0.000 -3.677) 3.677 9.192 ( -0.577 0.000 -5.577) 5.607 9.318 ( -1.266 0.000 4.000) 4.195 9.502 ( 0.872 0.000 0.072) 0.875 9.622 ( -0.219 0.000 2.730) 2.739 10.090 ( -0.139 0.000 0.523) 0.542 10.122 ( 0.898 0.000 -0.231) 0.927 10.366 ( 7.316 0.000 6.733) 9.943 10.448 ( 1.392 0.000 -2.073) 2.497 10.703 ( 9.965 0.000 -0.291) 9.969 10.793 ( 19.457 0.000 1.450) 19.511 11.377 ( 0.723 0.000 17.833) 17.847 11.537 ( -10.408 0.000 -14.437) 17.797 16.471 ( 5.300 0.000 -0.420) 5.316 16.485 ( 4.144 0.000 0.989) 4.261 16.766 ( -4.289 0.000 0.954) 4.394 16.773 ( -3.813 0.000 0.945) 3.929 17.508 ( -2.092 0.000 -1.820) 2.773 17.556 ( -0.493 0.000 -1.198) 1.295 17.634 ( -0.213 0.000 -0.528) 0.569 17.642 ( 0.633 0.000 0.376) 0.736 17.661 ( -1.060 0.000 -0.599) 1.218 17.705 ( -1.035 0.000 -1.217) 1.598 17.789 ( -2.157 0.000 2.494) 3.298 17.912 ( -5.134 0.000 -0.574) 5.166 18.383 ( 0.081 0.000 -0.518) 0.525 18.386 ( 0.360 0.000 -0.555) 0.662 19.315 ( -3.202 0.000 0.939) 3.337 19.317 ( -3.874 0.000 -0.827) 3.961 21.319 ( 2.056 0.000 1.305) 2.436 21.333 ( -0.647 0.000 -1.631) 1.755 21.430 ( -0.349 0.000 -0.597) 0.691 21.506 ( 1.062 0.000 -1.157) 1.571 21.943 ( 0.602 0.000 0.014) 0.602 21.964 ( 0.791 0.000 0.044) 0.793 22.039 ( 0.944 0.000 -1.605) 1.862 22.125 ( 1.208 0.000 1.001) 1.569 26.961 ( 0.658 0.000 0.507) 0.831 26.964 ( -0.365 0.000 -0.756) 0.840 27.140 ( -0.471 0.000 -0.507) 0.692 27.157 ( 0.071 0.000 0.507) 0.512 27.649 ( -0.163 0.000 0.313) 0.353 27.698 ( -0.700 0.000 1.009) 1.228 27.715 ( -0.804 0.000 -0.817) 1.146 27.800 ( -1.131 0.000 -0.123) 1.137 35.601 ( -1.047 0.000 3.881) 4.020 35.810 ( -2.295 0.000 -3.291) 4.012 35.889 ( 4.494 0.000 6.304) 7.742 35.919 ( -9.564 0.000 5.613) 11.090 36.050 ( -2.869 0.000 0.040) 2.870 36.266 ( -10.213 0.000 -5.753) 11.722 36.548 ( 0.525 0.000 3.742) 3.779 36.785 ( -6.069 0.000 -3.396) 6.954 36.914 ( 7.051 0.000 -1.225) 7.156 37.295 ( 2.103 0.000 -2.530) 3.290 38.494 ( 11.148 0.000 4.264) 11.936 39.159 ( -0.206 0.000 -2.586) 2.594 39.757 ( 3.509 0.000 -7.393) 8.183 39.805 ( 9.884 0.000 4.670) 10.931 40.182 ( -2.728 0.000 6.755) 7.285 40.626 ( -11.102 0.000 -5.631) 12.449 ======================= Grid point 4 (5/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 4.843 0.000 5.037) 6.987 1.669 ( 8.210 0.000 6.991) 10.783 1.928 ( -0.228 0.000 -1.024) 1.049 1.979 ( 4.995 0.000 1.638) 5.256 2.170 ( 0.248 0.000 -3.184) 3.194 2.220 ( -3.990 0.000 -4.285) 5.855 2.414 ( 7.076 0.000 -1.820) 7.306 2.500 ( 0.791 0.000 2.631) 2.747 2.943 ( -0.740 0.000 0.152) 0.755 3.096 ( 0.565 0.000 11.503) 11.517 3.103 ( 0.612 0.000 -1.051) 1.216 3.201 ( 2.072 0.000 -6.994) 7.295 3.399 ( -5.132 0.000 -2.425) 5.676 3.465 ( 4.771 0.000 1.785) 5.094 3.556 ( 0.637 0.000 8.644) 8.668 3.664 ( -0.596 0.000 -5.869) 5.900 3.674 ( 0.314 0.000 -1.003) 1.051 3.720 ( -3.395 0.000 0.345) 3.413 3.922 ( 0.124 0.000 1.836) 1.841 3.929 ( 1.333 0.000 0.929) 1.625 4.010 ( -4.619 0.000 -5.677) 7.319 4.088 ( 5.556 0.000 5.731) 7.982 4.190 ( 2.592 0.000 0.164) 2.597 4.201 ( 4.757 0.000 7.337) 8.744 4.309 ( -1.866 0.000 -3.226) 3.727 4.440 ( 1.127 0.000 -2.241) 2.508 4.473 ( -4.524 0.000 1.171) 4.673 4.718 ( -3.162 0.000 2.060) 3.773 4.896 ( 2.467 0.000 -4.366) 5.015 4.929 ( 5.669 0.000 9.562) 11.117 4.982 ( 15.883 0.000 11.679) 19.714 4.999 ( -1.037 0.000 -4.131) 4.259 5.173 ( -1.441 0.000 -4.503) 4.728 5.177 ( 0.021 0.000 3.772) 3.772 5.322 ( -4.850 0.000 -3.418) 5.933 5.350 ( -3.276 0.000 2.608) 4.187 5.430 ( -3.231 0.000 -4.354) 5.422 5.431 ( -0.242 0.000 -0.555) 0.605 5.456 ( -1.803 0.000 -2.676) 3.227 5.476 ( -2.270 0.000 -4.098) 4.685 5.650 ( -1.297 0.000 -3.101) 3.361 5.666 ( -0.552 0.000 0.216) 0.593 5.860 ( -2.801 0.000 3.754) 4.683 5.950 ( 2.410 0.000 -2.636) 3.572 5.954 ( 6.272 0.000 1.844) 6.538 5.962 ( 2.279 0.000 0.609) 2.359 6.018 ( -5.148 0.000 -7.249) 8.891 6.050 ( -3.458 0.000 0.944) 3.584 6.137 ( -1.816 0.000 -5.341) 5.641 6.314 ( 3.513 0.000 -4.633) 5.814 6.361 ( -0.997 0.000 0.186) 1.014 6.376 ( -2.504 0.000 -1.886) 3.135 6.435 ( 3.022 0.000 -4.763) 5.641 6.442 ( 1.388 0.000 1.512) 2.053 6.504 ( -0.349 0.000 -0.257) 0.433 6.531 ( -4.626 0.000 2.510) 5.263 6.691 ( 3.596 0.000 3.903) 5.307 6.778 ( 0.337 0.000 2.512) 2.535 6.795 ( 1.080 0.000 1.538) 1.879 6.860 ( -0.150 0.000 3.289) 3.292 7.058 ( 2.634 0.000 -3.477) 4.362 7.130 ( 1.033 0.000 -0.399) 1.107 7.166 ( -4.068 0.000 -2.641) 4.850 7.401 ( 1.124 0.000 -2.344) 2.599 7.545 ( 0.603 0.000 -2.001) 2.089 7.590 ( 7.052 0.000 -4.508) 8.369 7.643 ( 0.125 0.000 5.881) 5.882 7.754 ( -8.286 0.000 4.746) 9.549 7.768 ( 3.721 0.000 -6.949) 7.883 7.849 ( -0.258 0.000 -6.138) 6.144 7.889 ( 3.199 0.000 -0.354) 3.218 8.173 ( -0.480 0.000 2.050) 2.105 8.322 ( 0.015 0.000 0.216) 0.217 8.347 ( -1.006 0.000 2.341) 2.548 8.408 ( 0.506 0.000 -1.780) 1.850 8.460 ( 1.440 0.000 3.748) 4.015 8.581 ( 1.044 0.000 -1.068) 1.494 8.688 ( -0.211 0.000 5.943) 5.946 8.763 ( 1.898 0.000 -2.801) 3.383 8.823 ( 3.559 0.000 1.745) 3.964 8.982 ( 1.129 0.000 4.362) 4.506 9.019 ( -0.550 0.000 -0.409) 0.685 9.044 ( -0.058 0.000 -0.367) 0.372 9.109 ( -2.399 0.000 -5.898) 6.367 9.125 ( 2.109 0.000 -1.178) 2.416 9.328 ( -1.081 0.000 2.374) 2.608 9.517 ( 0.564 0.000 -0.005) 0.564 9.637 ( -0.009 0.000 0.852) 0.852 10.092 ( 0.002 0.000 0.160) 0.160 10.134 ( 0.437 0.000 0.033) 0.438 10.452 ( 0.737 0.000 -1.047) 1.280 10.549 ( 5.153 0.000 4.311) 6.719 10.876 ( 9.880 0.000 1.981) 10.077 11.127 ( 16.609 0.000 -0.919) 16.634 11.219 ( -12.218 0.000 -8.794) 15.054 11.424 ( -8.898 0.000 8.961) 12.628 16.559 ( 3.061 0.000 0.405) 3.088 16.567 ( 5.895 0.000 -0.412) 5.909 16.688 ( -5.453 0.000 0.772) 5.508 16.716 ( -2.890 0.000 0.356) 2.912 17.474 ( -0.141 0.000 -1.172) 1.181 17.539 ( -0.284 0.000 -0.576) 0.643 17.568 ( -2.444 0.000 -0.888) 2.600 17.648 ( -0.057 0.000 0.160) 0.170 17.688 ( -0.096 0.000 -0.533) 0.542 17.725 ( 4.121 0.000 1.688) 4.453 17.781 ( -0.739 0.000 1.054) 1.287 17.817 ( -4.867 0.000 -1.380) 5.059 18.380 ( 0.034 0.000 -0.189) 0.192 18.386 ( 0.127 0.000 -0.237) 0.268 19.266 ( -1.398 0.000 -0.316) 1.433 19.281 ( -1.261 0.000 0.237) 1.283 21.315 ( -0.251 0.000 -0.545) 0.600 21.367 ( 1.856 0.000 1.587) 2.442 21.408 ( -1.163 0.000 -1.240) 1.700 21.510 ( 0.327 0.000 -0.376) 0.498 21.950 ( 0.246 0.000 0.015) 0.247 21.974 ( 0.292 0.000 0.013) 0.292 22.040 ( 0.285 0.000 -0.489) 0.566 22.146 ( 0.438 0.000 0.431) 0.614 26.955 ( -0.120 0.000 -0.266) 0.291 26.973 ( 0.295 0.000 0.245) 0.384 27.131 ( -0.198 0.000 -0.216) 0.293 27.160 ( 0.031 0.000 0.165) 0.168 27.652 ( 0.136 0.000 0.144) 0.198 27.693 ( -0.427 0.000 0.212) 0.476 27.705 ( -0.054 0.000 -0.125) 0.136 27.782 ( -0.651 0.000 -0.118) 0.661 35.654 ( 1.928 0.000 4.058) 4.493 35.767 ( -0.192 0.000 -1.555) 1.567 35.830 ( -4.093 0.000 1.641) 4.409 35.985 ( 0.110 0.000 -1.960) 1.963 36.020 ( -1.084 0.000 0.483) 1.186 36.058 ( -5.056 0.000 0.308) 5.066 36.576 ( 0.047 0.000 1.340) 1.341 36.652 ( -3.640 0.000 -3.295) 4.910 36.990 ( 2.605 0.000 -0.446) 2.643 37.334 ( 2.034 0.000 -0.083) 2.035 38.669 ( 4.790 0.000 1.834) 5.129 39.141 ( 0.068 0.000 -1.079) 1.081 39.736 ( 0.545 0.000 -3.071) 3.119 40.022 ( 9.251 0.000 4.016) 10.085 40.208 ( -0.262 0.000 2.804) 2.816 40.388 ( -9.594 0.000 -4.587) 10.634 ======================= Grid point 9 (6/92) ======================= q-point: ( 0.00 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 0.385 ( 0.000 20.467 0.000) 20.467 0.567 ( 0.000 29.702 0.000) 29.702 1.404 ( 0.000 62.181 0.000) 62.181 1.847 ( 0.000 0.932 0.000) 0.932 1.976 ( 0.000 1.194 0.000) 1.194 2.043 ( 0.000 1.695 0.000) 1.695 2.070 ( 0.000 0.209 0.000) 0.209 2.131 ( 0.000 -3.326 0.000) 3.326 2.379 ( 0.000 4.485 0.000) 4.485 2.469 ( 0.000 3.198 0.000) 3.198 2.662 ( 0.000 6.330 0.000) 6.330 2.857 ( 0.000 -1.626 0.000) 1.626 2.863 ( 0.000 -4.543 0.000) 4.543 3.063 ( 0.000 -3.701 0.000) 3.701 3.109 ( 0.000 1.596 0.000) 1.596 3.315 ( 0.000 -2.449 0.000) 2.449 3.543 ( 0.000 -2.477 0.000) 2.477 3.775 ( 0.000 2.414 0.000) 2.414 3.887 ( 0.000 5.423 0.000) 5.423 3.997 ( 0.000 0.719 0.000) 0.719 4.072 ( 0.000 0.146 0.000) 0.146 4.159 ( 0.000 -1.724 0.000) 1.724 4.262 ( 0.000 3.872 0.000) 3.872 4.473 ( 0.000 -2.804 0.000) 2.804 4.573 ( 0.000 -7.008 0.000) 7.008 4.589 ( 0.000 -2.203 0.000) 2.203 4.658 ( 0.000 -7.517 0.000) 7.517 4.742 ( 0.000 -2.833 0.000) 2.833 4.820 ( 0.000 -5.014 0.000) 5.014 4.927 ( 0.000 10.119 0.000) 10.119 4.932 ( 0.000 -1.919 0.000) 1.919 5.035 ( 0.000 8.044 0.000) 8.044 5.136 ( 0.000 4.269 0.000) 4.269 5.137 ( 0.000 1.162 0.000) 1.162 5.219 ( 0.000 2.656 0.000) 2.656 5.403 ( 0.000 2.627 0.000) 2.627 5.429 ( 0.000 -0.260 0.000) 0.260 5.490 ( 0.000 7.736 0.000) 7.736 5.576 ( 0.000 6.290 0.000) 6.290 5.628 ( 0.000 -0.394 0.000) 0.394 5.639 ( 0.000 -5.471 0.000) 5.471 5.687 ( 0.000 -3.105 0.000) 3.105 5.842 ( 0.000 1.965 0.000) 1.965 5.870 ( 0.000 -0.277 0.000) 0.277 6.049 ( 0.000 -4.222 0.000) 4.222 6.084 ( 0.000 -0.007 0.000) 0.007 6.091 ( 0.000 2.874 0.000) 2.874 6.143 ( 0.000 3.153 0.000) 3.153 6.175 ( 0.000 2.306 0.000) 2.306 6.263 ( 0.000 -4.088 0.000) 4.088 6.346 ( 0.000 0.236 0.000) 0.236 6.409 ( 0.000 0.671 0.000) 0.671 6.430 ( 0.000 0.142 0.000) 0.142 6.483 ( 0.000 -6.279 0.000) 6.279 6.666 ( 0.000 0.238 0.000) 0.238 6.677 ( 0.000 0.284 0.000) 0.284 6.701 ( 0.000 -1.311 0.000) 1.311 6.772 ( 0.000 6.523 0.000) 6.523 6.860 ( 0.000 -6.543 0.000) 6.543 6.920 ( 0.000 -2.455 0.000) 2.455 6.937 ( 0.000 -1.776 0.000) 1.776 7.057 ( 0.000 2.313 0.000) 2.313 7.159 ( 0.000 -6.936 0.000) 6.936 7.178 ( 0.000 -2.616 0.000) 2.616 7.312 ( 0.000 3.546 0.000) 3.546 7.328 ( 0.000 2.900 0.000) 2.900 7.454 ( 0.000 -2.722 0.000) 2.722 7.530 ( 0.000 -8.810 0.000) 8.810 7.721 ( 0.000 -4.170 0.000) 4.170 7.763 ( 0.000 0.352 0.000) 0.352 7.920 ( 0.000 -0.098 0.000) 0.098 7.989 ( 0.000 5.612 0.000) 5.612 8.174 ( 0.000 1.802 0.000) 1.802 8.283 ( 0.000 8.167 0.000) 8.167 8.362 ( 0.000 -7.172 0.000) 7.172 8.396 ( 0.000 4.143 0.000) 4.143 8.533 ( 0.000 -1.635 0.000) 1.635 8.612 ( 0.000 -0.679 0.000) 0.679 8.755 ( 0.000 1.707 0.000) 1.707 8.795 ( 0.000 -3.663 0.000) 3.663 8.851 ( 0.000 -1.008 0.000) 1.008 8.980 ( 0.000 4.759 0.000) 4.759 8.982 ( 0.000 -6.354 0.000) 6.354 9.217 ( 0.000 -1.938 0.000) 1.938 9.283 ( 0.000 0.409 0.000) 0.409 9.286 ( 0.000 -0.480 0.000) 0.480 9.582 ( 0.000 -1.589 0.000) 1.589 9.657 ( 0.000 -3.402 0.000) 3.402 9.913 ( 0.000 -0.681 0.000) 0.681 10.063 ( 0.000 -2.998 0.000) 2.998 10.164 ( 0.000 -1.899 0.000) 1.899 10.201 ( 0.000 -2.514 0.000) 2.514 10.313 ( 0.000 3.932 0.000) 3.932 10.520 ( 0.000 4.682 0.000) 4.682 10.648 ( 0.000 8.340 0.000) 8.340 12.069 ( 0.000 -10.173 0.000) 10.173 16.348 ( 0.000 -0.111 0.000) 0.111 16.354 ( 0.000 -0.182 0.000) 0.182 16.851 ( 0.000 -0.592 0.000) 0.592 16.856 ( 0.000 -0.771 0.000) 0.771 17.533 ( 0.000 -1.665 0.000) 1.665 17.536 ( 0.000 -3.348 0.000) 3.348 17.614 ( 0.000 1.073 0.000) 1.073 17.647 ( 0.000 0.387 0.000) 0.387 17.789 ( 0.000 -0.130 0.000) 0.130 17.812 ( 0.000 -1.430 0.000) 1.430 17.819 ( 0.000 -0.205 0.000) 0.205 17.980 ( 0.000 -7.408 0.000) 7.408 18.603 ( 0.000 15.506 0.000) 15.506 18.825 ( 0.000 6.829 0.000) 6.829 19.341 ( 0.000 -3.859 0.000) 3.859 19.504 ( 0.000 -2.943 0.000) 2.943 21.235 ( 0.000 0.331 0.000) 0.331 21.263 ( 0.000 -0.086 0.000) 0.086 21.421 ( 0.000 -0.020 0.000) 0.020 21.434 ( 0.000 -0.239 0.000) 0.239 21.925 ( 0.000 0.586 0.000) 0.586 21.989 ( 0.000 -0.491 0.000) 0.491 22.053 ( 0.000 0.155 0.000) 0.155 22.065 ( 0.000 -0.152 0.000) 0.152 26.940 ( 0.000 1.042 0.000) 1.042 27.029 ( 0.000 1.573 0.000) 1.573 27.110 ( 0.000 -1.728 0.000) 1.728 27.165 ( 0.000 -0.411 0.000) 0.411 27.677 ( 0.000 0.381 0.000) 0.381 27.708 ( 0.000 -0.225 0.000) 0.225 27.798 ( 0.000 0.665 0.000) 0.665 27.824 ( 0.000 0.459 0.000) 0.459 35.815 ( 0.000 1.954 0.000) 1.954 35.816 ( 0.000 0.542 0.000) 0.542 35.966 ( 0.000 0.968 0.000) 0.968 36.083 ( 0.000 3.228 0.000) 3.228 36.261 ( 0.000 1.124 0.000) 1.124 36.370 ( 0.000 1.819 0.000) 1.819 36.560 ( 0.000 0.284 0.000) 0.284 36.723 ( 0.000 3.499 0.000) 3.499 36.818 ( 0.000 -3.954 0.000) 3.954 36.975 ( 0.000 2.944 0.000) 2.944 37.480 ( 0.000 -8.625 0.000) 8.625 38.019 ( 0.000 -12.079 0.000) 12.079 39.431 ( 0.000 3.810 0.000) 3.810 39.617 ( 0.000 -0.629 0.000) 0.629 41.014 ( 0.000 8.128 0.000) 8.128 41.801 ( 0.000 -5.170 0.000) 5.170 ======================= Grid point 10 (7/92) ======================= q-point: ( 0.11 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.699 ( 5.863 23.001 18.010) 29.795 1.033 ( 34.091 11.475 13.664) 38.478 1.434 ( 4.571 49.481 3.624) 49.824 1.882 ( 3.751 3.861 -1.893) 5.707 2.003 ( 4.317 2.340 -2.912) 5.708 2.067 ( 1.295 -4.199 -4.849) 6.544 2.130 ( 8.207 7.611 2.448) 11.457 2.254 ( 11.266 -13.527 -0.277) 17.606 2.432 ( 7.805 7.704 -1.512) 11.070 2.624 ( 6.973 0.907 1.784) 7.254 2.694 ( 7.905 1.039 -0.850) 8.018 2.851 ( 2.663 -3.390 1.200) 4.475 2.985 ( 9.078 -1.727 1.468) 9.357 3.096 ( 5.129 -7.048 5.510) 10.313 3.251 ( 7.487 4.471 5.214) 10.161 3.358 ( 5.875 -3.218 0.209) 6.701 3.583 ( 1.588 -1.607 0.502) 2.314 3.788 ( 0.404 0.788 1.971) 2.161 3.838 ( -0.593 2.105 -2.006) 2.968 4.032 ( -4.034 -2.778 -0.540) 4.928 4.062 ( -2.946 2.159 2.269) 4.300 4.167 ( 1.341 -0.263 8.553) 8.661 4.254 ( -2.944 0.899 0.522) 3.122 4.371 ( -9.084 4.272 2.288) 10.295 4.439 ( -11.240 -4.335 -2.422) 12.288 4.540 ( -5.257 -1.786 -3.612) 6.624 4.599 ( -6.386 -0.228 -2.544) 6.878 4.677 ( 0.178 -3.189 -1.927) 3.731 4.787 ( -0.012 3.132 -0.188) 3.138 4.944 ( 2.925 -0.367 -1.654) 3.380 4.981 ( -1.021 6.008 1.968) 6.404 5.102 ( 3.659 3.374 -0.514) 5.004 5.152 ( 0.945 -1.956 7.984) 8.274 5.249 ( 7.298 -0.183 -3.509) 8.100 5.290 ( 8.194 4.398 0.249) 9.303 5.376 ( 0.022 2.395 -2.513) 3.472 5.411 ( -0.728 4.991 -0.949) 5.132 5.519 ( 5.517 -0.020 -1.478) 5.712 5.576 ( -4.031 0.332 -0.786) 4.121 5.610 ( 0.884 -1.322 -3.842) 4.158 5.675 ( 2.354 -1.498 1.836) 3.340 5.732 ( 3.319 -4.645 0.382) 5.722 5.819 ( 0.015 1.130 -3.556) 3.732 5.861 ( -1.516 -0.320 0.863) 1.773 5.993 ( -2.427 -0.039 0.026) 2.427 6.068 ( -3.882 2.810 -2.583) 5.444 6.097 ( -0.333 -0.106 5.569) 5.580 6.143 ( -0.784 -0.521 1.405) 1.691 6.145 ( 1.157 3.825 -2.698) 4.822 6.245 ( -2.144 -1.658 -0.123) 2.713 6.334 ( -0.510 1.963 -0.310) 2.052 6.416 ( -1.141 -0.576 1.279) 1.808 6.430 ( -3.750 -2.861 2.499) 5.338 6.559 ( 4.892 -3.877 -8.621) 10.644 6.589 ( -5.570 -6.087 2.911) 8.749 6.693 ( 2.595 -1.805 0.400) 3.186 6.722 ( 2.056 0.055 -1.003) 2.289 6.760 ( -6.116 2.219 2.227) 6.877 6.876 ( 3.302 -6.095 -5.157) 8.640 6.889 ( 2.194 -1.619 -4.170) 4.983 6.963 ( 3.085 -4.990 0.826) 5.925 7.062 ( -0.815 -3.658 -5.652) 6.781 7.104 ( -0.771 4.769 -10.347) 11.419 7.204 ( 9.849 4.392 -2.231) 11.013 7.331 ( 3.030 1.601 2.300) 4.128 7.415 ( 3.378 -4.039 -0.530) 5.291 7.478 ( 2.716 -3.667 3.371) 5.673 7.587 ( 1.564 -2.691 -2.930) 4.275 7.650 ( 8.303 3.395 0.833) 9.008 7.833 ( 0.383 -0.325 -3.906) 3.939 7.958 ( 6.985 -3.892 -1.817) 8.200 8.001 ( -0.341 2.018 2.272) 3.058 8.175 ( -0.293 3.712 0.794) 3.808 8.281 ( -0.186 4.828 3.324) 5.864 8.322 ( -0.645 -4.023 -2.740) 4.910 8.414 ( -2.006 4.136 8.064) 9.282 8.588 ( 3.422 -1.830 -0.476) 3.909 8.623 ( -0.627 -0.450 0.379) 0.860 8.740 ( -4.258 0.026 2.860) 5.129 8.809 ( -0.870 3.029 -0.593) 3.207 8.830 ( 2.335 -1.729 3.079) 4.234 8.965 ( 2.005 -6.361 -3.161) 7.380 9.045 ( -6.298 4.249 -4.223) 8.692 9.143 ( 4.956 0.670 0.608) 5.038 9.222 ( -1.433 -1.134 -0.905) 2.039 9.323 ( -0.504 0.027 -0.077) 0.511 9.544 ( -3.093 -1.216 -0.764) 3.410 9.632 ( -6.345 0.730 11.325) 13.002 10.004 ( 3.866 -5.805 -0.108) 6.975 10.076 ( 1.149 -2.426 0.363) 2.709 10.181 ( 1.637 -0.654 0.012) 1.763 10.293 ( 4.665 -1.999 6.119) 7.950 10.363 ( 5.993 2.416 0.012) 6.462 10.587 ( 4.422 10.669 -0.634) 11.566 10.715 ( 7.208 -1.284 8.565) 11.268 11.940 ( 2.022 -7.447 -23.976) 25.187 16.361 ( 1.401 -0.163 0.127) 1.416 16.367 ( 1.576 -0.021 0.144) 1.583 16.833 ( -1.651 -0.771 -0.327) 1.851 16.852 ( -0.716 -0.694 0.086) 1.001 17.498 ( -1.159 -1.994 -0.043) 2.306 17.541 ( -0.504 -2.724 0.593) 2.833 17.615 ( 0.212 0.382 0.196) 0.479 17.646 ( -1.280 0.019 0.738) 1.478 17.778 ( -1.710 -0.549 0.700) 1.927 17.796 ( -1.260 -1.140 -0.631) 1.813 17.807 ( -1.368 0.089 -0.544) 1.475 17.960 ( -2.111 -6.569 0.073) 6.900 18.592 ( -1.152 14.972 -0.309) 15.019 18.642 ( -7.995 16.659 -3.115) 18.739 19.348 ( -2.606 -4.904 3.278) 6.449 19.467 ( -3.680 -2.983 -0.811) 4.806 21.255 ( 0.859 -0.047 0.030) 0.861 21.338 ( 5.384 -4.356 -2.827) 7.480 21.426 ( 0.465 -0.063 0.076) 0.476 21.436 ( 0.816 -0.734 0.110) 1.103 21.929 ( 0.446 0.647 -0.009) 0.786 21.981 ( -1.357 1.788 1.229) 2.560 22.027 ( 1.619 -0.094 -4.273) 4.570 22.075 ( 1.730 0.501 -1.762) 2.519 26.945 ( 0.272 1.022 0.374) 1.122 27.017 ( -0.676 1.284 -1.131) 1.840 27.119 ( 0.354 -1.435 0.999) 1.784 27.154 ( -0.728 -0.731 -0.178) 1.047 27.669 ( -0.970 0.281 0.294) 1.052 27.707 ( -0.336 0.038 0.352) 0.488 27.783 ( -1.344 0.649 -0.528) 1.583 27.816 ( -0.513 0.013 0.264) 0.577 35.665 ( -2.641 5.500 -0.470) 6.119 35.776 ( -3.836 1.525 0.589) 4.170 36.041 ( -2.252 2.845 -3.366) 4.949 36.073 ( -10.632 -1.756 20.200) 22.894 36.231 ( -2.567 2.639 -0.402) 3.703 36.387 ( 0.024 0.042 3.068) 3.069 36.489 ( -1.671 4.705 -0.071) 4.993 36.690 ( 7.847 4.223 -3.053) 9.420 36.902 ( 3.283 3.554 -0.050) 4.838 37.371 ( -4.089 -14.746 0.909) 15.329 37.799 ( 25.141 -29.883 5.370) 39.419 38.208 ( 20.810 -28.450 14.592) 38.150 39.475 ( 3.850 3.902 2.370) 5.972 39.659 ( 4.615 -0.470 0.217) 4.644 40.906 ( -10.722 13.193 -5.093) 17.747 41.326 ( -26.531 18.638 -11.335) 34.347 ======================= Grid point 11 (8/92) ======================= q-point: ( 0.22 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.055 ( 13.707 14.657 18.841) 27.527 1.361 ( 3.965 45.442 6.691) 46.103 1.701 ( 9.893 1.409 3.659) 10.641 1.911 ( 1.996 3.025 -0.018) 3.625 2.045 ( 4.298 -2.595 -1.828) 5.343 2.187 ( 15.740 3.337 -8.170) 18.046 2.333 ( 5.037 3.002 0.054) 5.864 2.462 ( 13.027 10.894 0.301) 16.985 2.541 ( 14.146 -2.415 4.005) 14.899 2.794 ( 8.602 -5.922 5.404) 11.758 2.846 ( 6.126 -3.040 3.527) 7.695 2.973 ( 8.608 -0.660 3.153) 9.191 3.148 ( 6.597 -2.979 3.786) 8.169 3.305 ( 9.428 -4.675 3.789) 11.185 3.393 ( 7.444 -0.496 1.032) 7.531 3.514 ( 6.421 -2.040 8.098) 10.534 3.565 ( -2.277 -1.758 -1.873) 3.433 3.819 ( -3.765 -1.994 1.870) 4.653 3.831 ( 1.986 -2.482 2.902) 4.304 3.959 ( -2.764 -4.559 1.683) 5.591 4.026 ( -6.893 -3.503 0.473) 7.747 4.096 ( -5.449 2.617 -0.527) 6.068 4.217 ( -4.289 10.822 4.584) 12.511 4.262 ( -5.660 6.699 0.734) 8.800 4.361 ( -0.673 -1.312 -0.529) 1.567 4.426 ( -2.471 -0.378 2.093) 3.260 4.493 ( -1.010 3.739 -1.877) 4.304 4.684 ( 1.209 2.995 -1.649) 3.626 4.788 ( 0.730 5.237 -2.980) 6.069 4.907 ( -1.313 0.795 -4.857) 5.094 4.983 ( -2.321 3.283 2.461) 4.714 5.127 ( -1.013 -1.545 3.933) 4.345 5.196 ( -1.842 1.408 -1.386) 2.701 5.282 ( -1.439 1.965 -1.843) 3.054 5.372 ( 3.734 1.683 -3.871) 5.636 5.409 ( -1.627 2.071 2.011) 3.313 5.465 ( 8.047 -3.440 -1.467) 8.874 5.496 ( -0.156 3.096 0.347) 3.119 5.550 ( -1.531 -2.619 -4.005) 5.024 5.627 ( 4.999 2.485 -3.380) 6.526 5.665 ( -0.528 -2.649 -3.066) 4.086 5.754 ( 0.576 -2.008 -4.377) 4.850 5.818 ( 3.988 0.143 -1.716) 4.344 5.871 ( 0.451 -1.270 0.877) 1.607 5.959 ( -1.281 1.530 -2.274) 3.026 5.971 ( -4.961 2.418 -1.949) 5.853 6.055 ( -2.592 0.492 -1.429) 3.001 6.144 ( 0.506 -1.352 0.925) 1.715 6.220 ( 1.998 -1.414 7.028) 7.442 6.238 ( 2.135 1.770 1.274) 3.052 6.354 ( 2.281 1.106 0.128) 2.538 6.401 ( -0.212 -0.038 0.418) 0.471 6.437 ( 0.171 1.401 4.701) 4.908 6.500 ( -3.986 -4.889 1.269) 6.434 6.526 ( -2.502 -4.197 -7.212) 8.711 6.632 ( -5.624 -0.661 1.277) 5.805 6.710 ( 1.380 -0.983 -1.936) 2.572 6.769 ( -2.457 -2.779 -4.382) 5.741 6.868 ( -1.392 -1.103 -1.211) 2.150 6.883 ( 4.550 -3.647 -3.504) 6.803 6.930 ( -1.673 7.227 -9.735) 12.239 7.005 ( 5.192 -0.837 -6.178) 8.113 7.122 ( 7.084 -5.976 -0.401) 9.277 7.331 ( 6.715 2.947 -7.105) 10.211 7.434 ( -1.093 -8.289 0.638) 8.385 7.467 ( 7.815 -0.143 0.607) 7.840 7.512 ( 5.751 -2.209 -3.195) 6.940 7.635 ( 1.287 -1.115 3.533) 3.922 7.794 ( 4.386 -2.985 -7.796) 9.430 7.861 ( 7.468 4.673 4.697) 9.983 7.959 ( 2.198 0.790 -7.503) 7.858 8.105 ( 4.334 -3.631 5.029) 7.567 8.182 ( -1.381 2.465 -2.405) 3.710 8.255 ( 0.884 -4.102 0.395) 4.215 8.357 ( 1.709 3.581 3.729) 5.445 8.486 ( -1.052 4.564 9.326) 10.437 8.574 ( -2.874 -0.851 -0.941) 3.141 8.600 ( -1.121 0.822 -0.190) 1.403 8.753 ( 2.470 -1.663 2.700) 4.020 8.789 ( 0.111 3.626 -2.257) 4.272 8.873 ( -5.189 0.715 0.320) 5.248 8.907 ( 2.563 -2.153 1.305) 3.593 9.022 ( 3.436 0.292 -0.532) 3.489 9.178 ( -1.002 -0.865 -3.980) 4.194 9.221 ( 0.618 1.287 1.397) 1.998 9.318 ( -0.303 0.508 1.528) 1.639 9.501 ( -0.798 -0.217 0.488) 0.960 9.653 ( -1.222 3.132 6.498) 7.316 10.047 ( 1.302 -4.824 1.587) 5.243 10.097 ( 0.666 0.019 0.688) 0.958 10.223 ( 2.458 -0.123 2.047) 3.201 10.417 ( 3.443 -1.402 2.982) 4.766 10.506 ( 11.904 1.763 -0.512) 12.044 10.651 ( 7.501 9.686 -3.839) 12.838 11.020 ( 9.763 -6.820 18.328) 21.857 11.731 ( -2.946 -7.971 -19.797) 21.543 16.400 ( 3.315 -0.048 -0.227) 3.323 16.412 ( 3.140 -0.031 0.843) 3.252 16.795 ( -2.711 -1.128 0.233) 2.946 16.828 ( -2.477 -0.481 0.467) 2.566 17.498 ( -0.069 -3.285 0.877) 3.400 17.537 ( 0.139 -2.566 -0.447) 2.609 17.611 ( -1.471 0.396 -0.112) 1.527 17.633 ( 0.298 -0.801 0.280) 0.899 17.744 ( -2.930 -0.657 -0.734) 3.091 17.752 ( -2.256 0.541 -1.564) 2.798 17.772 ( -2.443 -1.111 0.908) 2.834 17.915 ( -3.227 -5.404 0.365) 6.304 18.547 ( -2.574 13.070 -0.570) 13.333 18.562 ( -1.558 14.238 -0.892) 14.351 19.315 ( -3.679 -4.580 1.816) 6.149 19.379 ( -4.973 -3.019 -1.088) 5.919 21.277 ( 1.569 -0.046 0.437) 1.629 21.350 ( 0.343 -1.525 -2.488) 2.938 21.432 ( 0.194 -0.089 -0.094) 0.234 21.465 ( 2.035 -2.013 -0.555) 2.916 21.939 ( 0.714 0.799 0.023) 1.072 21.978 ( 0.171 2.295 0.127) 2.305 22.028 ( 1.808 -0.767 -2.549) 3.218 22.094 ( 1.288 0.035 0.110) 1.294 26.956 ( 0.539 1.024 0.449) 1.241 26.993 ( -0.688 1.070 -1.105) 1.685 27.130 ( -0.159 -1.613 0.254) 1.641 27.143 ( -0.327 -1.016 0.177) 1.082 27.657 ( -0.762 0.313 0.589) 1.012 27.705 ( -0.398 0.275 0.595) 0.767 27.749 ( -1.800 0.542 -0.593) 1.971 27.810 ( -0.729 -0.458 0.284) 0.907 35.648 ( -2.939 3.524 2.615) 5.281 35.755 ( 0.661 -0.460 3.604) 3.693 35.954 ( -3.384 3.685 -3.850) 6.313 36.026 ( -12.036 0.279 13.439) 18.043 36.166 ( -3.047 4.820 -2.331) 6.160 36.404 ( -2.801 -1.645 -0.752) 3.335 36.466 ( -1.170 -2.186 1.851) 3.094 36.808 ( 5.926 3.125 -1.072) 6.785 36.962 ( 3.087 8.739 -0.177) 9.270 37.271 ( -2.092 -8.755 -4.001) 9.850 38.062 ( 12.028 -18.209 1.025) 21.847 38.670 ( 13.826 -34.806 8.442) 38.392 39.604 ( 7.508 3.742 3.751) 9.190 39.767 ( 7.975 0.615 -0.765) 8.035 40.592 ( -15.969 20.977 -5.373) 26.905 40.944 ( -13.230 8.362 -5.456) 16.575 ======================= Grid point 12 (9/92) ======================= q-point: ( 0.33 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( 8.931 13.417 16.994) 23.421 1.514 ( 9.735 37.793 4.440) 39.279 1.792 ( 3.477 -3.422 -1.440) 5.087 1.960 ( 2.337 1.981 1.267) 3.315 2.094 ( 3.463 -4.022 -3.025) 6.109 2.311 ( -1.346 1.074 -3.747) 4.123 2.382 ( 10.601 6.246 -2.856) 12.632 2.600 ( 8.130 13.971 -1.185) 16.208 2.815 ( 2.778 -8.773 7.458) 11.845 2.976 ( 4.060 -5.300 4.507) 8.055 2.984 ( 3.825 -3.131 2.659) 5.613 3.171 ( 13.265 2.639 -2.826) 13.817 3.291 ( 6.776 -2.357 5.265) 8.899 3.413 ( 3.734 -5.791 -0.218) 6.894 3.495 ( -4.346 -4.858 2.077) 6.841 3.531 ( 0.895 0.268 1.839) 2.063 3.693 ( 6.496 -4.987 5.973) 10.136 3.781 ( -6.327 -1.950 6.447) 9.241 3.822 ( -0.686 0.587 -1.056) 1.390 3.900 ( -0.157 -2.478 6.101) 6.587 4.020 ( -2.063 2.134 1.505) 3.328 4.039 ( 0.409 -2.026 -3.366) 3.950 4.175 ( -0.914 5.442 0.682) 5.560 4.247 ( -3.638 -0.168 -2.056) 4.182 4.370 ( 4.846 4.094 4.989) 8.071 4.412 ( 4.112 6.890 -2.825) 8.506 4.589 ( 1.222 11.358 8.472) 14.223 4.685 ( 1.595 -0.540 2.408) 2.938 4.727 ( -1.389 -2.718 -5.656) 6.427 4.887 ( 3.147 5.452 -2.417) 6.743 4.958 ( -2.408 4.413 1.427) 5.226 5.109 ( -2.072 0.164 -5.181) 5.582 5.158 ( -1.534 -1.138 2.956) 3.520 5.206 ( -1.774 0.600 -2.119) 2.828 5.356 ( -2.506 -4.855 -7.690) 9.433 5.389 ( -3.698 3.672 1.302) 5.372 5.435 ( 2.042 3.672 2.037) 4.669 5.468 ( -4.218 -0.293 -3.781) 5.672 5.568 ( 0.372 0.167 -0.892) 0.980 5.610 ( 1.430 -0.812 -2.920) 3.351 5.691 ( 0.506 2.821 -3.053) 4.188 5.759 ( 3.567 2.075 -3.167) 5.202 5.837 ( -2.775 -0.025 -0.212) 2.784 5.877 ( 0.894 -0.258 2.262) 2.445 5.909 ( -0.366 1.978 2.494) 3.204 5.947 ( 3.023 0.095 -3.641) 4.733 6.019 ( -1.358 -2.381 0.273) 2.755 6.190 ( 2.462 0.329 -2.217) 3.329 6.244 ( -4.568 0.314 -2.243) 5.098 6.295 ( 3.520 2.457 -3.540) 5.564 6.372 ( -0.148 -2.635 -3.280) 4.210 6.411 ( 0.742 2.303 -0.395) 2.452 6.433 ( 3.448 1.218 -4.888) 6.104 6.469 ( -1.820 -3.166 8.569) 9.315 6.509 ( 1.319 0.988 3.920) 4.253 6.584 ( -0.718 -5.145 -0.219) 5.200 6.610 ( -5.249 -0.175 -8.537) 10.023 6.713 ( -2.752 1.625 1.399) 3.488 6.817 ( 1.091 5.425 -3.967) 6.809 6.838 ( -0.723 -2.701 0.275) 2.810 6.999 ( 3.159 -3.315 1.818) 4.927 7.075 ( 6.717 -1.151 -1.485) 6.975 7.199 ( 0.581 -4.804 -1.293) 5.009 7.328 ( 2.541 -5.522 -5.019) 7.883 7.422 ( 0.598 -7.118 -2.279) 7.497 7.525 ( 4.972 0.439 -3.354) 6.014 7.620 ( 0.396 -4.820 -5.528) 7.345 7.656 ( 5.521 -3.525 0.300) 6.557 7.819 ( 2.850 2.195 -3.076) 4.734 7.883 ( 2.049 1.249 -8.923) 9.240 8.016 ( 1.215 6.342 1.354) 6.598 8.092 ( -1.583 -9.586 -0.422) 9.725 8.193 ( 0.158 -0.983 3.923) 4.047 8.346 ( 4.310 -0.809 3.221) 5.441 8.423 ( 2.073 3.045 1.550) 3.996 8.467 ( -1.842 3.404 -0.574) 3.913 8.589 ( -0.628 -1.389 3.730) 4.029 8.603 ( -0.010 2.033 5.716) 6.067 8.769 ( 0.275 5.025 -0.399) 5.048 8.826 ( 4.967 4.296 -2.861) 7.163 8.849 ( -1.245 -5.274 6.283) 8.297 8.965 ( 2.856 -2.304 -0.588) 3.716 9.068 ( 1.714 0.903 0.210) 1.949 9.122 ( -0.498 1.314 -4.336) 4.558 9.199 ( -2.686 0.226 -0.283) 2.710 9.341 ( 0.093 1.411 3.142) 3.445 9.526 ( 1.855 1.770 1.283) 2.868 9.698 ( 0.959 5.567 2.697) 6.260 10.084 ( 1.386 -3.437 1.049) 3.852 10.117 ( 0.595 2.247 1.413) 2.721 10.311 ( 4.295 -4.345 3.990) 7.297 10.473 ( 3.180 1.925 -0.589) 3.763 10.712 ( 9.344 0.559 0.206) 9.363 10.823 ( 16.883 3.036 -1.663) 17.234 11.291 ( 0.999 -7.770 15.683) 17.531 11.474 ( -8.298 -6.006 -13.024) 16.570 16.472 ( 5.202 0.054 -0.190) 5.206 16.486 ( 4.341 0.026 0.805) 4.415 16.745 ( -3.691 -1.277 0.696) 3.967 16.775 ( -4.253 -0.533 0.588) 4.327 17.489 ( -1.099 -1.591 -0.593) 2.022 17.537 ( 0.422 -1.830 -1.075) 2.164 17.600 ( 0.223 -1.906 1.058) 2.191 17.649 ( 0.977 -0.923 0.127) 1.351 17.658 ( -4.208 -0.283 -2.164) 4.740 17.709 ( -1.578 0.247 -1.441) 2.151 17.748 ( -1.831 -1.842 2.105) 3.343 17.859 ( -3.571 -3.775 0.088) 5.198 18.512 ( -1.275 11.326 -0.505) 11.409 18.531 ( -0.946 12.025 -0.787) 12.088 19.264 ( -3.209 -4.316 0.426) 5.395 19.294 ( -3.721 -3.165 -0.512) 4.912 21.315 ( 1.945 -0.280 0.876) 2.151 21.330 ( -0.225 -0.355 -1.291) 1.358 21.427 ( -0.453 -0.211 -0.590) 0.773 21.487 ( 1.146 -1.634 -0.548) 2.069 21.952 ( 0.666 0.975 0.058) 1.182 21.984 ( 0.488 1.752 -0.075) 1.821 22.035 ( 1.019 -0.442 -1.347) 1.745 22.118 ( 0.979 -0.691 0.685) 1.380 26.967 ( 0.151 0.656 -0.169) 0.694 26.979 ( 0.042 1.319 -0.004) 1.320 27.119 ( -0.550 -1.937 -0.586) 2.097 27.146 ( -0.006 -1.064 0.493) 1.172 27.656 ( 0.002 0.635 0.662) 0.918 27.703 ( -0.393 0.368 0.518) 0.747 27.717 ( -1.208 0.391 -0.495) 1.363 27.795 ( -1.075 -0.415 0.085) 1.156 35.633 ( -1.179 2.965 3.709) 4.893 35.818 ( 0.983 -0.251 1.344) 1.684 35.876 ( -2.181 0.730 -0.718) 2.410 35.940 ( -7.886 1.597 7.696) 11.134 36.108 ( -1.858 5.473 -0.730) 5.826 36.241 ( -10.290 -2.106 -5.109) 11.680 36.494 ( -0.009 -5.091 3.379) 6.110 36.774 ( -5.963 -1.698 -4.389) 7.597 37.029 ( 6.199 10.385 -1.762) 12.222 37.295 ( 5.418 1.251 0.014) 5.560 38.284 ( 11.492 -18.125 1.656) 21.525 38.872 ( 5.555 -24.437 2.602) 25.196 39.768 ( 7.611 4.930 0.662) 9.092 39.911 ( 10.175 3.827 -0.770) 10.898 40.342 ( -10.183 12.824 0.585) 16.385 40.677 ( -12.921 4.294 -4.960) 14.491 ======================= Grid point 13 (10/92) ======================= q-point: ( 0.44 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 1.500 32.905 4.547) 33.252 1.747 ( 4.818 3.345 4.081) 7.145 1.847 ( 5.213 0.562 -1.362) 5.417 2.014 ( 3.121 2.159 1.151) 3.966 2.107 ( -0.401 -4.480 -0.181) 4.502 2.218 ( -4.040 2.390 -2.970) 5.555 2.512 ( 5.507 3.769 -0.883) 6.732 2.707 ( 2.996 18.673 1.426) 18.965 2.884 ( 1.584 -6.263 2.040) 6.775 2.971 ( -2.486 -4.736 -0.148) 5.351 3.062 ( -0.133 -6.784 4.208) 7.984 3.228 ( 1.566 -2.486 -1.977) 3.541 3.340 ( -3.888 -5.727 -7.491) 10.199 3.484 ( 6.505 -1.072 -0.753) 6.636 3.510 ( -3.441 -1.445 6.992) 7.926 3.570 ( 4.893 1.563 8.571) 9.993 3.718 ( -3.304 4.068 -4.703) 7.042 3.781 ( 3.108 0.199 -1.487) 3.451 3.907 ( -3.917 -0.448 -3.352) 5.175 3.918 ( 2.137 -0.114 4.593) 5.067 3.985 ( 1.538 -3.563 3.687) 5.353 4.078 ( 5.560 -3.081 -0.037) 6.357 4.158 ( -1.643 -3.882 -0.079) 4.216 4.191 ( -2.577 4.880 -0.282) 5.525 4.390 ( -0.211 4.518 1.701) 4.832 4.526 ( 1.283 5.014 -0.061) 5.176 4.566 ( -2.569 7.266 -1.819) 7.918 4.714 ( -0.546 0.230 0.185) 0.620 4.819 ( 5.450 -4.564 7.529) 10.355 4.933 ( -1.119 2.104 -0.279) 2.399 4.961 ( 3.904 -1.124 -5.339) 6.708 5.051 ( 0.055 -0.097 5.540) 5.541 5.175 ( 2.342 -0.498 -1.771) 2.978 5.204 ( 1.051 2.696 0.541) 2.944 5.264 ( 0.104 0.504 0.439) 0.676 5.367 ( -1.262 2.609 0.010) 2.898 5.379 ( -2.629 1.381 -0.240) 2.979 5.488 ( 1.500 5.289 1.596) 5.725 5.552 ( -3.622 3.155 -0.366) 4.817 5.572 ( -0.541 4.577 -5.297) 7.021 5.638 ( -0.224 -0.687 -1.244) 1.439 5.721 ( -1.871 6.543 -3.322) 7.572 5.855 ( 1.403 -2.968 0.970) 3.424 5.906 ( -1.583 0.603 -1.094) 2.017 5.927 ( 0.943 -1.270 2.330) 2.816 5.979 ( -3.584 -0.857 -0.847) 3.781 5.986 ( 0.912 -0.426 -3.950) 4.076 6.071 ( 1.650 0.935 -2.001) 2.757 6.162 ( -3.622 1.438 -2.279) 4.514 6.323 ( 1.511 0.582 -0.594) 1.725 6.374 ( 1.515 -0.332 -1.556) 2.197 6.400 ( -1.675 0.783 -2.447) 3.067 6.464 ( -0.302 2.558 -4.239) 4.960 6.477 ( 2.369 3.842 1.339) 4.708 6.518 ( 0.223 1.708 0.467) 1.785 6.566 ( -1.208 -5.289 4.133) 6.820 6.630 ( 2.285 -1.427 0.008) 2.693 6.675 ( -0.919 0.643 2.892) 3.102 6.796 ( -0.662 -0.976 -0.632) 1.338 6.898 ( 3.168 -1.466 2.813) 4.483 7.024 ( 0.145 -1.849 -0.454) 1.910 7.102 ( -4.712 -5.260 -1.664) 7.255 7.189 ( 3.962 2.373 -0.410) 4.636 7.331 ( 0.807 -7.048 -3.733) 8.017 7.436 ( 1.829 -8.405 1.269) 8.695 7.534 ( 0.716 -4.920 -5.879) 7.699 7.625 ( 3.432 -3.216 -0.265) 4.711 7.683 ( -3.446 -4.401 3.842) 6.783 7.789 ( 0.657 -3.379 -6.120) 7.021 7.871 ( 1.923 6.737 -3.000) 7.621 7.983 ( -1.314 5.801 0.113) 5.949 8.145 ( 1.972 -11.100 1.988) 11.448 8.194 ( -1.185 -1.695 0.219) 2.080 8.400 ( -0.483 2.888 2.392) 3.780 8.438 ( 1.084 3.456 -0.462) 3.651 8.468 ( 0.140 1.576 -0.915) 1.828 8.614 ( 0.540 1.782 1.011) 2.118 8.657 ( -0.315 -2.765 4.781) 5.532 8.794 ( 2.119 3.557 -0.838) 4.224 8.883 ( -1.076 1.383 6.556) 6.786 8.892 ( 3.897 -2.345 -3.811) 5.933 8.993 ( 1.597 -3.007 -0.094) 3.406 9.073 ( -0.193 4.738 -0.429) 4.761 9.096 ( 0.123 0.715 -2.244) 2.358 9.149 ( -1.857 0.294 -0.741) 2.021 9.366 ( -0.015 3.033 1.738) 3.496 9.561 ( 0.852 2.896 0.586) 3.075 9.725 ( 0.428 6.944 0.550) 6.979 10.108 ( 0.641 0.089 0.220) 0.684 10.138 ( 0.344 2.107 0.747) 2.262 10.393 ( 1.375 -8.000 1.241) 8.211 10.549 ( 3.907 0.963 1.650) 4.349 10.848 ( 6.704 -1.611 0.390) 6.906 11.111 ( 13.966 -1.363 -1.821) 14.150 11.190 ( -6.628 -2.818 -7.551) 10.435 11.364 ( -8.811 -5.852 8.969) 13.868 16.562 ( 3.597 0.218 0.408) 3.627 16.569 ( 5.634 0.111 -0.407) 5.650 16.679 ( -4.763 -0.804 0.689) 4.879 16.703 ( -3.720 -1.196 0.244) 3.915 17.467 ( -0.322 -0.561 -0.718) 0.966 17.538 ( 0.736 -0.287 -0.574) 0.977 17.577 ( -2.829 0.554 -0.708) 2.969 17.615 ( 0.084 -2.812 0.479) 2.853 17.674 ( 1.434 -3.386 -0.510) 3.713 17.680 ( -0.882 -1.453 0.225) 1.715 17.752 ( 0.682 -1.127 1.328) 1.871 17.797 ( -3.158 -1.943 -0.627) 3.761 18.492 ( -0.478 10.687 -0.313) 10.702 18.517 ( -0.246 10.510 -0.249) 10.515 19.224 ( -1.294 -4.032 -0.168) 4.238 19.248 ( -1.333 -3.441 0.022) 3.690 21.314 ( -0.148 -0.024 -0.506) 0.528 21.363 ( 1.863 -0.526 1.368) 2.370 21.405 ( -1.231 -0.154 -1.120) 1.671 21.496 ( 0.354 -1.362 -0.207) 1.422 21.961 ( 0.273 1.098 0.033) 1.132 21.990 ( 0.216 1.444 -0.035) 1.461 22.038 ( 0.309 -0.233 -0.430) 0.579 22.135 ( 0.363 -1.094 0.341) 1.202 26.961 ( -0.108 0.601 -0.251) 0.660 26.988 ( 0.260 1.389 0.287) 1.442 27.107 ( -0.247 -2.182 -0.296) 2.216 27.149 ( 0.004 -1.130 0.163) 1.142 27.666 ( 0.324 1.219 0.385) 1.318 27.699 ( -0.555 0.493 0.430) 0.858 27.701 ( -0.133 -0.180 -0.524) 0.570 27.780 ( -0.575 -0.203 0.000) 0.610 35.687 ( 2.357 2.941 4.334) 5.743 35.800 ( -0.661 2.604 -0.615) 2.756 35.825 ( -3.392 0.266 0.038) 3.403 35.949 ( 1.168 -1.894 0.471) 2.275 36.001 ( -7.762 -1.697 -2.330) 8.280 36.119 ( -0.316 4.975 0.684) 5.032 36.514 ( -0.123 -5.833 1.165) 5.949 36.637 ( -3.573 -2.311 -3.128) 5.282 37.100 ( 2.633 10.607 -0.591) 10.945 37.379 ( 2.761 5.137 0.573) 5.861 38.442 ( 4.702 -18.930 0.789) 19.521 38.944 ( 1.647 -19.416 0.620) 19.496 39.838 ( 2.280 9.980 -2.272) 10.486 40.115 ( 11.536 5.910 2.675) 13.235 40.249 ( -2.964 3.875 1.959) 5.258 40.413 ( -12.220 2.357 -3.970) 13.063 ======================= Grid point 18 (11/92) ======================= q-point: ( 0.00 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.806 ( 0.000 22.207 0.000) 22.207 1.173 ( 0.000 31.785 0.000) 31.785 1.612 ( 0.000 -14.408 0.000) 14.408 1.949 ( 0.000 -2.199 0.000) 2.199 1.981 ( 0.000 -0.814 0.000) 0.814 2.083 ( 0.000 2.439 0.000) 2.439 2.093 ( 0.000 1.713 0.000) 1.713 2.327 ( 0.000 -18.527 0.000) 18.527 2.479 ( 0.000 4.808 0.000) 4.808 2.593 ( 0.000 -0.155 0.000) 0.155 2.790 ( 0.000 -1.935 0.000) 1.935 2.813 ( 0.000 28.299 0.000) 28.299 2.864 ( 0.000 16.970 0.000) 16.970 3.140 ( 0.000 1.325 0.000) 1.325 3.236 ( 0.000 15.607 0.000) 15.607 3.281 ( 0.000 3.001 0.000) 3.001 3.517 ( 0.000 -0.351 0.000) 0.351 3.819 ( 0.000 2.098 0.000) 2.098 3.905 ( 0.000 -3.235 0.000) 3.235 4.048 ( 0.000 -6.787 0.000) 6.787 4.067 ( 0.000 7.370 0.000) 7.370 4.150 ( 0.000 3.789 0.000) 3.789 4.329 ( 0.000 1.581 0.000) 1.581 4.416 ( 0.000 -2.447 0.000) 2.447 4.463 ( 0.000 -2.297 0.000) 2.297 4.518 ( 0.000 -4.882 0.000) 4.882 4.571 ( 0.000 -2.176 0.000) 2.176 4.671 ( 0.000 -3.248 0.000) 3.248 4.686 ( 0.000 -8.127 0.000) 8.127 4.864 ( 0.000 -8.787 0.000) 8.787 5.087 ( 0.000 -1.081 0.000) 1.081 5.092 ( 0.000 5.472 0.000) 5.472 5.210 ( 0.000 6.657 0.000) 6.657 5.290 ( 0.000 9.085 0.000) 9.085 5.320 ( 0.000 6.063 0.000) 6.063 5.440 ( 0.000 1.678 0.000) 1.678 5.451 ( 0.000 1.407 0.000) 1.407 5.571 ( 0.000 0.737 0.000) 0.737 5.593 ( 0.000 -3.755 0.000) 3.755 5.638 ( 0.000 3.225 0.000) 3.225 5.680 ( 0.000 6.008 0.000) 6.008 5.694 ( 0.000 4.754 0.000) 4.754 5.840 ( 0.000 -0.636 0.000) 0.636 5.855 ( 0.000 -1.829 0.000) 1.829 5.941 ( 0.000 -5.606 0.000) 5.606 6.067 ( 0.000 -1.847 0.000) 1.847 6.073 ( 0.000 -4.634 0.000) 4.634 6.159 ( 0.000 -6.535 0.000) 6.535 6.230 ( 0.000 2.525 0.000) 2.525 6.249 ( 0.000 6.082 0.000) 6.082 6.338 ( 0.000 -5.188 0.000) 5.188 6.376 ( 0.000 2.326 0.000) 2.326 6.428 ( 0.000 0.567 0.000) 0.567 6.434 ( 0.000 0.229 0.000) 0.229 6.612 ( 0.000 -5.495 0.000) 5.495 6.618 ( 0.000 -8.499 0.000) 8.499 6.729 ( 0.000 2.276 0.000) 2.276 6.732 ( 0.000 -0.864 0.000) 0.864 6.867 ( 0.000 -2.551 0.000) 2.551 6.877 ( 0.000 -2.571 0.000) 2.571 6.908 ( 0.000 5.171 0.000) 5.171 7.030 ( 0.000 -2.978 0.000) 2.978 7.105 ( 0.000 0.272 0.000) 0.272 7.109 ( 0.000 -3.866 0.000) 3.866 7.341 ( 0.000 -2.531 0.000) 2.531 7.365 ( 0.000 -6.849 0.000) 6.849 7.428 ( 0.000 5.250 0.000) 5.250 7.434 ( 0.000 3.318 0.000) 3.318 7.675 ( 0.000 -0.309 0.000) 0.309 7.744 ( 0.000 -1.967 0.000) 1.967 7.961 ( 0.000 3.944 0.000) 3.944 8.094 ( 0.000 4.667 0.000) 4.667 8.212 ( 0.000 1.334 0.000) 1.334 8.217 ( 0.000 -6.954 0.000) 6.954 8.408 ( 0.000 4.196 0.000) 4.196 8.492 ( 0.000 -2.090 0.000) 2.090 8.513 ( 0.000 7.247 0.000) 7.247 8.587 ( 0.000 -0.978 0.000) 0.978 8.730 ( 0.000 -3.332 0.000) 3.332 8.769 ( 0.000 -9.015 0.000) 9.015 8.797 ( 0.000 2.290 0.000) 2.290 8.866 ( 0.000 -2.420 0.000) 2.420 9.055 ( 0.000 2.686 0.000) 2.686 9.174 ( 0.000 -3.302 0.000) 3.302 9.293 ( 0.000 2.393 0.000) 2.393 9.312 ( 0.000 2.885 0.000) 2.885 9.527 ( 0.000 -3.970 0.000) 3.970 9.566 ( 0.000 -5.477 0.000) 5.477 9.910 ( 0.000 0.646 0.000) 0.646 9.997 ( 0.000 -3.322 0.000) 3.322 10.145 ( 0.000 -0.187 0.000) 0.187 10.169 ( 0.000 -1.084 0.000) 1.084 10.381 ( 0.000 3.006 0.000) 3.006 10.494 ( 0.000 -3.150 0.000) 3.150 10.979 ( 0.000 20.650 0.000) 20.650 11.789 ( 0.000 -17.678 0.000) 17.678 16.346 ( 0.000 -0.067 0.000) 0.067 16.350 ( 0.000 -0.234 0.000) 0.234 16.837 ( 0.000 -0.729 0.000) 0.729 16.838 ( 0.000 -0.833 0.000) 0.833 17.478 ( 0.000 -2.011 0.000) 2.011 17.495 ( 0.000 -1.979 0.000) 1.979 17.634 ( 0.000 0.978 0.000) 0.978 17.653 ( 0.000 0.143 0.000) 0.143 17.783 ( 0.000 -0.503 0.000) 0.503 17.785 ( 0.000 -1.072 0.000) 1.072 17.820 ( 0.000 0.401 0.000) 0.401 17.880 ( 0.000 -3.202 0.000) 3.202 18.877 ( 0.000 11.685 0.000) 11.685 19.016 ( 0.000 11.966 0.000) 11.966 19.234 ( 0.000 -6.825 0.000) 6.825 19.412 ( 0.000 -6.539 0.000) 6.539 21.244 ( 0.000 0.495 0.000) 0.495 21.260 ( 0.000 -0.240 0.000) 0.240 21.421 ( 0.000 0.043 0.000) 0.043 21.428 ( 0.000 -0.313 0.000) 0.313 21.940 ( 0.000 0.928 0.000) 0.928 21.976 ( 0.000 -0.770 0.000) 0.770 22.056 ( 0.000 0.126 0.000) 0.126 22.061 ( 0.000 -0.193 0.000) 0.193 26.970 ( 0.000 1.969 0.000) 1.969 27.066 ( 0.000 -2.540 0.000) 2.540 27.069 ( 0.000 2.338 0.000) 2.338 27.149 ( 0.000 -1.295 0.000) 1.295 27.687 ( 0.000 0.505 0.000) 0.505 27.703 ( 0.000 -0.318 0.000) 0.318 27.814 ( 0.000 0.886 0.000) 0.886 27.831 ( 0.000 0.192 0.000) 0.192 35.835 ( 0.000 1.371 0.000) 1.371 35.856 ( 0.000 1.631 0.000) 1.631 35.990 ( 0.000 1.721 0.000) 1.721 36.101 ( 0.000 -1.820 0.000) 1.820 36.353 ( 0.000 8.289 0.000) 8.289 36.424 ( 0.000 3.569 0.000) 3.569 36.550 ( 0.000 -1.629 0.000) 1.629 36.712 ( 0.000 -6.939 0.000) 6.939 36.821 ( 0.000 6.429 0.000) 6.429 37.057 ( 0.000 3.565 0.000) 3.565 37.296 ( 0.000 -6.535 0.000) 6.535 37.722 ( 0.000 -16.870 0.000) 16.870 39.510 ( 0.000 3.688 0.000) 3.688 39.600 ( 0.000 -1.149 0.000) 1.149 41.217 ( 0.000 11.745 0.000) 11.745 41.657 ( 0.000 -9.181 0.000) 9.181 ======================= Grid point 19 (12/92) ======================= q-point: ( 0.11 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -0.097 26.197 11.061) 28.436 1.237 ( 31.021 12.544 11.293) 35.316 1.764 ( 12.007 -3.776 -1.755) 12.709 1.921 ( -0.513 -5.632 -2.177) 6.060 1.994 ( 2.802 -4.256 2.668) 5.752 2.062 ( -0.956 -4.267 0.923) 4.469 2.086 ( 3.337 4.761 -1.461) 5.995 2.470 ( 11.322 -11.867 1.125) 16.440 2.490 ( 3.196 0.787 3.563) 4.850 2.723 ( 7.254 0.699 2.770) 7.796 2.764 ( 0.832 15.047 -0.359) 15.074 2.932 ( 6.310 19.223 2.777) 20.422 2.958 ( 7.615 8.473 3.720) 11.984 3.042 ( 1.356 4.193 -5.068) 6.716 3.295 ( 2.766 0.534 0.137) 2.821 3.409 ( 10.012 9.219 2.894) 13.914 3.565 ( 1.192 -0.156 3.760) 3.947 3.782 ( -1.094 -0.912 -2.943) 3.270 3.879 ( -2.864 1.223 -3.179) 4.451 3.984 ( -5.363 -2.372 -1.184) 5.983 4.026 ( -4.408 -1.995 -0.734) 4.893 4.221 ( 4.138 3.960 8.983) 10.653 4.301 ( -5.083 0.018 -1.123) 5.206 4.361 ( -1.436 1.242 -0.510) 1.966 4.438 ( -2.440 0.936 4.437) 5.149 4.479 ( -4.614 -3.893 0.411) 6.051 4.595 ( -7.197 -2.633 1.121) 7.745 4.654 ( 3.873 -0.738 -1.063) 4.083 4.765 ( 7.189 -1.734 2.763) 7.895 4.897 ( -0.225 -9.130 4.272) 10.083 5.062 ( 4.122 2.882 -4.216) 6.563 5.126 ( -1.955 4.824 0.366) 5.218 5.222 ( 5.185 2.935 -3.616) 6.969 5.303 ( 0.280 6.818 -0.387) 6.835 5.379 ( 3.693 1.585 0.480) 4.047 5.410 ( 0.295 -3.849 0.604) 3.907 5.448 ( 0.537 3.334 -3.415) 4.802 5.548 ( -0.423 -0.616 -2.628) 2.733 5.592 ( -5.653 2.841 1.159) 6.432 5.619 ( 1.914 4.395 -2.056) 5.216 5.666 ( 1.409 3.082 -1.611) 3.752 5.731 ( 4.282 2.961 0.759) 5.261 5.818 ( -1.379 0.444 -0.613) 1.573 5.869 ( 0.668 1.702 0.428) 1.878 5.967 ( 0.547 -3.545 2.720) 4.502 6.063 ( -1.374 -2.694 2.041) 3.649 6.077 ( -0.589 -3.180 2.361) 4.004 6.135 ( -3.036 -4.178 -2.441) 5.713 6.199 ( 1.325 2.127 -7.204) 7.628 6.250 ( -1.691 3.948 3.478) 5.526 6.322 ( -1.570 -5.595 -2.550) 6.346 6.377 ( -3.574 -1.014 0.008) 3.715 6.404 ( 1.484 0.555 0.918) 1.831 6.469 ( 1.152 -2.083 2.162) 3.216 6.531 ( 1.028 -2.336 -6.610) 7.086 6.658 ( -0.817 -4.899 1.535) 5.199 6.691 ( -0.460 -6.983 -6.324) 9.433 6.721 ( 1.277 -0.383 -1.534) 2.032 6.774 ( -6.487 -0.241 -0.993) 6.567 6.857 ( 0.735 -3.896 -0.682) 4.023 6.920 ( 2.405 1.208 -1.416) 3.041 6.991 ( -1.890 -2.307 -3.538) 4.627 7.158 ( 0.309 0.306 -0.509) 0.670 7.224 ( 4.555 -3.225 4.661) 7.271 7.323 ( 5.100 -0.763 0.650) 5.198 7.412 ( 4.630 4.778 -5.022) 8.336 7.472 ( 3.745 0.460 -3.868) 5.403 7.491 ( 5.490 -2.732 -0.454) 6.148 7.716 ( 6.793 2.729 0.587) 7.344 7.829 ( 4.050 -2.367 2.769) 5.447 7.930 ( 2.704 2.566 -5.842) 6.930 8.047 ( -0.510 2.749 -6.166) 6.770 8.173 ( -1.181 -4.386 -1.590) 4.813 8.242 ( 1.908 -1.109 -1.939) 2.938 8.415 ( -1.569 5.889 4.412) 7.524 8.498 ( -2.720 2.345 10.255) 10.866 8.565 ( 1.673 1.032 -0.316) 1.991 8.601 ( 0.171 -0.512 2.162) 2.228 8.724 ( -3.915 -2.289 4.969) 6.727 8.763 ( 0.039 -8.590 0.518) 8.606 8.825 ( 3.207 1.598 -1.752) 3.988 8.897 ( 3.112 1.160 1.705) 3.733 9.082 ( 3.162 -0.533 -4.340) 5.396 9.134 ( -0.060 -1.116 -3.505) 3.679 9.253 ( -2.487 3.420 1.470) 4.477 9.328 ( -2.180 1.075 3.184) 4.006 9.508 ( -1.026 -2.190 -0.914) 2.586 9.589 ( -0.753 -4.351 6.566) 7.913 9.948 ( 2.476 -0.333 0.646) 2.580 10.020 ( 1.626 -2.951 1.661) 3.757 10.183 ( 3.136 0.639 0.990) 3.350 10.250 ( 4.452 -2.151 6.536) 8.196 10.421 ( 4.970 2.945 -0.037) 5.777 10.569 ( 6.391 -5.223 4.955) 9.627 10.962 ( 1.175 19.033 -4.683) 19.636 11.705 ( -1.290 -15.756 -13.939) 21.076 16.359 ( 1.443 -0.031 0.176) 1.454 16.364 ( 1.631 -0.197 0.169) 1.651 16.819 ( -1.541 -0.529 -0.504) 1.706 16.832 ( -0.822 -1.090 -0.134) 1.372 17.468 ( -0.774 -1.153 -0.162) 1.398 17.493 ( -0.106 -2.025 -0.089) 2.029 17.616 ( -1.575 0.200 0.439) 1.648 17.642 ( -1.624 -0.405 0.208) 1.686 17.767 ( -1.892 -0.272 0.654) 2.021 17.783 ( -0.693 -0.630 0.097) 0.942 17.811 ( -0.824 0.462 -0.602) 1.120 17.868 ( -1.392 -2.997 -0.047) 3.305 18.855 ( -2.655 11.745 0.328) 12.046 18.950 ( -4.828 14.515 -1.857) 15.409 19.227 ( -2.018 -7.270 1.701) 7.734 19.372 ( -3.662 -6.689 -1.176) 7.716 21.256 ( 1.017 0.266 -0.037) 1.052 21.285 ( 2.773 -1.459 -0.572) 3.185 21.424 ( 0.338 -0.049 0.084) 0.352 21.429 ( 0.161 -0.228 0.002) 0.279 21.946 ( 0.572 1.010 0.061) 1.163 21.984 ( 0.749 -0.719 0.233) 1.064 22.040 ( -0.341 1.009 -1.149) 1.567 22.074 ( 1.245 -0.522 -0.939) 1.645 26.974 ( 0.258 1.864 0.274) 1.902 27.040 ( -0.799 0.329 -1.567) 1.789 27.090 ( 0.196 -0.727 1.469) 1.651 27.136 ( -1.132 -1.250 -0.274) 1.709 27.679 ( -0.772 0.702 0.108) 1.049 27.704 ( -0.098 -0.347 0.231) 0.429 27.800 ( -1.405 0.925 -0.330) 1.714 27.819 ( -1.130 0.083 0.107) 1.138 35.759 ( -3.518 3.832 -0.475) 5.224 35.810 ( -4.259 1.472 -0.061) 4.507 36.034 ( -3.306 -0.252 7.394) 8.104 36.088 ( -3.781 -0.351 4.283) 5.724 36.359 ( -0.616 10.301 1.712) 10.460 36.401 ( -3.175 1.746 1.353) 3.868 36.512 ( -4.103 -1.712 -0.507) 4.475 36.830 ( 8.845 8.996 -3.981) 13.229 36.918 ( 12.088 -11.148 -0.253) 16.446 37.085 ( -0.533 -2.558 1.228) 2.887 37.430 ( 14.611 -9.008 2.260) 17.312 37.807 ( 8.135 -18.248 5.327) 20.677 39.556 ( 4.168 3.781 2.158) 6.027 39.645 ( 4.656 -1.021 0.912) 4.853 41.130 ( -8.102 10.972 -3.517) 14.085 41.451 ( -16.558 -2.187 -7.879) 18.467 ======================= Grid point 20 (13/92) ======================= q-point: ( 0.22 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.389 ( 6.103 18.018 15.812) 24.737 1.695 ( 9.809 5.058 1.653) 11.159 1.859 ( 0.765 5.098 3.332) 6.138 1.975 ( 1.938 -4.102 1.095) 4.667 2.080 ( 3.624 1.636 3.051) 5.011 2.140 ( 16.838 -6.619 0.460) 18.099 2.297 ( 16.932 1.141 1.339) 17.023 2.610 ( 6.314 -8.080 -2.191) 10.486 2.663 ( 7.100 1.472 3.696) 8.139 2.793 ( 0.938 12.757 3.910) 13.375 2.842 ( 7.726 0.571 3.760) 8.611 3.010 ( 1.457 7.362 4.523) 8.762 3.124 ( 6.175 3.748 3.143) 7.878 3.194 ( 11.295 3.770 2.175) 12.104 3.364 ( 4.734 -1.117 -0.361) 4.877 3.534 ( 2.808 -0.657 -4.643) 5.466 3.613 ( 3.140 3.921 4.566) 6.788 3.761 ( -2.917 -0.706 1.503) 3.356 3.796 ( 0.082 0.115 -2.778) 2.782 3.858 ( -5.908 -1.241 0.876) 6.100 4.010 ( -0.132 -1.401 6.241) 6.398 4.183 ( -4.590 4.397 -3.228) 7.128 4.278 ( -4.193 -4.045 -4.730) 7.504 4.384 ( -1.756 3.486 -0.565) 3.944 4.397 ( -5.377 3.512 6.178) 8.912 4.424 ( 1.302 3.443 1.357) 3.923 4.609 ( 6.672 4.539 10.398) 13.162 4.713 ( 4.516 -3.078 -4.895) 7.337 4.814 ( -1.859 1.315 -5.313) 5.780 4.943 ( 2.415 2.598 3.428) 4.933 5.055 ( -2.867 -2.208 1.946) 4.109 5.115 ( -1.940 7.160 2.908) 7.967 5.272 ( -0.570 3.178 -6.983) 7.694 5.307 ( -3.242 -2.663 -7.094) 8.242 5.356 ( 8.983 -1.705 -1.524) 9.270 5.422 ( -0.303 -3.774 -0.602) 3.833 5.441 ( -0.578 1.391 -1.585) 2.186 5.497 ( -4.285 2.569 2.620) 5.642 5.574 ( 0.333 2.799 1.413) 3.153 5.638 ( 3.442 3.275 -0.164) 4.754 5.738 ( 6.035 7.589 -0.705) 9.721 5.759 ( -0.903 2.558 -3.500) 4.428 5.823 ( 4.245 -1.245 -2.065) 4.882 5.870 ( -0.540 4.412 -0.482) 4.471 5.962 ( -4.994 -2.726 -0.638) 5.725 5.997 ( -1.241 -1.329 -4.273) 4.644 6.052 ( -2.145 0.108 -2.002) 2.936 6.115 ( 2.376 -3.628 4.585) 6.311 6.197 ( 3.118 -0.095 1.517) 3.468 6.266 ( -0.414 0.277 3.351) 3.388 6.319 ( 1.628 -6.870 0.216) 7.064 6.372 ( 0.215 -1.465 1.539) 2.136 6.420 ( -0.841 1.341 0.397) 1.632 6.472 ( -0.430 0.929 1.152) 1.541 6.505 ( 1.564 0.212 -5.831) 6.041 6.619 ( -5.799 -1.650 -3.713) 7.081 6.651 ( 1.979 -4.720 -1.934) 5.471 6.660 ( -1.796 -7.908 1.345) 8.220 6.778 ( 2.252 -3.158 2.444) 4.585 6.869 ( -0.315 1.116 -2.741) 2.977 6.925 ( 2.131 -6.148 -5.804) 8.719 6.969 ( 3.157 -4.282 -1.034) 5.420 7.115 ( -0.438 3.403 -4.975) 6.044 7.239 ( -2.564 -7.097 -0.183) 7.548 7.390 ( 1.883 1.689 -8.293) 8.670 7.472 ( 3.352 -0.494 -5.203) 6.209 7.507 ( 9.372 2.214 -4.735) 10.731 7.581 ( 6.131 -2.446 -0.833) 6.653 7.776 ( 0.847 0.269 -2.470) 2.625 7.908 ( 1.462 -3.091 -1.576) 3.766 7.962 ( 4.474 -0.214 -8.779) 9.856 8.063 ( 8.891 3.834 2.593) 10.024 8.155 ( 1.067 -2.101 -0.529) 2.415 8.268 ( 0.880 1.175 1.279) 1.947 8.444 ( 0.544 4.862 4.022) 6.334 8.515 ( -2.392 -1.017 3.424) 4.299 8.556 ( -3.219 -0.813 1.984) 3.868 8.627 ( -1.803 1.657 5.609) 6.121 8.724 ( -2.140 -1.271 6.635) 7.087 8.812 ( 4.457 -6.108 0.153) 7.563 8.867 ( 4.721 5.452 -0.699) 7.246 8.949 ( 0.244 4.384 -0.392) 4.409 9.056 ( 2.173 1.942 -4.197) 5.110 9.157 ( 2.152 -0.836 -0.666) 2.402 9.247 ( -1.440 -0.031 3.071) 3.392 9.299 ( -3.549 -1.642 3.506) 5.252 9.507 ( 1.235 1.443 1.024) 2.158 9.658 ( 0.911 -3.010 7.458) 8.094 9.985 ( 1.076 -0.405 1.032) 1.545 10.074 ( 2.006 -2.389 2.687) 4.117 10.248 ( 3.094 2.757 0.929) 4.248 10.385 ( 4.900 -2.233 4.393) 6.949 10.550 ( 9.698 2.853 0.179) 10.111 10.760 ( 7.821 -4.764 3.396) 9.767 10.980 ( 5.255 9.626 1.353) 11.050 11.523 ( -2.499 -12.678 -16.697) 21.114 16.400 ( 3.286 0.098 0.118) 3.290 16.410 ( 3.264 -0.235 0.576) 3.323 16.779 ( -2.645 -0.372 -0.239) 2.681 16.806 ( -2.242 -1.442 -0.042) 2.666 17.460 ( -0.282 -0.829 0.548) 1.033 17.492 ( 0.152 -1.919 -0.152) 1.931 17.598 ( -1.394 -1.500 0.609) 2.136 17.608 ( -1.943 -0.621 0.227) 2.053 17.733 ( -2.724 0.239 0.737) 2.833 17.760 ( -1.849 -0.086 -0.515) 1.922 17.777 ( -2.186 0.797 -0.976) 2.523 17.835 ( -2.342 -2.828 0.118) 3.674 18.803 ( -3.427 12.394 0.370) 12.865 18.857 ( -3.886 14.419 -1.725) 15.033 19.196 ( -3.259 -7.420 1.486) 8.239 19.282 ( -4.863 -6.904 -1.633) 8.601 21.279 ( 1.575 0.269 0.101) 1.601 21.315 ( 1.515 -1.662 -1.262) 2.578 21.430 ( 0.131 -0.102 -0.091) 0.189 21.438 ( 0.815 -0.757 0.214) 1.133 21.960 ( 0.911 1.207 0.133) 1.517 22.003 ( 1.051 -0.594 0.312) 1.247 22.028 ( 0.421 1.591 -1.557) 2.266 22.086 ( 0.905 -0.870 -0.442) 1.331 26.982 ( 0.366 1.593 0.304) 1.662 27.015 ( -0.608 0.821 -0.963) 1.404 27.097 ( -0.614 -1.376 0.210) 1.522 27.117 ( -0.585 -1.495 0.241) 1.623 27.669 ( -0.631 0.884 0.509) 1.200 27.704 ( -0.135 -0.454 0.221) 0.523 27.767 ( -1.941 1.188 -0.085) 2.277 27.802 ( -1.157 -0.414 0.366) 1.282 35.725 ( -3.368 3.428 1.818) 5.138 35.758 ( -0.746 0.553 1.952) 2.162 35.999 ( -4.115 1.748 0.917) 4.564 36.051 ( -8.569 1.382 9.827) 13.112 36.318 ( -3.019 7.982 -2.779) 8.975 36.365 ( -4.317 0.288 0.628) 4.372 36.409 ( -5.538 -2.645 -0.376) 6.148 36.844 ( -4.734 -5.161 -3.723) 7.931 37.093 ( 9.697 0.435 -1.224) 9.783 37.195 ( 13.666 9.863 0.320) 16.857 37.691 ( 13.188 -15.580 0.369) 20.416 38.088 ( 14.032 -25.009 8.157) 29.814 39.688 ( 8.073 3.953 3.296) 9.574 39.769 ( 8.696 -0.406 0.934) 8.755 40.886 ( -14.629 10.795 -5.685) 19.049 41.073 ( -17.136 2.809 -7.026) 18.732 ======================= Grid point 21 (14/92) ======================= q-point: ( 0.33 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( 2.890 5.769 10.770) 12.555 1.783 ( 4.965 3.566 -0.284) 6.119 1.919 ( 2.643 1.905 3.435) 4.734 1.991 ( 0.645 -0.974 0.671) 1.347 2.163 ( 2.073 4.255 3.101) 5.659 2.439 ( 13.151 3.899 0.730) 13.736 2.526 ( 7.417 8.210 -1.033) 11.112 2.624 ( 2.439 1.487 -2.295) 3.664 2.815 ( 1.797 -2.257 6.410) 7.029 2.865 ( 1.983 -0.102 6.209) 6.519 3.003 ( 3.600 4.243 -3.872) 6.779 3.102 ( 4.857 -1.570 4.670) 6.918 3.221 ( 1.874 -3.756 5.249) 6.720 3.328 ( 3.379 -2.589 4.090) 5.903 3.453 ( 6.760 -0.655 -5.331) 8.634 3.545 ( 2.638 -2.891 2.255) 4.516 3.683 ( 2.657 -2.520 2.618) 4.502 3.755 ( 2.753 6.999 3.732) 8.396 3.828 ( 2.063 -0.404 0.582) 2.182 3.879 ( 1.005 2.582 6.757) 7.303 4.040 ( -4.562 -1.154 -2.608) 5.380 4.094 ( -1.738 0.369 0.950) 2.015 4.124 ( -2.844 0.902 -6.235) 6.912 4.328 ( -1.181 4.243 -1.742) 4.737 4.433 ( 2.343 0.653 6.490) 6.931 4.513 ( 0.852 0.400 -1.038) 1.401 4.666 ( -0.190 1.837 -2.516) 3.121 4.734 ( 1.901 3.183 -7.642) 8.494 4.824 ( 0.657 9.966 9.292) 13.642 4.948 ( 0.295 1.162 -6.952) 7.054 5.036 ( -1.295 -0.213 1.622) 2.086 5.105 ( -1.464 3.348 2.672) 4.527 5.176 ( -3.609 0.068 -0.234) 3.617 5.252 ( 3.936 3.969 -7.244) 9.150 5.304 ( -4.921 1.226 -0.707) 5.121 5.402 ( -1.828 -0.823 1.267) 2.372 5.473 ( 1.532 -0.644 -0.717) 1.810 5.520 ( 3.312 -1.965 0.740) 3.922 5.604 ( 1.540 6.479 3.319) 7.441 5.648 ( -1.983 5.987 -5.959) 8.677 5.727 ( 0.914 3.352 -0.434) 3.501 5.814 ( 2.431 1.891 -1.104) 3.272 5.844 ( -0.943 1.561 0.081) 1.825 5.878 ( 3.433 -0.557 -4.310) 5.538 5.922 ( 1.139 0.482 3.942) 4.131 5.968 ( -0.362 2.586 -0.264) 2.625 6.011 ( -1.039 1.714 -1.399) 2.444 6.226 ( -1.654 -2.601 2.592) 4.027 6.238 ( 2.731 1.012 2.878) 4.094 6.288 ( -0.004 -2.920 -3.065) 4.234 6.316 ( -2.038 -8.001 4.061) 9.201 6.357 ( -1.828 0.936 -6.327) 6.652 6.401 ( 1.976 -2.242 -0.385) 3.013 6.492 ( 0.811 -1.365 1.012) 1.883 6.502 ( 2.799 1.689 -1.646) 3.660 6.564 ( 1.629 3.436 1.431) 4.063 6.613 ( -2.292 -1.160 -2.347) 3.479 6.695 ( 0.464 -2.495 3.700) 4.487 6.783 ( 0.218 -2.292 -4.213) 4.801 6.879 ( 3.831 -7.952 0.812) 8.864 6.909 ( -1.055 -0.115 -2.876) 3.065 7.000 ( -0.196 -6.058 1.633) 6.277 7.110 ( 5.066 -2.051 -3.673) 6.585 7.185 ( -1.781 -5.955 -1.808) 6.473 7.321 ( -0.736 -2.650 -8.732) 9.155 7.439 ( 1.680 -7.362 -5.892) 9.578 7.586 ( 3.263 1.308 -5.070) 6.170 7.648 ( 2.856 2.018 -3.292) 4.803 7.752 ( 1.355 -7.513 -6.499) 10.026 7.832 ( -1.523 -9.081 -5.379) 10.663 8.018 ( 5.770 8.621 -0.322) 10.379 8.142 ( -1.535 5.087 -0.167) 5.317 8.237 ( -0.485 2.081 2.074) 2.978 8.295 ( 5.670 -3.444 1.057) 6.718 8.501 ( 1.087 4.368 1.104) 4.634 8.519 ( -0.305 1.240 3.140) 3.390 8.536 ( -0.555 -2.428 5.170) 5.738 8.641 ( -1.835 0.782 4.184) 4.635 8.756 ( -0.833 -2.298 4.742) 5.335 8.861 ( 3.244 -3.380 -3.447) 5.817 8.922 ( -0.366 4.565 -1.212) 4.737 8.984 ( 5.621 9.514 2.544) 11.340 9.072 ( 2.060 -0.320 -2.514) 3.266 9.183 ( 0.930 3.662 0.555) 3.819 9.221 ( -3.743 1.929 3.114) 5.237 9.341 ( 3.624 -1.874 3.876) 5.628 9.552 ( 1.424 1.444 2.248) 3.028 9.752 ( 2.884 -2.154 5.276) 6.387 10.011 ( 0.592 -1.717 2.194) 2.848 10.127 ( 1.168 -2.999 2.408) 4.020 10.290 ( 1.233 4.113 -1.061) 4.423 10.490 ( 4.304 -1.376 0.902) 4.608 10.729 ( 9.534 2.132 0.358) 9.776 10.885 ( 11.380 1.096 -5.200) 12.559 11.140 ( 1.839 -4.808 11.420) 12.527 11.327 ( -4.633 -8.238 -11.238) 14.684 16.473 ( 5.012 0.146 0.125) 5.016 16.484 ( 4.642 -0.227 0.528) 4.677 16.726 ( -3.601 -0.455 0.317) 3.643 16.753 ( -3.943 -1.427 0.163) 4.196 17.463 ( -0.033 -0.776 0.118) 0.786 17.499 ( 1.036 -1.744 -0.289) 2.049 17.573 ( -1.608 -1.099 1.045) 2.210 17.592 ( -1.389 -2.222 1.065) 2.828 17.681 ( -2.775 1.303 -1.549) 3.435 17.711 ( -2.317 -0.173 -1.965) 3.043 17.740 ( -1.625 0.462 1.043) 1.985 17.796 ( -2.391 -2.577 0.376) 3.536 18.756 ( -2.251 12.400 0.128) 12.603 18.786 ( -2.677 12.891 -1.466) 13.248 19.150 ( -2.938 -7.243 0.503) 7.832 19.193 ( -3.694 -7.075 -1.065) 8.052 21.310 ( 1.718 -0.140 0.195) 1.735 21.320 ( 0.592 -0.524 -0.764) 1.099 21.425 ( -0.450 0.071 -0.370) 0.587 21.454 ( 0.750 -1.476 0.095) 1.658 21.977 ( 0.867 1.429 0.161) 1.680 22.021 ( 0.347 0.294 0.668) 0.808 22.024 ( 0.933 0.973 -1.657) 2.136 22.097 ( 0.552 -1.448 0.111) 1.554 26.985 ( -0.137 1.135 -0.403) 1.212 27.009 ( 0.305 1.355 0.437) 1.456 27.078 ( -0.880 -1.637 -0.746) 2.003 27.117 ( -0.154 -1.830 0.466) 1.894 27.670 ( 0.126 0.816 0.803) 1.152 27.702 ( -0.099 -0.462 -0.084) 0.480 27.738 ( -1.488 1.503 0.208) 2.125 27.785 ( -1.154 -0.663 0.329) 1.371 35.698 ( -1.205 3.131 2.624) 4.259 35.790 ( 0.875 -1.954 2.084) 2.988 35.938 ( -3.838 4.643 0.665) 6.061 35.983 ( -7.769 2.627 7.559) 11.153 36.187 ( -9.860 -1.279 -6.183) 11.709 36.255 ( -1.316 5.957 -1.786) 6.357 36.376 ( -2.231 -4.812 2.236) 5.757 36.683 ( -7.100 -7.810 -5.018) 11.687 37.255 ( 9.322 11.390 -1.287) 14.775 37.427 ( 10.351 13.107 2.765) 16.929 37.902 ( 10.997 -18.405 -0.006) 21.440 38.349 ( 8.921 -26.830 4.489) 28.628 39.873 ( 10.021 4.720 1.774) 11.218 39.954 ( 11.890 0.753 0.756) 11.938 40.577 ( -14.883 10.066 -3.644) 18.333 40.746 ( -15.416 1.662 -4.404) 16.119 ======================= Grid point 22 (15/92) ======================= q-point: ( 0.44 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( -0.075 -1.780 0.793) 1.950 1.869 ( 1.915 -3.814 2.232) 4.817 1.991 ( 1.950 2.597 1.373) 3.526 2.016 ( 0.827 -1.093 0.807) 1.591 2.200 ( 0.234 13.512 1.252) 13.572 2.557 ( 2.186 24.368 -0.817) 24.480 2.593 ( 2.373 4.228 -1.184) 4.991 2.723 ( 7.997 -7.998 2.980) 11.696 2.869 ( -1.641 -2.584 5.625) 6.404 2.889 ( -3.775 -3.206 0.390) 4.968 2.947 ( -1.327 -0.341 -4.081) 4.305 3.137 ( -1.216 -4.868 -1.033) 5.123 3.326 ( 3.401 -8.556 3.389) 9.811 3.386 ( -0.155 6.640 3.440) 7.480 3.489 ( 3.086 -2.212 -3.175) 4.949 3.707 ( 4.159 -3.964 6.206) 8.457 3.731 ( 1.893 1.939 0.796) 2.824 3.796 ( 0.845 6.863 -4.647) 8.332 3.923 ( 3.581 -0.196 5.845) 6.857 3.932 ( 1.033 -1.569 0.880) 2.074 3.977 ( 1.605 0.471 -3.402) 3.791 4.014 ( -2.469 4.541 -2.084) 5.573 4.098 ( -0.649 -1.345 1.990) 2.488 4.292 ( -2.041 4.632 0.468) 5.083 4.399 ( -4.932 -3.590 -4.657) 7.675 4.553 ( 2.150 -1.625 5.246) 5.898 4.682 ( 2.895 1.829 -8.578) 9.236 4.723 ( -2.745 2.954 1.529) 4.313 4.763 ( -1.108 -2.899 0.650) 3.171 4.941 ( -2.110 -0.479 1.240) 2.493 5.010 ( -1.002 6.025 -3.978) 7.289 5.104 ( 1.590 6.928 0.237) 7.112 5.178 ( 0.710 3.165 3.464) 4.745 5.301 ( 0.187 2.567 3.183) 4.093 5.313 ( 7.242 3.826 -1.212) 8.280 5.410 ( 1.489 1.938 1.115) 2.686 5.468 ( -2.876 3.603 0.316) 4.621 5.558 ( -2.030 -0.039 -1.077) 2.299 5.583 ( 3.779 0.382 -1.378) 4.041 5.653 ( -4.458 5.353 -2.022) 7.254 5.697 ( 2.679 7.005 2.826) 8.015 5.790 ( -2.270 0.968 -0.457) 2.510 5.851 ( 1.398 0.978 -0.102) 1.709 5.895 ( 1.525 -1.828 -1.324) 2.724 5.961 ( 0.496 6.657 -1.028) 6.754 5.979 ( -0.280 1.675 0.814) 1.884 6.025 ( -1.423 1.255 0.704) 2.024 6.103 ( -1.898 4.122 -5.535) 7.157 6.165 ( -4.231 -1.331 -1.597) 4.715 6.291 ( 0.169 -5.337 -0.247) 5.345 6.348 ( 1.223 -2.535 1.389) 3.138 6.372 ( 2.363 -2.813 -1.307) 3.899 6.415 ( -0.901 -1.854 1.599) 2.609 6.511 ( -1.700 -0.430 -0.716) 1.894 6.538 ( 2.469 -1.859 0.554) 3.140 6.587 ( 2.957 6.340 -0.967) 7.062 6.626 ( 1.468 2.379 3.274) 4.305 6.731 ( -0.051 -0.185 4.210) 4.214 6.774 ( -0.218 -1.897 -1.758) 2.595 6.843 ( -1.202 -2.449 -4.201) 5.009 6.945 ( 2.487 -8.322 -0.176) 8.687 6.981 ( -3.451 -6.460 2.074) 7.612 7.153 ( 0.549 -5.536 -1.367) 5.729 7.192 ( 4.067 -4.006 -0.783) 5.762 7.265 ( 1.594 -6.472 -0.699) 6.702 7.383 ( -2.658 -9.219 -6.489) 11.583 7.571 ( 1.347 -2.091 -1.162) 2.746 7.618 ( -2.563 -4.004 -1.832) 5.095 7.733 ( 2.243 -1.814 -4.312) 5.188 7.796 ( -0.058 -8.100 -0.833) 8.143 8.087 ( -1.297 5.811 1.984) 6.276 8.117 ( 2.468 7.270 -1.919) 7.914 8.203 ( -1.639 0.083 -0.278) 1.665 8.382 ( 1.769 -3.683 1.229) 4.267 8.503 ( -0.276 2.884 0.382) 2.923 8.551 ( 0.822 3.727 0.904) 3.922 8.601 ( 1.324 -0.528 3.479) 3.760 8.639 ( -1.220 -0.015 0.838) 1.480 8.779 ( -0.335 -3.388 2.182) 4.044 8.857 ( 0.463 -0.065 -2.464) 2.508 8.928 ( 0.950 -0.768 -0.199) 1.238 9.069 ( 0.891 -1.971 -1.059) 2.408 9.093 ( 3.718 13.237 0.893) 13.779 9.176 ( -2.557 3.365 1.323) 4.428 9.214 ( 0.185 5.376 0.839) 5.444 9.435 ( 2.665 4.989 1.854) 5.952 9.580 ( 0.100 -1.334 0.944) 1.637 9.829 ( 1.643 0.858 1.484) 2.374 10.065 ( 2.136 -4.407 4.006) 6.327 10.147 ( -0.461 -9.281 -0.342) 9.299 10.266 ( -1.038 6.683 -2.413) 7.181 10.553 ( 2.290 -2.357 0.091) 3.287 10.855 ( 5.123 2.978 -0.366) 5.937 11.076 ( 14.429 -3.083 -5.340) 15.691 11.131 ( -4.685 -2.062 -2.473) 5.684 11.221 ( -7.934 -7.333 7.535) 13.172 16.565 ( 4.686 0.033 0.197) 4.691 16.570 ( 5.033 -0.103 -0.270) 5.042 16.663 ( -4.120 -0.576 0.551) 4.196 16.678 ( -4.540 -1.118 0.206) 4.681 17.458 ( -0.134 -0.129 -0.340) 0.387 17.522 ( 2.085 -1.846 -0.828) 2.905 17.556 ( -2.413 -1.323 1.354) 3.067 17.582 ( -0.746 -0.776 1.468) 1.821 17.634 ( -0.713 -0.068 -1.347) 1.526 17.661 ( -1.037 -0.971 -1.539) 2.094 17.735 ( -0.167 -0.334 0.807) 0.889 17.764 ( -1.401 -1.467 0.090) 2.030 18.730 ( -0.772 12.173 0.003) 12.198 18.744 ( -0.948 11.979 -0.606) 12.032 19.113 ( -1.213 -7.116 -0.168) 7.220 19.144 ( -1.322 -7.172 -0.151) 7.295 21.316 ( 0.124 0.263 -0.376) 0.475 21.346 ( 1.180 -1.092 0.483) 1.679 21.410 ( -0.654 0.712 -0.415) 1.052 21.463 ( 0.259 -1.775 0.009) 1.794 21.990 ( 0.371 1.601 0.078) 1.646 22.024 ( 0.127 1.867 -0.211) 1.884 22.031 ( 0.322 -0.502 -0.179) 0.622 22.105 ( 0.197 -1.904 0.144) 1.919 26.978 ( -0.104 1.148 -0.213) 1.172 27.023 ( 0.434 1.856 0.609) 2.001 27.058 ( -0.547 -2.243 -0.653) 2.399 27.118 ( -0.053 -1.988 0.151) 1.995 27.685 ( 0.629 0.553 0.763) 1.133 27.698 ( -0.174 -0.048 -0.387) 0.427 27.719 ( -0.789 1.531 0.033) 1.722 27.772 ( -0.545 -0.697 0.140) 0.896 35.743 ( 2.734 2.202 3.749) 5.136 35.806 ( -0.475 -0.727 -0.329) 0.928 35.873 ( -2.894 2.054 1.033) 3.696 35.957 ( -5.979 -0.654 4.106) 7.282 35.982 ( -2.126 4.720 -6.529) 8.332 36.239 ( 0.066 6.856 -0.262) 6.861 36.361 ( -1.015 -9.096 0.799) 9.187 36.552 ( -3.168 -6.275 -2.573) 7.485 37.360 ( 3.456 14.534 -0.405) 14.945 37.571 ( 3.760 15.219 1.351) 15.734 38.041 ( 4.493 -20.331 0.087) 20.822 38.476 ( 2.892 -26.108 1.304) 26.300 40.037 ( 7.580 8.682 -0.754) 11.550 40.187 ( 13.787 1.077 1.649) 13.927 40.345 ( -9.011 5.394 -0.310) 10.507 40.455 ( -14.905 1.038 -2.529) 15.154 ======================= Grid point 27 (16/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.241 ( 0.000 -21.454 0.000) 21.454 1.241 ( 0.000 21.454 0.000) 21.454 1.789 ( 0.000 -28.939 0.000) 28.939 1.789 ( 0.000 28.939 0.000) 28.939 1.961 ( 0.000 -0.162 0.000) 0.162 1.961 ( 0.000 0.162 0.000) 0.162 2.116 ( 0.000 -0.349 0.000) 0.349 2.116 ( 0.000 0.349 0.000) 0.349 2.547 ( 0.000 -2.413 0.000) 2.413 2.547 ( 0.000 2.413 0.000) 2.413 2.799 ( 0.000 -2.230 0.000) 2.230 2.799 ( 0.000 2.230 0.000) 2.230 3.160 ( 0.000 -0.551 0.000) 0.551 3.160 ( 0.000 0.551 0.000) 0.551 3.481 ( 0.000 -5.648 0.000) 5.648 3.481 ( 0.000 5.648 0.000) 5.648 3.715 ( 0.000 -21.735 0.000) 21.735 3.715 ( 0.000 21.735 0.000) 21.735 3.891 ( 0.000 -6.129 0.000) 6.129 3.891 ( 0.000 6.129 0.000) 6.129 4.229 ( 0.000 -2.151 0.000) 2.151 4.229 ( 0.000 2.151 0.000) 2.151 4.373 ( 0.000 -14.758 0.000) 14.758 4.373 ( 0.000 14.758 0.000) 14.758 4.465 ( 0.000 -6.754 0.000) 6.754 4.465 ( 0.000 6.754 0.000) 6.754 4.509 ( 0.000 -6.490 0.000) 6.490 4.509 ( 0.000 6.490 0.000) 6.490 4.654 ( 0.000 -3.255 0.000) 3.255 4.654 ( 0.000 3.255 0.000) 3.255 5.120 ( 0.000 -2.148 0.000) 2.148 5.120 ( 0.000 2.148 0.000) 2.148 5.319 ( 0.000 -3.661 0.000) 3.661 5.319 ( 0.000 3.661 0.000) 3.661 5.435 ( 0.000 -3.562 0.000) 3.562 5.435 ( 0.000 3.562 0.000) 3.562 5.504 ( 0.000 -4.325 0.000) 4.325 5.504 ( 0.000 4.325 0.000) 4.325 5.685 ( 0.000 -0.508 0.000) 0.508 5.685 ( 0.000 0.508 0.000) 0.508 5.721 ( 0.000 -4.934 0.000) 4.934 5.721 ( 0.000 4.934 0.000) 4.934 5.834 ( 0.000 -3.595 0.000) 3.595 5.834 ( 0.000 3.595 0.000) 3.595 5.939 ( 0.000 -7.983 0.000) 7.983 5.939 ( 0.000 7.983 0.000) 7.983 6.050 ( 0.000 -2.107 0.000) 2.107 6.050 ( 0.000 2.107 0.000) 2.107 6.261 ( 0.000 -1.095 0.000) 1.095 6.261 ( 0.000 1.095 0.000) 1.095 6.380 ( 0.000 -3.692 0.000) 3.692 6.380 ( 0.000 3.692 0.000) 3.692 6.440 ( 0.000 -0.066 0.000) 0.066 6.440 ( 0.000 0.066 0.000) 0.066 6.520 ( 0.000 -0.951 0.000) 0.951 6.520 ( 0.000 0.951 0.000) 0.951 6.748 ( 0.000 -0.660 0.000) 0.660 6.748 ( 0.000 0.660 0.000) 0.660 6.839 ( 0.000 -0.122 0.000) 0.122 6.839 ( 0.000 0.122 0.000) 0.122 6.983 ( 0.000 -2.343 0.000) 2.343 6.983 ( 0.000 2.343 0.000) 2.343 7.081 ( 0.000 -1.430 0.000) 1.430 7.081 ( 0.000 1.430 0.000) 1.430 7.303 ( 0.000 -0.243 0.000) 0.243 7.303 ( 0.000 0.243 0.000) 0.243 7.485 ( 0.000 -0.132 0.000) 0.132 7.485 ( 0.000 0.132 0.000) 0.132 7.697 ( 0.000 -2.279 0.000) 2.279 7.697 ( 0.000 2.279 0.000) 2.279 8.065 ( 0.000 -6.227 0.000) 6.227 8.065 ( 0.000 6.227 0.000) 6.227 8.197 ( 0.000 -2.990 0.000) 2.990 8.197 ( 0.000 2.990 0.000) 2.990 8.460 ( 0.000 -1.534 0.000) 1.534 8.460 ( 0.000 1.534 0.000) 1.534 8.611 ( 0.000 -4.317 0.000) 4.317 8.611 ( 0.000 4.317 0.000) 4.317 8.646 ( 0.000 -5.267 0.000) 5.267 8.646 ( 0.000 5.267 0.000) 5.267 8.836 ( 0.000 -1.556 0.000) 1.556 8.836 ( 0.000 1.556 0.000) 1.556 9.105 ( 0.000 -3.028 0.000) 3.028 9.105 ( 0.000 3.028 0.000) 3.028 9.355 ( 0.000 -1.424 0.000) 1.424 9.355 ( 0.000 1.424 0.000) 1.424 9.475 ( 0.000 -1.695 0.000) 1.695 9.475 ( 0.000 1.695 0.000) 1.695 9.940 ( 0.000 -2.339 0.000) 2.339 9.940 ( 0.000 2.339 0.000) 2.339 10.151 ( 0.000 -0.725 0.000) 0.725 10.151 ( 0.000 0.725 0.000) 0.725 10.435 ( 0.000 -2.732 0.000) 2.732 10.435 ( 0.000 2.732 0.000) 2.732 11.399 ( 0.000 -21.332 0.000) 21.332 11.399 ( 0.000 21.332 0.000) 21.332 16.346 ( 0.000 -0.104 0.000) 0.104 16.346 ( 0.000 0.104 0.000) 0.104 16.829 ( 0.000 -0.050 0.000) 0.050 16.829 ( 0.000 0.050 0.000) 0.050 17.466 ( 0.000 -0.682 0.000) 0.682 17.466 ( 0.000 0.682 0.000) 0.682 17.650 ( 0.000 -0.497 0.000) 0.497 17.650 ( 0.000 0.497 0.000) 0.497 17.775 ( 0.000 -0.078 0.000) 0.078 17.775 ( 0.000 0.078 0.000) 0.078 17.837 ( 0.000 -1.416 0.000) 1.416 17.837 ( 0.000 1.416 0.000) 1.416 19.077 ( 0.000 -9.026 0.000) 9.026 19.077 ( 0.000 9.026 0.000) 9.026 19.245 ( 0.000 -10.407 0.000) 10.407 19.245 ( 0.000 10.407 0.000) 10.407 21.253 ( 0.000 -0.429 0.000) 0.429 21.253 ( 0.000 0.429 0.000) 0.429 21.423 ( 0.000 -0.198 0.000) 0.198 21.423 ( 0.000 0.198 0.000) 0.198 21.959 ( 0.000 -0.948 0.000) 0.948 21.959 ( 0.000 0.948 0.000) 0.948 22.058 ( 0.000 -0.139 0.000) 0.139 22.058 ( 0.000 0.139 0.000) 0.139 27.015 ( 0.000 -2.547 0.000) 2.547 27.015 ( 0.000 2.547 0.000) 2.547 27.115 ( 0.000 -2.128 0.000) 2.128 27.115 ( 0.000 2.128 0.000) 2.128 27.696 ( 0.000 -0.423 0.000) 0.423 27.696 ( 0.000 0.423 0.000) 0.423 27.828 ( 0.000 -0.483 0.000) 0.483 27.828 ( 0.000 0.483 0.000) 0.483 35.862 ( 0.000 -0.929 0.000) 0.929 35.862 ( 0.000 0.929 0.000) 0.929 36.042 ( 0.000 -3.391 0.000) 3.391 36.042 ( 0.000 3.391 0.000) 3.391 36.495 ( 0.000 -3.826 0.000) 3.826 36.495 ( 0.000 3.826 0.000) 3.826 36.546 ( 0.000 -9.596 0.000) 9.596 36.546 ( 0.000 9.596 0.000) 9.596 36.972 ( 0.000 -8.581 0.000) 8.581 36.972 ( 0.000 8.581 0.000) 8.581 37.404 ( 0.000 -14.048 0.000) 14.048 37.404 ( 0.000 14.048 0.000) 14.048 39.568 ( 0.000 -2.202 0.000) 2.202 39.568 ( 0.000 2.202 0.000) 2.202 41.451 ( 0.000 -11.558 0.000) 11.558 41.451 ( 0.000 11.558 0.000) 11.558 ======================= Grid point 29 (17/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.495 ( 21.433 -10.192 5.050) 24.264 1.495 ( 21.433 10.192 5.050) 24.264 1.730 ( -5.158 -14.780 4.673) 16.337 1.730 ( -5.158 14.780 4.673) 16.337 1.989 ( 0.405 -5.437 1.817) 5.747 1.989 ( 0.405 5.437 1.817) 5.747 2.190 ( 8.031 -8.457 0.406) 11.670 2.190 ( 8.031 8.457 0.406) 11.670 2.598 ( 6.748 -7.100 0.463) 9.806 2.598 ( 6.748 7.100 0.463) 9.806 2.892 ( 4.209 -4.546 4.534) 7.677 2.892 ( 4.209 4.546 4.534) 7.677 3.143 ( 2.297 -4.464 -2.775) 5.736 3.143 ( 2.297 4.464 -2.775) 5.736 3.522 ( 2.487 -4.253 -0.813) 4.994 3.522 ( 2.487 4.253 -0.813) 4.994 3.718 ( 1.255 -13.381 -2.698) 13.708 3.718 ( 1.255 13.381 -2.698) 13.708 3.903 ( -0.388 -3.278 4.637) 5.692 3.903 ( -0.388 3.278 4.637) 5.692 4.113 ( -6.789 -9.853 -4.093) 12.646 4.113 ( -6.789 9.853 -4.093) 12.646 4.405 ( 0.819 -4.944 0.464) 5.033 4.405 ( 0.819 4.944 0.464) 5.033 4.464 ( -2.617 -8.956 2.962) 9.790 4.464 ( -2.617 8.956 2.962) 9.790 4.508 ( -1.360 -9.826 4.206) 10.775 4.508 ( -1.360 9.826 4.206) 10.775 4.750 ( 7.668 -0.464 4.442) 8.874 4.750 ( 7.668 0.464 4.442) 8.874 5.173 ( 7.085 -3.881 -4.544) 9.269 5.173 ( 7.085 3.881 -4.544) 9.269 5.270 ( -4.455 -5.396 -0.810) 7.044 5.270 ( -4.455 5.396 -0.810) 7.044 5.396 ( -2.186 -1.338 -3.049) 3.983 5.396 ( -2.186 1.338 -3.049) 3.983 5.511 ( 2.249 -2.098 -0.005) 3.076 5.511 ( 2.249 2.098 -0.005) 3.076 5.658 ( -2.479 -2.520 -1.012) 3.677 5.658 ( -2.479 2.520 -1.012) 3.677 5.778 ( 4.848 -4.706 0.731) 6.795 5.778 ( 4.848 4.706 0.731) 6.795 5.859 ( 0.701 -5.633 3.813) 6.838 5.859 ( 0.701 5.633 3.813) 6.838 5.958 ( 0.277 -8.266 1.596) 8.424 5.958 ( 0.277 8.266 1.596) 8.424 6.028 ( -2.910 -1.690 -0.496) 3.402 6.028 ( -2.910 1.690 -0.496) 3.402 6.244 ( -1.875 -1.708 -1.346) 2.871 6.244 ( -1.875 1.708 -1.346) 2.871 6.341 ( -2.366 -3.544 -0.364) 4.276 6.341 ( -2.366 3.544 -0.364) 4.276 6.440 ( 1.636 -2.913 -2.784) 4.349 6.440 ( 1.636 2.913 -2.784) 4.349 6.511 ( 1.899 -2.413 -4.858) 5.747 6.511 ( 1.899 2.413 -4.858) 5.747 6.694 ( -2.733 -2.103 -2.871) 4.487 6.694 ( -2.733 2.103 -2.871) 4.487 6.788 ( -1.639 -2.129 -0.374) 2.712 6.788 ( -1.639 2.129 -0.374) 2.712 6.953 ( -0.811 -2.014 -3.197) 3.864 6.953 ( -0.811 2.014 -3.197) 3.864 7.165 ( 0.605 -1.239 2.440) 2.802 7.165 ( 0.605 1.239 2.440) 2.802 7.371 ( 6.824 -3.929 3.526) 8.628 7.371 ( 6.824 3.929 3.526) 8.628 7.507 ( 4.574 -1.171 -6.278) 7.855 7.507 ( 4.574 1.171 -6.278) 7.855 7.767 ( 5.595 -2.929 1.690) 6.537 7.767 ( 5.595 2.929 1.690) 6.537 8.016 ( 0.189 -5.057 -7.544) 9.084 8.016 ( 0.189 5.057 -7.544) 9.084 8.184 ( 1.194 -4.425 -2.295) 5.126 8.184 ( 1.194 4.425 -2.295) 5.126 8.497 ( -1.753 -1.942 7.207) 7.666 8.497 ( -1.753 1.942 7.207) 7.666 8.607 ( -0.589 -4.678 0.093) 4.716 8.607 ( -0.589 4.678 0.093) 4.716 8.663 ( -0.593 -4.095 5.327) 6.746 8.663 ( -0.593 4.095 5.327) 6.746 8.877 ( 4.024 -2.959 1.077) 5.110 8.877 ( 4.024 2.959 1.077) 5.110 9.097 ( 1.233 -2.180 -3.528) 4.327 9.097 ( 1.233 2.180 -3.528) 4.327 9.325 ( -4.259 -2.750 1.964) 5.437 9.325 ( -4.259 2.750 1.964) 5.437 9.504 ( 1.945 -2.922 2.213) 4.150 9.504 ( 1.945 2.922 2.213) 4.150 9.969 ( 1.715 -2.083 1.985) 3.350 9.969 ( 1.715 2.083 1.985) 3.350 10.208 ( 3.992 -1.900 3.634) 5.723 10.208 ( 3.992 1.900 3.634) 5.723 10.482 ( 4.920 -3.501 1.522) 6.227 10.482 ( 4.920 3.501 1.522) 6.227 11.350 ( -0.524 -19.609 -8.623) 21.428 11.350 ( -0.524 19.609 -8.623) 21.428 16.360 ( 1.557 -0.156 0.196) 1.577 16.360 ( 1.557 0.156 0.196) 1.577 16.817 ( -1.215 -0.346 -0.322) 1.304 16.817 ( -1.215 0.346 -0.322) 1.304 17.464 ( -0.192 -0.808 -0.028) 0.831 17.464 ( -0.192 0.808 -0.028) 0.831 17.629 ( -2.124 -0.874 0.126) 2.300 17.629 ( -2.124 0.874 0.126) 2.300 17.770 ( -1.093 -0.554 0.581) 1.356 17.770 ( -1.093 0.554 0.581) 1.356 17.828 ( -0.920 -1.318 -0.356) 1.646 17.828 ( -0.920 1.318 -0.356) 1.646 19.063 ( -2.205 -9.432 0.979) 9.736 19.063 ( -2.205 9.432 0.979) 9.736 19.201 ( -3.869 -10.772 -1.430) 11.535 19.201 ( -3.869 10.772 -1.430) 11.535 21.266 ( 1.366 -0.686 -0.150) 1.536 21.266 ( 1.366 0.686 -0.150) 1.536 21.425 ( 0.228 -0.132 0.018) 0.264 21.425 ( 0.228 0.132 0.018) 0.264 21.966 ( 0.740 -1.026 0.067) 1.266 21.966 ( 0.740 1.026 0.067) 1.266 22.059 ( 0.423 -0.910 -0.588) 1.163 22.059 ( 0.423 0.910 -0.588) 1.163 27.014 ( 0.013 -2.127 -0.192) 2.136 27.014 ( 0.013 2.127 -0.192) 2.136 27.106 ( -0.892 -1.597 0.095) 1.832 27.106 ( -0.892 1.597 0.095) 1.832 27.693 ( -0.354 -0.667 0.148) 0.770 27.693 ( -0.354 0.667 0.148) 0.770 27.815 ( -1.336 -0.534 -0.082) 1.442 27.815 ( -1.336 0.534 -0.082) 1.442 35.812 ( -3.760 -1.430 -0.120) 4.024 35.812 ( -3.760 1.430 -0.120) 4.024 36.056 ( -2.700 -2.102 5.423) 6.412 36.056 ( -2.700 2.102 5.423) 6.412 36.453 ( -4.730 -3.343 0.240) 5.797 36.453 ( -4.730 3.343 0.240) 5.797 36.616 ( 3.102 -14.982 2.421) 15.490 36.616 ( 3.102 14.982 2.421) 15.490 37.015 ( 10.043 -8.488 -6.060) 14.479 37.015 ( 10.043 8.488 -6.060) 14.479 37.484 ( 6.391 -12.967 4.593) 15.169 37.484 ( 6.391 12.967 4.593) 15.169 39.614 ( 4.513 -2.177 1.600) 5.260 39.614 ( 4.513 2.177 1.600) 5.260 41.330 ( -10.554 -8.901 -4.841) 14.630 41.330 ( -10.554 8.901 -4.841) 14.630 ======================= Grid point 31 (18/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.711 ( 0.290 -11.762 4.960) 12.769 1.711 ( 0.290 11.762 4.960) 12.769 1.865 ( 6.817 -2.656 4.626) 8.656 1.865 ( 6.817 2.656 4.626) 8.656 2.079 ( 9.343 -4.596 4.988) 11.545 2.079 ( 9.343 4.596 4.988) 11.545 2.392 ( 15.585 -9.569 0.798) 18.305 2.392 ( 15.585 9.569 0.798) 18.305 2.739 ( 4.499 -6.571 4.492) 9.143 2.739 ( 4.499 6.571 4.492) 9.143 2.966 ( 0.733 -6.109 6.048) 8.628 2.966 ( 0.733 6.109 6.048) 8.628 3.218 ( 6.643 -7.160 -1.267) 9.849 3.218 ( 6.643 7.160 -1.267) 9.849 3.504 ( -0.565 -3.069 -4.845) 5.763 3.504 ( -0.565 3.069 -4.845) 5.763 3.720 ( 1.354 -5.802 -1.858) 6.241 3.720 ( 1.354 5.802 -1.858) 6.241 3.935 ( -2.094 -6.994 3.879) 8.267 3.935 ( -2.094 6.994 3.879) 8.267 3.989 ( -2.422 -17.646 -2.078) 17.932 3.989 ( -2.422 17.646 -2.078) 17.932 4.369 ( -2.884 -6.321 -2.576) 7.409 4.369 ( -2.884 6.321 -2.576) 7.409 4.444 ( -1.867 -2.953 3.621) 5.031 4.444 ( -1.867 2.953 3.621) 5.031 4.627 ( 8.216 -1.238 4.879) 9.636 4.627 ( 8.216 1.238 4.879) 9.636 4.893 ( 2.387 -5.033 4.310) 7.043 4.893 ( 2.387 5.033 4.310) 7.043 5.169 ( -1.824 -9.393 -4.844) 10.724 5.169 ( -1.824 9.393 -4.844) 10.724 5.249 ( -0.499 -5.009 0.687) 5.080 5.249 ( -0.499 5.009 0.687) 5.080 5.345 ( 3.874 -1.667 -6.632) 7.860 5.345 ( 3.874 1.667 -6.632) 7.860 5.500 ( -2.935 -2.137 -1.440) 3.906 5.500 ( -2.935 2.137 -1.440) 3.906 5.674 ( 2.390 -4.702 1.962) 5.628 5.674 ( 2.390 4.702 1.962) 5.628 5.830 ( 0.469 -7.143 -2.301) 7.519 5.830 ( 0.469 7.143 -2.301) 7.519 5.883 ( -1.362 -7.117 1.045) 7.321 5.883 ( -1.362 7.117 1.045) 7.321 5.949 ( 1.797 -6.982 0.994) 7.278 5.949 ( 1.797 6.982 0.994) 7.278 6.014 ( -0.120 -3.838 4.431) 5.863 6.014 ( -0.120 3.838 4.431) 5.863 6.222 ( 0.047 -1.440 0.634) 1.574 6.222 ( 0.047 1.440 0.634) 1.574 6.309 ( 0.573 -4.397 -4.052) 6.007 6.309 ( 0.573 4.397 -4.052) 6.007 6.462 ( 2.966 -1.957 -2.069) 4.112 6.462 ( 2.966 1.957 -2.069) 4.112 6.511 ( -0.056 -4.068 0.566) 4.107 6.511 ( -0.056 4.068 0.566) 4.107 6.617 ( -1.880 -0.981 -1.734) 2.740 6.617 ( -1.880 0.981 -1.734) 2.740 6.792 ( 0.537 -4.658 0.893) 4.774 6.792 ( 0.537 4.658 0.893) 4.774 6.906 ( -0.173 -2.566 -4.791) 5.438 6.906 ( -0.173 2.566 -4.791) 5.438 7.152 ( -1.516 -1.970 -0.588) 2.555 7.152 ( -1.516 1.970 -0.588) 2.555 7.450 ( 1.222 -2.440 -11.082) 11.413 7.450 ( 1.222 2.440 -11.082) 11.413 7.545 ( 8.457 -1.779 -3.022) 9.155 7.545 ( 8.457 1.779 -3.022) 9.155 7.808 ( -2.257 -3.607 -2.923) 5.162 7.808 ( -2.257 3.607 -2.923) 5.162 8.033 ( 8.985 -4.105 -3.370) 10.438 8.033 ( 8.985 4.105 -3.370) 10.438 8.223 ( 2.649 -5.008 1.982) 6.002 8.223 ( 2.649 5.008 1.982) 6.002 8.499 ( -2.755 -1.223 2.875) 4.165 8.499 ( -2.755 1.223 2.875) 4.165 8.601 ( -1.898 -4.786 3.909) 6.464 8.601 ( -1.898 4.786 3.909) 6.464 8.720 ( 1.023 -1.798 4.762) 5.192 8.720 ( 1.023 1.798 4.762) 5.192 8.974 ( 4.785 -2.914 1.630) 5.835 8.974 ( 4.785 2.914 1.630) 5.835 9.100 ( 3.353 -3.597 -2.028) 5.319 9.100 ( 3.353 3.597 -2.028) 5.319 9.264 ( -4.745 -2.158 2.739) 5.889 9.264 ( -4.745 2.158 2.739) 5.889 9.570 ( 2.065 -4.659 3.896) 6.415 9.570 ( 2.065 4.659 3.896) 6.415 10.018 ( 1.234 -2.875 2.518) 4.016 10.018 ( 1.234 2.875 2.518) 4.016 10.320 ( 4.687 -4.089 3.039) 6.922 10.320 ( 4.687 4.089 3.039) 6.922 10.631 ( 8.951 -5.668 3.468) 11.148 10.631 ( 8.951 5.668 3.468) 11.148 11.249 ( 0.109 -14.789 -10.756) 18.287 11.249 ( 0.109 14.789 -10.756) 18.287 16.404 ( 3.285 -0.270 0.362) 3.316 16.404 ( 3.285 0.270 0.362) 3.316 16.783 ( -2.437 -0.735 -0.260) 2.559 16.783 ( -2.437 0.735 -0.260) 2.559 17.462 ( -0.026 -0.998 0.168) 1.013 17.462 ( -0.026 0.998 0.168) 1.013 17.593 ( -2.210 -0.688 0.607) 2.393 17.593 ( -2.210 0.688 0.607) 2.393 17.747 ( -2.098 -0.928 0.384) 2.326 17.747 ( -2.098 0.928 0.384) 2.326 17.797 ( -2.102 -1.275 -0.618) 2.535 17.797 ( -2.102 1.275 -0.618) 2.535 19.024 ( -3.306 -9.914 1.070) 10.505 19.024 ( -3.306 9.914 1.070) 10.505 19.108 ( -4.629 -10.731 -1.935) 11.846 19.108 ( -4.629 10.731 -1.935) 11.846 21.290 ( 1.606 -0.919 -0.374) 1.888 21.290 ( 1.606 0.919 -0.374) 1.888 21.430 ( 0.233 -0.150 0.063) 0.284 21.430 ( 0.233 0.150 0.063) 0.284 21.984 ( 1.136 -1.166 0.066) 1.629 21.984 ( 1.136 1.166 0.066) 1.629 22.061 ( 0.473 -1.551 -0.648) 1.746 22.061 ( 0.473 1.551 -0.648) 1.746 27.012 ( -0.030 -1.147 -0.271) 1.179 27.012 ( -0.030 1.147 -0.271) 1.179 27.091 ( -0.893 -0.856 0.149) 1.246 27.091 ( -0.893 0.856 0.149) 1.246 27.688 ( -0.377 -1.007 0.279) 1.111 27.688 ( -0.377 1.007 0.279) 1.111 27.789 ( -1.606 -0.931 0.232) 1.871 27.789 ( -1.606 0.931 0.232) 1.871 35.763 ( -2.377 -0.521 0.989) 2.627 35.763 ( -2.377 0.521 0.989) 2.627 36.044 ( -5.047 -2.158 6.832) 8.764 36.044 ( -5.047 2.158 6.832) 8.764 36.344 ( -6.689 -1.771 -2.381) 7.317 36.344 ( -6.689 1.771 -2.381) 7.317 36.602 ( -4.773 -14.679 -0.910) 15.462 36.602 ( -4.773 14.679 -0.910) 15.462 37.229 ( 17.971 -8.713 -3.090) 20.209 37.229 ( 17.971 8.713 -3.090) 20.209 37.676 ( 9.343 -15.345 5.352) 18.746 37.676 ( 9.343 15.345 5.352) 18.746 39.747 ( 8.669 -1.988 2.234) 9.171 39.747 ( 8.669 1.988 2.234) 9.171 41.045 ( -15.555 -5.168 -6.118) 17.495 41.045 ( -15.555 5.168 -6.118) 17.495 ======================= Grid point 33 (19/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.739 ( -1.052 -6.603 1.915) 6.955 1.739 ( -1.052 6.603 1.915) 6.955 1.960 ( 2.473 -3.029 3.346) 5.147 1.960 ( 2.473 3.029 3.346) 5.147 2.299 ( 8.851 -10.812 6.998) 15.628 2.299 ( 8.851 10.812 6.998) 15.628 2.628 ( 8.294 -4.474 -2.729) 9.811 2.628 ( 8.294 4.474 -2.729) 9.811 2.819 ( 0.271 -3.532 6.301) 7.229 2.819 ( 0.271 3.532 6.301) 7.229 3.075 ( 3.768 -6.453 5.574) 9.322 3.075 ( 3.768 6.453 5.574) 9.322 3.309 ( 4.618 -9.876 -0.742) 10.928 3.309 ( 4.618 9.876 -0.742) 10.928 3.443 ( -0.826 -8.059 -1.096) 8.175 3.443 ( -0.826 8.059 -1.096) 8.175 3.741 ( 3.063 -5.597 -0.121) 6.381 3.741 ( 3.063 5.597 -0.121) 6.381 3.913 ( -0.162 -8.378 -1.328) 8.485 3.913 ( -0.162 8.378 -1.328) 8.485 4.001 ( 0.800 -5.626 2.704) 6.293 4.001 ( 0.800 5.626 2.704) 6.293 4.296 ( -2.054 -8.806 -4.075) 9.918 4.296 ( -2.054 8.806 -4.075) 9.918 4.452 ( -1.025 -3.727 2.769) 4.755 4.452 ( -1.025 3.727 2.769) 4.755 4.753 ( 2.366 -3.820 -4.244) 6.181 4.753 ( 2.366 3.820 -4.244) 6.181 4.915 ( -0.911 -0.913 -0.928) 1.589 4.915 ( -0.911 0.913 -0.928) 1.589 5.113 ( 0.013 -3.597 2.418) 4.335 5.113 ( 0.013 3.597 2.418) 4.335 5.232 ( -1.742 -5.171 1.845) 5.760 5.232 ( -1.742 5.171 1.845) 5.760 5.377 ( 3.258 -4.910 -2.353) 6.345 5.377 ( 3.258 4.910 -2.353) 6.345 5.458 ( 2.127 -4.227 -4.138) 6.286 5.458 ( 2.127 4.227 -4.138) 6.286 5.701 ( -0.324 -3.719 1.581) 4.055 5.701 ( -0.324 3.719 1.581) 4.055 5.815 ( -0.452 -3.214 1.800) 3.711 5.815 ( -0.452 3.214 1.800) 3.711 5.885 ( -1.673 -1.747 -0.497) 2.469 5.885 ( -1.673 1.747 -0.497) 2.469 5.987 ( 1.259 -5.192 0.389) 5.357 5.987 ( 1.259 5.192 0.389) 5.357 6.081 ( 2.054 -9.896 4.123) 10.916 6.081 ( 2.054 9.896 4.123) 10.916 6.225 ( -0.288 -0.253 1.371) 1.424 6.225 ( -0.288 0.253 1.371) 1.424 6.287 ( 1.522 -4.325 -5.349) 7.045 6.287 ( 1.522 4.325 -5.349) 7.045 6.437 ( -2.101 -2.338 -0.335) 3.161 6.437 ( -2.101 2.338 -0.335) 3.161 6.567 ( 2.631 -4.348 5.022) 7.145 6.567 ( 2.631 4.348 5.022) 7.145 6.636 ( 3.689 -2.261 -1.456) 4.565 6.636 ( 3.689 2.261 -1.456) 4.565 6.769 ( 0.310 -3.011 -5.782) 6.527 6.769 ( 0.310 3.011 -5.782) 6.527 6.888 ( -1.328 -2.369 2.383) 3.613 6.888 ( -1.328 2.369 2.383) 3.613 7.122 ( 0.146 -1.833 -2.816) 3.363 7.122 ( 0.146 1.833 -2.816) 3.363 7.335 ( -0.182 -3.474 -11.875) 12.374 7.335 ( -0.182 3.474 -11.875) 12.374 7.617 ( 1.142 -3.597 -3.878) 5.412 7.617 ( 1.142 3.597 -3.878) 5.412 7.724 ( 0.376 -4.442 -4.963) 6.671 7.724 ( 0.376 4.442 -4.963) 6.671 8.167 ( 5.731 -5.361 0.744) 7.883 8.167 ( 5.731 5.361 0.744) 7.883 8.246 ( -0.731 -1.752 -0.872) 2.089 8.246 ( -0.731 1.752 -0.872) 2.089 8.507 ( 0.120 -0.380 4.537) 4.554 8.507 ( 0.120 0.380 4.537) 4.554 8.614 ( -0.966 -4.122 3.859) 5.729 8.614 ( -0.966 4.122 3.859) 5.729 8.765 ( 1.271 -3.490 0.437) 3.740 8.765 ( 1.271 3.490 0.437) 3.740 9.013 ( 0.854 -3.524 -2.637) 4.484 9.013 ( 0.854 3.524 -2.637) 4.484 9.205 ( 2.760 -6.821 2.902) 7.910 9.205 ( 2.760 6.821 2.902) 7.910 9.250 ( 3.146 -4.740 5.458) 7.884 9.250 ( 3.146 4.740 5.458) 7.884 9.634 ( 1.093 -6.917 3.268) 7.728 9.634 ( 1.093 6.917 3.268) 7.728 10.048 ( -0.183 -4.034 1.610) 4.348 10.048 ( -0.183 4.034 1.610) 4.348 10.408 ( 3.375 -6.196 0.149) 7.057 10.408 ( 3.375 6.196 0.149) 7.057 10.814 ( 9.511 -5.869 0.788) 11.203 10.814 ( 9.511 5.869 0.788) 11.203 11.176 ( -0.491 -6.437 -4.232) 7.719 11.176 ( -0.491 6.437 -4.232) 7.719 16.478 ( 4.821 -0.310 0.321) 4.841 16.478 ( 4.821 0.310 0.321) 4.841 16.729 ( -3.661 -0.791 0.128) 3.748 16.729 ( -3.661 0.791 0.128) 3.748 17.467 ( 0.515 -1.242 0.024) 1.345 17.467 ( 0.515 1.242 0.024) 1.345 17.568 ( -1.797 -0.614 1.490) 2.414 17.568 ( -1.797 0.614 1.490) 2.414 17.702 ( -2.477 -0.761 -1.828) 3.171 17.702 ( -2.477 0.761 -1.828) 3.171 17.757 ( -2.029 -1.341 0.585) 2.502 17.757 ( -2.029 1.341 0.585) 2.502 18.976 ( -2.705 -8.828 0.297) 9.238 18.976 ( -2.705 8.828 0.297) 9.238 19.021 ( -3.440 -9.230 -1.354) 9.943 19.021 ( -3.440 9.230 -1.354) 9.943 21.312 ( 1.293 -0.283 -0.313) 1.360 21.312 ( 1.293 0.283 -0.313) 1.360 21.432 ( 0.000 -0.707 0.012) 0.708 21.432 ( 0.000 0.707 0.012) 0.708 22.003 ( 1.043 -1.167 -0.025) 1.565 22.003 ( 1.043 1.167 -0.025) 1.565 22.063 ( 0.246 -1.932 -0.313) 1.973 22.063 ( 0.246 1.932 -0.313) 1.973 27.009 ( -0.025 -1.177 -0.188) 1.192 27.009 ( -0.025 1.177 -0.188) 1.192 27.080 ( -0.532 -1.620 0.077) 1.706 27.080 ( -0.532 1.620 0.077) 1.706 27.688 ( 0.023 -0.918 0.355) 0.984 27.688 ( 0.023 0.918 0.355) 0.984 27.767 ( -1.346 -1.264 0.342) 1.878 27.767 ( -1.346 1.264 0.342) 1.878 35.749 ( -0.489 -2.226 1.564) 2.765 35.749 ( -0.489 2.226 1.564) 2.765 36.010 ( -6.749 -1.268 6.254) 9.288 36.010 ( -6.749 1.268 6.254) 9.288 36.205 ( -4.228 -4.592 -4.561) 7.731 36.205 ( -4.228 4.592 -4.561) 7.731 36.491 ( -5.224 -10.637 -2.370) 12.085 36.491 ( -5.224 10.637 -2.370) 12.085 37.497 ( 13.869 -12.631 -0.403) 18.763 37.497 ( 13.869 12.631 -0.403) 18.763 37.866 ( 7.359 -20.413 3.435) 21.969 37.866 ( 7.359 20.413 3.435) 21.969 39.941 ( 11.612 -2.060 1.477) 11.885 39.941 ( 11.612 2.060 1.477) 11.885 40.721 ( -15.995 -4.384 -4.240) 17.118 40.721 ( -15.995 4.384 -4.240) 17.118 ======================= Grid point 35 (20/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.728 ( -0.665 -6.800 0.051) 6.833 1.728 ( -0.665 6.800 0.051) 6.833 2.009 ( 0.638 -0.507 1.244) 1.487 2.009 ( 0.638 0.507 1.244) 1.487 2.499 ( 5.835 -14.296 5.283) 16.320 2.499 ( 5.835 14.296 5.283) 16.320 2.668 ( 1.223 -3.650 -1.019) 3.982 2.668 ( 1.223 3.650 -1.019) 3.982 2.842 ( -2.383 -1.163 1.722) 3.162 2.842 ( -2.383 1.163 1.722) 3.162 3.121 ( 0.480 -6.990 -0.779) 7.049 3.121 ( 0.480 6.990 -0.779) 7.049 3.276 ( -1.414 -17.586 -3.696) 18.026 3.276 ( -1.414 17.586 -3.696) 18.026 3.590 ( 5.341 -9.040 11.005) 15.211 3.590 ( 5.341 9.040 11.005) 15.211 3.783 ( 2.682 -6.066 -6.547) 9.319 3.783 ( 2.682 6.066 -6.547) 9.319 3.913 ( 1.625 -2.638 -0.188) 3.104 3.913 ( 1.625 2.638 -0.188) 3.104 4.030 ( -0.744 -2.670 3.207) 4.239 4.030 ( -0.744 2.670 3.207) 4.239 4.220 ( -2.342 -9.648 -2.970) 10.363 4.220 ( -2.342 9.648 -2.970) 10.363 4.456 ( -0.424 -7.280 0.812) 7.338 4.456 ( -0.424 7.280 0.812) 7.338 4.699 ( -1.004 -2.318 -3.307) 4.161 4.699 ( -1.004 2.318 -3.307) 4.161 4.853 ( -2.203 -6.977 -2.387) 7.696 4.853 ( -2.203 6.977 -2.387) 7.696 5.183 ( 1.064 -4.712 3.374) 5.892 5.183 ( 1.064 4.712 3.374) 5.892 5.259 ( 2.527 -5.194 1.355) 5.933 5.259 ( 2.527 5.194 1.355) 5.933 5.406 ( 1.737 -5.317 -0.708) 5.639 5.406 ( 1.737 5.317 -0.708) 5.639 5.478 ( 2.054 -4.693 -1.315) 5.288 5.478 ( 2.054 4.693 -1.315) 5.288 5.667 ( -4.264 -2.765 0.296) 5.091 5.667 ( -4.264 2.765 0.296) 5.091 5.822 ( 0.190 -0.801 0.176) 0.841 5.822 ( 0.190 0.801 0.176) 0.841 5.876 ( 1.187 -0.939 0.224) 1.530 5.876 ( 1.187 0.939 0.224) 1.531 5.990 ( -0.642 -0.845 0.341) 1.114 5.990 ( -0.642 0.845 0.341) 1.114 6.110 ( -0.632 -4.378 1.088) 4.555 6.110 ( -0.632 4.378 1.088) 4.555 6.216 ( -0.275 -3.580 -3.249) 4.843 6.216 ( -0.275 3.580 -3.249) 4.843 6.313 ( 2.459 -2.644 2.288) 4.274 6.313 ( 2.459 2.644 2.288) 4.274 6.422 ( 0.260 -1.873 -0.014) 1.891 6.422 ( 0.260 1.873 -0.014) 1.891 6.613 ( -1.442 -8.437 1.196) 8.642 6.613 ( -1.442 8.437 1.196) 8.642 6.681 ( 1.637 -0.929 1.019) 2.140 6.681 ( 1.637 0.929 1.019) 2.140 6.761 ( 3.982 -5.316 -3.345) 7.437 6.761 ( 3.982 5.316 -3.345) 7.437 6.854 ( -4.148 -4.569 1.050) 6.259 6.854 ( -4.148 4.569 1.050) 6.259 7.128 ( 2.597 -2.474 -1.269) 3.804 7.128 ( 2.597 2.474 -1.269) 3.804 7.251 ( -1.028 -3.784 -3.767) 5.438 7.251 ( -1.028 3.784 -3.767) 5.438 7.544 ( -1.933 -1.150 -3.532) 4.187 7.544 ( -1.933 1.150 -3.532) 4.187 7.734 ( 1.691 -1.310 -1.141) 2.425 7.734 ( 1.691 1.310 -1.141) 2.425 8.171 ( -1.754 -2.986 -0.670) 3.527 8.171 ( -1.754 2.986 -0.670) 3.527 8.274 ( 2.091 -7.079 0.332) 7.389 8.274 ( 2.091 7.079 0.332) 7.389 8.551 ( 0.417 -2.365 2.152) 3.224 8.551 ( 0.417 2.365 2.152) 3.224 8.635 ( 0.041 -1.616 1.839) 2.449 8.635 ( 0.041 1.616 1.839) 2.449 8.777 ( 0.475 -3.810 -0.717) 3.906 8.777 ( 0.475 3.810 -0.717) 3.906 8.996 ( 0.005 -4.543 -1.451) 4.769 8.996 ( 0.005 4.543 -1.451) 4.769 9.220 ( -0.372 -2.385 1.306) 2.744 9.220 ( -0.372 2.385 1.306) 2.744 9.411 ( 5.023 -11.921 3.758) 13.471 9.411 ( 5.023 11.921 3.758) 13.471 9.659 ( -0.351 -12.262 0.939) 12.303 9.659 ( -0.351 12.262 0.939) 12.303 10.045 ( -0.574 -2.939 0.093) 2.996 10.045 ( -0.574 2.939 0.093) 2.996 10.436 ( 0.849 -8.606 -0.939) 8.699 10.436 ( 0.849 8.606 -0.939) 8.699 10.963 ( 7.584 -7.092 -1.643) 10.513 10.963 ( 7.584 7.092 -1.643) 10.513 11.131 ( -3.533 -1.871 1.342) 4.217 11.131 ( -3.533 1.871 1.342) 4.217 16.566 ( 4.855 -0.159 -0.075) 4.859 16.566 ( 4.855 0.159 -0.075) 4.859 16.662 ( -4.245 -0.464 0.381) 4.288 16.662 ( -4.245 0.464 0.381) 4.288 17.475 ( 0.375 -1.929 -0.330) 1.992 17.475 ( 0.375 1.929 -0.330) 1.992 17.563 ( -0.666 -1.099 1.904) 2.297 17.563 ( -0.666 1.099 1.904) 2.297 17.643 ( -1.403 -0.768 -2.122) 2.657 17.643 ( -1.403 0.768 -2.122) 2.657 17.741 ( -0.700 -0.782 0.536) 1.178 17.741 ( -0.700 0.782 0.536) 1.178 18.945 ( -0.874 -8.890 -0.117) 8.934 18.945 ( -0.874 8.890 -0.117) 8.934 18.971 ( -1.403 -9.533 -0.385) 9.643 18.971 ( -1.403 9.533 -0.385) 9.643 21.326 ( 0.542 -0.781 -0.094) 0.955 21.326 ( 0.542 0.781 -0.094) 0.955 21.431 ( -0.082 -1.401 -0.023) 1.404 21.431 ( -0.082 1.401 -0.023) 1.404 22.016 ( 0.436 -1.021 -0.053) 1.112 22.016 ( 0.436 1.021 -0.053) 1.112 22.064 ( 0.047 -2.173 -0.042) 2.174 22.064 ( 0.047 2.173 -0.042) 2.174 27.008 ( -0.003 -1.846 -0.057) 1.847 27.008 ( -0.003 1.846 -0.057) 1.847 27.074 ( -0.174 -2.325 0.010) 2.332 27.074 ( -0.174 2.325 0.010) 2.332 27.694 ( 0.215 -0.384 0.195) 0.482 27.694 ( 0.215 0.384 0.195) 0.482 27.751 ( -0.650 -1.438 0.123) 1.583 27.751 ( -0.650 1.438 0.123) 1.583 35.779 ( 1.936 -1.733 1.687) 3.098 35.779 ( 1.936 1.733 1.687) 3.098 35.916 ( -6.088 -2.350 0.220) 6.529 35.916 ( -6.088 2.350 0.220) 6.529 36.152 ( 0.019 -10.216 -0.761) 10.244 36.152 ( 0.019 10.216 -0.761) 10.244 36.404 ( -2.394 -8.207 -1.228) 8.637 36.404 ( -2.394 8.207 -1.228) 8.637 37.663 ( 5.081 -16.675 0.148) 17.432 37.663 ( 5.081 16.675 0.148) 17.432 37.975 ( 2.719 -23.563 1.126) 23.746 37.975 ( 2.719 23.563 1.126) 23.746 40.160 ( 12.317 -3.765 0.533) 12.891 40.160 ( 12.317 3.765 0.533) 12.891 40.435 ( -13.737 -3.138 -1.537) 14.175 40.435 ( -13.737 3.138 -1.537) 14.175 ======================= Grid point 63 (21/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.424 ( 17.243 0.000 23.695) 29.305 0.576 ( -6.475 0.000 30.999) 31.668 1.155 ( -11.527 0.000 54.530) 55.735 1.717 ( -0.628 0.000 -14.028) 14.042 1.984 ( -0.365 0.000 0.660) 0.754 2.031 ( 9.333 0.000 -3.293) 9.897 2.062 ( 0.774 0.000 6.066) 6.116 2.165 ( -7.102 0.000 -6.172) 9.409 2.183 ( -9.713 0.000 -7.087) 12.024 2.556 ( 3.904 0.000 12.310) 12.915 2.574 ( 2.828 0.000 0.640) 2.899 2.882 ( 2.018 0.000 1.169) 2.332 2.908 ( -0.940 0.000 -0.336) 0.999 3.180 ( 0.128 0.000 4.005) 4.007 3.234 ( 0.378 0.000 9.692) 9.700 3.332 ( 1.228 0.000 1.992) 2.340 3.623 ( -1.283 0.000 3.232) 3.478 3.700 ( 6.309 0.000 -5.625) 8.452 3.831 ( 1.826 0.000 8.078) 8.282 4.002 ( 2.419 0.000 -1.148) 2.678 4.198 ( 1.564 0.000 1.340) 2.059 4.222 ( 0.450 0.000 -0.756) 0.880 4.245 ( -0.058 0.000 0.548) 0.551 4.432 ( 5.183 0.000 -7.048) 8.749 4.538 ( -6.320 0.000 -3.569) 7.258 4.652 ( -6.720 0.000 -6.772) 9.540 4.700 ( -1.462 0.000 3.291) 3.602 4.714 ( -0.381 0.000 -6.023) 6.035 4.835 ( -11.529 0.000 -1.424) 11.617 4.855 ( 4.715 0.000 2.232) 5.217 4.922 ( 4.389 0.000 -4.508) 6.292 4.963 ( 1.004 0.000 2.438) 2.637 5.073 ( 5.295 0.000 -7.485) 9.169 5.094 ( 3.441 0.000 0.373) 3.462 5.238 ( 2.571 0.000 4.156) 4.887 5.338 ( 3.654 0.000 -6.220) 7.214 5.408 ( -2.999 0.000 3.986) 4.988 5.417 ( -2.608 0.000 -0.767) 2.718 5.467 ( 3.801 0.000 2.018) 4.304 5.664 ( 0.690 0.000 -6.120) 6.158 5.669 ( 3.160 0.000 -5.809) 6.613 5.716 ( -3.039 0.000 5.822) 6.567 5.828 ( 2.120 0.000 2.429) 3.224 5.947 ( -1.475 0.000 5.765) 5.951 5.995 ( 2.470 0.000 -3.865) 4.587 6.005 ( 4.602 0.000 -0.315) 4.613 6.096 ( -3.027 0.000 -2.457) 3.899 6.170 ( 4.335 0.000 4.224) 6.053 6.195 ( -4.239 0.000 8.294) 9.315 6.294 ( -2.728 0.000 -0.584) 2.790 6.374 ( -2.461 0.000 1.605) 2.938 6.382 ( 5.357 0.000 -2.722) 6.009 6.449 ( -0.117 0.000 3.794) 3.796 6.622 ( -4.619 0.000 -9.496) 10.560 6.625 ( 5.790 0.000 -3.464) 6.747 6.686 ( 0.378 0.000 -0.348) 0.514 6.691 ( 3.240 0.000 -5.034) 5.986 6.709 ( -3.579 0.000 -1.236) 3.786 6.831 ( 1.280 0.000 -3.921) 4.125 6.906 ( -3.317 0.000 -6.445) 7.248 6.959 ( -1.499 0.000 -0.151) 1.507 7.008 ( -3.880 0.000 0.106) 3.881 7.026 ( -3.909 0.000 -4.021) 5.608 7.184 ( -9.241 0.000 -2.554) 9.587 7.280 ( 5.600 0.000 -2.359) 6.077 7.406 ( -4.003 0.000 4.726) 6.193 7.467 ( 2.849 0.000 -0.507) 2.893 7.522 ( 3.975 0.000 3.511) 5.304 7.636 ( -3.007 0.000 3.897) 4.923 7.669 ( 6.835 0.000 -7.569) 10.198 7.986 ( -1.714 0.000 6.024) 6.263 8.050 ( -0.655 0.000 1.313) 1.468 8.189 ( 3.586 0.000 2.894) 4.608 8.271 ( -9.226 0.000 4.439) 10.238 8.394 ( 1.608 0.000 2.411) 2.898 8.427 ( -0.088 0.000 -3.224) 3.225 8.555 ( 1.046 0.000 -2.861) 3.046 8.622 ( -0.521 0.000 1.658) 1.738 8.714 ( 2.053 0.000 -1.100) 2.330 8.742 ( -0.344 0.000 -1.786) 1.818 8.858 ( 5.809 0.000 -0.769) 5.860 8.981 ( -1.217 0.000 -4.596) 4.754 9.150 ( -6.071 0.000 2.334) 6.504 9.199 ( -3.996 0.000 2.619) 4.778 9.225 ( -2.069 0.000 -5.702) 6.066 9.271 ( 1.738 0.000 0.060) 1.739 9.740 ( -11.656 0.000 7.572) 13.900 9.821 ( 42.476 0.000 0.387) 42.477 10.002 ( -15.025 0.000 -0.833) 15.048 10.118 ( -1.738 0.000 -1.693) 2.427 10.121 ( -0.424 0.000 1.834) 1.882 10.188 ( 2.842 0.000 -3.165) 4.254 10.260 ( 3.243 0.000 1.965) 3.792 10.403 ( 3.356 0.000 0.770) 3.443 10.731 ( 7.499 0.000 12.015) 14.163 11.607 ( -25.165 0.000 -8.582) 26.588 16.352 ( 0.589 0.000 0.209) 0.625 16.355 ( -0.569 0.000 0.176) 0.595 16.857 ( 0.155 0.000 -0.026) 0.157 16.862 ( 0.035 0.000 -0.177) 0.180 17.549 ( 0.041 0.000 0.817) 0.818 17.590 ( 0.649 0.000 0.250) 0.696 17.633 ( 0.270 0.000 -1.010) 1.046 17.640 ( -0.248 0.000 -0.210) 0.325 17.783 ( 0.226 0.000 -1.446) 1.463 17.804 ( -0.237 0.000 -1.646) 1.663 17.901 ( -0.596 0.000 4.665) 4.702 18.081 ( 0.757 0.000 -0.494) 0.904 18.376 ( -0.105 0.000 -0.316) 0.333 18.385 ( 0.008 0.000 -0.630) 0.630 19.499 ( 2.043 0.000 0.175) 2.050 19.526 ( -0.433 0.000 -0.534) 0.688 21.234 ( -0.850 0.000 0.211) 0.876 21.248 ( 0.034 0.000 -0.124) 0.129 21.422 ( 0.175 0.000 0.084) 0.194 21.434 ( -0.225 0.000 -0.214) 0.310 21.919 ( -0.116 0.000 0.028) 0.119 21.922 ( 0.130 0.000 -0.026) 0.132 22.046 ( -7.319 0.000 0.071) 7.319 22.051 ( 0.606 0.000 -0.044) 0.607 26.940 ( -0.074 0.000 0.210) 0.223 26.996 ( -0.251 0.000 -1.477) 1.498 27.138 ( 0.379 0.000 1.160) 1.220 27.169 ( -0.200 0.000 0.051) 0.206 27.691 ( -0.534 0.000 0.379) 0.655 27.708 ( 0.584 0.000 0.065) 0.588 27.792 ( -0.725 0.000 0.160) 0.742 27.815 ( 0.502 0.000 -0.330) 0.601 35.605 ( 1.465 0.000 4.599) 4.827 35.824 ( -0.949 0.000 3.185) 3.324 35.982 ( -0.716 0.000 -5.546) 5.592 36.183 ( 1.300 0.000 -6.499) 6.627 36.335 ( -0.852 0.000 0.099) 0.858 36.336 ( 2.658 0.000 -0.481) 2.701 36.641 ( 3.139 0.000 11.221) 11.652 36.859 ( 2.316 0.000 -0.189) 2.323 36.880 ( -22.664 0.000 0.657) 22.674 37.434 ( 2.590 0.000 -11.832) 12.112 38.229 ( -5.426 0.000 12.452) 13.583 38.886 ( 42.123 0.000 -6.610) 42.638 39.419 ( 2.883 0.000 2.944) 4.121 39.602 ( -0.299 0.000 -2.103) 2.124 40.358 ( -2.079 0.000 5.918) 6.273 40.889 ( 6.615 0.000 -6.961) 9.603 ======================= Grid point 64 (22/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.780 ( -3.556 0.000 30.042) 30.252 1.035 ( 13.848 0.000 24.583) 28.215 1.541 ( 11.395 0.000 24.802) 27.294 1.653 ( 13.747 0.000 -17.873) 22.548 1.975 ( -1.767 0.000 0.334) 1.799 2.015 ( -1.076 0.000 -12.360) 12.407 2.090 ( 5.457 0.000 -1.963) 5.800 2.231 ( 3.805 0.000 16.521) 16.953 2.292 ( 21.533 0.000 -6.025) 22.360 2.736 ( 7.106 0.000 3.733) 8.027 2.759 ( 13.455 0.000 5.234) 14.437 2.913 ( 2.024 0.000 -0.110) 2.027 3.005 ( 10.575 0.000 1.561) 10.689 3.263 ( 0.996 0.000 -1.926) 2.168 3.302 ( 9.002 0.000 2.751) 9.413 3.528 ( 9.985 0.000 10.924) 14.800 3.621 ( -2.083 0.000 4.123) 4.619 3.788 ( 5.031 0.000 -0.552) 5.061 3.961 ( 3.324 0.000 10.399) 10.918 4.042 ( 4.497 0.000 0.060) 4.497 4.083 ( -8.475 0.000 -4.336) 9.520 4.192 ( -4.766 0.000 -7.539) 8.919 4.255 ( -4.607 0.000 5.523) 7.192 4.289 ( -2.776 0.000 -3.699) 4.624 4.387 ( -13.642 0.000 -7.982) 15.806 4.471 ( 0.495 0.000 -2.655) 2.701 4.606 ( -12.884 0.000 -1.233) 12.943 4.644 ( -0.895 0.000 -4.925) 5.005 4.697 ( -2.586 0.000 2.698) 3.737 4.918 ( 1.910 0.000 0.225) 1.923 4.929 ( -6.231 0.000 -4.299) 7.571 5.070 ( 7.585 0.000 -2.227) 7.905 5.177 ( 6.180 0.000 -2.688) 6.739 5.184 ( 12.204 0.000 -2.105) 12.384 5.278 ( 5.165 0.000 -0.884) 5.240 5.295 ( -2.614 0.000 -5.085) 5.717 5.394 ( -3.377 0.000 1.771) 3.813 5.442 ( 8.465 0.000 -4.492) 9.583 5.566 ( 2.832 0.000 4.027) 4.923 5.579 ( -3.360 0.000 -3.686) 4.987 5.692 ( -6.641 0.000 4.862) 8.230 5.694 ( 4.071 0.000 -1.948) 4.514 5.864 ( -0.101 0.000 2.954) 2.956 5.959 ( -2.302 0.000 4.489) 5.045 5.984 ( -0.959 0.000 -3.581) 3.707 6.011 ( -4.018 0.000 -0.357) 4.034 6.025 ( -1.676 0.000 0.092) 1.678 6.207 ( -4.124 0.000 -0.758) 4.193 6.211 ( -1.865 0.000 5.446) 5.757 6.300 ( 3.532 0.000 1.046) 3.684 6.317 ( -3.566 0.000 -3.263) 4.833 6.351 ( -0.552 0.000 -3.808) 3.847 6.490 ( 0.439 0.000 3.801) 3.826 6.540 ( 0.511 0.000 -5.625) 5.648 6.617 ( 1.336 0.000 -6.316) 6.456 6.658 ( -0.914 0.000 -3.883) 3.989 6.674 ( 4.210 0.000 -5.928) 7.271 6.731 ( -0.836 0.000 -8.330) 8.372 6.817 ( -2.213 0.000 7.699) 8.011 6.874 ( 0.284 0.000 6.167) 6.174 6.917 ( -0.063 0.000 0.926) 0.928 6.945 ( -6.961 0.000 -6.786) 9.722 7.029 ( 4.387 0.000 1.696) 4.704 7.124 ( 12.515 0.000 1.310) 12.584 7.375 ( 1.006 0.000 -3.695) 3.830 7.379 ( 4.513 0.000 -3.346) 5.618 7.507 ( 4.897 0.000 -5.633) 7.464 7.578 ( 1.795 0.000 -2.023) 2.704 7.692 ( 4.470 0.000 2.666) 5.205 7.727 ( 4.454 0.000 -2.679) 5.198 8.003 ( -2.643 0.000 6.110) 6.657 8.110 ( 4.929 0.000 1.656) 5.200 8.188 ( -5.957 0.000 6.620) 8.906 8.288 ( 2.861 0.000 2.848) 4.037 8.393 ( -0.413 0.000 0.550) 0.688 8.426 ( 1.428 0.000 -2.328) 2.731 8.558 ( 2.071 0.000 -1.834) 2.767 8.589 ( -3.087 0.000 -1.092) 3.274 8.722 ( -0.366 0.000 -1.029) 1.092 8.770 ( 3.218 0.000 0.274) 3.230 8.927 ( 0.889 0.000 -2.517) 2.669 8.945 ( 0.274 0.000 0.182) 0.329 9.058 ( -2.080 0.000 2.116) 2.967 9.164 ( -2.093 0.000 0.174) 2.100 9.173 ( -1.635 0.000 -0.056) 1.636 9.315 ( 1.702 0.000 2.566) 3.079 9.591 ( -8.322 0.000 0.398) 8.332 9.784 ( -10.614 0.000 6.730) 12.568 10.100 ( 0.061 0.000 -0.320) 0.326 10.108 ( -0.119 0.000 0.392) 0.410 10.196 ( 7.649 0.000 -1.758) 7.848 10.265 ( 9.268 0.000 -2.874) 9.703 10.370 ( 7.462 0.000 1.348) 7.583 10.416 ( 0.800 0.000 -2.206) 2.346 11.093 ( 13.880 0.000 20.780) 24.989 11.480 ( 10.424 0.000 -20.245) 22.772 16.359 ( 1.093 0.000 -0.222) 1.115 16.378 ( 1.978 0.000 0.628) 2.075 16.852 ( -1.020 0.000 0.079) 1.023 16.858 ( -0.497 0.000 0.069) 0.501 17.565 ( 0.711 0.000 1.140) 1.344 17.596 ( -1.709 0.000 0.650) 1.829 17.609 ( 0.458 0.000 -0.453) 0.644 17.615 ( -2.002 0.000 -0.856) 2.177 17.759 ( -1.449 0.000 -1.023) 1.774 17.769 ( -1.993 0.000 -1.801) 2.686 17.896 ( -3.703 0.000 4.448) 5.788 18.060 ( -2.469 0.000 -1.055) 2.685 18.373 ( 0.187 0.000 -0.352) 0.398 18.380 ( 0.055 0.000 -0.612) 0.615 19.466 ( -4.515 0.000 1.692) 4.821 19.477 ( -4.106 0.000 -1.018) 4.231 21.258 ( 1.199 0.000 0.233) 1.221 21.296 ( 4.711 0.000 -3.462) 5.846 21.429 ( 0.356 0.000 0.196) 0.407 21.436 ( 1.175 0.000 -0.660) 1.348 21.922 ( 0.402 0.000 -0.004) 0.402 21.931 ( 0.853 0.000 -0.012) 0.853 22.006 ( -0.319 0.000 0.909) 0.964 22.073 ( 1.603 0.000 0.706) 1.752 26.944 ( 0.167 0.000 0.609) 0.631 26.977 ( -0.336 0.000 -1.393) 1.433 27.154 ( 0.181 0.000 0.997) 1.013 27.160 ( -0.682 0.000 -0.215) 0.715 27.678 ( -1.228 0.000 0.443) 1.306 27.715 ( 0.025 0.000 0.361) 0.361 27.769 ( -1.866 0.000 -0.123) 1.870 27.819 ( 0.150 0.000 -0.253) 0.294 35.681 ( 0.233 0.000 6.130) 6.134 35.813 ( -2.448 0.000 4.354) 4.995 35.889 ( -2.550 0.000 -6.783) 7.246 36.107 ( -2.236 0.000 -7.523) 7.848 36.366 ( 3.171 0.000 -1.135) 3.368 36.414 ( 3.093 0.000 2.768) 4.150 36.534 ( -16.621 0.000 9.761) 19.276 36.761 ( -1.100 0.000 11.062) 11.116 36.896 ( 0.574 0.000 1.226) 1.354 37.328 ( -1.416 0.000 -12.527) 12.607 38.263 ( -1.728 0.000 9.792) 9.943 39.100 ( 6.742 0.000 -13.892) 15.441 39.538 ( 6.222 0.000 1.967) 6.525 39.601 ( 2.987 0.000 -4.086) 5.062 40.355 ( -5.021 0.000 7.533) 9.053 40.864 ( -0.586 0.000 -10.471) 10.487 ======================= Grid point 65 (23/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 0.264 0.000 26.264) 26.265 1.399 ( 6.090 0.000 23.076) 23.866 1.834 ( 4.779 0.000 7.048) 8.516 1.840 ( 18.244 0.000 -8.830) 20.268 1.918 ( 7.649 0.000 -16.479) 18.168 1.977 ( 4.583 0.000 -2.961) 5.456 2.263 ( 11.402 0.000 4.015) 12.088 2.347 ( -2.092 0.000 6.979) 7.286 2.733 ( 24.742 0.000 1.281) 24.775 2.863 ( 9.307 0.000 -4.434) 10.309 2.962 ( 2.290 0.000 0.069) 2.291 3.016 ( 7.775 0.000 6.052) 9.853 3.239 ( 14.437 0.000 -0.020) 14.437 3.265 ( 3.512 0.000 -3.080) 4.671 3.470 ( 7.206 0.000 1.422) 7.345 3.682 ( 1.136 0.000 10.018) 10.083 3.780 ( 9.509 0.000 2.145) 9.748 3.856 ( 2.046 0.000 4.372) 4.827 3.923 ( -4.940 0.000 -8.486) 9.819 3.971 ( -7.880 0.000 -0.869) 7.928 3.992 ( -4.558 0.000 -4.881) 6.678 4.105 ( 0.818 0.000 -8.066) 8.108 4.197 ( -9.363 0.000 3.978) 10.173 4.257 ( 1.843 0.000 -6.256) 6.521 4.260 ( 3.238 0.000 12.599) 13.009 4.329 ( -13.875 0.000 -6.368) 15.267 4.529 ( 0.266 0.000 11.062) 11.065 4.615 ( 1.498 0.000 -0.645) 1.631 4.711 ( 4.889 0.000 2.799) 5.634 4.810 ( 0.499 0.000 -6.301) 6.321 4.918 ( -0.886 0.000 -2.904) 3.036 5.009 ( -5.484 0.000 -16.518) 17.404 5.216 ( 6.340 0.000 -5.155) 8.171 5.261 ( 3.973 0.000 3.436) 5.253 5.330 ( 1.900 0.000 0.226) 1.913 5.338 ( -0.876 0.000 -2.415) 2.569 5.363 ( 1.356 0.000 2.894) 3.196 5.505 ( -2.463 0.000 -2.309) 3.376 5.590 ( -5.518 0.000 3.111) 6.335 5.614 ( 3.985 0.000 5.202) 6.553 5.616 ( -0.185 0.000 1.305) 1.318 5.760 ( 6.876 0.000 -3.960) 7.935 5.850 ( -7.371 0.000 0.025) 7.371 5.894 ( -0.151 0.000 3.899) 3.901 5.956 ( -4.206 0.000 -7.634) 8.716 5.974 ( -4.316 0.000 1.227) 4.487 6.026 ( 0.357 0.000 2.321) 2.348 6.128 ( 2.743 0.000 4.991) 5.695 6.159 ( -1.303 0.000 -9.268) 9.359 6.269 ( 3.027 0.000 -6.819) 7.461 6.314 ( -0.163 0.000 0.305) 0.346 6.324 ( -3.019 0.000 -1.870) 3.551 6.493 ( -3.932 0.000 0.485) 3.962 6.516 ( -1.138 0.000 2.562) 2.803 6.571 ( -1.955 0.000 -1.333) 2.366 6.595 ( -4.156 0.000 -5.410) 6.822 6.682 ( 5.624 0.000 5.894) 8.147 6.772 ( 3.533 0.000 4.527) 5.742 6.779 ( -4.357 0.000 -3.823) 5.797 6.882 ( 3.514 0.000 -2.620) 4.383 6.931 ( -1.832 0.000 7.574) 7.792 7.008 ( 2.933 0.000 9.253) 9.707 7.156 ( 9.782 0.000 -2.050) 9.995 7.292 ( -0.634 0.000 0.311) 0.706 7.389 ( 2.638 0.000 -5.072) 5.717 7.428 ( 14.713 0.000 -6.497) 16.083 7.526 ( 1.332 0.000 -2.866) 3.160 7.590 ( 3.201 0.000 -2.794) 4.248 7.753 ( 5.575 0.000 -9.424) 10.950 7.773 ( 1.810 0.000 3.244) 3.715 8.020 ( -3.692 0.000 7.654) 8.498 8.185 ( 0.104 0.000 4.612) 4.613 8.225 ( 5.418 0.000 0.580) 5.449 8.325 ( 1.253 0.000 4.180) 4.364 8.387 ( -1.208 0.000 -4.417) 4.580 8.453 ( 1.550 0.000 4.654) 4.905 8.509 ( -1.221 0.000 -6.539) 6.652 8.599 ( 4.923 0.000 -4.134) 6.429 8.712 ( -0.275 0.000 0.740) 0.789 8.767 ( -1.747 0.000 -1.504) 2.305 8.941 ( 2.504 0.000 3.110) 3.993 8.981 ( 2.380 0.000 0.324) 2.402 9.076 ( -2.356 0.000 4.593) 5.162 9.125 ( -1.942 0.000 -0.009) 1.942 9.153 ( 0.050 0.000 -2.954) 2.955 9.362 ( 0.570 0.000 2.655) 2.715 9.501 ( -1.612 0.000 -0.609) 1.723 9.719 ( -5.527 0.000 7.239) 9.107 10.102 ( -0.603 0.000 0.497) 0.781 10.107 ( 0.693 0.000 0.297) 0.754 10.300 ( 5.536 0.000 3.014) 6.303 10.364 ( 4.105 0.000 -5.745) 7.061 10.506 ( 13.724 0.000 0.315) 13.728 10.521 ( 9.935 0.000 -1.207) 10.008 11.410 ( 4.093 0.000 -21.820) 22.201 11.498 ( 8.039 0.000 21.397) 22.857 16.392 ( 3.219 0.000 -0.468) 3.253 16.429 ( 3.243 0.000 0.662) 3.310 16.830 ( -2.144 0.000 0.783) 2.282 16.835 ( -2.350 0.000 0.133) 2.353 17.539 ( -3.660 0.000 -2.027) 4.184 17.565 ( -1.576 0.000 -0.037) 1.576 17.610 ( 2.011 0.000 0.886) 2.198 17.628 ( 1.305 0.000 0.057) 1.306 17.706 ( -3.564 0.000 -0.948) 3.688 17.720 ( -2.032 0.000 -0.622) 2.125 17.869 ( -3.716 0.000 3.515) 5.115 17.983 ( -4.438 0.000 -2.194) 4.951 18.375 ( 0.353 0.000 -0.192) 0.401 18.377 ( 0.137 0.000 -0.263) 0.296 19.385 ( -4.947 0.000 -1.091) 5.066 19.398 ( -4.884 0.000 1.313) 5.058 21.296 ( 2.207 0.000 1.407) 2.617 21.312 ( 1.089 0.000 -2.414) 2.648 21.432 ( -0.176 0.000 -0.055) 0.185 21.459 ( 2.242 0.000 -1.263) 2.573 21.932 ( 0.681 0.000 0.078) 0.685 21.947 ( 1.056 0.000 -0.131) 1.064 22.018 ( 0.660 0.000 0.426) 0.785 22.113 ( 1.650 0.000 1.477) 2.215 26.957 ( 0.493 0.000 0.824) 0.960 26.961 ( -0.212 0.000 -0.962) 0.985 27.145 ( -0.646 0.000 -0.455) 0.790 27.161 ( -0.072 0.000 0.451) 0.457 27.662 ( -0.942 0.000 0.389) 1.019 27.715 ( -0.301 0.000 -0.058) 0.306 27.734 ( -1.967 0.000 0.354) 1.999 27.812 ( -0.586 0.000 -0.498) 0.769 35.690 ( -3.921 0.000 5.459) 6.721 35.789 ( -1.602 0.000 -6.433) 6.629 35.877 ( 3.183 0.000 5.542) 6.391 35.980 ( -3.709 0.000 -7.907) 8.734 36.330 ( -15.033 0.000 13.117) 19.951 36.348 ( -4.147 0.000 -3.707) 5.562 36.555 ( 4.603 0.000 1.608) 4.875 36.845 ( -6.012 0.000 -5.396) 8.078 36.851 ( 1.342 0.000 8.041) 8.152 37.216 ( 1.924 0.000 -6.650) 6.923 38.390 ( 7.047 0.000 7.837) 10.539 39.063 ( 3.990 0.000 -11.149) 11.842 39.617 ( 4.248 0.000 -5.849) 7.229 39.678 ( 8.435 0.000 2.284) 8.739 40.341 ( -5.615 0.000 9.393) 10.944 40.704 ( -6.275 0.000 -9.917) 11.736 ======================= Grid point 66 (24/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( -1.005 0.000 20.095) 20.120 1.699 ( 9.691 0.000 11.308) 14.892 1.865 ( 2.141 0.000 -1.197) 2.453 1.920 ( 0.331 0.000 -0.708) 0.782 2.027 ( 9.753 0.000 -2.863) 10.165 2.162 ( 17.231 0.000 -6.951) 18.580 2.301 ( -8.594 0.000 3.900) 9.438 2.475 ( 6.456 0.000 5.100) 8.227 2.941 ( 1.177 0.000 -2.173) 2.472 3.000 ( 10.967 0.000 -9.221) 14.328 3.028 ( 8.026 0.000 -1.048) 8.094 3.127 ( 4.027 0.000 -0.287) 4.037 3.345 ( 8.549 0.000 -3.669) 9.303 3.414 ( 4.333 0.000 -2.473) 4.989 3.570 ( 0.304 0.000 -0.334) 0.451 3.666 ( -3.896 0.000 -3.936) 5.538 3.760 ( -3.649 0.000 10.032) 10.675 3.820 ( -6.001 0.000 -0.922) 6.071 3.880 ( 0.968 0.000 -2.904) 3.062 3.958 ( 3.859 0.000 -4.806) 6.163 3.983 ( -9.443 0.000 -4.759) 10.574 4.041 ( -1.319 0.000 1.156) 1.754 4.074 ( 10.527 0.000 -12.146) 16.073 4.182 ( 1.642 0.000 5.129) 5.385 4.229 ( 0.839 0.000 -4.649) 4.725 4.389 ( 2.690 0.000 -1.544) 3.102 4.605 ( -2.068 0.000 8.413) 8.664 4.677 ( -7.251 0.000 -18.449) 19.823 4.736 ( 7.004 0.000 0.116) 7.005 4.888 ( 10.853 0.000 11.974) 16.160 4.915 ( 3.664 0.000 -4.719) 5.975 4.932 ( 6.813 0.000 10.596) 12.597 5.227 ( -4.399 0.000 0.798) 4.471 5.284 ( -4.573 0.000 3.584) 5.810 5.346 ( -1.290 0.000 -0.796) 1.516 5.394 ( 3.492 0.000 7.334) 8.123 5.409 ( 2.295 0.000 0.811) 2.434 5.441 ( -0.121 0.000 -4.252) 4.254 5.514 ( -5.265 0.000 2.587) 5.866 5.556 ( -7.166 0.000 -3.567) 8.005 5.628 ( -1.853 0.000 -5.336) 5.649 5.744 ( -3.970 0.000 3.314) 5.172 5.837 ( 5.423 0.000 -2.865) 6.133 5.876 ( 3.353 0.000 -0.555) 3.398 5.900 ( -1.511 0.000 -2.867) 3.241 5.944 ( -0.281 0.000 1.116) 1.150 6.029 ( -3.733 0.000 -4.670) 5.979 6.082 ( 2.358 0.000 3.265) 4.028 6.185 ( -4.875 0.000 -0.182) 4.878 6.254 ( 3.726 0.000 -7.198) 8.105 6.288 ( 0.772 0.000 9.066) 9.099 6.389 ( 3.557 0.000 -1.272) 3.778 6.433 ( -3.264 0.000 4.140) 5.272 6.479 ( -3.182 0.000 1.809) 3.660 6.500 ( -1.847 0.000 -4.205) 4.593 6.607 ( 1.292 0.000 3.448) 3.682 6.707 ( -1.170 0.000 4.194) 4.355 6.806 ( 0.767 0.000 4.061) 4.133 6.856 ( -1.754 0.000 6.151) 6.396 6.912 ( 1.056 0.000 2.279) 2.512 6.964 ( 0.094 0.000 0.913) 0.917 7.109 ( 2.056 0.000 3.091) 3.712 7.217 ( -1.628 0.000 -4.649) 4.925 7.294 ( 7.687 0.000 -2.534) 8.094 7.403 ( 5.607 0.000 -5.554) 7.892 7.502 ( 0.835 0.000 -4.720) 4.793 7.577 ( 4.174 0.000 -2.923) 5.096 7.694 ( 8.447 0.000 5.246) 9.943 7.755 ( 2.815 0.000 -3.181) 4.248 7.855 ( 2.760 0.000 4.642) 5.401 7.992 ( -7.191 0.000 7.812) 10.618 8.217 ( -1.438 0.000 2.080) 2.529 8.304 ( 4.688 0.000 -2.230) 5.191 8.344 ( -0.377 0.000 -1.039) 1.105 8.393 ( -2.246 0.000 -0.843) 2.398 8.436 ( 2.665 0.000 -1.193) 2.919 8.533 ( 3.879 0.000 1.008) 4.008 8.632 ( 5.747 0.000 -7.642) 9.562 8.726 ( 0.282 0.000 0.774) 0.824 8.754 ( 2.495 0.000 -1.946) 3.164 8.987 ( 1.285 0.000 -4.764) 4.934 9.018 ( 1.548 0.000 4.423) 4.686 9.072 ( -1.893 0.000 1.331) 2.314 9.099 ( -2.295 0.000 -1.565) 2.778 9.138 ( 0.324 0.000 5.813) 5.822 9.370 ( -1.638 0.000 0.313) 1.668 9.504 ( 1.080 0.000 0.304) 1.122 9.702 ( -4.086 0.000 5.860) 7.144 10.098 ( -0.366 0.000 0.345) 0.503 10.126 ( 0.826 0.000 0.577) 1.007 10.377 ( 3.968 0.000 -4.925) 6.325 10.444 ( 7.991 0.000 0.379) 8.000 10.694 ( 11.777 0.000 -0.262) 11.780 10.791 ( 18.440 0.000 -1.924) 18.540 11.236 ( -2.706 0.000 -16.283) 16.507 11.689 ( -6.296 0.000 13.983) 15.335 16.460 ( 5.303 0.000 -0.633) 5.341 16.497 ( 3.976 0.000 0.212) 3.982 16.782 ( -3.745 0.000 -0.132) 3.748 16.784 ( -4.336 0.000 0.804) 4.410 17.464 ( -1.573 0.000 -2.347) 2.825 17.545 ( -0.836 0.000 0.143) 0.849 17.631 ( -3.427 0.000 1.089) 3.596 17.649 ( 1.241 0.000 -0.458) 1.323 17.675 ( 2.767 0.000 0.850) 2.895 17.684 ( -1.713 0.000 0.043) 1.713 17.837 ( -3.264 0.000 2.308) 3.997 17.880 ( -4.663 0.000 -2.667) 5.372 18.379 ( 0.123 0.000 0.182) 0.219 18.381 ( 0.341 0.000 0.166) 0.380 19.304 ( -3.401 0.000 -0.554) 3.446 19.330 ( -3.893 0.000 0.594) 3.938 21.306 ( 0.411 0.000 -1.146) 1.217 21.352 ( 2.107 0.000 2.308) 3.125 21.419 ( -1.035 0.000 -0.607) 1.200 21.483 ( 1.775 0.000 -1.068) 2.072 21.944 ( 0.567 0.000 0.165) 0.590 21.962 ( 0.871 0.000 -0.261) 0.909 22.033 ( 0.555 0.000 0.681) 0.878 22.147 ( 0.554 0.000 1.401) 1.506 26.952 ( 0.029 0.000 -0.467) 0.468 26.972 ( 0.327 0.000 0.662) 0.738 27.132 ( -0.318 0.000 -0.370) 0.488 27.162 ( -0.078 0.000 0.073) 0.106 27.655 ( -0.285 0.000 0.313) 0.423 27.698 ( -0.670 0.000 -0.979) 1.186 27.720 ( -0.946 0.000 1.249) 1.567 27.792 ( -0.937 0.000 -0.719) 1.182 35.690 ( -1.558 0.000 4.541) 4.801 35.724 ( 0.467 0.000 -4.935) 4.957 35.848 ( -3.143 0.000 -7.296) 7.945 35.965 ( 1.611 0.000 1.501) 2.202 36.170 ( -9.376 0.000 -4.018) 10.201 36.215 ( -11.529 0.000 10.858) 15.838 36.615 ( -0.223 0.000 2.923) 2.931 36.661 ( -4.212 0.000 -8.727) 9.691 36.953 ( 2.917 0.000 5.282) 6.034 37.264 ( 5.306 0.000 -0.864) 5.376 38.602 ( 7.771 0.000 6.781) 10.314 39.046 ( 5.161 0.000 -9.127) 10.485 39.640 ( 4.532 0.000 -4.796) 6.599 39.872 ( 11.170 0.000 2.880) 11.535 40.331 ( -5.856 0.000 8.825) 10.592 40.484 ( -8.625 0.000 -8.970) 12.444 ======================= Grid point 67 (25/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( -9.272 0.000 11.249) 14.578 1.878 ( 2.836 0.000 -6.321) 6.928 1.923 ( -0.840 0.000 12.659) 12.687 1.930 ( 0.855 0.000 1.111) 1.401 2.088 ( 0.647 0.000 -5.592) 5.630 2.237 ( 0.788 0.000 5.908) 5.960 2.346 ( 10.226 0.000 -5.151) 11.450 2.545 ( -2.223 0.000 2.156) 3.096 2.929 ( 0.305 0.000 -1.666) 1.694 2.986 ( 0.326 0.000 -10.837) 10.842 3.115 ( 0.819 0.000 2.774) 2.893 3.167 ( 5.393 0.000 -8.663) 10.204 3.382 ( -2.634 0.000 -0.176) 2.640 3.466 ( 7.056 0.000 -2.732) 7.566 3.495 ( 0.637 0.000 -2.973) 3.041 3.665 ( -3.005 0.000 -6.648) 7.296 3.724 ( 0.596 0.000 6.685) 6.712 3.740 ( -5.099 0.000 3.017) 5.925 3.909 ( 0.607 0.000 -4.960) 4.997 3.945 ( -2.570 0.000 -3.155) 4.069 3.954 ( 5.463 0.000 -13.814) 14.855 3.987 ( 3.527 0.000 7.979) 8.724 4.134 ( 11.288 0.000 -15.263) 18.984 4.191 ( -2.833 0.000 -5.815) 6.468 4.214 ( 0.149 0.000 0.824) 0.837 4.449 ( -1.512 0.000 -5.520) 5.723 4.456 ( 2.953 0.000 2.711) 4.008 4.649 ( -1.857 0.000 2.025) 2.748 4.809 ( 6.603 0.000 -4.761) 8.141 4.881 ( -1.132 0.000 -12.013) 12.067 5.037 ( -2.242 0.000 3.989) 4.576 5.172 ( -7.126 0.000 3.771) 8.062 5.203 ( 2.335 0.000 4.213) 4.817 5.218 ( 1.102 0.000 -2.550) 2.778 5.291 ( 0.668 0.000 0.976) 1.183 5.330 ( -9.571 0.000 3.573) 10.216 5.445 ( 0.360 0.000 -0.760) 0.841 5.459 ( 0.432 0.000 4.119) 4.141 5.474 ( -0.348 0.000 2.888) 2.909 5.517 ( 1.529 0.000 8.343) 8.482 5.646 ( 2.492 0.000 4.170) 4.858 5.721 ( -3.343 0.000 4.093) 5.285 5.774 ( -1.514 0.000 -7.541) 7.691 5.929 ( 5.013 0.000 -0.164) 5.016 5.963 ( 5.494 0.000 -0.567) 5.523 5.985 ( 4.641 0.000 4.217) 6.271 5.999 ( -1.846 0.000 0.395) 1.888 6.060 ( -6.911 0.000 -0.079) 6.912 6.196 ( 1.582 0.000 9.111) 9.247 6.297 ( 7.206 0.000 -3.736) 8.116 6.388 ( 2.035 0.000 12.439) 12.604 6.391 ( -1.370 0.000 2.148) 2.547 6.440 ( 0.481 0.000 -4.578) 4.603 6.472 ( -2.015 0.000 4.114) 4.581 6.478 ( 0.472 0.000 1.397) 1.475 6.610 ( -3.751 0.000 6.045) 7.114 6.732 ( -3.523 0.000 0.419) 3.548 6.811 ( -1.224 0.000 0.703) 1.412 6.829 ( -5.148 0.000 1.713) 5.425 6.859 ( -4.010 0.000 -3.442) 5.285 7.013 ( 4.356 0.000 -0.403) 4.375 7.154 ( -0.413 0.000 2.902) 2.931 7.223 ( 0.442 0.000 6.808) 6.822 7.373 ( 4.916 0.000 -0.291) 4.925 7.467 ( 7.830 0.000 -9.088) 11.995 7.543 ( 7.247 0.000 3.215) 7.928 7.576 ( 0.008 0.000 -4.049) 4.049 7.769 ( -3.530 0.000 4.561) 5.768 7.864 ( 3.287 0.000 6.288) 7.095 7.923 ( 0.472 0.000 3.045) 3.081 7.970 ( -4.025 0.000 10.796) 11.522 8.195 ( -2.806 0.000 2.833) 3.987 8.315 ( -1.337 0.000 -6.116) 6.260 8.326 ( -0.961 0.000 -0.198) 0.981 8.356 ( 4.840 0.000 -3.548) 6.002 8.446 ( -1.201 0.000 -1.715) 2.094 8.588 ( 0.948 0.000 0.081) 0.951 8.615 ( -0.315 0.000 -8.467) 8.473 8.744 ( 3.638 0.000 -3.025) 4.732 8.790 ( 3.480 0.000 -5.301) 6.341 8.971 ( -3.022 0.000 -6.461) 7.132 8.984 ( 2.092 0.000 -2.267) 3.085 9.071 ( 0.302 0.000 3.519) 3.532 9.148 ( 0.774 0.000 9.757) 9.788 9.211 ( -0.130 0.000 8.215) 8.216 9.307 ( -3.120 0.000 -4.320) 5.329 9.522 ( 0.307 0.000 0.365) 0.477 9.680 ( -3.658 0.000 3.514) 5.072 10.095 ( -0.297 0.000 0.051) 0.301 10.139 ( 0.088 0.000 0.397) 0.407 10.409 ( 4.207 0.000 -3.651) 5.571 10.508 ( 2.595 0.000 -8.504) 8.891 10.917 ( 7.475 0.000 1.202) 7.571 11.040 ( 13.834 0.000 -7.240) 15.614 11.085 ( 3.093 0.000 -3.590) 4.739 11.552 ( -17.538 0.000 3.763) 17.937 16.552 ( 5.793 0.000 -0.998) 5.878 16.558 ( 2.671 0.000 -0.450) 2.709 16.699 ( -5.602 0.000 0.263) 5.608 16.715 ( -3.054 0.000 -0.529) 3.100 17.458 ( 1.606 0.000 0.225) 1.621 17.542 ( 0.047 0.000 0.774) 0.776 17.592 ( -2.269 0.000 2.777) 3.586 17.662 ( 1.555 0.000 -1.751) 2.342 17.666 ( -1.286 0.000 1.537) 2.004 17.746 ( 4.268 0.000 0.351) 4.282 17.778 ( -4.306 0.000 -2.522) 4.990 17.800 ( -2.576 0.000 0.631) 2.652 18.384 ( 0.037 0.000 0.543) 0.545 18.389 ( 0.179 0.000 0.541) 0.569 19.264 ( -0.933 0.000 0.135) 0.943 19.284 ( -1.703 0.000 0.139) 1.709 21.309 ( 0.685 0.000 -0.068) 0.688 21.385 ( -1.621 0.000 -0.952) 1.880 21.405 ( 1.113 0.000 2.041) 2.324 21.500 ( 1.183 0.000 -0.685) 1.367 21.952 ( 0.135 0.000 0.176) 0.221 21.971 ( 0.439 0.000 -0.325) 0.546 22.050 ( 0.276 0.000 1.381) 1.408 22.155 ( -0.596 0.000 0.422) 0.731 26.953 ( 0.291 0.000 0.035) 0.293 26.977 ( -0.214 0.000 0.116) 0.243 27.129 ( 0.147 0.000 0.035) 0.151 27.160 ( -0.117 0.000 -0.211) 0.241 27.655 ( -0.151 0.000 0.171) 0.228 27.684 ( 0.011 0.000 -0.791) 0.791 27.716 ( -0.705 0.000 0.982) 1.209 27.774 ( -0.133 0.000 -0.675) 0.688 35.667 ( -3.438 0.000 -3.116) 4.639 35.716 ( 2.808 0.000 -3.510) 4.495 35.751 ( -0.247 0.000 -5.960) 5.965 35.978 ( 2.616 0.000 2.492) 3.613 36.039 ( -4.284 0.000 -3.047) 5.257 36.137 ( -7.703 0.000 7.893) 11.029 36.601 ( 3.118 0.000 -1.628) 3.518 36.610 ( -2.814 0.000 1.934) 3.415 37.032 ( 0.448 0.000 4.631) 4.652 37.327 ( 2.406 0.000 -0.947) 2.586 38.725 ( -0.284 0.000 4.175) 4.185 39.067 ( 5.634 0.000 -6.533) 8.627 39.695 ( 5.302 0.000 -1.011) 5.398 40.060 ( 3.810 0.000 -0.409) 3.832 40.290 ( -7.036 0.000 5.451) 8.900 40.297 ( -0.600 0.000 -4.349) 4.390 ======================= Grid point 68 (26/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( -17.495 0.000 5.899) 18.462 1.685 ( -22.058 0.000 7.563) 23.318 1.929 ( -5.070 0.000 -0.318) 5.080 1.944 ( -0.546 0.000 -0.248) 0.599 2.142 ( 11.044 0.000 -7.154) 13.159 2.352 ( 2.862 0.000 7.954) 8.453 2.401 ( -0.066 0.000 -2.704) 2.704 2.466 ( -5.769 0.000 -0.473) 5.789 2.890 ( -0.468 0.000 -7.373) 7.388 2.921 ( -0.304 0.000 -2.508) 2.526 3.135 ( -0.019 0.000 -11.048) 11.048 3.150 ( 0.267 0.000 3.899) 3.908 3.401 ( 4.247 0.000 -0.698) 4.304 3.431 ( -7.288 0.000 -1.193) 7.385 3.494 ( 0.738 0.000 -1.868) 2.008 3.618 ( 5.281 0.000 -13.899) 14.868 3.714 ( -2.096 0.000 -0.891) 2.277 3.751 ( -3.850 0.000 6.979) 7.970 3.812 ( 1.020 0.000 -9.350) 9.406 3.872 ( 0.664 0.000 -1.465) 1.608 3.927 ( 1.250 0.000 -3.781) 3.982 4.043 ( -4.567 0.000 -6.474) 7.922 4.174 ( 2.256 0.000 -3.872) 4.481 4.185 ( 3.113 0.000 10.065) 10.536 4.248 ( 7.945 0.000 -9.132) 12.105 4.396 ( -7.679 0.000 -5.511) 9.451 4.484 ( 3.546 0.000 0.348) 3.563 4.584 ( -2.636 0.000 -4.374) 5.107 4.696 ( -2.396 0.000 -10.565) 10.833 4.872 ( -2.089 0.000 -0.527) 2.155 4.968 ( -0.486 0.000 2.307) 2.358 5.088 ( 3.756 0.000 -0.011) 3.756 5.155 ( -6.884 0.000 1.457) 7.036 5.284 ( 0.695 0.000 8.764) 8.791 5.302 ( -2.093 0.000 -0.960) 2.302 5.376 ( 1.900 0.000 1.633) 2.505 5.476 ( 6.287 0.000 0.267) 6.293 5.525 ( 3.465 0.000 2.638) 4.355 5.529 ( 2.515 0.000 4.179) 4.877 5.563 ( -2.867 0.000 5.635) 6.322 5.684 ( -1.152 0.000 1.779) 2.119 5.757 ( 0.982 0.000 7.488) 7.552 5.759 ( 4.172 0.000 -4.137) 5.875 5.915 ( -2.153 0.000 -2.888) 3.602 5.944 ( -4.641 0.000 1.180) 4.789 5.973 ( -0.681 0.000 -0.285) 0.738 6.033 ( 2.490 0.000 -0.175) 2.496 6.170 ( 4.038 0.000 3.991) 5.677 6.369 ( 0.900 0.000 0.487) 1.023 6.378 ( 4.072 0.000 1.603) 4.376 6.383 ( -0.428 0.000 11.985) 11.993 6.405 ( -0.669 0.000 -3.077) 3.149 6.456 ( -1.850 0.000 -1.346) 2.288 6.460 ( -0.275 0.000 2.247) 2.263 6.506 ( -0.804 0.000 4.684) 4.752 6.555 ( -7.788 0.000 -1.950) 8.028 6.716 ( -1.883 0.000 10.360) 10.529 6.755 ( -0.899 0.000 4.957) 5.038 6.797 ( -2.116 0.000 4.443) 4.921 6.821 ( 1.160 0.000 -0.972) 1.514 7.075 ( 2.590 0.000 -0.026) 2.590 7.120 ( -3.607 0.000 -1.314) 3.839 7.323 ( 2.970 0.000 7.538) 8.102 7.443 ( 2.215 0.000 -0.823) 2.363 7.516 ( -3.216 0.000 -1.313) 3.474 7.536 ( 7.268 0.000 -3.914) 8.255 7.712 ( -9.035 0.000 7.766) 11.914 7.743 ( 6.594 0.000 7.911) 10.299 7.831 ( -5.831 0.000 -5.385) 7.938 7.991 ( 1.038 0.000 5.633) 5.728 8.052 ( 0.052 0.000 11.773) 11.774 8.163 ( -5.257 0.000 4.550) 6.952 8.236 ( -0.326 0.000 -7.625) 7.632 8.318 ( -0.866 0.000 1.270) 1.537 8.371 ( -3.257 0.000 -3.469) 4.758 8.429 ( 6.350 0.000 -1.952) 6.644 8.498 ( -2.187 0.000 -9.411) 9.662 8.576 ( -0.902 0.000 -2.925) 3.061 8.730 ( -2.208 0.000 -5.607) 6.026 8.762 ( 1.633 0.000 -3.145) 3.544 8.911 ( 1.083 0.000 -4.472) 4.601 8.971 ( -0.674 0.000 -6.259) 6.296 9.101 ( -0.742 0.000 3.620) 3.696 9.198 ( -3.376 0.000 -0.911) 3.497 9.263 ( 0.300 0.000 11.910) 11.914 9.293 ( 0.005 0.000 5.755) 5.755 9.517 ( -0.880 0.000 -0.304) 0.931 9.641 ( -3.283 0.000 0.712) 3.359 10.088 ( -0.351 0.000 -0.324) 0.477 10.137 ( -0.517 0.000 0.229) 0.566 10.389 ( -4.344 0.000 -10.619) 11.473 10.438 ( 2.391 0.000 -3.343) 4.110 10.851 ( -7.002 0.000 -0.846) 7.053 11.046 ( -6.994 0.000 -8.530) 11.031 11.274 ( -9.610 0.000 -5.849) 11.250 11.374 ( 18.734 0.000 7.171) 20.060 16.545 ( -3.385 0.000 -0.955) 3.517 16.564 ( -4.487 0.000 -0.739) 4.548 16.679 ( 4.165 0.000 -0.042) 4.165 16.705 ( 2.602 0.000 -0.711) 2.697 17.496 ( 1.424 0.000 1.591) 2.135 17.558 ( 0.619 0.000 0.914) 1.104 17.622 ( 1.910 0.000 3.938) 4.377 17.659 ( -1.154 0.000 1.223) 1.682 17.681 ( 2.212 0.000 -0.761) 2.339 17.687 ( -3.393 0.000 -2.124) 4.003 17.763 ( -1.287 0.000 -1.134) 1.715 17.825 ( 4.891 0.000 -0.565) 4.924 18.390 ( -0.055 0.000 0.723) 0.725 18.396 ( -0.105 0.000 0.662) 0.671 19.275 ( 1.763 0.000 0.565) 1.852 19.276 ( 0.706 0.000 -0.237) 0.744 21.329 ( 1.162 0.000 0.858) 1.445 21.342 ( -2.017 0.000 -1.115) 2.305 21.434 ( 0.292 0.000 1.425) 1.455 21.510 ( 0.669 0.000 -0.494) 0.832 21.952 ( -0.362 0.000 0.152) 0.392 21.970 ( -0.123 0.000 -0.314) 0.338 22.069 ( -0.028 0.000 2.496) 2.496 22.138 ( -1.236 0.000 -0.573) 1.362 26.962 ( 0.519 0.000 0.454) 0.690 26.968 ( -0.634 0.000 -0.297) 0.700 27.137 ( 0.480 0.000 0.410) 0.631 27.154 ( -0.190 0.000 -0.518) 0.552 27.650 ( -0.420 0.000 -0.001) 0.420 27.682 ( 0.383 0.000 -0.710) 0.807 27.716 ( -0.138 0.000 0.842) 0.853 27.778 ( 1.114 0.000 -0.556) 1.245 35.577 ( -1.874 0.000 -2.959) 3.503 35.703 ( 3.588 0.000 -7.693) 8.488 35.782 ( 4.809 0.000 0.270) 4.817 35.900 ( -4.607 0.000 -7.818) 9.075 36.101 ( -3.548 0.000 5.148) 6.252 36.147 ( 9.382 0.000 6.619) 11.482 36.562 ( -3.492 0.000 -0.209) 3.498 36.697 ( 6.681 0.000 0.916) 6.743 37.047 ( -4.101 0.000 5.257) 6.668 37.328 ( -0.563 0.000 -1.178) 1.306 38.664 ( -9.521 0.000 1.764) 9.683 39.108 ( 4.805 0.000 -4.383) 6.504 39.805 ( 5.534 0.000 4.235) 6.969 39.917 ( -9.585 0.000 -6.764) 11.731 40.188 ( -7.881 0.000 0.478) 7.896 40.454 ( 12.923 0.000 2.065) 13.087 ======================= Grid point 69 (27/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( -21.815 0.000 6.947) 22.895 1.337 ( -29.890 0.000 15.298) 33.578 1.822 ( -6.285 0.000 -0.618) 6.315 1.900 ( -2.192 0.000 -2.961) 3.684 2.242 ( 6.462 0.000 -5.208) 8.300 2.282 ( -9.357 0.000 -0.949) 9.405 2.408 ( -3.954 0.000 3.158) 5.061 2.434 ( -3.295 0.000 5.018) 6.003 2.821 ( -3.857 0.000 -6.891) 7.896 2.823 ( -5.407 0.000 -7.514) 9.257 2.903 ( -11.842 0.000 -8.581) 14.624 3.175 ( -2.828 0.000 3.646) 4.615 3.301 ( -6.146 0.000 -0.403) 6.159 3.355 ( -7.962 0.000 -3.650) 8.759 3.484 ( -2.947 0.000 -3.090) 4.270 3.563 ( 2.251 0.000 -9.881) 10.134 3.671 ( 6.649 0.000 -5.116) 8.390 3.777 ( -3.864 0.000 3.971) 5.541 3.796 ( 2.245 0.000 -0.980) 2.450 3.920 ( -0.761 0.000 -6.010) 6.058 3.940 ( 3.452 0.000 -3.364) 4.820 3.973 ( 5.302 0.000 6.022) 8.023 4.095 ( -4.798 0.000 1.214) 4.949 4.148 ( -0.783 0.000 -2.710) 2.821 4.254 ( 2.882 0.000 -13.418) 13.724 4.423 ( -3.120 0.000 0.934) 3.257 4.447 ( 5.346 0.000 8.215) 9.801 4.539 ( 2.423 0.000 -8.536) 8.873 4.734 ( 9.463 0.000 -3.741) 10.175 4.812 ( -4.538 0.000 5.325) 6.996 5.067 ( 4.627 0.000 -4.030) 6.136 5.079 ( -4.029 0.000 6.287) 7.467 5.167 ( 4.226 0.000 0.481) 4.253 5.262 ( -0.032 0.000 -0.382) 0.383 5.291 ( -1.828 0.000 1.194) 2.184 5.419 ( -0.832 0.000 3.524) 3.621 5.519 ( -3.909 0.000 -0.762) 3.983 5.568 ( 1.609 0.000 2.019) 2.582 5.634 ( 4.805 0.000 1.123) 4.934 5.667 ( 7.485 0.000 1.563) 7.646 5.714 ( 1.496 0.000 5.250) 5.459 5.781 ( -0.504 0.000 -0.177) 0.534 5.827 ( -0.483 0.000 5.022) 5.045 5.862 ( -0.868 0.000 -1.182) 1.466 5.950 ( 0.933 0.000 5.841) 5.915 5.954 ( -1.228 0.000 -0.225) 1.248 6.037 ( -2.718 0.000 1.574) 3.141 6.152 ( 0.526 0.000 -9.384) 9.399 6.274 ( -9.205 0.000 -2.774) 9.614 6.315 ( -4.098 0.000 -2.003) 4.561 6.380 ( -1.463 0.000 -2.412) 2.821 6.385 ( -1.190 0.000 4.189) 4.355 6.425 ( -5.242 0.000 -1.309) 5.403 6.467 ( 2.158 0.000 1.922) 2.890 6.502 ( 1.736 0.000 -6.645) 6.868 6.662 ( 5.604 0.000 12.599) 13.789 6.752 ( 3.631 0.000 2.962) 4.686 6.816 ( -3.097 0.000 8.380) 8.934 6.853 ( 2.819 0.000 0.785) 2.926 6.888 ( -1.969 0.000 9.225) 9.432 7.076 ( -2.413 0.000 9.588) 9.887 7.089 ( -0.029 0.000 -0.928) 0.928 7.415 ( -2.488 0.000 -5.281) 5.838 7.435 ( 5.811 0.000 -4.893) 7.597 7.471 ( -7.770 0.000 14.288) 16.265 7.600 ( -2.465 0.000 -0.690) 2.560 7.619 ( -8.260 0.000 -11.714) 14.333 7.623 ( -4.549 0.000 4.287) 6.251 7.802 ( -2.444 0.000 -0.629) 2.523 7.983 ( -3.319 0.000 -5.958) 6.820 8.115 ( -4.868 0.000 8.137) 9.482 8.142 ( -6.656 0.000 13.918) 15.427 8.251 ( 3.499 0.000 5.613) 6.615 8.275 ( -2.212 0.000 -6.607) 6.967 8.301 ( -1.969 0.000 -4.315) 4.743 8.377 ( -1.146 0.000 -4.794) 4.929 8.517 ( 0.971 0.000 -5.228) 5.317 8.551 ( 5.821 0.000 2.684) 6.410 8.683 ( 0.980 0.000 -2.982) 3.139 8.761 ( 1.296 0.000 -2.610) 2.914 8.851 ( -2.603 0.000 -9.098) 9.463 8.885 ( 0.002 0.000 -3.172) 3.172 9.115 ( -1.052 0.000 3.337) 3.499 9.168 ( -0.212 0.000 -1.110) 1.130 9.325 ( -3.210 0.000 6.814) 7.533 9.371 ( -2.037 0.000 12.699) 12.862 9.498 ( -0.203 0.000 0.846) 0.870 9.577 ( -3.082 0.000 -3.142) 4.401 10.075 ( -0.565 0.000 -1.007) 1.154 10.132 ( -0.365 0.000 0.627) 0.726 10.229 ( -3.601 0.000 -6.155) 7.131 10.412 ( -0.192 0.000 -6.856) 6.858 10.704 ( -9.809 0.000 -0.058) 9.810 10.773 ( -15.517 0.000 0.605) 15.528 11.062 ( -7.048 0.000 -14.252) 15.900 11.766 ( 17.328 0.000 9.698) 19.857 16.464 ( -4.241 0.000 -1.092) 4.379 16.476 ( -4.729 0.000 0.214) 4.734 16.754 ( 4.172 0.000 -0.214) 4.177 16.757 ( 3.550 0.000 -0.362) 3.569 17.538 ( 1.782 0.000 1.611) 2.402 17.567 ( 0.185 0.000 -0.969) 0.987 17.617 ( -2.246 0.000 -1.411) 2.653 17.645 ( -1.646 0.000 0.880) 1.866 17.712 ( 3.350 0.000 3.105) 4.568 17.724 ( 2.301 0.000 1.131) 2.564 17.746 ( 1.426 0.000 -2.048) 2.496 17.903 ( 5.363 0.000 -1.294) 5.517 18.395 ( -0.152 0.000 0.567) 0.587 18.397 ( -0.410 0.000 0.458) 0.614 19.298 ( 2.226 0.000 -0.684) 2.329 19.332 ( 4.135 0.000 0.663) 4.188 21.300 ( -1.754 0.000 -0.694) 1.886 21.363 ( 1.551 0.000 1.473) 2.139 21.442 ( -0.429 0.000 0.637) 0.768 21.512 ( 0.257 0.000 -0.807) 0.847 21.944 ( -0.676 0.000 0.149) 0.693 21.961 ( -0.658 0.000 -0.273) 0.713 22.098 ( -0.174 0.000 4.191) 4.195 22.106 ( -1.442 0.000 -1.022) 1.768 26.953 ( -0.720 0.000 -0.328) 0.791 26.979 ( 0.722 0.000 0.676) 0.989 27.144 ( -0.255 0.000 -0.744) 0.786 27.150 ( 0.558 0.000 0.526) 0.766 27.646 ( -0.013 0.000 0.088) 0.088 27.681 ( 0.398 0.000 -0.773) 0.870 27.732 ( 0.946 0.000 0.953) 1.342 27.794 ( 1.330 0.000 -0.774) 1.539 35.563 ( 1.342 0.000 0.069) 1.344 35.716 ( 6.509 0.000 -8.432) 10.652 35.757 ( -3.419 0.000 -6.685) 7.509 35.885 ( 5.259 0.000 2.483) 5.816 36.113 ( 0.691 0.000 2.560) 2.651 36.369 ( 8.774 0.000 4.632) 9.922 36.490 ( -3.555 0.000 -2.245) 4.205 36.792 ( 3.930 0.000 -2.025) 4.421 36.992 ( -8.477 0.000 6.615) 10.752 37.323 ( 2.280 0.000 -0.847) 2.433 38.471 ( -14.002 0.000 2.693) 14.259 39.136 ( 3.183 0.000 -5.267) 6.155 39.691 ( -8.947 0.000 -6.688) 11.171 39.911 ( -4.494 0.000 8.438) 9.560 40.079 ( 1.460 0.000 -3.977) 4.236 40.684 ( 12.008 0.000 0.220) 12.010 ======================= Grid point 70 (28/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( -20.424 0.000 14.992) 25.336 1.002 ( -31.963 0.000 30.432) 44.133 1.608 ( -24.835 0.000 -3.193) 25.039 1.843 ( -0.608 0.000 -3.156) 3.214 2.114 ( -8.286 0.000 -0.765) 8.321 2.154 ( -16.305 0.000 -3.641) 16.707 2.279 ( 1.679 0.000 -7.457) 7.643 2.381 ( -5.873 0.000 10.128) 11.708 2.652 ( -7.164 0.000 -4.807) 8.627 2.674 ( -2.002 0.000 0.976) 2.228 2.798 ( -4.124 0.000 -2.437) 4.790 3.080 ( -8.702 0.000 -0.354) 8.709 3.127 ( -11.915 0.000 -6.115) 13.393 3.218 ( -4.773 0.000 1.204) 4.923 3.351 ( -11.397 0.000 2.311) 11.629 3.502 ( -2.959 0.000 -2.677) 3.990 3.677 ( -0.532 0.000 -4.202) 4.236 3.698 ( -1.136 0.000 -0.708) 1.338 3.830 ( -1.200 0.000 -2.486) 2.761 3.937 ( 2.814 0.000 -5.316) 6.014 3.999 ( 6.848 0.000 3.287) 7.596 4.063 ( 4.422 0.000 1.448) 4.653 4.151 ( 1.943 0.000 -5.190) 5.541 4.184 ( 6.134 0.000 -2.703) 6.703 4.277 ( 12.771 0.000 8.615) 15.405 4.447 ( 4.716 0.000 -4.319) 6.394 4.543 ( 6.248 0.000 -3.598) 7.210 4.608 ( 6.147 0.000 7.192) 9.461 4.808 ( 3.311 0.000 -4.133) 5.296 4.826 ( -0.024 0.000 5.323) 5.323 5.044 ( -4.674 0.000 0.493) 4.699 5.085 ( 3.134 0.000 -2.516) 4.019 5.149 ( -5.572 0.000 1.384) 5.741 5.311 ( 2.560 0.000 2.494) 3.574 5.314 ( -0.273 0.000 -7.223) 7.228 5.393 ( -7.163 0.000 -5.489) 9.024 5.449 ( 2.999 0.000 4.321) 5.260 5.546 ( -6.830 0.000 4.073) 7.953 5.658 ( -4.491 0.000 1.086) 4.621 5.707 ( -2.364 0.000 5.549) 6.031 5.747 ( 0.158 0.000 -3.628) 3.632 5.755 ( -6.461 0.000 -8.660) 10.804 5.833 ( 4.684 0.000 1.471) 4.909 5.853 ( -0.718 0.000 -1.995) 2.121 5.939 ( 0.670 0.000 -0.917) 1.136 5.987 ( 1.194 0.000 -4.217) 4.383 6.069 ( -0.125 0.000 12.821) 12.822 6.089 ( 1.280 0.000 -6.046) 6.181 6.195 ( 4.002 0.000 -1.630) 4.321 6.253 ( -4.475 0.000 4.996) 6.707 6.326 ( -1.711 0.000 -3.526) 3.919 6.360 ( -0.733 0.000 1.413) 1.592 6.400 ( 0.343 0.000 0.458) 0.572 6.525 ( 5.787 0.000 -1.920) 6.097 6.543 ( 4.961 0.000 0.902) 5.043 6.768 ( -0.929 0.000 1.807) 2.032 6.789 ( -4.597 0.000 -0.663) 4.645 6.860 ( -0.403 0.000 7.616) 7.626 6.911 ( 4.666 0.000 3.164) 5.638 6.937 ( 3.254 0.000 4.866) 5.853 7.072 ( -1.123 0.000 -3.799) 3.961 7.195 ( 0.162 0.000 13.326) 13.327 7.267 ( -7.125 0.000 -6.941) 9.947 7.308 ( -8.096 0.000 -5.507) 9.791 7.408 ( -11.949 0.000 -4.230) 12.676 7.453 ( -7.119 0.000 4.511) 8.428 7.519 ( 1.925 0.000 -2.587) 3.225 7.636 ( -2.138 0.000 3.722) 4.292 7.766 ( -3.495 0.000 2.612) 4.363 7.795 ( -6.502 0.000 -13.439) 14.929 8.053 ( -9.020 0.000 3.937) 9.842 8.091 ( -3.928 0.000 -1.121) 4.085 8.192 ( -2.283 0.000 -5.826) 6.257 8.246 ( -1.015 0.000 7.044) 7.117 8.358 ( -2.108 0.000 4.514) 4.982 8.361 ( 1.853 0.000 5.469) 5.774 8.548 ( 4.552 0.000 -2.198) 5.055 8.665 ( 1.153 0.000 -1.545) 1.928 8.679 ( 3.302 0.000 -4.994) 5.987 8.685 ( 1.634 0.000 -6.084) 6.300 8.827 ( 1.901 0.000 1.957) 2.728 8.853 ( -1.402 0.000 -1.985) 2.430 9.138 ( -1.556 0.000 -2.812) 3.214 9.147 ( -0.199 0.000 5.789) 5.792 9.315 ( -4.241 0.000 5.404) 6.870 9.373 ( -2.829 0.000 -0.141) 2.832 9.474 ( -3.034 0.000 -7.690) 8.267 9.600 ( 1.673 0.000 15.603) 15.692 10.062 ( 0.478 0.000 -0.279) 0.554 10.143 ( 0.454 0.000 1.887) 1.940 10.168 ( -0.076 0.000 -1.711) 1.712 10.313 ( -1.730 0.000 -9.120) 9.282 10.519 ( -10.781 0.000 -1.347) 10.865 10.562 ( -12.386 0.000 1.946) 12.538 10.790 ( -8.705 0.000 -10.345) 13.520 12.132 ( 13.938 0.000 10.234) 17.292 16.393 ( -2.798 0.000 -0.832) 2.919 16.412 ( -3.310 0.000 0.662) 3.376 16.812 ( 2.639 0.000 0.745) 2.742 16.813 ( 2.863 0.000 0.012) 2.863 17.544 ( -0.029 0.000 -3.795) 3.795 17.565 ( -0.956 0.000 0.273) 0.995 17.597 ( 1.695 0.000 0.067) 1.696 17.623 ( -1.706 0.000 0.835) 1.899 17.754 ( 1.847 0.000 -1.085) 2.142 17.780 ( 2.267 0.000 0.883) 2.433 17.788 ( 2.401 0.000 1.725) 2.957 17.984 ( 5.154 0.000 -1.152) 5.281 18.391 ( -0.546 0.000 0.098) 0.555 18.395 ( -0.195 0.000 0.105) 0.222 19.333 ( 2.364 0.000 -0.616) 2.443 19.420 ( 5.142 0.000 0.469) 5.164 21.271 ( -1.183 0.000 -0.209) 1.202 21.405 ( 1.551 0.000 1.366) 2.067 21.434 ( -0.716 0.000 0.111) 0.725 21.501 ( -0.067 0.000 -2.558) 2.559 21.933 ( -0.708 0.000 0.154) 0.725 21.944 ( -0.949 0.000 -0.231) 0.976 22.074 ( -1.185 0.000 -0.916) 1.497 22.148 ( 0.592 0.000 6.158) 6.186 26.940 ( -0.539 0.000 -0.112) 0.551 26.997 ( 0.759 0.000 0.439) 0.877 27.132 ( -0.338 0.000 -0.633) 0.717 27.163 ( 0.362 0.000 0.285) 0.461 27.654 ( 0.630 0.000 0.523) 0.819 27.684 ( 0.804 0.000 -0.679) 1.052 27.762 ( 1.346 0.000 0.979) 1.664 27.805 ( 0.899 0.000 -1.091) 1.414 35.581 ( -0.539 0.000 -0.479) 0.721 35.700 ( 2.260 0.000 -1.136) 2.530 35.766 ( 7.229 0.000 -5.263) 8.942 35.994 ( 3.779 0.000 3.939) 5.458 36.162 ( 3.461 0.000 -0.440) 3.489 36.406 ( -3.237 0.000 -2.833) 4.302 36.476 ( -1.336 0.000 2.708) 3.019 36.807 ( 2.744 0.000 -3.990) 4.843 36.897 ( -10.408 0.000 9.037) 13.784 37.392 ( 7.167 0.000 -3.939) 8.178 38.286 ( -11.771 0.000 7.206) 13.801 39.081 ( -0.560 0.000 -15.286) 15.296 39.503 ( -6.525 0.000 -4.123) 7.719 39.794 ( -9.515 0.000 0.812) 9.550 40.183 ( 6.483 0.000 3.265) 7.259 40.849 ( 8.846 0.000 -4.013) 9.714 ======================= Grid point 71 (29/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.475 ( -14.050 0.000 26.032) 29.582 0.799 ( -39.400 0.000 9.250) 40.471 0.971 ( -32.963 0.000 39.614) 51.535 1.814 ( 0.597 0.000 -5.426) 5.458 2.009 ( -3.625 0.000 0.321) 3.639 2.027 ( -1.760 0.000 1.208) 2.135 2.202 ( -1.564 0.000 -11.479) 11.585 2.415 ( -3.380 0.000 13.117) 13.546 2.453 ( -11.786 0.000 -3.413) 12.270 2.584 ( -11.891 0.000 -16.777) 20.563 2.638 ( -8.410 0.000 -1.773) 8.595 2.914 ( -5.637 0.000 -2.888) 6.333 2.953 ( -4.220 0.000 -0.853) 4.305 3.166 ( -4.397 0.000 7.495) 8.689 3.216 ( -7.535 0.000 4.938) 9.009 3.401 ( -5.652 0.000 -2.277) 6.094 3.628 ( -3.285 0.000 1.309) 3.537 3.724 ( 0.296 0.000 -11.005) 11.009 3.736 ( 3.403 0.000 2.729) 4.362 3.960 ( 1.375 0.000 1.158) 1.798 4.117 ( 3.806 0.000 6.756) 7.754 4.159 ( 1.957 0.000 0.936) 2.169 4.162 ( 4.738 0.000 1.747) 5.050 4.333 ( 10.724 0.000 -4.851) 11.770 4.514 ( 7.340 0.000 -1.338) 7.461 4.585 ( 14.338 0.000 3.849) 14.846 4.656 ( 6.067 0.000 0.291) 6.074 4.782 ( 0.673 0.000 1.774) 1.897 4.809 ( 2.080 0.000 -3.236) 3.847 4.861 ( 5.222 0.000 2.180) 5.658 4.982 ( -5.547 0.000 4.097) 6.896 5.040 ( -8.753 0.000 -0.211) 8.755 5.126 ( 2.351 0.000 0.412) 2.387 5.136 ( -4.714 0.000 -11.160) 12.114 5.191 ( -8.099 0.000 -5.094) 9.568 5.360 ( 1.181 0.000 0.745) 1.396 5.399 ( -3.999 0.000 -4.276) 5.855 5.522 ( -8.516 0.000 -3.922) 9.376 5.544 ( -7.666 0.000 -1.033) 7.735 5.620 ( 6.333 0.000 -0.180) 6.336 5.700 ( -1.143 0.000 -7.523) 7.609 5.724 ( -2.497 0.000 4.801) 5.412 5.790 ( -2.085 0.000 1.415) 2.520 5.904 ( 1.871 0.000 2.556) 3.168 5.956 ( 2.666 0.000 -2.630) 3.745 5.989 ( 2.771 0.000 -4.471) 5.260 6.101 ( 2.561 0.000 -0.234) 2.572 6.144 ( -1.483 0.000 2.789) 3.159 6.222 ( -7.100 0.000 8.566) 11.126 6.262 ( 4.185 0.000 -0.285) 4.195 6.350 ( 3.023 0.000 2.983) 4.247 6.391 ( 0.372 0.000 -5.392) 5.404 6.394 ( 1.897 0.000 3.758) 4.209 6.612 ( 3.323 0.000 -2.396) 4.097 6.630 ( 4.368 0.000 -0.806) 4.442 6.682 ( -3.353 0.000 -0.753) 3.436 6.734 ( -1.777 0.000 -2.035) 2.702 6.857 ( -3.852 0.000 -16.202) 16.653 6.922 ( 1.575 0.000 3.391) 3.739 7.047 ( 3.630 0.000 -4.369) 5.680 7.075 ( -2.002 0.000 -3.040) 3.640 7.075 ( -1.484 0.000 5.252) 5.458 7.125 ( -9.814 0.000 -15.346) 18.216 7.172 ( -9.595 0.000 -2.851) 10.010 7.306 ( -0.541 0.000 8.850) 8.867 7.395 ( -4.761 0.000 8.387) 9.644 7.465 ( 0.027 0.000 -2.148) 2.148 7.563 ( -12.632 0.000 4.306) 13.346 7.655 ( 2.387 0.000 -7.693) 8.055 7.692 ( -3.365 0.000 -2.886) 4.433 7.967 ( -3.569 0.000 4.999) 6.142 8.072 ( 0.804 0.000 -1.054) 1.325 8.144 ( 0.669 0.000 -1.514) 1.655 8.323 ( -1.753 0.000 13.748) 13.860 8.364 ( -1.270 0.000 0.507) 1.367 8.425 ( 2.052 0.000 0.487) 2.109 8.566 ( 0.456 0.000 -5.941) 5.958 8.586 ( 2.911 0.000 -1.437) 3.247 8.713 ( 2.217 0.000 -1.386) 2.615 8.751 ( 2.576 0.000 -1.864) 3.180 8.809 ( 0.574 0.000 -2.817) 2.875 8.948 ( 9.155 0.000 13.802) 16.563 9.068 ( -2.049 0.000 -1.776) 2.712 9.182 ( -3.200 0.000 6.519) 7.262 9.304 ( -1.992 0.000 6.071) 6.390 9.315 ( -0.633 0.000 -6.414) 6.445 9.334 ( -4.958 0.000 -6.331) 8.041 9.762 ( -3.527 0.000 17.632) 17.982 10.091 ( 1.267 0.000 2.191) 2.531 10.166 ( 0.826 0.000 -1.573) 1.777 10.174 ( -1.237 0.000 2.179) 2.506 10.219 ( -1.048 0.000 -4.786) 4.900 10.319 ( -9.563 0.000 -3.793) 10.288 10.362 ( -4.350 0.000 -4.948) 6.588 10.650 ( -2.977 0.000 1.156) 3.193 12.302 ( -3.091 0.000 -16.956) 17.236 16.355 ( -0.984 0.000 -0.302) 1.029 16.373 ( -1.931 0.000 0.570) 2.014 16.851 ( 1.455 0.000 -0.013) 1.455 16.855 ( 0.859 0.000 0.934) 1.268 17.531 ( 3.165 0.000 0.081) 3.166 17.549 ( -0.773 0.000 0.357) 0.851 17.609 ( -0.689 0.000 1.110) 1.306 17.630 ( 1.393 0.000 0.124) 1.399 17.774 ( 1.434 0.000 -0.775) 1.630 17.808 ( 1.110 0.000 -0.834) 1.388 17.839 ( 1.090 0.000 3.284) 3.460 18.050 ( 3.433 0.000 -0.768) 3.518 18.382 ( -0.393 0.000 -0.168) 0.427 18.391 ( -0.094 0.000 -0.364) 0.376 19.380 ( 3.408 0.000 3.188) 4.667 19.501 ( 3.515 0.000 0.013) 3.515 21.255 ( -0.622 0.000 -0.032) 0.623 21.424 ( -0.430 0.000 -0.054) 0.434 21.426 ( -4.329 0.000 -8.618) 9.645 21.434 ( 0.115 0.000 -0.419) 0.434 21.924 ( -0.481 0.000 0.125) 0.497 21.928 ( -0.684 0.000 -0.143) 0.699 22.052 ( -0.451 0.000 -0.539) 0.703 22.205 ( -0.428 0.000 -1.798) 1.848 26.935 ( -0.001 0.000 0.420) 0.420 27.007 ( 0.283 0.000 -0.622) 0.684 27.126 ( 0.003 0.000 0.322) 0.322 27.167 ( 0.111 0.000 -0.029) 0.115 27.676 ( 0.939 0.000 1.328) 1.627 27.695 ( 0.979 0.000 -0.346) 1.039 27.788 ( 0.679 0.000 0.656) 0.944 27.808 ( 0.718 0.000 -0.825) 1.094 35.566 ( -0.302 0.000 1.167) 1.206 35.771 ( 3.586 0.000 2.244) 4.230 35.938 ( 11.165 0.000 6.427) 12.883 36.128 ( 10.175 0.000 12.640) 16.226 36.217 ( 4.456 0.000 5.566) 7.130 36.341 ( -1.763 0.000 -1.224) 2.147 36.405 ( -6.688 0.000 0.979) 6.759 36.829 ( 2.902 0.000 -2.523) 3.845 36.857 ( -3.736 0.000 14.527) 15.000 37.454 ( 6.382 0.000 -8.914) 10.963 38.217 ( -7.112 0.000 11.706) 13.698 38.736 ( -16.164 0.000 -26.973) 31.445 39.411 ( -2.487 0.000 0.385) 2.517 39.663 ( -5.145 0.000 -1.136) 5.269 40.303 ( 2.554 0.000 5.094) 5.699 40.892 ( 2.645 0.000 -7.997) 8.423 ======================= Grid point 72 (30/92) ======================= q-point: ( 0.00 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.587 ( 12.631 14.351 16.294) 25.119 1.162 ( -8.595 19.980 37.691) 43.516 1.510 ( -1.722 34.530 10.034) 36.000 1.758 ( -3.438 11.832 -5.768) 13.604 1.984 ( 0.623 -0.640 -0.229) 0.922 2.020 ( -2.417 -0.747 -1.428) 2.905 2.063 ( 1.231 1.198 -0.290) 1.742 2.161 ( -0.325 4.943 5.446) 7.362 2.369 ( -3.700 8.753 -0.993) 9.555 2.529 ( 3.836 3.966 -7.622) 9.409 2.606 ( 0.199 2.284 8.921) 9.211 2.862 ( -0.622 -1.747 2.781) 3.343 2.870 ( 1.711 -2.948 1.706) 3.812 3.174 ( -0.877 -6.598 10.727) 12.624 3.194 ( 2.993 1.292 3.503) 4.785 3.289 ( -0.833 -3.136 -0.829) 3.349 3.586 ( 2.724 -1.891 3.513) 4.831 3.729 ( 1.423 1.473 -6.170) 6.501 3.866 ( 0.967 2.905 5.581) 6.366 4.049 ( 1.646 2.212 -1.924) 3.362 4.128 ( -1.016 -3.192 1.641) 3.730 4.173 ( 0.805 -2.557 0.555) 2.738 4.292 ( 1.554 4.024 3.135) 5.333 4.426 ( 4.260 -1.154 -4.827) 6.541 4.520 ( -5.412 -2.232 -2.604) 6.407 4.615 ( 0.271 -3.139 -2.292) 3.896 4.628 ( -1.421 -4.179 -0.201) 4.418 4.695 ( -0.724 -4.212 -0.512) 4.304 4.820 ( -7.654 2.618 -6.977) 10.683 4.862 ( 6.339 -3.307 1.839) 7.383 4.970 ( 1.393 6.005 -4.343) 7.540 5.053 ( -2.208 5.990 3.627) 7.342 5.113 ( 2.616 6.315 -2.792) 7.383 5.155 ( 5.508 -0.410 2.187) 5.940 5.251 ( 1.210 6.228 0.425) 6.359 5.351 ( 0.035 1.273 -2.848) 3.120 5.415 ( -3.458 2.491 -1.796) 4.625 5.455 ( -1.594 2.218 -0.679) 2.815 5.526 ( 2.414 3.646 -0.680) 4.425 5.618 ( 2.311 -1.450 0.101) 2.730 5.665 ( 1.606 -1.282 -5.617) 5.981 5.709 ( -3.551 -0.741 4.502) 5.782 5.801 ( -0.338 -0.889 0.901) 1.310 5.908 ( -1.324 -2.685 1.166) 3.213 6.004 ( 0.990 -0.788 -2.450) 2.757 6.042 ( 4.032 1.308 -2.738) 5.046 6.109 ( -1.081 1.313 -2.653) 3.151 6.137 ( 2.616 -2.714 2.268) 4.399 6.209 ( -3.077 0.332 5.760) 6.539 6.295 ( -1.976 -0.222 1.610) 2.559 6.364 ( -3.126 -1.395 0.764) 3.507 6.402 ( 4.281 0.985 -1.007) 4.507 6.443 ( 0.840 -0.327 3.149) 3.276 6.518 ( 0.514 -6.746 2.136) 7.095 6.581 ( -3.924 -4.376 -11.004) 12.475 6.632 ( 4.629 -0.678 -4.053) 6.189 6.706 ( -1.355 0.426 -1.523) 2.083 6.770 ( 1.821 2.032 -0.066) 2.729 6.841 ( 4.235 1.585 -7.253) 8.547 6.918 ( -4.739 -3.693 0.006) 6.008 6.954 ( -5.729 -0.823 4.525) 7.346 6.968 ( -4.461 -0.464 -4.511) 6.361 7.041 ( 1.357 2.233 -4.253) 4.992 7.221 ( -1.009 0.221 1.288) 1.651 7.255 ( -6.122 -0.504 -6.212) 8.737 7.411 ( 4.376 -0.335 1.564) 4.659 7.431 ( 0.205 -3.286 -1.326) 3.550 7.537 ( -1.027 -3.310 0.252) 3.475 7.671 ( -3.051 0.584 4.467) 5.441 7.692 ( 8.570 0.035 -8.064) 11.768 7.865 ( -0.560 -3.605 -1.445) 3.924 8.039 ( -1.669 0.279 4.194) 4.522 8.215 ( 1.460 1.763 4.484) 5.035 8.310 ( -0.876 -6.974 -4.187) 8.182 8.360 ( -5.455 7.660 4.222) 10.308 8.441 ( 3.995 3.160 2.401) 5.631 8.575 ( 1.317 0.914 -2.641) 3.089 8.649 ( -3.167 -0.151 6.144) 6.914 8.703 ( 5.036 0.889 -1.507) 5.331 8.767 ( 3.404 0.483 -1.305) 3.677 8.911 ( -2.537 3.159 -2.861) 4.960 8.961 ( -1.857 -2.588 -1.991) 3.756 9.040 ( 0.662 -6.153 3.556) 7.137 9.143 ( -2.898 -0.820 1.453) 3.344 9.243 ( -2.350 0.763 -1.430) 2.855 9.340 ( -0.801 2.094 0.956) 2.438 9.680 ( 2.512 -6.288 5.774) 8.899 9.717 ( 6.044 -4.869 4.539) 8.991 9.934 ( -3.984 -0.615 2.170) 4.579 10.075 ( 0.072 -2.888 0.861) 3.015 10.163 ( -0.593 -0.051 1.382) 1.505 10.271 ( 1.758 1.527 0.317) 2.350 10.301 ( 2.488 2.098 1.159) 3.455 10.490 ( 4.899 8.343 -2.640) 10.029 10.686 ( 4.155 0.002 7.260) 8.365 11.732 ( -12.286 0.938 -22.854) 25.964 16.351 ( 0.433 -0.074 0.258) 0.509 16.355 ( -0.473 -0.075 0.117) 0.493 16.849 ( -0.315 -0.701 -0.149) 0.783 16.854 ( -0.005 -0.797 -0.213) 0.825 17.505 ( -0.129 -2.224 -0.228) 2.240 17.557 ( -0.310 -3.851 -0.070) 3.864 17.617 ( 0.522 1.411 0.535) 1.597 17.660 ( 0.573 0.222 0.576) 0.841 17.782 ( 0.435 -0.217 -1.269) 1.359 17.804 ( 0.181 -0.567 -1.352) 1.477 17.839 ( -1.153 -2.277 2.983) 3.925 17.972 ( 0.351 -6.871 -0.719) 6.917 18.597 ( 0.086 16.022 -0.624) 16.034 18.666 ( 0.180 16.735 -7.249) 18.239 19.410 ( 1.070 -6.778 3.126) 7.541 19.495 ( -0.451 -3.253 -0.885) 3.401 21.237 ( -0.269 0.304 0.200) 0.452 21.255 ( -0.075 0.292 -0.474) 0.562 21.421 ( 0.184 -0.048 0.055) 0.198 21.432 ( -0.128 -0.234 -0.206) 0.336 21.926 ( -0.062 0.653 0.095) 0.663 21.959 ( 1.207 1.685 -1.812) 2.753 22.048 ( -3.416 0.135 -0.429) 3.446 22.052 ( -0.904 0.090 -0.175) 0.925 26.947 ( 0.048 0.834 0.484) 0.966 27.011 ( -0.280 1.306 -1.639) 2.114 27.123 ( 0.461 -1.344 1.249) 1.892 27.164 ( -0.239 -0.554 -0.126) 0.616 27.690 ( -0.588 0.161 0.847) 1.044 27.709 ( 0.328 0.001 0.101) 0.343 27.801 ( -0.834 0.697 0.206) 1.106 27.820 ( 0.333 0.458 -0.338) 0.659 35.682 ( 0.739 6.026 1.072) 6.165 35.838 ( -1.089 1.340 2.066) 2.692 36.025 ( -0.356 3.217 -4.419) 5.477 36.188 ( 0.619 1.425 -3.436) 3.771 36.336 ( 1.784 -0.612 4.734) 5.095 36.362 ( 2.449 2.617 -0.081) 3.585 36.626 ( 3.039 -0.917 8.967) 9.512 36.819 ( -12.371 -4.512 1.408) 13.243 36.835 ( -5.717 -4.305 0.893) 7.212 37.348 ( 6.831 -7.544 -8.148) 13.037 37.592 ( 10.737 -38.748 42.651) 58.616 38.119 ( 2.334 -16.247 8.116) 18.310 39.463 ( 0.737 4.237 3.375) 5.467 39.635 ( -0.518 -0.101 1.378) 1.476 40.945 ( -1.295 9.648 -6.759) 11.851 41.276 ( 6.398 24.694 -33.509) 42.114 ======================= Grid point 73 (31/92) ======================= q-point: ( 0.11 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( 16.243 8.977 18.372) 26.114 1.373 ( 3.243 31.924 18.607) 37.093 1.615 ( 9.160 5.694 0.703) 10.809 1.752 ( 5.845 14.268 0.941) 15.447 1.955 ( -0.658 -1.680 -2.835) 3.361 2.010 ( 0.337 -0.230 -0.938) 1.023 2.223 ( 15.645 -3.629 -1.045) 16.094 2.271 ( 5.311 16.569 2.928) 17.644 2.366 ( 3.524 14.258 6.448) 16.040 2.656 ( 9.889 -7.764 2.949) 12.914 2.724 ( 9.509 -3.125 1.914) 10.191 2.908 ( 3.009 1.279 3.875) 5.071 3.012 ( 9.712 -0.232 2.132) 9.946 3.257 ( 3.556 -0.594 -2.685) 4.495 3.286 ( 5.565 -1.812 5.506) 8.035 3.412 ( 7.138 -7.545 7.333) 12.714 3.662 ( 0.210 -0.144 8.264) 8.268 3.747 ( 5.985 -2.578 -2.576) 7.007 3.910 ( -2.189 -1.635 1.432) 3.085 3.989 ( -3.648 -4.004 -2.758) 6.079 4.098 ( -1.567 -2.176 1.110) 2.902 4.195 ( 2.387 1.307 -3.486) 4.422 4.307 ( -4.772 2.307 -0.869) 5.372 4.377 ( -4.308 3.135 1.241) 5.470 4.420 ( -12.464 5.573 -2.698) 13.918 4.454 ( -0.070 3.340 -2.158) 3.978 4.536 ( -7.039 -2.821 -1.813) 7.796 4.632 ( 1.326 -0.546 -1.827) 2.322 4.773 ( -0.696 1.285 -2.830) 3.185 4.885 ( -3.591 -0.230 -2.887) 4.613 5.028 ( -1.668 5.744 -0.122) 5.983 5.079 ( 8.466 3.161 -3.086) 9.549 5.178 ( 7.921 0.889 0.185) 7.973 5.219 ( 1.955 2.000 -3.351) 4.364 5.307 ( 4.299 1.161 -4.190) 6.114 5.323 ( -2.166 2.197 2.527) 3.988 5.417 ( -1.845 3.248 0.761) 3.812 5.449 ( 8.257 1.877 -3.425) 9.134 5.544 ( 1.702 -1.440 0.227) 2.241 5.601 ( -2.303 1.927 -1.439) 3.330 5.688 ( 1.811 -0.492 0.588) 1.966 5.693 ( -2.552 -0.482 2.575) 3.657 5.787 ( -1.937 -4.821 0.555) 5.225 5.894 ( -0.639 -3.653 2.420) 4.429 5.956 ( -3.214 -2.460 -5.582) 6.895 6.016 ( -1.597 0.454 -1.857) 2.491 6.100 ( -2.377 3.656 2.189) 4.879 6.185 ( -1.039 -1.617 2.085) 2.836 6.215 ( -0.268 -0.538 2.154) 2.236 6.291 ( -2.814 -1.052 1.631) 3.419 6.317 ( 1.357 -0.033 -0.152) 1.366 6.380 ( -0.303 2.484 -6.918) 7.357 6.464 ( 0.726 -2.684 1.187) 3.023 6.480 ( -1.059 -4.996 -0.165) 5.109 6.590 ( 2.076 -2.380 -4.022) 5.114 6.663 ( 0.691 -1.447 -4.370) 4.655 6.682 ( 5.157 -1.117 -0.651) 5.316 6.738 ( -1.377 0.005 -5.648) 5.814 6.767 ( -5.467 1.036 -1.566) 5.781 6.869 ( 0.397 -2.487 0.470) 2.562 6.939 ( -1.906 2.264 3.354) 4.473 6.997 ( 4.865 -4.486 1.020) 6.696 7.010 ( -6.307 3.941 -1.483) 7.583 7.146 ( 10.689 4.652 0.849) 11.689 7.328 ( 6.611 -3.546 -2.787) 8.003 7.387 ( -0.110 -1.202 -2.824) 3.071 7.459 ( 0.239 -4.507 -4.213) 6.174 7.572 ( 6.656 -4.397 -7.492) 10.944 7.670 ( 0.501 2.995 0.403) 3.063 7.821 ( 8.116 5.528 -0.055) 9.820 7.882 ( 0.549 -8.209 5.048) 9.653 8.048 ( 0.329 -4.998 1.419) 5.206 8.239 ( -0.371 -2.699 0.064) 2.725 8.267 ( -2.767 -0.840 2.281) 3.683 8.369 ( 1.137 6.371 4.357) 7.801 8.529 ( 4.927 4.844 -2.352) 7.299 8.562 ( 0.426 0.326 -1.262) 1.372 8.633 ( -4.309 3.136 3.411) 6.327 8.717 ( -1.282 1.088 -2.877) 3.332 8.789 ( 1.812 1.610 0.086) 2.425 8.890 ( 0.573 -2.718 -1.024) 2.961 8.970 ( 3.331 -0.149 -0.859) 3.443 8.986 ( -4.427 -2.490 4.414) 6.730 9.145 ( -1.315 -1.976 -1.930) 3.059 9.231 ( 0.667 3.785 2.754) 4.728 9.349 ( 0.115 2.393 2.112) 3.194 9.564 ( -6.962 -2.499 0.610) 7.422 9.807 ( -7.018 0.063 7.260) 10.098 10.003 ( 6.055 -5.306 0.182) 8.053 10.097 ( 0.931 -1.472 1.410) 2.241 10.197 ( 2.711 0.224 1.355) 3.039 10.321 ( 7.292 3.216 -2.282) 8.290 10.375 ( 3.301 -0.013 0.626) 3.360 10.511 ( 3.918 9.174 -5.526) 11.404 11.004 ( 13.706 -7.824 19.721) 25.258 11.463 ( 3.917 -2.927 -23.642) 24.143 16.359 ( 1.157 0.059 -0.122) 1.165 16.377 ( 1.950 -0.154 0.574) 2.038 16.833 ( -1.427 -1.242 0.166) 1.899 16.852 ( -0.297 -0.924 -0.089) 0.975 17.509 ( 0.055 -2.942 1.057) 3.126 17.541 ( -0.827 -3.288 -0.549) 3.435 17.625 ( -0.282 1.027 0.816) 1.342 17.650 ( -1.504 0.441 -0.300) 1.596 17.764 ( -1.103 0.367 -1.289) 1.736 17.775 ( -1.725 0.193 -1.920) 2.589 17.835 ( -2.560 -3.314 3.114) 5.218 17.955 ( -1.487 -6.253 -0.682) 6.464 18.579 ( -1.372 16.107 -0.920) 16.191 18.588 ( -2.837 15.138 -1.692) 15.494 19.405 ( -3.740 -5.423 2.204) 6.947 19.445 ( -3.781 -3.536 -1.284) 5.334 21.256 ( 1.239 -0.153 0.083) 1.251 21.286 ( 3.520 -0.731 -1.868) 4.051 21.428 ( 0.376 -0.137 0.060) 0.405 21.432 ( 0.701 -0.260 -0.301) 0.806 21.930 ( 0.412 0.786 0.127) 0.896 21.960 ( 0.950 2.001 -1.738) 2.816 22.007 ( -0.737 0.256 1.126) 1.370 22.072 ( 1.537 -0.153 0.382) 1.592 26.954 ( 0.224 1.015 0.632) 1.216 26.989 ( -0.357 1.121 -1.487) 1.897 27.139 ( -0.200 -1.283 0.818) 1.535 27.152 ( -0.592 -0.833 -0.051) 1.023 27.681 ( -1.135 0.350 0.735) 1.397 27.714 ( -0.037 -0.092 0.340) 0.354 27.778 ( -1.836 0.811 -0.042) 2.008 27.819 ( -0.182 0.093 -0.019) 0.206 35.722 ( -0.314 3.584 5.132) 6.267 35.804 ( -3.461 -0.044 1.858) 3.929 35.952 ( -2.319 4.785 -4.623) 7.046 36.141 ( -1.733 4.099 -5.683) 7.218 36.358 ( -2.655 -0.307 4.016) 4.824 36.438 ( 4.567 1.335 1.879) 5.116 36.530 ( -13.719 -0.284 5.650) 14.840 36.754 ( 1.007 -0.082 8.569) 8.628 36.914 ( 4.157 1.728 0.815) 4.575 37.247 ( -2.179 -8.189 -10.909) 13.814 37.969 ( 2.709 -25.972 8.971) 27.610 38.461 ( 19.295 -35.603 8.219) 41.321 39.544 ( 4.096 4.155 4.577) 7.415 39.669 ( 3.396 1.099 -0.052) 3.570 40.756 ( -10.742 18.685 -8.517) 23.175 41.022 ( -5.399 13.720 -14.707) 20.825 ======================= Grid point 74 (32/92) ======================= q-point: ( 0.22 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 6.533 17.743 17.280) 25.614 1.571 ( 2.905 27.900 13.226) 31.013 1.790 ( -0.841 -2.636 6.238) 6.824 1.857 ( 14.096 3.359 -7.211) 16.186 1.984 ( -0.040 1.377 -2.706) 3.036 2.050 ( 15.731 6.117 -5.648) 17.798 2.344 ( 3.258 5.707 -0.619) 6.601 2.423 ( 7.186 9.872 3.884) 12.813 2.690 ( 16.595 -0.621 5.812) 17.594 2.820 ( 12.495 -4.271 -3.000) 13.541 2.943 ( 7.670 -6.169 6.241) 11.655 2.993 ( 3.881 1.825 -0.615) 4.332 3.198 ( 8.611 -0.915 1.046) 8.722 3.285 ( 5.787 0.210 -5.803) 8.198 3.442 ( 7.950 -2.611 0.192) 8.370 3.559 ( 3.960 -6.876 5.824) 9.843 3.764 ( -3.881 -8.579 9.339) 13.262 3.822 ( 0.367 0.538 -0.845) 1.067 3.854 ( 5.406 -3.184 -3.795) 7.333 3.981 ( 0.348 2.910 1.023) 3.104 3.997 ( -6.472 -8.429 -0.721) 10.652 4.125 ( -8.459 5.354 -0.810) 10.044 4.219 ( -2.917 -1.173 -4.475) 5.470 4.287 ( -5.262 4.322 -1.648) 7.006 4.306 ( 5.833 5.348 3.985) 8.860 4.377 ( -6.485 6.383 -6.000) 10.899 4.616 ( 3.424 5.302 6.329) 8.938 4.645 ( 3.975 2.015 4.943) 6.655 4.709 ( -1.109 -1.958 -2.830) 3.616 4.802 ( 1.474 4.199 -4.438) 6.285 4.994 ( -0.090 5.741 -3.572) 6.762 5.047 ( -6.622 3.989 -13.665) 15.701 5.180 ( 4.680 -2.236 -4.388) 6.794 5.221 ( -2.654 -4.536 -1.959) 5.609 5.302 ( 1.621 2.307 4.476) 5.290 5.419 ( 3.013 3.256 1.856) 4.809 5.444 ( 1.601 5.481 0.038) 5.710 5.524 ( -2.319 2.275 -3.166) 4.536 5.565 ( 2.958 -2.478 3.071) 4.932 5.602 ( -5.792 0.780 4.955) 7.662 5.622 ( 1.771 0.277 -0.943) 2.025 5.747 ( 5.419 -1.750 -3.007) 6.440 5.772 ( -2.357 -4.396 1.772) 5.294 5.885 ( 1.048 -2.654 -0.154) 2.858 5.925 ( 1.325 -2.317 1.899) 3.275 5.977 ( -3.365 2.038 -4.436) 5.929 6.022 ( -5.278 0.783 2.368) 5.838 6.188 ( 0.005 4.373 -3.273) 5.462 6.222 ( 1.795 3.157 1.277) 3.850 6.233 ( 2.420 -1.176 -4.941) 5.626 6.328 ( 1.056 0.047 -2.148) 2.393 6.368 ( -2.412 3.200 -1.531) 4.290 6.448 ( -2.589 -4.076 2.009) 5.231 6.534 ( 1.702 -2.888 3.185) 4.624 6.551 ( -0.712 -1.740 -4.558) 4.931 6.600 ( -1.882 0.165 1.142) 2.208 6.625 ( -4.085 -0.686 0.416) 4.163 6.759 ( 2.186 -2.688 3.473) 4.906 6.821 ( -4.381 3.992 -0.839) 5.986 6.858 ( -2.687 -4.216 2.199) 5.462 6.877 ( 11.240 0.628 -2.216) 11.473 7.038 ( -0.525 -2.332 7.994) 8.343 7.127 ( 8.267 -3.647 -0.924) 9.083 7.270 ( -0.775 -1.112 -1.602) 2.099 7.371 ( 3.701 -0.917 -4.167) 5.648 7.425 ( 1.694 -4.886 -0.440) 5.190 7.473 ( 10.904 2.133 -1.961) 11.282 7.561 ( 2.065 -10.155 -6.339) 12.148 7.714 ( 5.263 7.848 -3.146) 9.959 7.827 ( -0.770 -3.977 -4.456) 6.022 8.023 ( 3.042 -1.067 8.039) 8.662 8.080 ( 3.146 -7.545 -1.829) 8.377 8.246 ( -2.255 3.308 2.515) 4.728 8.271 ( 3.227 -4.067 2.179) 5.630 8.425 ( 0.567 3.885 3.224) 5.081 8.522 ( -3.360 2.096 -2.703) 4.795 8.549 ( 2.546 4.304 -1.870) 5.339 8.644 ( 4.372 5.628 -2.712) 7.625 8.685 ( -0.285 -0.849 -0.732) 1.156 8.790 ( -1.001 1.824 0.198) 2.090 8.930 ( 1.795 -0.873 3.721) 4.222 8.961 ( -0.679 -1.841 3.355) 3.887 9.053 ( 1.678 -1.414 1.410) 2.608 9.085 ( -1.631 -0.311 -2.291) 2.829 9.244 ( -1.609 4.175 -0.005) 4.474 9.369 ( -0.320 0.467 2.107) 2.182 9.509 ( 0.614 0.479 0.051) 0.781 9.767 ( -4.445 3.692 5.995) 8.326 10.067 ( 1.824 -3.115 0.961) 3.736 10.121 ( 0.465 1.149 1.176) 1.708 10.272 ( 3.766 -2.252 2.806) 5.209 10.396 ( 2.522 2.384 -3.909) 5.227 10.502 ( 14.047 -0.095 -0.590) 14.060 10.576 ( 8.767 4.824 -4.043) 10.792 11.322 ( 3.349 -7.553 -17.428) 19.287 11.410 ( 8.717 -8.559 16.737) 20.721 16.394 ( 3.252 0.248 -0.343) 3.280 16.427 ( 3.284 -0.218 0.599) 3.345 16.805 ( -2.393 -1.519 0.661) 2.910 16.833 ( -2.030 -0.937 0.065) 2.237 17.510 ( -1.366 -2.034 -0.068) 2.451 17.527 ( -0.202 -3.090 -0.328) 3.114 17.611 ( -0.907 0.460 0.102) 1.022 17.638 ( 0.310 -0.173 0.084) 0.365 17.708 ( -3.468 0.382 -1.528) 3.809 17.728 ( -2.116 0.295 -0.913) 2.323 17.814 ( -2.926 -3.171 2.675) 5.077 17.911 ( -2.774 -4.731 -0.900) 5.557 18.538 ( -2.082 13.329 -0.313) 13.494 18.545 ( -1.535 13.575 -0.681) 13.678 19.340 ( -4.824 -4.311 0.070) 6.470 19.364 ( -4.572 -3.706 0.152) 5.887 21.289 ( 2.058 -0.525 0.588) 2.204 21.308 ( 1.273 -0.428 -1.361) 1.912 21.430 ( -0.183 -0.176 -0.157) 0.298 21.451 ( 1.793 -0.668 -0.663) 2.025 21.941 ( 0.691 0.957 0.197) 1.196 21.965 ( 1.022 1.499 -0.882) 2.017 22.017 ( 0.530 0.014 0.703) 0.880 22.106 ( 1.480 -0.700 1.098) 1.971 26.963 ( 0.090 0.739 -0.046) 0.746 26.977 ( 0.145 1.380 -0.097) 1.391 27.126 ( -0.900 -1.680 -0.437) 1.955 27.152 ( -0.127 -0.974 0.396) 1.059 27.670 ( -0.801 0.699 0.697) 1.271 27.713 ( -0.355 -0.179 0.028) 0.398 27.744 ( -1.971 0.931 0.229) 2.192 27.810 ( -0.735 -0.097 -0.189) 0.765 35.717 ( -3.864 2.250 3.902) 5.934 35.804 ( 0.340 0.721 -0.215) 0.826 35.886 ( -1.220 2.318 -1.473) 3.006 36.037 ( -3.240 5.289 -5.524) 8.306 36.304 ( -9.486 -0.526 8.030) 12.439 36.367 ( -10.170 -0.235 0.071) 10.173 36.531 ( 2.128 -2.509 3.446) 4.764 36.811 ( -3.413 -1.978 -1.058) 4.084 36.936 ( 2.066 6.545 -1.699) 7.070 37.190 ( 5.391 -1.586 -2.161) 6.020 38.121 ( 9.619 -21.783 3.775) 24.109 38.735 ( 10.745 -26.891 -1.759) 29.011 39.664 ( 5.335 5.129 1.217) 7.500 39.751 ( 7.602 3.195 -0.542) 8.264 40.522 ( -10.414 14.027 -0.416) 17.475 40.805 ( -8.747 8.093 -7.611) 14.140 ======================= Grid point 75 (33/92) ======================= q-point: ( 0.33 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.640 ( 0.640 29.791 7.160) 30.646 1.741 ( 5.800 2.748 1.635) 6.623 1.827 ( -0.254 -0.592 13.746) 13.761 1.966 ( 1.900 2.497 -2.040) 3.743 2.030 ( 8.538 0.703 -1.851) 8.765 2.270 ( 9.679 7.409 -3.369) 12.646 2.355 ( -1.044 4.580 3.690) 5.974 2.588 ( 8.530 11.613 1.540) 14.491 2.859 ( 3.362 -3.307 -1.210) 4.868 2.958 ( 3.940 -2.802 -5.596) 7.396 3.009 ( 3.248 -3.464 -5.844) 7.530 3.147 ( 10.047 -2.561 5.148) 11.576 3.273 ( 5.377 -4.690 -8.004) 10.723 3.383 ( 5.261 -1.748 -2.098) 5.928 3.532 ( 3.574 -2.942 0.984) 4.733 3.638 ( -2.399 -0.612 3.539) 4.319 3.697 ( 2.672 -2.596 -2.750) 4.630 3.757 ( -6.508 -1.575 -3.134) 7.393 3.912 ( -2.848 -5.701 -2.703) 6.922 3.939 ( 5.792 -2.116 -1.657) 6.386 3.980 ( -2.750 -2.014 -0.504) 3.446 4.049 ( -3.390 5.406 3.176) 7.128 4.151 ( 0.144 1.671 -0.996) 1.951 4.206 ( -2.555 2.452 -3.819) 5.208 4.359 ( 5.957 10.591 1.548) 12.250 4.405 ( 5.522 6.427 -7.043) 11.018 4.600 ( -2.416 -4.478 -6.635) 8.361 4.699 ( -1.733 4.941 1.320) 5.400 4.780 ( 1.207 1.295 -6.179) 6.428 4.861 ( 5.051 0.398 4.814) 6.989 4.919 ( 3.257 1.314 4.914) 6.040 5.014 ( 8.583 7.180 2.311) 11.426 5.142 ( -3.842 -5.999 1.584) 7.298 5.244 ( -1.232 -5.828 1.997) 6.282 5.338 ( -2.172 4.009 3.123) 5.527 5.415 ( -3.595 0.924 0.444) 3.738 5.466 ( 0.729 3.601 -0.583) 3.720 5.496 ( -3.882 0.549 2.725) 4.775 5.508 ( 2.072 3.849 2.079) 4.840 5.593 ( -2.360 3.002 -5.952) 7.072 5.649 ( 0.829 -0.673 1.413) 1.772 5.705 ( -1.507 1.124 -4.472) 4.851 5.808 ( 3.041 -1.668 1.595) 3.818 5.885 ( 1.598 -0.116 -1.578) 2.249 5.949 ( -2.192 2.379 -0.550) 3.281 5.968 ( 1.482 1.997 1.966) 3.170 6.018 ( 0.007 -0.636 -1.021) 1.203 6.074 ( -4.364 1.624 1.578) 4.917 6.220 ( -1.163 2.101 -1.822) 3.014 6.269 ( 1.456 0.624 -5.750) 5.964 6.326 ( 0.999 1.707 5.495) 5.840 6.381 ( 1.479 -1.518 -0.481) 2.174 6.426 ( 1.287 -0.501 -0.459) 1.456 6.493 ( -3.109 1.843 0.315) 3.628 6.524 ( -0.986 2.055 -0.326) 2.302 6.593 ( 1.883 -2.592 1.536) 3.553 6.686 ( -1.652 -7.255 9.564) 12.117 6.752 ( -3.462 4.226 1.892) 5.781 6.818 ( -2.248 -1.767 1.121) 3.071 6.860 ( 4.050 -3.434 2.682) 5.949 7.049 ( 3.995 2.243 3.664) 5.867 7.094 ( 2.526 -3.683 1.286) 4.648 7.164 ( -2.150 -2.933 -5.015) 6.195 7.239 ( 3.738 -6.070 -0.460) 7.143 7.385 ( 2.510 -5.324 -0.152) 5.888 7.441 ( 1.948 0.395 -6.437) 6.736 7.588 ( 4.073 -4.477 2.705) 6.629 7.655 ( 8.010 -3.433 -0.097) 8.715 7.765 ( -2.070 -5.797 -0.561) 6.181 7.798 ( 5.647 6.831 0.461) 8.875 8.074 ( -4.434 2.883 5.117) 7.359 8.119 ( 3.277 -12.794 0.592) 13.220 8.227 ( -1.928 0.663 1.012) 2.276 8.355 ( 3.621 0.477 -0.923) 3.767 8.435 ( -0.649 1.448 -3.770) 4.091 8.463 ( -0.423 4.560 1.739) 4.898 8.593 ( 3.024 3.104 -1.713) 4.660 8.670 ( 0.421 -0.289 -3.910) 3.944 8.709 ( 5.391 4.113 -0.598) 6.807 8.788 ( 1.564 2.377 -2.083) 3.526 8.974 ( -0.995 -3.639 5.108) 6.350 9.005 ( 0.728 -1.850 2.347) 3.076 9.031 ( 1.859 3.797 -2.793) 5.067 9.100 ( -0.954 -0.063 3.501) 3.630 9.191 ( -3.011 2.491 -0.627) 3.958 9.374 ( -0.304 0.715 -0.714) 1.055 9.548 ( 2.115 2.742 0.869) 3.570 9.758 ( -2.426 4.562 3.901) 6.474 10.100 ( 1.011 -0.726 1.168) 1.707 10.135 ( 0.380 2.048 0.051) 2.083 10.344 ( 2.670 -6.419 -2.387) 7.351 10.439 ( 7.073 1.735 -2.205) 7.609 10.695 ( 9.904 0.195 -1.675) 10.047 10.784 ( 17.718 -0.472 -2.442) 17.892 11.180 ( -1.091 -4.403 -13.916) 14.636 11.608 ( -4.776 -7.941 13.760) 16.590 16.464 ( 5.253 0.323 -0.527) 5.289 16.496 ( 4.102 -0.154 0.162) 4.108 16.760 ( -3.678 -1.418 0.650) 3.996 16.781 ( -4.168 -0.894 0.027) 4.263 17.469 ( -1.462 0.269 -1.487) 2.102 17.523 ( 0.225 -2.156 -0.236) 2.180 17.622 ( 0.295 -1.455 1.106) 1.851 17.638 ( -2.359 -0.835 -0.068) 2.503 17.644 ( -0.325 -0.225 -0.714) 0.816 17.690 ( -1.211 -1.179 0.028) 1.691 17.788 ( -2.446 -2.367 1.824) 3.862 17.847 ( -3.434 -2.884 -1.218) 4.646 18.506 ( -1.255 11.864 -0.061) 11.930 18.523 ( -0.739 11.223 0.073) 11.248 19.264 ( -3.381 -3.958 -0.352) 5.217 19.295 ( -3.780 -3.636 0.488) 5.268 21.304 ( 0.598 -0.168 -0.954) 1.138 21.345 ( 2.083 -0.714 1.917) 2.919 21.416 ( -1.025 -0.134 -0.618) 1.204 21.473 ( 1.498 -0.882 -0.703) 1.875 21.955 ( 0.577 1.087 0.242) 1.254 21.976 ( 0.930 1.176 -0.613) 1.620 22.033 ( 0.479 0.012 0.809) 0.940 22.135 ( 0.523 -1.164 1.130) 1.705 26.959 ( 0.020 0.644 -0.411) 0.765 26.987 ( 0.268 1.455 0.623) 1.605 27.109 ( -0.462 -2.068 -0.369) 2.151 27.151 ( -0.127 -1.079 0.032) 1.087 27.668 ( -0.144 1.166 0.557) 1.300 27.701 ( -0.513 0.113 -0.733) 0.902 27.721 ( -1.304 0.349 0.801) 1.569 27.792 ( -0.985 -0.051 -0.464) 1.090 35.708 ( -0.470 1.739 2.220) 2.859 35.777 ( -0.533 4.214 -2.678) 5.021 35.840 ( -2.565 0.124 -4.341) 5.044 35.970 ( -1.759 0.686 -1.251) 2.265 36.158 ( -9.745 -1.297 -3.348) 10.385 36.227 ( -8.840 1.603 9.134) 12.812 36.565 ( -1.669 -4.258 3.040) 5.491 36.656 ( -4.657 -2.454 -6.401) 8.287 37.031 ( 5.496 8.350 2.207) 10.238 37.304 ( 6.361 4.579 0.626) 7.863 38.337 ( 9.892 -21.145 3.480) 23.602 38.847 ( 7.018 -20.037 -5.176) 21.852 39.735 ( 5.336 8.283 -3.285) 10.386 39.933 ( 11.679 3.843 2.542) 12.555 40.385 ( -8.183 5.944 3.293) 10.637 40.576 ( -11.270 6.920 -4.393) 13.936 ======================= Grid point 76 (34/92) ======================= q-point: ( 0.44 0.17 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -5.486 26.037 3.567) 26.847 1.783 ( 1.992 -6.849 -1.769) 7.349 1.949 ( 0.813 1.446 4.111) 4.433 2.030 ( 2.833 6.098 3.904) 7.776 2.088 ( -1.447 -1.148 -1.011) 2.106 2.254 ( -4.431 6.939 6.981) 10.794 2.465 ( 8.220 6.097 -4.412) 11.145 2.677 ( 0.465 14.465 -4.338) 15.109 2.856 ( 2.237 -6.870 -4.285) 8.400 2.927 ( -0.318 -5.289 -4.380) 6.874 2.994 ( 2.140 -3.217 -4.050) 5.598 3.249 ( -0.741 -4.701 -0.940) 4.851 3.346 ( 6.922 -0.360 5.921) 9.116 3.386 ( 1.264 -6.445 -7.111) 9.680 3.529 ( -0.537 6.128 -8.210) 10.259 3.607 ( -6.053 -2.775 -2.006) 6.954 3.699 ( 4.003 -1.410 4.393) 6.109 3.781 ( 1.993 0.930 0.157) 2.205 3.861 ( 3.180 -0.748 -4.190) 5.313 3.930 ( -1.174 -2.052 -2.636) 3.541 3.996 ( -2.911 3.197 -3.778) 5.742 4.048 ( 6.262 -2.030 0.834) 6.636 4.110 ( -2.447 1.202 -5.280) 5.943 4.187 ( 1.232 0.955 2.248) 2.736 4.305 ( 1.023 7.756 -15.602) 17.454 4.465 ( 3.193 3.545 -1.365) 4.962 4.566 ( 4.293 5.906 0.968) 7.365 4.664 ( -2.161 2.321 0.296) 3.185 4.809 ( 6.333 0.471 -4.150) 7.587 4.872 ( -4.260 -1.844 -5.844) 7.463 5.001 ( -0.099 -0.373 2.909) 2.934 5.109 ( -6.282 -4.604 2.066) 8.058 5.179 ( 0.868 -2.533 1.103) 2.896 5.211 ( 3.225 1.863 1.937) 4.198 5.331 ( -3.275 2.987 3.707) 5.779 5.395 ( -1.959 1.844 1.983) 3.342 5.431 ( -4.749 4.185 1.032) 6.413 5.479 ( 0.632 2.346 -1.924) 3.099 5.521 ( 0.931 1.967 2.912) 3.635 5.593 ( 1.570 4.863 3.943) 6.455 5.680 ( -0.084 -0.977 4.326) 4.436 5.704 ( 3.234 4.117 1.877) 5.562 5.810 ( -2.719 2.667 -4.790) 6.120 5.892 ( 4.021 -1.945 2.115) 4.942 5.938 ( 1.790 -0.579 2.552) 3.170 5.966 ( -1.366 -0.821 1.163) 1.973 6.030 ( 1.319 1.337 2.754) 3.334 6.100 ( -3.462 1.973 -0.626) 4.034 6.180 ( 0.532 -0.968 6.745) 6.834 6.310 ( 6.019 0.664 -3.037) 6.774 6.373 ( 0.974 -0.304 1.369) 1.708 6.385 ( 1.049 -2.284 0.018) 2.514 6.477 ( 0.287 0.863 2.438) 2.602 6.487 ( 1.072 2.894 2.452) 3.942 6.522 ( -1.532 4.140 2.503) 5.075 6.590 ( -0.520 -9.798 -1.438) 9.916 6.679 ( -5.062 3.313 5.158) 7.951 6.729 ( -4.716 -3.253 1.263) 5.866 6.805 ( -0.542 -0.815 1.554) 1.837 6.920 ( -0.444 0.153 0.847) 0.969 7.023 ( -0.949 -0.034 -0.634) 1.141 7.117 ( -1.588 -4.490 4.028) 6.237 7.206 ( 2.284 -1.726 -0.902) 3.001 7.314 ( 5.447 -5.375 2.989) 8.216 7.416 ( 1.662 -4.113 -1.749) 4.768 7.492 ( 7.913 -3.212 0.455) 8.552 7.633 ( -0.222 -0.338 0.461) 0.613 7.715 ( -2.729 -4.524 4.795) 7.135 7.809 ( 3.987 -4.067 5.705) 8.061 7.908 ( 3.707 3.950 3.337) 6.363 8.036 ( -4.565 0.118 5.291) 6.989 8.158 ( 0.184 -10.748 -0.312) 10.755 8.201 ( -2.426 0.649 1.724) 3.046 8.358 ( -0.177 2.320 -3.557) 4.250 8.404 ( 2.391 3.852 -3.810) 5.922 8.482 ( 0.546 2.301 -0.377) 2.395 8.598 ( -0.540 -0.739 -5.013) 5.096 8.610 ( -0.938 1.202 -3.147) 3.497 8.777 ( 2.634 -0.878 -6.497) 7.066 8.788 ( 2.682 4.191 -2.382) 5.517 8.971 ( -1.870 2.195 -2.286) 3.680 9.046 ( 1.349 1.205 2.790) 3.325 9.059 ( -0.401 2.197 2.425) 3.297 9.111 ( 0.236 -1.206 3.749) 3.946 9.177 ( -1.369 -2.749 5.441) 6.248 9.342 ( -0.411 2.872 -3.659) 4.670 9.572 ( -0.191 2.850 0.293) 2.872 9.749 ( -1.868 5.583 1.725) 6.135 10.117 ( -0.272 -0.870 0.238) 0.943 10.131 ( -0.092 2.564 -1.260) 2.859 10.347 ( 2.763 -8.185 -5.918) 10.472 10.512 ( 3.789 1.220 -5.455) 6.753 10.862 ( 6.715 -3.245 0.991) 7.523 11.026 ( 12.419 -2.281 -7.028) 14.451 11.086 ( 4.375 0.424 -1.629) 4.687 11.501 ( -16.209 -5.074 4.531) 17.579 16.555 ( 5.311 0.246 -0.891) 5.390 16.562 ( 3.500 0.245 -0.389) 3.530 16.691 ( -5.118 -0.783 0.360) 5.190 16.700 ( -3.682 -1.222 -0.450) 3.906 17.459 ( 0.949 0.040 0.143) 0.960 17.536 ( 1.095 -0.981 0.585) 1.583 17.587 ( -2.334 -0.641 1.018) 2.626 17.629 ( -0.482 -2.577 0.203) 2.630 17.650 ( 0.528 -1.299 -0.035) 1.403 17.693 ( 0.433 -3.417 0.316) 3.459 17.768 ( -0.703 -0.383 -0.417) 0.903 17.780 ( -2.628 -2.054 -0.548) 3.380 18.496 ( -0.292 10.794 0.691) 10.820 18.518 ( -0.127 10.341 0.383) 10.349 19.226 ( -1.022 -3.832 0.337) 3.980 19.250 ( -1.591 -3.520 0.125) 3.865 21.309 ( 0.685 0.067 -0.015) 0.689 21.381 ( -1.323 -0.833 -0.654) 1.695 21.397 ( 1.029 -0.079 1.568) 1.877 21.488 ( 0.899 -1.123 -0.563) 1.545 21.963 ( 0.111 1.132 0.211) 1.157 21.984 ( 0.573 1.141 -0.515) 1.377 22.049 ( 0.188 -0.081 1.384) 1.399 22.142 ( -0.478 -1.236 0.355) 1.372 26.959 ( 0.274 0.627 0.052) 0.686 26.991 ( -0.268 1.342 0.008) 1.369 27.106 ( 0.149 -2.124 0.201) 2.139 27.148 ( -0.116 -1.162 -0.263) 1.197 27.670 ( -0.284 1.423 0.090) 1.454 27.689 ( 0.022 0.406 -0.730) 0.836 27.712 ( -0.623 -0.334 0.861) 1.115 27.774 ( -0.295 -0.065 -0.599) 0.671 35.699 ( -2.849 2.851 -3.681) 5.459 35.744 ( 0.488 1.224 -4.950) 5.123 35.763 ( 1.163 2.723 -3.660) 4.707 35.946 ( 1.212 -2.772 1.514) 3.383 36.025 ( -4.725 -0.535 0.566) 4.789 36.178 ( -5.165 3.505 5.240) 8.150 36.551 ( -2.279 -4.634 2.272) 5.642 36.595 ( 1.466 -2.635 -0.891) 3.144 37.122 ( 1.901 9.299 2.937) 9.935 37.379 ( 2.073 5.602 -0.864) 6.035 38.476 ( 2.138 -20.078 2.911) 20.400 38.890 ( 4.141 -18.300 -6.118) 19.735 39.814 ( 5.939 10.934 -0.125) 12.443 40.157 ( 7.729 6.739 1.471) 10.359 40.276 ( -2.903 0.608 -1.222) 3.208 40.364 ( -10.323 4.427 1.075) 11.284 ======================= Grid point 77 (35/92) ======================= q-point: (-0.44 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( -10.581 22.001 0.418) 24.417 1.732 ( -10.161 3.468 0.198) 10.738 1.923 ( -6.853 1.017 2.317) 7.305 2.002 ( -5.084 6.999 3.186) 9.219 2.097 ( 3.464 -0.732 -1.151) 3.723 2.324 ( 2.299 0.526 7.526) 7.887 2.497 ( 0.300 3.896 -4.116) 5.676 2.579 ( -0.505 9.939 -9.905) 14.041 2.813 ( -3.735 -3.507 -1.822) 5.438 2.927 ( 2.561 -3.499 -3.729) 5.719 3.013 ( 1.361 -2.709 -1.607) 3.431 3.282 ( 2.334 -6.238 0.840) 6.713 3.346 ( 2.191 -3.196 -5.097) 6.403 3.362 ( -7.787 -0.026 -9.008) 11.908 3.504 ( -3.131 -3.576 1.593) 5.013 3.513 ( 2.769 2.802 1.149) 4.103 3.719 ( -1.735 0.996 -2.377) 3.107 3.742 ( -5.256 -0.344 -9.739) 11.072 3.822 ( -1.420 -3.641 -2.161) 4.465 3.844 ( 0.291 0.905 2.086) 2.292 3.980 ( 1.349 3.198 -5.056) 6.133 4.042 ( -0.202 0.391 -1.523) 1.585 4.171 ( 7.528 -2.540 -1.819) 8.150 4.186 ( -2.377 2.251 -1.791) 3.732 4.357 ( 8.185 8.081 0.904) 11.538 4.475 ( -9.534 7.892 -9.972) 15.894 4.523 ( 7.349 2.248 -2.274) 8.015 4.618 ( -6.105 4.139 -0.403) 7.387 4.742 ( 0.107 4.329 -5.468) 6.975 4.916 ( 6.784 -0.870 -0.218) 6.843 4.975 ( -5.229 6.603 3.171) 9.000 5.062 ( 0.517 -2.093 0.831) 2.310 5.169 ( -6.397 0.312 -0.433) 6.419 5.227 ( 4.394 -5.342 3.361) 7.691 5.343 ( 3.245 1.235 -0.716) 3.545 5.362 ( -2.805 2.561 6.388) 7.432 5.454 ( -0.804 2.279 -1.582) 2.888 5.476 ( 0.923 -0.264 5.541) 5.623 5.554 ( 1.145 -1.388 -0.285) 1.822 5.677 ( 3.818 4.995 3.814) 7.354 5.699 ( -3.240 1.140 4.227) 5.447 5.768 ( 4.084 1.007 0.458) 4.232 5.801 ( 2.853 4.005 -0.148) 4.920 5.900 ( -2.947 -1.090 -2.841) 4.236 5.942 ( -3.746 1.606 3.401) 5.308 5.978 ( -0.335 -0.595 0.052) 0.685 6.014 ( 1.450 -0.721 1.650) 2.312 6.179 ( 2.477 -0.059 0.560) 2.540 6.303 ( 1.149 -4.489 10.524) 11.499 6.339 ( 1.339 -3.166 -4.490) 5.655 6.374 ( 1.029 -3.557 -1.720) 4.083 6.405 ( -1.946 -0.427 -0.309) 2.016 6.448 ( -0.420 2.816 0.719) 2.937 6.488 ( -1.915 1.170 2.416) 3.298 6.540 ( 0.417 0.808 -1.497) 1.751 6.576 ( -5.763 2.697 2.128) 6.709 6.639 ( -2.244 -6.075 3.101) 7.180 6.723 ( 2.275 -1.152 9.136) 9.485 6.818 ( 0.564 -0.113 1.016) 1.167 6.904 ( -1.928 6.167 6.568) 9.214 7.048 ( -1.908 -2.844 0.553) 3.469 7.091 ( 0.319 -4.332 0.605) 4.385 7.242 ( 2.757 -5.246 -0.568) 5.953 7.379 ( -2.068 -6.459 2.173) 7.121 7.460 ( 1.649 -3.150 4.703) 5.896 7.572 ( 1.751 -3.349 -3.352) 5.052 7.679 ( -0.214 -1.557 6.572) 6.757 7.721 ( -2.895 2.008 5.727) 6.724 7.890 ( -1.001 1.311 2.834) 3.279 7.982 ( 1.859 -1.135 5.567) 5.978 8.042 ( -0.380 0.542 5.332) 5.373 8.135 ( -3.750 -7.812 4.708) 9.862 8.162 ( -1.601 -0.400 -3.084) 3.498 8.327 ( 0.234 2.114 -3.190) 3.834 8.432 ( 4.733 -0.124 -3.992) 6.193 8.454 ( -1.652 4.325 -3.404) 5.746 8.487 ( -2.791 -0.199 -6.891) 7.438 8.593 ( -1.320 1.719 -1.763) 2.794 8.757 ( 2.082 -2.742 -5.825) 6.766 8.771 ( -0.159 5.553 -1.497) 5.753 8.898 ( -2.298 4.053 -4.756) 6.658 9.038 ( -3.005 2.784 -1.634) 4.410 9.081 ( -0.304 -0.494 2.087) 2.166 9.149 ( 0.085 -2.698 1.983) 3.349 9.218 ( -0.794 -3.390 7.587) 8.348 9.331 ( -0.012 1.946 2.655) 3.292 9.548 ( -1.937 1.612 -1.209) 2.795 9.715 ( -2.647 5.376 -1.412) 6.157 10.087 ( -1.109 -4.320 -3.231) 5.507 10.118 ( -0.558 2.084 -0.560) 2.229 10.317 ( -0.769 -4.822 -4.864) 6.892 10.484 ( -0.054 2.727 -5.268) 5.932 10.842 ( -5.843 -0.447 -0.273) 5.866 11.051 ( -2.271 0.158 -7.684) 8.014 11.224 ( -13.082 -4.424 -3.556) 14.260 11.343 ( 16.557 -2.977 6.982) 18.214 16.549 ( -3.722 0.344 -0.857) 3.835 16.566 ( -4.736 0.185 -0.644) 4.783 16.673 ( 3.889 -0.636 0.048) 3.941 16.694 ( 3.480 -0.975 -0.555) 3.656 17.485 ( 0.714 -0.982 1.274) 1.760 17.547 ( 0.103 -1.002 0.267) 1.042 17.606 ( 0.159 -2.839 0.752) 2.941 17.618 ( 1.169 -2.822 1.268) 3.307 17.662 ( 0.498 -1.361 0.025) 1.450 17.689 ( 0.141 -0.123 0.228) 0.295 17.732 ( -1.149 -1.095 -0.882) 1.816 17.795 ( 3.049 -2.314 -0.936) 3.941 18.505 ( 0.347 10.499 0.925) 10.545 18.525 ( 0.488 10.823 0.528) 10.846 19.230 ( 0.764 -3.971 0.366) 4.061 19.250 ( 1.677 -3.189 0.197) 3.609 21.328 ( 0.938 -0.078 0.837) 1.259 21.341 ( -1.924 -0.090 -0.966) 2.155 21.428 ( 0.511 -0.497 1.309) 1.491 21.493 ( 0.273 -1.558 -0.563) 1.680 21.962 ( -0.432 1.053 0.152) 1.148 21.985 ( 0.110 1.305 -0.448) 1.384 22.066 ( -0.239 -0.375 2.288) 2.330 22.129 ( -0.943 -0.904 -0.434) 1.377 26.968 ( 0.372 0.597 0.429) 0.824 26.981 ( -0.459 1.193 -0.393) 1.337 27.116 ( 0.487 -1.896 0.628) 2.056 27.142 ( -0.135 -1.169 -0.582) 1.313 27.658 ( -0.735 0.741 -0.258) 1.075 27.690 ( 0.618 0.825 -0.557) 1.172 27.714 ( -0.078 -0.195 0.843) 0.869 27.774 ( 0.912 -0.366 -0.630) 1.168 35.607 ( -1.756 2.803 -3.067) 4.511 35.721 ( 3.521 1.773 -6.807) 7.866 35.805 ( 4.698 2.112 -0.432) 5.169 35.878 ( -4.064 -1.737 -5.929) 7.395 36.121 ( 5.975 -0.230 6.910) 9.138 36.154 ( -0.234 3.232 3.328) 4.645 36.511 ( -3.604 -5.016 0.667) 6.212 36.685 ( 7.151 -2.099 1.246) 7.556 37.144 ( -3.187 9.542 3.940) 10.804 37.359 ( -2.568 3.910 -1.846) 5.029 38.455 ( -7.327 -18.004 2.640) 19.616 38.872 ( 0.400 -20.998 -6.610) 22.017 39.887 ( -3.596 8.350 2.148) 9.341 40.066 ( -4.372 9.062 -1.986) 10.255 40.230 ( -3.409 4.431 -0.130) 5.592 40.475 ( 14.316 1.849 2.106) 14.588 ======================= Grid point 78 (36/92) ======================= q-point: (-0.33 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -17.408 14.998 4.959) 23.507 1.489 ( -15.066 23.905 1.697) 28.308 1.821 ( -6.441 0.911 1.129) 6.602 1.956 ( -3.805 7.008 2.186) 8.269 2.120 ( -1.377 -4.836 -0.467) 5.050 2.398 ( -2.207 -1.565 1.923) 3.320 2.427 ( -5.065 5.504 3.776) 8.379 2.528 ( 3.364 10.167 -8.369) 13.592 2.711 ( -8.493 -4.158 -1.846) 9.635 2.863 ( -5.986 -2.491 -6.501) 9.181 2.915 ( -9.437 0.781 -4.199) 10.358 3.098 ( -9.210 -4.186 -5.072) 11.317 3.228 ( -7.717 -5.304 -2.375) 9.660 3.397 ( 4.682 -6.420 -3.761) 8.791 3.459 ( -5.457 2.351 1.008) 6.027 3.511 ( -6.036 0.352 0.991) 6.127 3.643 ( 6.518 -2.344 -6.793) 9.702 3.654 ( -2.580 -1.890 1.206) 3.418 3.831 ( 2.312 -1.057 -1.274) 2.844 3.899 ( 1.888 -4.867 4.473) 6.874 3.949 ( -0.243 1.849 -4.275) 4.664 4.075 ( 5.932 2.770 -3.466) 7.408 4.116 ( -1.059 6.452 -0.985) 6.612 4.227 ( -4.299 7.752 -1.078) 8.929 4.239 ( 4.115 -0.976 -11.521) 12.272 4.456 ( -2.199 3.463 1.023) 4.228 4.503 ( -1.954 4.444 2.909) 5.660 4.640 ( 5.764 8.464 -3.876) 10.949 4.792 ( 8.178 5.150 -0.707) 9.690 4.882 ( -6.055 5.557 0.002) 8.219 4.991 ( 1.612 -4.993 1.129) 5.367 5.060 ( -1.557 -0.500 -0.722) 1.788 5.189 ( 5.852 1.605 5.173) 7.974 5.304 ( -0.120 3.386 -0.711) 3.462 5.330 ( -2.557 3.114 1.140) 4.188 5.423 ( 3.361 -0.418 2.230) 4.055 5.473 ( 3.860 -5.548 -0.393) 6.770 5.532 ( -0.258 -0.784 -0.021) 0.825 5.559 ( -0.060 -2.206 2.028) 2.997 5.709 ( -0.947 0.558 4.689) 4.816 5.745 ( -2.021 1.511 3.688) 4.469 5.813 ( 1.724 2.729 -2.019) 3.808 5.850 ( 0.394 -0.853 -0.393) 1.018 5.876 ( 1.063 3.600 5.488) 6.649 5.911 ( -1.600 -1.689 2.505) 3.419 5.981 ( 2.219 1.148 -1.194) 2.769 6.060 ( -2.090 1.603 6.379) 6.902 6.128 ( -0.159 -2.333 -10.186) 10.451 6.220 ( -5.689 -3.581 -1.431) 6.872 6.325 ( -6.293 -1.024 0.229) 6.380 6.357 ( 0.712 -3.729 -2.815) 4.726 6.368 ( 0.624 0.696 -2.886) 3.034 6.420 ( -2.031 2.997 -2.951) 4.671 6.489 ( -3.917 -0.410 2.431) 4.628 6.522 ( 1.806 0.286 -1.716) 2.508 6.599 ( 2.568 -2.300 9.773) 10.363 6.726 ( 4.617 -2.630 5.092) 7.360 6.797 ( -1.355 -2.844 5.582) 6.409 6.834 ( 0.657 -1.009 -1.000) 1.566 6.961 ( -2.892 -1.503 0.128) 3.262 7.038 ( 1.992 1.746 12.048) 12.336 7.108 ( -2.899 -0.432 3.660) 4.689 7.278 ( -1.638 -8.414 0.851) 8.614 7.341 ( 0.347 -7.767 -0.307) 7.780 7.510 ( -2.941 -2.193 4.357) 5.696 7.549 ( -2.815 -2.156 -1.065) 3.702 7.619 ( -7.103 3.352 -2.535) 8.253 7.676 ( -4.301 2.538 -0.689) 5.041 7.860 ( -2.677 4.410 2.162) 5.593 8.027 ( -6.884 -3.761 3.533) 8.604 8.059 ( -2.243 -2.935 -1.283) 3.911 8.094 ( -1.969 3.823 4.806) 6.449 8.213 ( 2.983 -5.722 6.457) 9.129 8.291 ( -2.009 0.700 0.341) 2.154 8.349 ( -3.003 3.404 -7.016) 8.356 8.394 ( -0.098 1.698 -6.294) 6.520 8.522 ( 3.313 -0.479 1.599) 3.710 8.550 ( 2.008 1.304 -3.140) 3.949 8.728 ( -0.200 -2.573 -4.008) 4.768 8.809 ( 1.935 6.165 2.516) 6.934 8.817 ( 0.105 5.015 -4.940) 7.040 8.945 ( -3.251 2.332 -3.662) 5.423 9.075 ( -1.581 -1.976 1.231) 2.814 9.166 ( 1.059 -0.399 -0.893) 1.441 9.271 ( -2.685 -4.593 8.098) 9.689 9.366 ( -2.346 -1.200 7.948) 8.374 9.502 ( -1.024 0.116 -0.546) 1.166 9.626 ( -3.491 2.629 -5.792) 7.256 10.039 ( -0.755 -3.740 -2.562) 4.596 10.105 ( -0.351 -0.858 -0.248) 0.960 10.248 ( -2.749 1.448 -2.009) 3.700 10.416 ( -1.680 0.326 -6.961) 7.168 10.700 ( -10.212 0.164 -0.444) 10.223 10.855 ( -12.233 7.252 1.856) 14.341 11.002 ( -6.952 -5.473 -12.924) 15.663 11.704 ( 15.365 -6.158 9.933) 19.305 16.464 ( -4.434 0.070 -0.843) 4.514 16.477 ( -4.730 0.024 0.023) 4.730 16.741 ( 3.650 -0.770 0.380) 3.750 16.763 ( 4.273 -0.108 -0.554) 4.310 17.494 ( -0.271 -2.975 -0.073) 2.988 17.554 ( -1.067 -2.673 0.303) 2.894 17.584 ( 1.032 -0.900 -0.576) 1.486 17.650 ( -1.269 -1.436 0.383) 1.954 17.693 ( 3.031 -2.474 0.192) 3.917 17.727 ( 2.084 0.245 0.379) 2.133 17.728 ( 2.376 0.484 1.021) 2.631 17.845 ( 3.884 -3.870 -1.172) 5.607 18.522 ( 0.891 10.931 0.363) 10.973 18.545 ( 1.194 12.471 0.487) 12.538 19.254 ( 2.107 -4.153 -0.391) 4.673 19.307 ( 4.198 -2.878 0.611) 5.127 21.301 ( -1.754 0.086 -0.584) 1.851 21.358 ( 1.159 -0.581 1.463) 1.955 21.439 ( -0.243 -0.298 0.582) 0.698 21.485 ( -0.490 -2.262 -0.946) 2.500 21.953 ( -0.762 0.884 0.130) 1.174 21.979 ( -0.297 1.578 -0.457) 1.670 22.078 ( -1.121 -1.260 2.042) 2.649 22.113 ( -0.464 -0.055 0.720) 0.858 26.962 ( -0.669 0.927 -0.364) 1.200 26.988 ( 0.827 0.907 0.649) 1.388 27.127 ( -0.003 -1.641 -0.127) 1.646 27.136 ( 0.330 -1.256 -0.084) 1.301 27.648 ( -0.144 0.388 -0.007) 0.414 27.693 ( 0.325 1.060 -0.492) 1.213 27.730 ( 1.109 -0.189 0.778) 1.367 27.788 ( 1.235 -0.521 -0.669) 1.498 35.595 ( 1.601 3.038 -0.096) 3.436 35.725 ( 2.144 0.582 -6.077) 6.471 35.774 ( 1.504 2.120 -6.910) 7.383 35.904 ( 5.678 1.310 1.517) 6.022 36.153 ( 0.686 4.399 1.449) 4.682 36.342 ( 8.642 -2.372 5.004) 10.264 36.450 ( -2.921 -3.757 -1.269) 4.925 36.809 ( 5.399 0.465 -0.722) 5.467 37.092 ( -7.353 9.376 4.961) 12.907 37.287 ( -2.557 -1.999 -1.682) 3.656 38.303 ( -13.020 -15.438 4.365) 20.662 38.761 ( -6.238 -28.362 -8.420) 30.236 39.723 ( -10.124 4.977 -3.131) 11.707 39.953 ( -11.119 0.830 2.893) 11.519 40.348 ( 14.730 18.603 0.548) 23.735 40.733 ( 14.050 4.323 0.494) 14.708 ======================= Grid point 79 (37/92) ======================= q-point: (-0.22 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( -23.844 9.324 20.122) 32.563 1.310 ( -10.016 34.824 0.470) 36.239 1.666 ( -15.916 7.350 0.695) 17.545 1.914 ( -2.785 8.101 1.175) 8.647 2.048 ( -3.486 -3.642 -0.838) 5.111 2.289 ( -16.144 12.151 0.171) 20.207 2.331 ( -11.161 4.483 0.809) 12.055 2.386 ( -6.158 -11.959 -1.324) 13.516 2.537 ( -2.275 6.679 -3.575) 7.910 2.731 ( -5.614 1.302 -1.554) 5.969 2.765 ( -5.838 -2.980 -0.983) 6.628 2.939 ( -8.098 -6.964 0.195) 10.682 3.077 ( -7.175 -2.880 -1.535) 7.883 3.297 ( -13.606 -4.939 1.797) 14.586 3.328 ( -6.072 4.997 -3.508) 8.610 3.424 ( -2.874 -5.823 -1.561) 6.679 3.649 ( -3.573 -2.435 2.891) 5.201 3.712 ( 4.994 2.843 -4.584) 7.351 3.837 ( 1.299 0.567 -1.456) 2.032 3.972 ( 5.179 -1.022 -3.097) 6.120 3.991 ( 4.303 -1.774 4.371) 6.385 4.074 ( 1.622 -0.265 -8.054) 8.220 4.182 ( 5.657 3.329 4.668) 8.055 4.229 ( 3.314 7.614 -2.870) 8.786 4.268 ( 8.408 2.639 0.902) 8.858 4.452 ( 4.707 -1.963 -1.238) 5.248 4.547 ( 2.262 -0.515 1.756) 2.910 4.676 ( 2.510 5.422 -1.228) 6.099 4.788 ( -2.836 0.363 -2.827) 4.021 4.911 ( 4.037 5.360 -2.141) 7.044 5.009 ( 0.363 -1.773 3.611) 4.039 5.071 ( 0.941 0.555 2.156) 2.418 5.225 ( -5.903 5.195 0.647) 7.890 5.305 ( -2.225 0.184 -6.798) 7.156 5.332 ( 4.618 3.471 2.604) 6.337 5.441 ( -5.187 3.144 -5.436) 8.145 5.471 ( 1.817 1.150 3.611) 4.203 5.516 ( -5.229 -2.126 4.433) 7.177 5.574 ( 3.184 -7.408 -2.515) 8.446 5.689 ( -5.491 -0.261 1.295) 5.648 5.728 ( -3.776 0.564 5.002) 6.293 5.770 ( -2.764 0.262 -5.540) 6.197 5.832 ( -1.677 0.511 -1.326) 2.198 5.891 ( -2.207 -1.618 2.496) 3.704 5.950 ( 2.522 3.354 -1.420) 4.431 5.976 ( 1.675 -0.636 -5.948) 6.212 6.080 ( 2.908 -1.352 -3.358) 4.643 6.109 ( 1.291 2.263 8.767) 9.146 6.208 ( 0.824 1.936 2.279) 3.102 6.228 ( -3.043 -3.137 0.470) 4.396 6.327 ( -0.709 1.038 -2.189) 2.524 6.372 ( 2.729 -0.131 -0.582) 2.793 6.398 ( 1.174 1.974 -0.699) 2.400 6.486 ( 1.106 -3.496 1.515) 3.968 6.571 ( 5.285 0.459 -1.283) 5.458 6.711 ( -0.772 -5.197 8.257) 9.787 6.756 ( -1.756 -1.576 -0.398) 2.393 6.799 ( -3.873 -1.444 1.711) 4.474 6.878 ( 3.789 -3.112 2.096) 5.332 6.926 ( 0.091 -5.272 -2.937) 6.035 7.026 ( -3.135 -3.157 -1.431) 4.673 7.181 ( -6.470 -4.236 5.831) 9.686 7.216 ( -1.725 -4.109 8.121) 9.264 7.316 ( -9.934 0.504 -9.287) 13.609 7.363 ( -0.010 -3.048 -5.358) 6.164 7.472 ( -2.720 2.690 -0.553) 3.865 7.556 ( -4.490 3.544 4.760) 7.442 7.643 ( -2.184 -1.000 5.551) 6.048 7.779 ( -7.374 2.965 -4.726) 9.246 7.925 ( -5.218 4.192 -9.059) 11.263 7.967 ( -4.961 -3.321 8.803) 10.636 8.060 ( -4.632 -1.351 -2.511) 5.439 8.201 ( -3.535 1.164 -2.292) 4.371 8.286 ( 1.086 4.274 4.053) 5.989 8.345 ( -0.272 -1.213 0.873) 1.519 8.353 ( -0.645 -0.717 2.974) 3.126 8.562 ( 3.920 1.034 -2.188) 4.606 8.613 ( 4.415 -2.851 -2.694) 5.905 8.669 ( -2.845 -0.591 -1.347) 3.203 8.775 ( -0.564 2.089 -5.002) 5.450 8.845 ( 1.523 1.797 -0.664) 2.448 8.962 ( 4.726 11.103 3.006) 12.436 9.069 ( -2.473 -4.667 5.362) 7.526 9.164 ( 0.684 0.365 -2.395) 2.517 9.260 ( -4.330 -4.613 3.739) 7.349 9.357 ( -3.558 -2.110 1.956) 4.576 9.508 ( -1.676 1.732 -8.258) 8.603 9.573 ( 1.857 -2.478 11.924) 12.320 10.020 ( -0.177 -2.974 -0.152) 2.983 10.099 ( -0.579 -3.144 0.162) 3.201 10.200 ( -1.281 2.107 -0.499) 2.516 10.302 ( -3.340 -1.287 -7.302) 8.132 10.509 ( -10.935 0.657 -0.757) 10.981 10.680 ( -9.452 5.349 -4.403) 11.719 10.771 ( -7.200 2.741 -4.103) 8.729 12.021 ( 10.251 -10.452 8.729) 17.045 16.393 ( -2.908 0.048 -0.634) 2.976 16.411 ( -3.273 -0.105 0.547) 3.320 16.803 ( 2.728 -0.609 1.178) 3.033 16.819 ( 2.748 -0.118 -0.378) 2.777 17.482 ( -0.008 -3.020 -0.871) 3.143 17.536 ( -0.401 -2.369 -0.595) 2.475 17.611 ( 1.804 0.566 -0.259) 1.908 17.629 ( -1.257 -0.929 -0.004) 1.563 17.732 ( 2.661 -1.500 -0.749) 3.145 17.771 ( 2.325 -0.937 0.078) 2.508 17.787 ( 2.024 0.255 1.566) 2.571 17.904 ( 3.803 -5.183 -0.622) 6.459 18.551 ( 2.959 12.761 -0.247) 13.102 18.571 ( 1.549 14.507 -0.094) 14.590 19.291 ( 2.408 -4.097 -0.352) 4.765 19.394 ( 5.107 -2.813 0.406) 5.845 21.272 ( -1.236 0.114 -0.169) 1.253 21.389 ( 0.456 -2.026 1.412) 2.511 21.434 ( -0.515 -0.086 0.049) 0.524 21.454 ( -1.637 -2.735 -1.939) 3.731 21.940 ( -0.776 0.721 0.135) 1.068 21.968 ( -0.375 1.773 -0.635) 1.920 22.063 ( -1.129 -0.857 -0.014) 1.418 22.132 ( -0.277 -1.297 3.744) 3.972 26.949 ( -0.503 0.961 -0.196) 1.102 27.010 ( 0.942 1.172 0.527) 1.594 27.117 ( -0.335 -1.517 -0.774) 1.736 27.147 ( 0.460 -1.278 0.332) 1.398 27.656 ( 0.692 0.431 0.687) 1.066 27.695 ( 0.449 0.758 -0.382) 0.960 27.763 ( 1.733 0.169 0.784) 1.910 27.800 ( 0.905 -0.293 -0.657) 1.156 35.626 ( 1.353 3.867 0.107) 4.099 35.713 ( 2.870 1.369 -0.262) 3.191 35.803 ( 6.754 3.319 -5.250) 9.176 36.013 ( 4.621 1.015 2.064) 5.162 36.186 ( 2.435 3.242 -1.062) 4.192 36.384 ( -2.450 -1.520 -0.756) 2.981 36.489 ( 2.843 -0.177 2.631) 3.878 36.823 ( -1.755 3.477 -1.602) 4.212 37.004 ( -7.907 9.051 5.715) 13.308 37.273 ( 3.350 -11.010 -3.757) 12.106 38.134 ( -13.383 -15.240 8.845) 22.127 38.452 ( -19.669 -36.630 -12.776) 43.495 39.548 ( -6.982 4.651 -1.712) 8.562 39.788 ( -9.536 -0.702 1.389) 9.662 40.657 ( 19.488 22.609 0.435) 29.852 40.961 ( 15.010 10.736 -3.985) 18.880 ======================= Grid point 80 (38/92) ======================= q-point: (-0.11 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.860 ( -34.694 8.873 3.980) 36.031 1.001 ( -17.811 16.651 32.279) 40.453 1.482 ( -5.756 44.962 7.539) 45.951 1.870 ( -3.388 7.600 -1.472) 8.450 2.026 ( -2.027 1.454 -0.172) 2.501 2.079 ( -4.350 7.958 0.838) 9.108 2.186 ( -8.516 -6.309 1.849) 10.759 2.223 ( -12.046 -13.188 -4.088) 18.323 2.474 ( -4.858 4.015 2.948) 6.958 2.608 ( -2.914 3.557 -7.765) 9.025 2.620 ( -11.150 6.271 2.913) 13.120 2.847 ( -2.855 -4.442 1.111) 5.396 2.954 ( -6.500 -1.379 -0.816) 6.694 3.138 ( -7.043 -3.341 6.086) 9.889 3.212 ( -6.371 -0.139 2.593) 6.880 3.355 ( -4.045 -4.312 -0.210) 5.916 3.566 ( -3.028 -3.224 -1.809) 4.778 3.749 ( 2.576 2.491 -2.435) 4.333 3.844 ( 1.088 6.525 -4.868) 8.213 3.989 ( 2.091 2.655 2.129) 3.994 4.083 ( 2.096 -2.367 3.911) 5.029 4.129 ( 4.152 -2.658 2.236) 5.413 4.243 ( 1.661 4.424 0.526) 4.755 4.336 ( 8.669 2.682 -2.484) 9.409 4.475 ( 10.045 -3.367 1.517) 10.702 4.571 ( 7.384 -4.184 -0.168) 8.489 4.623 ( 5.135 -1.876 -0.802) 5.525 4.696 ( 1.582 -4.319 -1.632) 4.881 4.730 ( 0.329 -5.441 -2.167) 5.866 4.937 ( 1.920 4.218 1.575) 4.894 5.044 ( -2.491 2.127 1.358) 3.546 5.064 ( -5.101 4.169 -1.761) 6.820 5.124 ( -4.793 5.159 3.100) 7.694 5.213 ( -2.958 3.442 -4.608) 6.468 5.238 ( -5.212 4.220 -3.288) 7.469 5.414 ( -2.854 3.991 -1.629) 5.170 5.443 ( 2.813 4.890 0.381) 5.655 5.491 ( -4.904 -1.730 -2.574) 5.803 5.573 ( -1.670 0.386 -2.509) 3.039 5.602 ( -0.333 -1.705 -2.426) 2.984 5.672 ( -0.094 0.659 -2.671) 2.753 5.727 ( -2.965 0.042 4.784) 5.628 5.810 ( -1.422 1.567 -0.009) 2.116 5.892 ( 0.936 -2.013 1.087) 2.472 5.966 ( 3.908 -2.498 -3.114) 5.587 5.989 ( 4.114 2.675 -3.077) 5.792 6.101 ( 2.641 0.305 -2.560) 3.690 6.165 ( -3.907 0.121 1.822) 4.312 6.201 ( -1.437 -0.740 2.795) 3.229 6.266 ( 2.866 -1.856 4.888) 5.962 6.362 ( 1.058 2.663 2.319) 3.687 6.399 ( -0.017 -0.349 0.339) 0.487 6.411 ( 1.426 1.788 -0.971) 2.485 6.514 ( 1.407 -9.840 -2.120) 10.163 6.635 ( -4.442 -1.996 -5.202) 7.126 6.659 ( 3.762 1.227 -2.701) 4.791 6.722 ( -0.946 -2.287 1.701) 3.003 6.774 ( -1.707 -0.667 0.766) 1.986 6.887 ( 2.334 -1.800 -0.417) 2.977 6.955 ( -6.655 -1.012 -7.765) 10.276 6.997 ( 2.179 -5.093 2.616) 6.126 7.070 ( -5.012 -2.211 1.001) 5.569 7.118 ( -4.431 -2.954 3.077) 6.150 7.191 ( -4.091 0.426 -3.524) 5.416 7.365 ( 0.983 -3.169 -2.834) 4.364 7.418 ( -3.236 1.246 4.440) 5.634 7.483 ( -6.612 1.704 -3.172) 7.528 7.627 ( -8.637 3.647 0.266) 9.379 7.644 ( 2.605 -4.756 -3.105) 6.249 7.749 ( -4.747 -1.163 -5.107) 7.068 7.939 ( -3.381 0.236 -5.966) 6.862 8.010 ( -0.870 2.723 7.001) 7.562 8.163 ( 0.427 1.530 0.541) 1.678 8.347 ( 0.663 -2.827 -2.419) 3.779 8.357 ( -0.931 2.722 8.804) 9.262 8.388 ( 0.332 2.866 5.627) 6.324 8.558 ( 0.630 -1.081 -4.021) 4.211 8.630 ( 1.071 1.557 -0.211) 1.901 8.682 ( 3.063 -1.856 -0.284) 3.593 8.714 ( -0.248 -0.505 -3.098) 3.149 8.895 ( 3.682 -0.619 1.897) 4.188 9.017 ( -2.397 2.082 2.611) 4.110 9.046 ( -4.086 0.894 -1.717) 4.521 9.181 ( 0.831 -2.004 -0.804) 2.313 9.277 ( 3.703 0.675 6.119) 7.184 9.310 ( -2.400 -0.726 1.317) 2.832 9.433 ( 4.233 5.109 -7.950) 10.355 9.720 ( -2.863 -4.337 16.381) 17.186 10.002 ( -3.161 -5.047 -0.345) 5.965 10.081 ( -1.489 -3.975 0.333) 4.258 10.190 ( -1.759 -2.086 -2.006) 3.387 10.205 ( -0.250 -0.266 2.588) 2.613 10.343 ( -5.392 3.199 -2.246) 6.660 10.500 ( -3.021 4.794 -6.722) 8.791 10.676 ( -3.587 7.741 0.736) 8.563 12.111 ( -4.591 -14.479 -8.663) 17.486 16.355 ( -1.075 0.021 -0.191) 1.092 16.373 ( -1.857 -0.147 0.500) 1.929 16.846 ( 0.886 -0.825 0.648) 1.374 16.849 ( 1.060 -0.562 -0.273) 1.231 17.503 ( 2.115 -1.978 -0.080) 2.897 17.531 ( 0.942 -1.288 0.363) 1.636 17.610 ( -0.402 -0.254 -0.478) 0.674 17.637 ( 1.190 0.538 0.250) 1.330 17.768 ( 2.059 -0.478 -0.579) 2.191 17.799 ( 1.276 -1.140 -0.693) 1.846 17.823 ( 0.455 -0.671 1.781) 1.957 17.954 ( 2.454 -6.364 -0.560) 6.844 18.590 ( 1.141 14.940 -0.421) 14.989 18.636 ( 8.111 16.435 -3.555) 18.669 19.336 ( 2.501 -4.243 2.176) 5.384 19.473 ( 3.449 -2.962 -0.177) 4.550 21.254 ( -0.757 -0.003 -0.020) 0.758 21.342 ( -6.018 -4.533 -2.546) 7.953 21.423 ( -0.374 -0.094 -0.165) 0.420 21.431 ( 0.280 -0.107 0.033) 0.301 21.930 ( -0.521 0.632 0.113) 0.827 21.958 ( 0.300 1.753 -1.027) 2.053 22.049 ( -0.304 -0.242 -0.240) 0.457 22.139 ( -2.860 -3.606 0.657) 4.649 26.943 ( -0.149 0.914 0.255) 0.961 27.023 ( 0.339 1.507 -0.628) 1.667 27.110 ( 0.092 -1.664 0.217) 1.681 27.158 ( 0.566 -0.680 0.192) 0.905 27.680 ( 0.680 0.361 1.200) 1.425 27.702 ( 0.569 0.313 -0.185) 0.675 27.796 ( 1.057 0.625 0.684) 1.405 27.810 ( 0.929 0.271 -0.422) 1.056 35.664 ( 3.568 6.548 -2.872) 7.991 35.791 ( 3.707 1.954 1.975) 4.632 35.957 ( 10.378 1.301 9.148) 13.896 36.103 ( 4.944 -1.282 6.316) 8.122 36.202 ( 1.066 1.135 -2.110) 2.622 36.354 ( -0.799 1.539 0.145) 1.740 36.511 ( -0.662 5.867 2.722) 6.501 36.780 ( -1.485 -0.448 1.407) 2.094 36.970 ( -1.728 7.770 7.649) 11.040 37.264 ( -2.520 -18.452 -5.123) 19.315 37.784 ( -38.435 -32.357 2.584) 50.309 38.101 ( -6.326 -13.650 4.972) 15.844 39.461 ( -2.903 4.302 0.972) 5.280 39.671 ( -5.299 -0.594 1.282) 5.485 40.923 ( 9.956 10.579 -3.197) 14.874 41.217 ( 26.887 26.116 -19.853) 42.416 ======================= Grid point 81 (39/92) ======================= q-point: ( 0.00 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.917 ( 6.000 18.354 9.219) 21.398 1.517 ( 3.588 10.705 16.218) 19.761 1.613 ( -12.017 1.548 11.410) 16.643 1.934 ( -1.823 -2.294 -1.462) 3.275 1.969 ( 2.389 -0.552 -0.780) 2.573 2.063 ( -1.249 2.542 -1.682) 3.293 2.094 ( 0.585 0.977 1.112) 1.592 2.346 ( 1.237 -6.585 3.226) 7.437 2.540 ( -0.191 0.140 1.326) 1.347 2.684 ( 1.733 -0.083 10.488) 10.630 2.780 ( -3.928 12.599 0.845) 13.225 2.850 ( 1.040 7.535 -0.582) 7.628 2.934 ( 1.845 20.713 6.907) 21.912 3.073 ( -5.580 0.071 1.295) 5.728 3.253 ( 4.407 4.899 -2.520) 7.055 3.263 ( 1.865 6.254 0.912) 6.589 3.568 ( 3.851 -1.338 2.990) 5.056 3.737 ( 0.205 -0.369 -6.588) 6.602 3.920 ( -1.562 1.453 1.421) 2.563 4.014 ( -0.581 -2.144 -1.468) 2.662 4.091 ( -3.982 -3.087 -1.400) 5.229 4.198 ( 4.057 5.401 2.521) 7.210 4.325 ( 0.664 -3.309 -1.501) 3.694 4.400 ( -0.107 1.238 0.507) 1.342 4.491 ( -0.240 -0.566 2.304) 2.384 4.540 ( 0.028 -3.180 2.527) 4.062 4.586 ( 1.282 -0.540 1.307) 1.909 4.634 ( 7.184 -3.377 -0.900) 7.989 4.747 ( 0.712 -5.360 6.069) 8.128 4.932 ( -0.977 5.726 -3.837) 6.962 5.017 ( -3.686 -6.617 2.981) 8.140 5.061 ( -2.214 3.119 -5.477) 6.681 5.226 ( 3.014 4.881 1.167) 5.854 5.314 ( -2.823 9.903 1.660) 10.430 5.362 ( 0.860 -0.158 0.570) 1.043 5.391 ( 0.071 5.817 -1.648) 6.047 5.453 ( -5.308 0.844 -4.940) 7.300 5.509 ( 3.548 3.047 2.946) 5.527 5.552 ( -0.937 0.468 -5.117) 5.223 5.659 ( -0.403 1.557 0.151) 1.615 5.664 ( 0.280 3.769 0.226) 3.786 5.711 ( -1.480 2.602 -0.168) 2.998 5.809 ( 0.148 0.554 -1.876) 1.962 5.868 ( -0.082 -0.372 -0.279) 0.472 5.950 ( 2.971 -3.236 -0.219) 4.399 6.030 ( 3.704 -3.375 -3.969) 6.393 6.068 ( 2.279 -4.976 -0.703) 5.518 6.111 ( -0.607 0.818 -4.858) 4.963 6.161 ( -0.229 -5.376 0.687) 5.424 6.299 ( -0.178 -1.376 0.937) 1.674 6.317 ( 0.782 -1.253 -1.205) 1.906 6.402 ( 1.535 -1.132 0.654) 2.016 6.436 ( -2.750 -0.034 1.080) 2.955 6.445 ( -0.677 0.306 1.671) 1.829 6.510 ( -3.164 -2.737 -5.175) 6.654 6.580 ( 1.842 -6.403 -4.514) 8.048 6.701 ( -1.994 -1.212 -3.427) 4.146 6.763 ( -0.793 -2.033 0.616) 2.267 6.825 ( -4.691 -3.187 -1.870) 5.971 6.851 ( -3.292 -2.238 -0.628) 4.030 6.940 ( -2.983 -0.614 1.189) 3.269 6.975 ( -0.050 1.500 -3.442) 3.755 7.078 ( 7.853 2.266 0.440) 8.185 7.224 ( 2.034 -3.499 3.786) 5.542 7.262 ( -0.013 -5.545 -5.647) 7.914 7.311 ( -2.718 3.681 -8.823) 9.939 7.375 ( 2.044 -2.616 -1.682) 3.721 7.465 ( -1.134 -0.916 -1.010) 1.774 7.676 ( 1.528 1.598 1.510) 2.677 7.724 ( 4.429 0.754 0.583) 4.530 7.898 ( -2.612 3.939 -6.580) 8.101 8.036 ( -3.567 -0.820 -0.771) 3.741 8.185 ( -1.939 -3.939 -2.599) 5.102 8.219 ( 1.073 -2.478 3.327) 4.284 8.503 ( -1.303 5.487 4.726) 7.357 8.543 ( 0.644 5.796 1.230) 5.960 8.590 ( -0.003 1.153 1.590) 1.964 8.631 ( -0.936 0.609 6.685) 6.777 8.731 ( 4.666 -0.005 4.094) 6.207 8.768 ( 2.767 -0.438 0.010) 2.802 8.841 ( -2.585 -4.975 -0.216) 5.611 8.942 ( -2.210 -2.984 7.503) 8.372 9.014 ( -1.324 2.256 -3.517) 4.383 9.112 ( -0.492 -2.213 -1.681) 2.822 9.290 ( -1.895 4.363 0.211) 4.761 9.375 ( 0.368 2.710 2.881) 3.972 9.554 ( 2.759 -6.420 1.941) 7.253 9.608 ( -1.928 -6.786 3.674) 7.953 9.940 ( 0.151 1.188 3.232) 3.447 10.026 ( -0.160 -2.287 2.901) 3.698 10.164 ( 0.694 0.459 2.531) 2.664 10.240 ( 3.304 -2.788 5.231) 6.786 10.363 ( 1.212 3.291 -1.212) 3.711 10.496 ( 5.240 -3.886 0.939) 6.591 10.905 ( -1.204 17.806 -6.373) 18.950 11.591 ( -5.438 -13.208 -18.233) 23.162 16.350 ( 0.171 -0.038 0.333) 0.376 16.353 ( -0.222 -0.153 0.238) 0.360 16.833 ( -0.438 -0.736 -0.283) 0.902 16.836 ( 0.006 -0.849 -0.259) 0.887 17.472 ( -0.039 -1.099 -0.178) 1.114 17.498 ( -0.308 -2.170 -0.006) 2.192 17.641 ( -0.172 1.019 0.788) 1.300 17.662 ( -0.072 0.046 0.803) 0.807 17.771 ( 0.951 -0.647 -1.221) 1.678 17.783 ( 0.589 -1.118 -0.726) 1.458 17.822 ( -0.809 0.131 0.787) 1.136 17.877 ( 0.144 -3.080 -0.299) 3.098 18.879 ( 0.287 12.228 0.185) 12.233 18.967 ( 0.084 14.332 -3.669) 14.794 19.266 ( 0.488 -7.957 2.500) 8.355 19.396 ( -0.447 -6.927 -1.589) 7.121 21.245 ( -0.074 0.437 0.123) 0.460 21.257 ( -0.050 -0.067 -0.254) 0.267 21.420 ( 0.143 -0.005 -0.020) 0.145 21.426 ( -0.045 -0.287 -0.174) 0.338 21.942 ( -0.048 0.963 0.214) 0.987 21.971 ( 0.402 -0.166 -0.517) 0.676 22.050 ( -0.553 0.098 -0.712) 0.907 22.053 ( -0.769 -0.025 -0.385) 0.860 26.973 ( 0.126 1.772 0.351) 1.811 27.034 ( -0.519 0.384 -1.773) 1.887 27.098 ( 0.642 -0.547 1.458) 1.685 27.146 ( -0.232 -1.285 -0.311) 1.343 27.697 ( -0.509 0.408 0.868) 1.086 27.708 ( 0.039 -0.133 0.435) 0.457 27.816 ( -0.579 0.776 0.162) 0.981 27.828 ( 0.122 0.301 -0.258) 0.415 35.790 ( -0.233 4.516 -0.193) 4.526 35.866 ( -1.236 0.942 0.228) 1.571 36.068 ( 0.823 1.836 0.855) 2.186 36.216 ( 0.077 -2.505 9.544) 9.867 36.351 ( 6.333 6.119 0.954) 8.858 36.432 ( 1.609 4.154 0.852) 4.535 36.613 ( -1.223 -1.865 5.446) 5.885 36.704 ( -3.973 -6.079 0.074) 7.262 36.785 ( 0.077 1.577 -1.937) 2.499 37.162 ( -6.391 -13.611 -3.862) 15.524 37.303 ( 6.767 2.755 13.688) 15.516 37.777 ( 0.269 -17.617 3.946) 18.055 39.545 ( 0.377 3.611 3.574) 5.095 39.625 ( -0.327 -0.817 2.405) 2.561 41.150 ( 0.095 10.814 -6.194) 12.463 41.451 ( 1.478 -1.105 -18.180) 18.273 ======================= Grid point 82 (40/92) ======================= q-point: ( 0.11 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 20.826 10.624 7.751) 24.631 1.664 ( 18.137 -2.040 -8.242) 20.026 1.729 ( -3.826 12.849 24.015) 27.504 1.905 ( 1.408 0.637 0.710) 1.701 2.018 ( 0.413 0.920 0.438) 1.099 2.053 ( 3.868 6.588 -0.745) 7.676 2.117 ( 3.997 -6.444 4.178) 8.657 2.525 ( 7.692 -8.393 3.005) 11.774 2.572 ( 4.730 0.808 4.943) 6.889 2.756 ( 2.361 13.643 -3.830) 14.365 2.808 ( 2.418 19.551 6.363) 20.702 2.971 ( 9.637 0.409 4.647) 10.707 3.042 ( 3.679 10.557 5.165) 12.316 3.127 ( 3.065 -8.294 11.569) 14.561 3.263 ( 4.611 3.788 -4.658) 7.570 3.387 ( 7.326 4.808 -1.035) 8.824 3.637 ( 0.711 -4.930 1.056) 5.092 3.711 ( 3.875 -0.440 -3.668) 5.354 3.858 ( -5.113 0.346 -0.083) 5.125 3.964 ( -5.072 -1.223 -0.704) 5.264 4.034 ( 0.610 -0.709 0.631) 1.129 4.227 ( 1.279 -2.912 -6.048) 6.833 4.277 ( -5.800 2.040 0.275) 6.154 4.431 ( -1.063 1.535 3.030) 3.559 4.478 ( -2.895 -2.138 -0.277) 3.610 4.535 ( -2.609 4.727 3.167) 6.259 4.610 ( 0.103 0.919 0.713) 1.168 4.634 ( -3.534 1.626 0.018) 3.890 4.781 ( 3.524 1.999 1.892) 4.471 4.894 ( 0.184 5.366 -5.070) 7.385 5.082 ( 7.484 0.943 -4.262) 8.664 5.140 ( 7.909 -5.456 7.648) 12.280 5.218 ( -4.063 -0.228 2.508) 4.780 5.245 ( -2.833 5.077 -6.815) 8.958 5.289 ( -3.635 -0.468 -5.563) 6.662 5.379 ( 1.711 2.327 0.197) 2.895 5.449 ( -0.433 -2.773 -0.965) 2.968 5.554 ( 6.006 4.706 -1.536) 7.783 5.564 ( -0.410 7.073 1.892) 7.333 5.639 ( -1.773 -0.902 2.081) 2.879 5.658 ( 0.086 4.378 1.928) 4.785 5.723 ( 0.988 3.887 -0.650) 4.063 5.790 ( -0.607 3.519 -2.634) 4.437 5.865 ( 0.881 2.292 0.761) 2.571 5.928 ( -1.228 0.404 -8.783) 8.877 5.986 ( -1.282 -4.130 -4.421) 6.184 6.102 ( 2.428 -3.963 0.935) 4.741 6.128 ( -4.106 -2.902 0.725) 5.080 6.160 ( 4.291 -5.217 3.869) 7.785 6.272 ( 0.848 -3.455 -1.603) 3.902 6.322 ( -0.249 0.483 2.319) 2.382 6.369 ( -1.972 -2.228 -5.008) 5.825 6.408 ( 0.426 -1.869 -1.059) 2.190 6.437 ( -1.572 -0.033 -1.368) 2.084 6.512 ( 2.616 -4.265 1.185) 5.142 6.591 ( 4.471 -8.636 -2.011) 9.930 6.654 ( -4.063 0.153 0.354) 4.081 6.732 ( 1.892 -1.220 1.456) 2.681 6.756 ( -4.119 -1.478 -2.035) 4.826 6.848 ( -0.529 -1.197 -3.320) 3.569 6.894 ( 0.448 -3.039 3.748) 4.846 6.947 ( -2.020 -2.023 0.221) 2.867 7.095 ( -4.712 5.058 -5.532) 8.854 7.248 ( 2.983 -0.030 -2.668) 4.002 7.272 ( 3.933 -1.424 -3.027) 5.163 7.305 ( 7.880 -2.245 -1.505) 8.331 7.365 ( 2.012 -3.016 -8.343) 9.097 7.475 ( 4.160 -3.404 -4.846) 7.237 7.750 ( 4.343 3.794 2.996) 6.499 7.803 ( 0.312 1.199 -6.608) 6.723 7.909 ( 8.819 -0.690 5.995) 10.686 7.939 ( -3.250 -3.344 -3.888) 6.071 8.162 ( -0.552 -0.637 2.123) 2.285 8.277 ( 1.228 -2.055 3.455) 4.203 8.498 ( -2.086 6.250 3.811) 7.611 8.545 ( -0.329 -0.388 -1.140) 1.248 8.582 ( -0.470 0.471 -1.438) 1.585 8.729 ( 0.126 4.659 6.792) 8.238 8.780 ( -0.045 1.065 1.412) 1.769 8.794 ( -1.435 -0.735 -0.931) 1.862 8.826 ( 2.595 -0.021 3.784) 4.588 8.963 ( 0.401 1.784 4.851) 5.184 8.992 ( 0.392 0.228 -2.650) 2.689 9.110 ( 0.602 -2.097 -1.449) 2.619 9.276 ( -0.656 1.602 1.629) 2.377 9.404 ( -1.906 2.847 3.811) 5.125 9.499 ( -2.242 -3.157 -0.734) 3.941 9.712 ( 3.046 -8.154 6.031) 10.589 9.982 ( 0.698 2.111 2.987) 3.723 10.066 ( 1.885 -1.597 3.049) 3.924 10.215 ( 2.159 1.790 1.956) 3.419 10.330 ( 4.581 -1.954 0.244) 4.986 10.419 ( 4.936 4.194 0.550) 6.501 10.641 ( 6.536 -1.488 -2.943) 7.321 10.910 ( 6.852 4.277 6.291) 10.239 11.341 ( -0.546 -9.328 -21.795) 23.713 16.362 ( 1.330 0.182 0.119) 1.348 16.372 ( 1.801 -0.279 0.475) 1.883 16.814 ( -1.511 -0.630 -0.063) 1.639 16.828 ( -0.708 -1.213 -0.179) 1.416 17.470 ( -0.278 -1.110 0.499) 1.249 17.491 ( -0.209 -1.715 -0.276) 1.749 17.633 ( -1.507 0.026 1.329) 2.010 17.649 ( -2.001 -0.196 0.509) 2.074 17.766 ( -0.463 -0.254 -1.259) 1.365 17.771 ( -0.884 -0.330 -1.745) 1.984 17.808 ( -1.827 0.151 1.157) 2.168 17.866 ( -1.174 -3.047 -0.170) 3.270 18.862 ( -2.492 12.982 0.405) 13.225 18.902 ( -3.381 14.980 -2.513) 15.561 19.271 ( -2.679 -8.043 2.470) 8.830 19.339 ( -3.696 -7.258 -2.135) 8.420 21.256 ( 1.053 0.190 -0.021) 1.070 21.273 ( 1.894 -0.587 -0.546) 2.057 21.425 ( 0.336 -0.107 -0.066) 0.359 21.428 ( 0.398 -0.198 -0.089) 0.453 21.949 ( 0.531 1.057 0.282) 1.216 21.978 ( 1.059 -0.108 -0.857) 1.367 22.024 ( -0.649 1.291 -0.065) 1.447 22.065 ( 1.160 -0.627 -0.152) 1.327 26.981 ( 0.229 1.594 0.511) 1.690 27.011 ( -0.338 0.803 -1.333) 1.593 27.113 ( -0.486 -1.085 0.803) 1.434 27.130 ( -0.822 -1.276 -0.240) 1.537 27.691 ( -0.979 0.599 0.883) 1.449 27.711 ( -0.210 -0.265 0.460) 0.570 27.797 ( -1.577 1.078 0.052) 1.911 27.821 ( -0.713 0.020 0.104) 0.721 35.786 ( -1.048 2.311 2.384) 3.482 35.815 ( -3.992 0.706 0.278) 4.064 36.053 ( -2.928 5.850 0.300) 6.548 36.252 ( -2.232 3.300 2.926) 4.943 36.357 ( -4.103 1.818 1.624) 4.773 36.471 ( -1.312 3.871 1.880) 4.499 36.511 ( -9.287 -1.979 2.640) 9.856 36.791 ( 5.664 3.911 0.812) 6.931 36.935 ( 15.005 -3.086 2.097) 15.462 37.020 ( -2.890 -11.614 -7.719) 14.241 37.557 ( 6.557 -10.388 9.029) 15.246 37.922 ( 12.272 -21.843 5.092) 25.567 39.622 ( 4.089 3.213 4.399) 6.811 39.678 ( 3.820 -0.023 1.957) 4.292 41.020 ( -8.090 10.466 -6.599) 14.783 41.206 ( -9.341 3.391 -14.303) 17.416 ======================= Grid point 83 (41/92) ======================= q-point: ( 0.22 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( 11.143 7.217 5.779) 14.479 1.759 ( -4.812 0.895 6.693) 8.291 1.903 ( 6.248 5.434 0.161) 8.282 1.994 ( -0.770 -0.818 0.570) 1.260 2.061 ( 18.331 0.241 -4.747) 18.938 2.182 ( 4.478 12.664 8.278) 15.778 2.360 ( 15.345 -2.298 1.427) 15.581 2.564 ( 2.960 0.644 -0.032) 3.029 2.766 ( 6.564 2.972 3.793) 8.143 2.835 ( 8.858 1.912 -2.621) 9.433 2.921 ( 1.551 8.690 8.272) 12.097 3.080 ( 2.146 10.874 1.009) 11.130 3.175 ( 6.992 -0.789 0.448) 7.051 3.293 ( 4.953 -0.172 -6.634) 8.281 3.325 ( 4.241 -9.011 9.720) 13.917 3.470 ( 6.225 0.447 -2.347) 6.668 3.663 ( 1.587 -9.322 0.552) 9.473 3.772 ( 2.341 1.128 -2.776) 3.803 3.778 ( 1.085 -1.767 0.558) 2.148 3.933 ( -1.356 2.641 4.889) 5.719 4.053 ( -1.653 2.002 -3.626) 4.460 4.137 ( -4.164 -5.362 -4.049) 7.904 4.175 ( -4.716 1.893 3.176) 5.992 4.342 ( -5.315 2.616 -2.484) 6.423 4.473 ( -1.435 5.972 1.958) 6.446 4.511 ( 3.352 4.273 5.189) 7.511 4.623 ( 0.063 -2.183 -3.517) 4.140 4.666 ( -0.543 3.269 -4.365) 5.481 4.815 ( 6.690 5.056 2.616) 8.785 4.902 ( 0.394 9.607 -2.450) 9.922 5.093 ( -3.895 -2.490 -2.596) 5.302 5.120 ( -1.559 1.090 -9.632) 9.819 5.145 ( -0.806 3.297 -2.778) 4.386 5.188 ( -1.256 4.145 0.941) 4.432 5.358 ( 0.843 -0.974 3.110) 3.366 5.390 ( 2.886 -1.890 -2.861) 4.482 5.480 ( 3.325 -6.698 4.327) 8.639 5.536 ( -4.441 -1.737 3.972) 6.206 5.589 ( -0.504 5.946 -0.082) 5.968 5.648 ( -1.578 6.169 -0.766) 6.413 5.694 ( 1.756 5.785 -0.837) 6.103 5.728 ( 5.296 4.137 -0.079) 6.720 5.776 ( 2.299 3.399 -2.903) 5.026 5.864 ( 0.471 0.903 -1.103) 1.501 5.905 ( 2.487 1.472 2.087) 3.565 5.979 ( 0.787 -2.336 -0.238) 2.476 6.076 ( -4.740 3.630 2.312) 6.402 6.158 ( 3.671 -4.292 -0.232) 5.652 6.240 ( 5.190 -2.049 -3.856) 6.782 6.277 ( 0.567 -2.254 -1.051) 2.550 6.294 ( -1.237 -2.742 -4.991) 5.827 6.336 ( -1.915 -3.683 -1.203) 4.322 6.404 ( -0.701 -3.244 -0.471) 3.352 6.445 ( 4.226 -0.652 0.842) 4.358 6.540 ( 0.144 -1.568 2.101) 2.626 6.574 ( -4.500 0.436 4.925) 6.685 6.663 ( -2.909 0.515 -3.397) 4.502 6.695 ( 2.684 -2.806 4.789) 6.165 6.788 ( -3.475 -2.084 1.701) 4.394 6.826 ( 3.865 -5.052 1.207) 6.474 6.907 ( 2.256 -3.125 0.959) 3.972 6.980 ( -2.058 4.035 -1.889) 4.908 7.008 ( 4.935 -7.136 -0.635) 8.700 7.208 ( -2.192 -5.807 -6.123) 8.718 7.257 ( -0.813 -5.746 -3.261) 6.657 7.338 ( 3.918 -8.782 -5.295) 10.978 7.477 ( 7.186 4.232 0.378) 8.349 7.530 ( 6.921 1.949 -1.150) 7.282 7.722 ( -2.344 -3.148 -4.056) 5.645 7.807 ( -0.985 -4.714 -5.577) 7.369 7.902 ( 5.815 4.903 1.750) 7.805 8.147 ( 8.410 2.750 3.646) 9.570 8.188 ( 1.234 -2.650 3.206) 4.339 8.290 ( -2.174 0.231 0.616) 2.272 8.502 ( -0.917 3.718 0.667) 3.887 8.540 ( 0.933 0.692 0.613) 1.313 8.564 ( -0.423 -0.563 0.455) 0.838 8.717 ( -2.022 1.396 0.108) 2.459 8.771 ( 1.316 2.498 -2.411) 3.713 8.811 ( 0.164 0.069 1.584) 1.594 8.934 ( 1.751 3.418 4.964) 6.276 8.968 ( -0.418 3.768 1.845) 4.216 9.040 ( 1.085 -1.451 4.833) 5.161 9.112 ( 4.243 4.369 -4.335) 7.476 9.277 ( -0.455 -1.297 -0.283) 1.403 9.368 ( -3.178 -1.246 2.688) 4.345 9.527 ( 3.177 2.536 0.677) 4.121 9.785 ( -0.405 -4.101 5.468) 6.847 10.019 ( 0.938 0.182 2.075) 2.284 10.127 ( 1.479 -1.603 2.552) 3.357 10.258 ( 1.391 2.125 -0.294) 2.557 10.406 ( 4.363 -2.172 -2.228) 5.359 10.539 ( 10.383 4.462 -1.598) 11.414 10.666 ( 6.886 2.907 -8.774) 11.526 11.171 ( 4.193 -6.840 -2.371) 8.366 11.214 ( 7.469 -9.241 2.929) 12.238 16.401 ( 3.279 0.416 -0.064) 3.305 16.421 ( 3.317 -0.469 0.425) 3.377 16.782 ( -2.423 -0.657 0.455) 2.551 16.805 ( -2.055 -1.569 0.015) 2.586 17.470 ( -0.346 -1.421 0.455) 1.532 17.488 ( 0.075 -1.155 -0.284) 1.192 17.614 ( -2.027 -0.390 0.880) 2.244 17.624 ( -1.276 -0.587 1.284) 1.903 17.718 ( -2.915 0.433 -2.154) 3.650 17.729 ( -2.110 -0.093 -2.051) 2.944 17.786 ( -2.109 -0.033 1.517) 2.598 17.837 ( -2.045 -2.759 -0.015) 3.435 18.811 ( -3.558 13.418 0.553) 13.893 18.823 ( -3.392 13.756 -1.603) 14.258 19.223 ( -4.465 -7.422 0.721) 8.692 19.252 ( -4.188 -7.574 -0.728) 8.685 21.281 ( 1.773 -0.141 0.066) 1.780 21.296 ( 1.411 -0.686 -0.477) 1.640 21.427 ( -0.057 -0.029 -0.174) 0.185 21.438 ( 0.920 -0.570 -0.118) 1.089 21.964 ( 0.856 1.212 0.330) 1.520 21.989 ( 1.226 0.449 -1.181) 1.760 22.025 ( 0.201 1.060 0.711) 1.292 22.086 ( 1.066 -1.369 0.405) 1.782 26.984 ( -0.183 1.259 -0.324) 1.313 27.006 ( 0.442 1.209 0.295) 1.321 27.092 ( -1.413 -1.292 -0.536) 1.988 27.125 ( -0.315 -1.654 0.362) 1.722 27.684 ( -0.654 0.703 0.937) 1.341 27.708 ( -0.435 -0.341 0.183) 0.582 27.768 ( -1.829 1.430 0.193) 2.330 27.807 ( -1.095 -0.325 0.149) 1.152 35.757 ( -3.016 1.578 1.305) 3.645 35.799 ( -0.183 -0.818 1.674) 1.872 35.994 ( -3.593 7.990 -0.174) 8.762 36.164 ( -6.626 6.638 -3.182) 9.905 36.304 ( -7.034 -2.771 4.348) 8.721 36.340 ( -8.706 -0.216 -1.846) 8.902 36.468 ( -3.969 -2.097 5.535) 7.127 36.735 ( -6.274 -6.882 -7.694) 12.080 37.066 ( 10.821 6.369 -0.727) 12.578 37.235 ( 15.191 6.103 3.651) 16.773 37.727 ( 9.284 -14.407 1.918) 17.246 38.191 ( 12.834 -26.388 1.841) 29.401 39.751 ( 6.575 3.238 2.101) 7.624 39.791 ( 8.165 1.039 1.173) 8.314 40.777 ( -12.914 10.767 -4.095) 17.305 40.931 ( -11.740 3.461 -5.952) 13.610 ======================= Grid point 84 (42/92) ======================= q-point: ( 0.33 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -1.378 -0.280 -1.186) 1.839 1.847 ( 3.489 -1.700 3.830) 5.453 1.971 ( -0.062 1.694 0.122) 1.700 1.998 ( 3.205 -0.098 1.311) 3.464 2.238 ( -0.603 16.031 5.198) 16.864 2.386 ( 16.231 1.549 -4.383) 16.884 2.511 ( 5.677 12.724 -1.383) 14.002 2.665 ( 2.982 -1.086 5.630) 6.463 2.864 ( 4.799 -2.566 -8.900) 10.431 2.903 ( 0.852 -5.061 -0.889) 5.209 2.989 ( -2.232 4.666 7.477) 9.092 3.125 ( 1.324 5.654 -0.945) 5.883 3.245 ( 6.755 -1.604 -0.809) 6.990 3.319 ( 3.067 -2.961 -7.595) 8.709 3.457 ( 5.310 -3.357 7.030) 9.428 3.600 ( 9.241 -1.629 -3.003) 9.852 3.679 ( 0.891 -5.250 1.426) 5.513 3.774 ( 0.597 2.471 -3.717) 4.503 3.844 ( 5.864 -5.076 -5.735) 9.646 3.906 ( -1.829 8.416 -6.447) 10.759 3.955 ( -2.960 -0.929 3.866) 4.957 4.104 ( -1.989 -2.507 3.741) 4.923 4.139 ( -4.366 3.502 2.219) 6.021 4.300 ( 3.035 3.240 1.450) 4.671 4.435 ( -3.981 -1.374 -4.558) 6.206 4.560 ( -0.635 0.964 -8.603) 8.680 4.604 ( 0.908 5.908 7.231) 9.381 4.714 ( 3.729 -0.129 3.243) 4.943 4.821 ( -2.159 3.452 -5.296) 6.680 4.888 ( 1.046 -0.309 -8.498) 8.568 5.004 ( -0.507 4.309 1.081) 4.471 5.105 ( 0.379 7.202 5.153) 8.864 5.153 ( 6.966 6.141 -0.727) 9.315 5.207 ( -1.149 2.419 1.574) 3.107 5.379 ( -1.766 -2.715 5.467) 6.355 5.414 ( 2.084 -0.707 -0.810) 2.345 5.476 ( -1.150 -1.641 -0.155) 2.010 5.519 ( -0.601 2.847 -2.037) 3.552 5.600 ( -0.870 1.926 2.299) 3.122 5.669 ( 1.841 6.637 2.194) 7.228 5.691 ( -0.874 4.617 -1.638) 4.977 5.791 ( 3.296 6.463 -3.002) 7.851 5.808 ( 1.750 2.810 0.817) 3.409 5.860 ( 0.461 -1.782 0.319) 1.868 5.962 ( -1.382 -0.179 0.532) 1.492 6.022 ( 3.174 3.151 3.821) 5.883 6.031 ( -0.367 2.435 0.259) 2.476 6.117 ( -7.356 -0.474 -3.694) 8.245 6.234 ( 1.258 -2.291 -2.284) 3.471 6.255 ( -0.196 -2.247 -2.229) 3.171 6.282 ( 2.195 -5.757 -3.398) 7.036 6.329 ( 1.859 0.321 1.361) 2.326 6.415 ( 3.061 -3.230 -1.514) 4.700 6.482 ( 0.156 -3.003 -3.127) 4.338 6.544 ( -1.904 2.906 2.805) 4.465 6.593 ( -0.848 0.564 4.320) 4.438 6.636 ( 0.252 0.688 2.859) 2.951 6.763 ( -0.268 -1.433 3.230) 3.544 6.789 ( 0.526 -0.721 5.704) 5.773 6.849 ( 1.013 -1.563 -3.567) 4.024 6.932 ( -1.230 -9.014 5.010) 10.385 7.048 ( 7.602 -2.988 0.302) 8.174 7.086 ( -3.140 -5.130 -4.133) 7.298 7.106 ( 2.760 -5.507 1.808) 6.420 7.253 ( 1.510 -6.718 2.893) 7.468 7.341 ( 1.346 -9.029 -4.591) 10.218 7.546 ( 1.870 1.356 0.700) 2.414 7.643 ( 1.193 -2.833 -1.464) 3.405 7.669 ( 1.712 -0.029 3.717) 4.092 7.789 ( 1.729 -7.374 1.439) 7.709 8.018 ( 5.969 7.128 -1.812) 9.472 8.154 ( -3.716 2.880 2.611) 5.377 8.243 ( -2.810 -0.046 0.004) 2.811 8.320 ( 5.790 -3.800 0.037) 6.926 8.481 ( -0.220 3.491 -2.391) 4.237 8.560 ( -0.150 2.905 0.190) 2.915 8.585 ( 2.560 -0.154 -0.602) 2.634 8.676 ( -2.485 -0.193 -0.835) 2.628 8.802 ( 0.066 -0.647 -1.759) 1.876 8.808 ( 2.980 1.320 -0.531) 3.303 8.944 ( -0.858 0.713 3.678) 3.843 9.047 ( 3.361 7.153 2.617) 8.325 9.072 ( -0.460 -1.048 3.476) 3.660 9.163 ( 2.895 7.912 -1.761) 8.607 9.245 ( -2.275 2.395 -1.362) 3.573 9.385 ( 2.752 0.506 0.209) 2.806 9.577 ( 1.691 0.546 -0.022) 1.777 9.816 ( 0.562 -1.310 1.375) 1.981 10.061 ( 1.820 -2.876 2.430) 4.182 10.142 ( -0.792 -6.618 -2.179) 7.012 10.243 ( 0.038 4.556 -3.271) 5.608 10.459 ( 5.628 -1.444 -3.255) 6.660 10.707 ( 9.667 1.395 -3.078) 10.241 10.775 ( 14.025 -0.669 -5.154) 14.957 11.129 ( 1.130 0.396 -5.457) 5.587 11.406 ( -1.646 -11.397 12.437) 16.950 16.471 ( 5.029 0.408 -0.291) 5.054 16.490 ( 4.362 -0.443 0.021) 4.384 16.737 ( -3.539 -0.705 0.679) 3.672 16.756 ( -3.811 -1.383 0.085) 4.055 17.464 ( -0.734 -0.652 0.147) 0.992 17.487 ( 0.830 -1.047 -1.062) 1.706 17.602 ( -0.937 -0.595 1.819) 2.131 17.618 ( -0.915 -0.982 1.294) 1.865 17.646 ( -2.879 0.136 -1.658) 3.325 17.665 ( -2.354 -0.797 -2.389) 3.447 17.765 ( -1.790 -0.318 1.258) 2.211 17.797 ( -2.360 -1.965 -0.260) 3.082 18.760 ( -2.063 12.081 -0.548) 12.268 18.766 ( -2.629 13.362 0.533) 13.628 19.153 ( -3.247 -7.259 -0.350) 7.960 19.186 ( -3.561 -7.340 0.589) 8.179 21.302 ( 0.969 0.099 -0.505) 1.097 21.327 ( 1.752 -1.032 0.940) 2.240 21.418 ( -0.657 0.398 -0.341) 0.841 21.452 ( 0.817 -1.170 -0.227) 1.445 21.982 ( 0.736 1.395 0.317) 1.609 21.999 ( 1.125 0.871 -0.987) 1.732 22.037 ( 0.200 0.626 0.932) 1.140 22.104 ( 0.411 -1.924 0.629) 2.065 26.977 ( -0.064 1.246 -0.287) 1.280 27.022 ( 0.506 1.552 0.835) 1.833 27.065 ( -0.986 -1.840 -0.674) 2.193 27.121 ( -0.272 -1.894 0.013) 1.914 27.688 ( 0.064 0.634 0.918) 1.117 27.701 ( -0.395 -0.067 -0.135) 0.423 27.740 ( -1.625 1.469 -0.026) 2.191 27.787 ( -1.180 -0.506 -0.172) 1.295 35.744 ( 0.080 1.590 1.320) 2.068 35.797 ( -0.538 -1.010 -1.400) 1.808 35.928 ( -3.425 6.502 -1.304) 7.464 36.011 ( -6.842 3.904 -5.803) 9.784 36.122 ( -9.152 -1.624 0.535) 9.310 36.282 ( -3.943 2.989 4.426) 6.638 36.444 ( -4.593 -6.986 5.114) 9.801 36.571 ( -3.945 -5.644 -6.010) 9.140 37.248 ( 9.273 12.511 0.435) 15.579 37.475 ( 9.093 13.080 1.955) 16.050 37.917 ( 10.307 -19.494 1.244) 22.086 38.370 ( 8.584 -26.008 -2.477) 27.499 39.880 ( 8.589 5.711 -1.330) 10.400 39.979 ( 11.937 0.646 1.519) 12.050 40.540 ( -12.623 8.420 0.360) 15.178 40.680 ( -13.749 2.708 -1.544) 14.098 ======================= Grid point 85 (43/92) ======================= q-point: ( 0.44 0.33 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( -0.157 -1.770 0.702) 1.911 1.877 ( -1.212 -4.691 -1.207) 4.993 1.966 ( 1.214 0.605 -3.335) 3.600 2.030 ( -0.377 -2.366 -0.344) 2.421 2.227 ( -3.229 16.209 1.933) 16.640 2.545 ( 6.424 4.486 -3.659) 8.648 2.608 ( 3.966 14.329 3.155) 15.199 2.726 ( 1.559 -5.090 -5.715) 7.810 2.807 ( 0.029 -3.325 -3.387) 4.747 2.843 ( -3.375 -1.098 -6.470) 7.380 2.999 ( -2.200 7.495 7.476) 10.812 3.127 ( -0.899 -9.916 -0.721) 9.982 3.285 ( 3.038 -10.621 -4.274) 11.844 3.326 ( 0.553 9.185 -5.925) 10.944 3.590 ( -0.648 -2.049 6.368) 6.721 3.628 ( 4.789 -4.311 -3.238) 7.211 3.705 ( 0.503 7.808 -7.388) 10.761 3.818 ( 6.065 -0.417 -0.448) 6.096 3.851 ( -0.418 3.534 -3.303) 4.855 3.927 ( 6.318 2.082 1.549) 6.830 3.971 ( 1.843 -4.367 -0.038) 4.741 4.060 ( -2.467 -2.988 -2.886) 4.831 4.079 ( -3.419 5.280 -1.542) 6.477 4.290 ( -3.953 2.481 -2.450) 5.272 4.407 ( -0.772 3.769 3.981) 5.536 4.530 ( 6.184 2.378 -2.459) 7.067 4.625 ( -0.443 1.491 1.155) 1.937 4.762 ( 0.223 3.670 -0.088) 3.678 4.811 ( -4.375 -2.269 1.806) 5.249 4.827 ( 7.432 1.519 -3.906) 8.532 5.028 ( 0.075 2.251 1.868) 2.926 5.118 ( -2.805 7.239 -1.647) 7.937 5.178 ( -1.467 3.127 0.514) 3.492 5.304 ( 4.912 6.480 0.733) 8.164 5.365 ( -3.787 -0.981 2.374) 4.575 5.441 ( -0.037 3.180 1.217) 3.405 5.492 ( 0.766 -0.349 0.119) 0.850 5.511 ( -0.560 -0.384 0.647) 0.938 5.571 ( 1.371 5.256 -1.891) 5.752 5.658 ( -0.019 0.789 0.738) 1.080 5.698 ( -0.886 5.032 -0.752) 5.165 5.781 ( -1.972 1.870 -0.435) 2.753 5.876 ( -0.881 0.534 -0.037) 1.031 5.909 ( 0.288 -1.342 3.634) 3.884 5.938 ( 4.721 5.508 -1.431) 7.394 5.960 ( 1.648 2.267 2.012) 3.450 6.065 ( -3.240 2.263 3.889) 5.544 6.111 ( -0.282 -0.504 -0.333) 0.667 6.170 ( -1.384 -0.505 3.756) 4.034 6.279 ( 1.129 -5.184 -3.668) 6.450 6.318 ( 2.797 -2.174 0.555) 3.586 6.367 ( 3.036 -0.631 -0.215) 3.109 6.420 ( -0.379 -4.527 -3.043) 5.468 6.482 ( 2.986 -2.325 -0.763) 3.861 6.539 ( -0.550 2.248 0.301) 2.333 6.599 ( -0.855 0.833 -0.246) 1.219 6.638 ( -1.749 -1.910 0.639) 2.668 6.761 ( -4.639 2.717 -1.075) 5.483 6.795 ( 0.090 0.130 3.397) 3.401 6.880 ( 1.273 -5.815 5.114) 7.848 6.989 ( -2.863 -8.362 3.470) 9.495 7.000 ( -2.602 -3.683 1.883) 4.886 7.116 ( 3.110 -3.233 -0.867) 4.569 7.201 ( 4.753 -4.438 0.695) 6.539 7.297 ( -0.209 -7.337 1.151) 7.430 7.397 ( 3.966 -6.569 9.418) 12.148 7.601 ( 2.135 -1.588 4.840) 5.523 7.637 ( -1.183 -2.297 6.188) 6.706 7.771 ( 3.112 -1.155 4.164) 5.325 7.844 ( -1.070 -7.655 6.320) 9.984 8.041 ( 1.838 6.531 -3.950) 7.851 8.147 ( -0.570 3.330 1.712) 3.787 8.208 ( -1.561 -0.211 1.622) 2.261 8.367 ( 1.511 -2.939 -2.774) 4.315 8.452 ( 0.678 2.839 -4.745) 5.571 8.541 ( 0.136 1.725 -4.700) 5.009 8.590 ( -1.349 0.672 -2.834) 3.209 8.640 ( -0.588 1.539 1.031) 1.944 8.760 ( -0.771 -0.302 -3.284) 3.386 8.869 ( 2.361 1.990 1.149) 3.295 8.976 ( -1.023 -2.051 4.817) 5.334 9.102 ( 0.048 -2.101 3.900) 4.430 9.113 ( 1.890 5.613 0.649) 5.958 9.144 ( -2.656 8.519 -3.074) 9.438 9.199 ( -0.207 4.413 -2.437) 5.046 9.415 ( 1.557 6.186 -3.569) 7.309 9.577 ( -0.559 -3.031 -1.610) 3.478 9.822 ( 0.245 -1.459 -2.908) 3.263 10.054 ( -1.999 -5.369 -5.592) 8.005 10.122 ( 1.884 -8.164 -1.043) 8.443 10.252 ( 2.343 7.229 1.092) 7.678 10.517 ( 3.943 -2.329 -3.706) 5.891 10.841 ( 7.048 1.203 -0.400) 7.161 10.960 ( 11.387 -3.739 -6.086) 13.442 11.116 ( 1.231 2.986 1.497) 3.560 11.366 ( -12.211 -8.128 5.800) 15.774 16.560 ( 5.125 0.150 -0.607) 5.163 16.564 ( 4.335 -0.077 -0.312) 4.347 16.673 ( -4.255 -0.798 0.292) 4.339 16.678 ( -4.854 -0.870 -0.157) 4.934 17.459 ( 0.210 0.126 0.391) 0.461 17.503 ( 2.145 -1.750 -0.782) 2.876 17.570 ( -3.107 -0.906 -0.832) 3.342 17.586 ( -2.356 -1.877 -0.353) 3.033 17.633 ( 0.801 0.014 0.941) 1.236 17.651 ( 1.238 -1.148 0.920) 1.923 17.747 ( -1.440 -0.855 0.229) 1.691 17.757 ( -1.282 -0.924 -0.756) 1.752 18.740 ( -1.304 12.443 0.936) 12.546 18.740 ( -0.075 11.775 0.202) 11.777 19.118 ( -0.935 -7.078 0.551) 7.161 19.145 ( -1.538 -7.118 0.296) 7.289 21.314 ( 0.659 0.431 0.110) 0.795 21.354 ( 0.155 -1.540 0.316) 1.580 21.407 ( -0.049 0.882 0.235) 0.914 21.460 ( 0.386 -1.600 -0.328) 1.679 21.992 ( 0.136 1.571 0.206) 1.590 22.008 ( 0.852 1.114 -0.714) 1.574 22.048 ( -0.092 0.188 1.275) 1.292 22.109 ( -0.260 -2.018 0.273) 2.053 26.977 ( 0.185 1.221 0.115) 1.240 27.026 ( -0.515 1.997 -0.421) 2.104 27.057 ( 0.338 -2.445 0.622) 2.545 27.116 ( -0.146 -1.983 -0.289) 2.010 27.693 ( -0.541 0.387 -0.237) 0.706 27.701 ( 0.383 0.379 0.839) 0.997 27.714 ( -0.813 1.302 -0.516) 1.619 27.768 ( -0.526 -0.657 -0.544) 1.002 35.750 ( -1.860 1.632 -4.347) 5.002 35.769 ( 1.412 1.928 -1.790) 2.986 35.838 ( -1.963 3.107 -5.669) 6.756 35.889 ( -1.220 -2.470 -0.568) 2.813 36.054 ( -3.023 4.443 4.956) 7.311 36.264 ( -1.945 4.998 2.306) 5.838 36.410 ( -4.304 -9.008 4.145) 10.809 36.516 ( 1.697 -5.320 -1.204) 5.713 37.367 ( 3.491 14.470 1.167) 14.931 37.573 ( 2.059 14.822 -1.265) 15.018 38.059 ( 3.578 -20.994 1.929) 21.384 38.440 ( 3.578 -25.244 -4.885) 25.960 40.030 ( 9.275 9.496 -0.012) 13.274 40.220 ( 14.390 -0.504 1.441) 14.471 40.343 ( -10.538 5.462 -0.154) 11.870 40.436 ( -14.103 2.105 1.171) 14.308 ======================= Grid point 86 (44/92) ======================= q-point: (-0.44 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -6.045 1.247 -1.055) 6.262 1.832 ( -1.161 -0.475 -0.390) 1.314 1.928 ( -1.576 0.555 -4.515) 4.815 2.000 ( -1.451 -1.777 -1.491) 2.736 2.183 ( -3.139 4.602 -0.071) 5.571 2.550 ( -2.024 0.955 -5.478) 5.917 2.637 ( -4.630 14.178 2.001) 15.048 2.651 ( 0.237 1.076 -3.906) 4.058 2.750 ( -0.745 -0.745 -1.174) 1.578 2.819 ( 2.713 -5.549 -5.438) 8.229 3.062 ( -0.218 8.444 4.525) 9.582 3.094 ( 0.092 -8.412 -5.374) 9.983 3.187 ( -1.921 -4.411 -6.129) 7.791 3.339 ( -0.999 -3.579 -1.721) 4.095 3.548 ( -0.757 -2.508 -3.557) 4.417 3.628 ( -5.651 3.559 7.225) 9.839 3.712 ( -2.844 0.683 -3.519) 4.576 3.765 ( -1.281 1.064 -5.448) 5.697 3.837 ( -3.759 7.145 -4.358) 9.175 3.861 ( -0.551 2.271 0.316) 2.358 4.005 ( -0.954 -0.091 -3.522) 3.650 4.055 ( 4.246 -3.737 1.679) 5.900 4.122 ( 2.849 5.384 2.674) 6.652 4.280 ( 3.883 3.800 -2.563) 6.007 4.453 ( -6.899 -0.493 -4.661) 8.340 4.528 ( 7.602 1.513 6.960) 10.417 4.682 ( -4.466 7.542 -1.528) 8.897 4.708 ( 2.304 6.814 -5.750) 9.209 4.823 ( 2.097 2.833 5.679) 6.684 4.956 ( 7.713 2.766 -2.112) 8.462 5.034 ( -0.226 -1.934 2.264) 2.987 5.095 ( -2.587 1.371 -0.998) 3.093 5.118 ( -1.946 6.213 3.044) 7.187 5.234 ( -2.352 2.980 -3.367) 5.074 5.384 ( -1.161 4.312 4.388) 6.261 5.434 ( -3.336 -1.960 3.450) 5.184 5.474 ( 0.348 4.274 0.129) 4.291 5.532 ( 1.122 1.363 -2.428) 3.002 5.575 ( 0.410 6.099 -4.502) 7.592 5.684 ( -0.297 -2.101 4.653) 5.114 5.724 ( 3.383 -0.162 2.908) 4.464 5.782 ( 2.309 0.760 -0.043) 2.431 5.826 ( -0.617 0.390 -1.943) 2.076 5.942 ( -1.332 -1.344 -1.632) 2.499 5.951 ( -0.222 2.266 1.304) 2.624 5.998 ( 0.741 0.035 1.915) 2.054 6.018 ( -3.843 3.261 0.230) 5.046 6.149 ( 1.938 -2.184 -2.577) 3.895 6.219 ( 0.147 -3.147 -1.424) 3.458 6.295 ( 4.286 -0.801 4.254) 6.092 6.309 ( -2.038 -2.597 -1.143) 3.494 6.385 ( -1.241 -2.519 0.362) 2.832 6.447 ( 1.159 -4.269 1.747) 4.756 6.493 ( -1.241 -3.207 1.038) 3.592 6.519 ( -1.696 -0.885 -2.238) 2.944 6.560 ( 1.700 -0.536 -2.732) 3.262 6.653 ( -1.683 4.305 3.286) 5.671 6.699 ( -1.977 0.443 1.818) 2.722 6.818 ( -0.450 -0.627 2.443) 2.562 6.923 ( -1.312 -9.312 -0.210) 9.407 6.944 ( -0.897 -3.008 2.521) 4.026 6.988 ( -0.167 -4.251 3.650) 5.605 7.171 ( 1.038 -2.710 2.288) 3.695 7.225 ( -2.226 -8.319 0.783) 8.647 7.375 ( 2.548 -1.105 9.409) 9.811 7.518 ( 0.056 -1.822 8.237) 8.436 7.690 ( -1.533 -1.432 7.091) 7.395 7.721 ( 1.090 0.959 9.793) 9.900 7.843 ( -0.276 -10.170 4.120) 10.976 7.860 ( -0.478 -3.104 5.434) 6.276 8.056 ( 1.339 5.721 -0.010) 5.876 8.139 ( -0.545 3.953 0.193) 3.995 8.220 ( 0.368 2.837 1.068) 3.054 8.336 ( -1.351 -2.236 -3.193) 4.125 8.414 ( 2.236 -0.240 -8.296) 8.595 8.484 ( 0.048 0.195 -6.365) 6.368 8.523 ( -2.837 2.361 -2.196) 4.295 8.627 ( -2.176 0.229 -0.075) 2.190 8.732 ( -0.590 2.163 -1.161) 2.525 8.903 ( 1.643 5.008 0.044) 5.271 8.977 ( -3.556 -2.383 3.252) 5.376 9.049 ( -4.058 6.045 -3.679) 8.158 9.117 ( -0.504 3.080 0.160) 3.126 9.149 ( 0.359 -2.190 3.234) 3.923 9.178 ( 0.133 2.901 -2.060) 3.560 9.365 ( -2.635 1.942 -3.546) 4.826 9.542 ( -0.647 -1.849 -3.346) 3.877 9.751 ( -2.759 -4.050 -7.260) 8.759 9.999 ( -0.321 -1.768 -1.521) 2.355 10.112 ( -0.134 -3.761 -3.369) 5.051 10.308 ( 0.976 4.984 1.882) 5.416 10.508 ( -0.546 -1.205 -4.753) 4.933 10.852 ( -5.075 1.996 -0.397) 5.468 11.026 ( 3.371 -3.672 -7.626) 9.111 11.154 ( -14.252 -0.939 2.664) 14.529 11.269 ( 10.724 -4.260 6.635) 13.310 16.556 ( -4.537 0.369 -0.589) 4.590 16.568 ( -5.082 -0.109 -0.477) 5.105 16.658 ( 3.791 -0.570 0.103) 3.835 16.673 ( 4.577 -1.031 -0.285) 4.700 17.470 ( -0.388 -0.224 0.723) 0.850 17.524 ( -1.054 -1.325 -0.427) 1.746 17.543 ( 1.125 -3.275 -0.033) 3.462 17.550 ( 1.079 -2.227 -1.449) 2.868 17.668 ( 1.074 1.012 1.859) 2.373 17.686 ( 1.847 -0.064 0.919) 2.064 17.721 ( -0.513 -0.269 -0.673) 0.888 17.753 ( 1.569 -1.846 -0.946) 2.601 18.737 ( 0.152 12.018 0.636) 12.036 18.760 ( 1.666 12.122 0.892) 12.269 19.122 ( 0.412 -6.997 0.575) 7.033 19.150 ( 1.977 -6.895 0.489) 7.189 21.327 ( 0.385 0.068 0.725) 0.824 21.337 ( -1.466 -0.298 -0.409) 1.551 21.421 ( 0.589 -0.026 0.732) 0.940 21.458 ( -0.128 -1.756 -0.531) 1.838 21.989 ( -0.584 1.563 0.065) 1.670 22.013 ( 0.393 1.245 -0.564) 1.422 22.057 ( -0.594 -0.288 1.766) 1.886 22.103 ( -0.383 -1.605 -0.089) 1.652 26.985 ( 0.325 1.110 0.476) 1.251 27.009 ( -0.471 1.407 -0.733) 1.655 27.075 ( 0.605 -1.841 0.966) 2.165 27.111 ( -0.049 -1.909 -0.606) 2.003 27.675 ( -0.969 0.899 -0.272) 1.350 27.708 ( -0.119 -0.500 0.536) 0.743 27.714 ( 0.792 1.502 -0.390) 1.742 27.763 ( 0.737 -0.749 -0.706) 1.266 35.673 ( -1.312 3.513 -2.808) 4.685 35.756 ( 1.743 0.862 -4.541) 4.940 35.837 ( 2.560 0.499 -2.386) 3.535 35.862 ( 1.479 0.764 -4.515) 4.812 36.126 ( 4.514 2.053 7.302) 8.826 36.263 ( 0.188 7.272 1.066) 7.352 36.378 ( -2.924 -8.002 2.502) 8.879 36.593 ( 6.602 -7.111 1.163) 9.773 37.385 ( -3.335 13.732 2.235) 14.307 37.528 ( -4.636 14.300 -2.981) 15.326 38.063 ( -5.470 -20.234 2.807) 21.148 38.397 ( -2.634 -25.461 -6.511) 26.412 40.052 ( -10.732 7.255 0.569) 12.967 40.170 ( -12.033 1.730 0.101) 12.157 40.359 ( 10.666 7.339 0.865) 12.976 40.504 ( 16.164 0.448 2.093) 16.305 ======================= Grid point 87 (45/92) ======================= q-point: (-0.33 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.468 ( -11.892 8.541 -1.483) 14.716 1.813 ( -3.277 4.574 2.362) 6.102 1.849 ( -2.374 2.661 -3.396) 4.924 1.973 ( -0.266 -3.812 -1.197) 4.004 2.111 ( -4.086 -2.538 -1.924) 5.181 2.362 ( -12.820 -3.819 -5.599) 14.501 2.560 ( -9.197 6.410 3.018) 11.609 2.666 ( 5.049 4.161 -4.975) 8.219 2.722 ( -3.347 -1.294 -4.770) 5.969 2.770 ( -3.845 -1.816 3.022) 5.217 2.939 ( -7.691 -7.360 -7.285) 12.899 3.032 ( -2.284 0.044 -0.505) 2.340 3.188 ( -2.920 9.701 3.688) 10.781 3.296 ( -1.785 2.279 -0.906) 3.033 3.488 ( -8.802 -5.999 -1.438) 10.748 3.564 ( -2.234 2.148 2.241) 3.824 3.663 ( 3.480 8.546 1.102) 9.293 3.685 ( -5.618 3.668 -2.327) 7.102 3.786 ( 1.107 -0.561 -0.696) 1.423 3.871 ( -2.238 0.998 3.133) 3.978 3.949 ( -0.405 -1.287 -6.031) 6.180 4.134 ( 3.409 -0.320 -2.132) 4.033 4.177 ( 6.632 3.946 -2.260) 8.041 4.274 ( 0.544 4.346 -6.357) 7.720 4.362 ( 1.205 3.541 -1.117) 3.904 4.534 ( -8.045 2.742 2.374) 8.825 4.625 ( -4.757 6.710 -5.977) 10.167 4.785 ( 8.978 4.240 5.395) 11.300 4.829 ( -3.971 -2.542 -0.559) 4.749 4.928 ( -5.366 0.519 -4.468) 7.002 5.028 ( 3.830 7.138 -2.148) 8.380 5.081 ( -1.494 5.211 5.041) 7.403 5.238 ( 7.697 -0.627 3.271) 8.387 5.320 ( 8.477 -0.221 4.190) 9.458 5.382 ( -4.005 2.413 5.205) 6.997 5.424 ( 0.329 1.520 -2.344) 2.813 5.466 ( -0.679 4.981 -1.975) 5.401 5.489 ( -2.532 -3.737 -0.897) 4.602 5.559 ( 0.710 2.680 -0.353) 2.795 5.718 ( -2.868 -0.528 2.058) 3.570 5.769 ( -0.322 1.521 1.436) 2.116 5.814 ( 1.147 -1.166 0.724) 1.789 5.842 ( 1.327 -0.385 1.059) 1.741 5.902 ( -1.290 -0.506 -1.363) 1.944 5.936 ( -1.882 2.412 3.679) 4.784 5.989 ( 0.332 -0.796 0.129) 0.872 6.057 ( 2.474 -1.469 -2.869) 4.063 6.096 ( -2.614 -0.972 -0.254) 2.800 6.180 ( -0.494 -0.837 -2.461) 2.646 6.261 ( -1.238 -5.136 -2.411) 5.807 6.322 ( -1.797 0.875 -1.451) 2.470 6.379 ( 0.117 -0.945 -0.941) 1.339 6.431 ( -0.758 -3.599 -0.479) 3.709 6.486 ( -0.274 2.476 -2.030) 3.213 6.523 ( -2.299 -0.269 3.049) 3.828 6.585 ( 2.944 -2.574 4.044) 5.626 6.652 ( 1.122 -3.141 2.005) 3.892 6.707 ( -0.807 -3.994 3.444) 5.335 6.788 ( -1.738 -4.196 -2.877) 5.376 6.881 ( -2.697 -3.109 0.006) 4.116 7.020 ( 2.443 -4.786 5.067) 7.386 7.051 ( -1.213 -4.472 8.181) 9.402 7.138 ( -3.574 -3.976 -2.158) 5.765 7.216 ( 0.687 -5.414 0.457) 5.476 7.496 ( -0.669 2.907 9.486) 9.944 7.570 ( -1.722 2.968 6.221) 7.105 7.662 ( -5.849 0.867 0.778) 5.964 7.719 ( -6.675 1.130 2.113) 7.092 7.846 ( -2.172 -3.375 4.470) 6.007 7.931 ( -0.385 -7.082 2.091) 7.394 8.091 ( -0.556 1.560 3.494) 3.866 8.119 ( -2.146 6.531 -2.275) 7.241 8.208 ( -0.929 1.354 3.604) 3.960 8.291 ( -1.708 -0.251 -0.631) 1.838 8.385 ( 2.692 0.661 -7.588) 8.079 8.424 ( -0.978 0.403 -6.086) 6.177 8.501 ( 2.019 -0.007 1.127) 2.312 8.587 ( -1.530 0.218 -0.521) 1.630 8.698 ( -2.338 1.975 0.171) 3.065 8.912 ( -5.293 -2.502 -0.847) 5.916 8.924 ( -1.145 5.959 -5.396) 8.120 8.963 ( -0.857 2.897 4.394) 5.332 9.109 ( -0.286 4.750 0.568) 4.792 9.164 ( 0.232 0.505 -1.253) 1.370 9.181 ( 0.355 -3.842 1.474) 4.130 9.303 ( -3.262 -5.547 2.211) 6.805 9.501 ( -0.170 0.621 -2.693) 2.769 9.624 ( -2.998 -2.632 -7.822) 8.780 9.993 ( -0.361 -0.341 0.235) 0.550 10.072 ( -0.767 -2.714 -3.100) 4.191 10.298 ( -2.951 3.457 0.228) 4.551 10.413 ( -4.025 -1.091 -6.479) 7.705 10.712 ( -9.537 1.175 -1.205) 9.684 10.862 ( -10.107 -6.466 -7.134) 13.959 11.056 ( -3.146 11.496 2.635) 12.206 11.536 ( 10.384 -10.614 9.193) 17.464 16.467 ( -4.701 0.163 -0.486) 4.729 16.476 ( -4.776 -0.183 -0.219) 4.785 16.729 ( 3.734 -0.321 0.586) 3.794 16.750 ( 4.134 -1.021 -0.146) 4.261 17.456 ( -0.653 -0.653 -0.496) 1.048 17.500 ( -0.947 -2.363 -0.267) 2.559 17.566 ( 2.189 -1.130 0.335) 2.486 17.585 ( 1.431 -2.938 0.257) 3.278 17.686 ( 1.319 0.601 -0.672) 1.598 17.724 ( 1.699 -0.645 -0.873) 2.016 17.743 ( 2.849 0.868 1.265) 3.236 17.788 ( 2.797 -1.953 -0.345) 3.429 18.756 ( 1.641 11.962 0.043) 12.075 18.809 ( 3.077 13.288 0.802) 13.663 19.142 ( 1.844 -7.172 -0.218) 7.408 19.213 ( 4.306 -6.652 0.856) 7.971 21.305 ( -1.668 0.418 -0.253) 1.738 21.340 ( -0.092 -1.122 1.083) 1.563 21.432 ( 0.056 -0.283 0.349) 0.453 21.446 ( -0.581 -1.425 -0.807) 1.738 21.976 ( -0.969 1.376 0.028) 1.683 22.009 ( -0.313 0.929 -0.603) 1.151 22.058 ( -1.010 -0.381 1.464) 1.819 22.101 ( -0.164 -1.108 0.587) 1.265 26.987 ( -0.435 1.450 -0.249) 1.534 27.009 ( 0.784 1.021 0.489) 1.377 27.090 ( 0.222 -1.759 0.211) 1.786 27.106 ( 0.361 -1.711 -0.418) 1.798 27.663 ( -0.209 1.088 0.159) 1.119 27.706 ( -0.418 -0.362 0.224) 0.596 27.734 ( 1.853 1.053 -0.083) 2.133 27.777 ( 1.302 -0.674 -0.502) 1.550 35.667 ( 1.934 3.704 -0.379) 4.196 35.734 ( -0.077 0.226 -3.010) 3.019 35.836 ( 4.714 3.631 -6.384) 8.727 35.917 ( 5.471 -0.092 -0.959) 5.555 36.281 ( 4.057 3.861 0.932) 5.678 36.304 ( 5.374 3.669 3.603) 7.438 36.360 ( -0.807 -4.695 1.425) 4.972 36.735 ( 8.527 -8.723 -0.032) 12.198 37.296 ( -9.785 9.917 2.623) 14.176 37.381 ( -9.056 13.699 -1.608) 16.500 37.943 ( -12.086 -19.232 4.850) 23.226 38.220 ( -10.081 -25.457 -8.325) 28.618 39.835 ( -11.842 5.416 -1.801) 13.145 39.954 ( -12.719 -0.710 0.751) 12.761 40.640 ( 17.770 10.940 2.117) 20.974 40.808 ( 17.453 2.100 1.367) 17.632 ======================= Grid point 88 (46/92) ======================= q-point: (-0.22 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.275 ( -11.765 14.865 6.733) 20.117 1.683 ( -19.745 10.793 1.136) 22.531 1.808 ( 0.420 4.419 -1.119) 4.577 1.950 ( -1.102 -6.543 -1.225) 6.747 2.026 ( -2.317 -7.377 -1.159) 7.818 2.105 ( -8.154 -2.767 -0.661) 8.636 2.332 ( -18.778 -1.957 1.461) 18.937 2.560 ( -8.242 -4.545 -3.714) 10.118 2.661 ( -6.619 -3.778 1.601) 7.788 2.747 ( 2.315 5.854 -0.658) 6.330 2.845 ( -6.062 1.431 4.207) 7.516 3.006 ( -2.153 2.329 3.024) 4.382 3.072 ( -10.340 25.461 -0.434) 27.484 3.202 ( -8.473 2.154 1.334) 8.843 3.331 ( -4.885 -1.896 -2.941) 6.008 3.485 ( -6.419 8.405 -7.519) 12.977 3.604 ( -3.651 -1.438 0.921) 4.031 3.755 ( 3.128 0.962 0.879) 3.388 3.867 ( 6.799 -5.136 2.803) 8.970 3.893 ( 3.454 5.589 3.837) 7.608 3.956 ( 3.149 -2.758 1.711) 4.522 4.108 ( 3.717 1.308 -13.292) 13.864 4.260 ( 2.015 4.892 0.954) 5.376 4.304 ( 8.168 -0.968 -4.366) 9.312 4.368 ( -0.024 4.479 -0.902) 4.569 4.445 ( -3.376 1.031 2.141) 4.128 4.525 ( -0.746 -1.312 -0.294) 1.538 4.742 ( -2.839 -2.955 -4.396) 6.010 4.784 ( -6.442 2.906 -4.386) 8.317 4.944 ( 0.205 -4.261 7.625) 8.737 5.059 ( 2.609 8.252 -1.543) 8.791 5.138 ( 1.396 5.739 6.020) 8.434 5.319 ( 0.106 0.036 -2.580) 2.582 5.338 ( -4.471 5.344 -3.854) 7.962 5.385 ( 1.178 -3.245 -0.713) 3.525 5.452 ( 2.952 4.211 1.806) 5.451 5.473 ( -0.774 -0.462 1.709) 1.932 5.494 ( 0.992 -0.145 4.351) 4.465 5.549 ( -0.538 2.017 -1.279) 2.448 5.674 ( -1.994 0.382 2.222) 3.010 5.746 ( -4.678 0.725 0.069) 4.735 5.781 ( -0.005 2.384 0.455) 2.427 5.819 ( -5.017 -1.242 -4.613) 6.928 5.881 ( -0.614 0.973 -1.041) 1.551 5.941 ( -1.018 -1.873 -1.517) 2.617 6.006 ( 2.949 -1.833 1.512) 3.787 6.040 ( 0.204 -0.944 -1.436) 1.730 6.111 ( 1.422 -5.366 1.362) 5.716 6.170 ( 0.775 1.073 -1.917) 2.329 6.269 ( 2.317 2.147 1.233) 3.391 6.313 ( -0.220 -6.348 -0.184) 6.354 6.335 ( 1.249 -0.722 -1.372) 1.991 6.434 ( -1.664 1.894 0.781) 2.639 6.471 ( -1.315 3.573 0.552) 3.847 6.548 ( 5.737 -2.850 -0.963) 6.477 6.655 ( -1.179 -1.532 4.676) 5.060 6.711 ( 2.201 -7.309 -0.681) 7.664 6.725 ( 1.489 -3.821 1.673) 4.429 6.763 ( -2.033 -3.816 5.626) 7.096 6.842 ( 0.593 -2.682 -1.981) 3.387 6.981 ( -4.114 -0.446 -2.771) 4.980 7.067 ( -5.422 -5.091 5.411) 9.198 7.133 ( 2.964 -3.564 -1.008) 4.743 7.241 ( 0.288 -5.640 1.481) 5.838 7.399 ( -8.446 3.402 -7.070) 11.528 7.542 ( -6.070 -1.840 -4.240) 7.629 7.588 ( -6.634 2.752 5.027) 8.767 7.630 ( -6.127 2.823 3.881) 7.783 7.810 ( -1.028 -0.092 -5.505) 5.601 7.877 ( -8.624 -1.986 3.420) 9.488 8.048 ( -3.945 3.808 1.791) 5.768 8.079 ( -0.047 4.175 -1.072) 4.311 8.216 ( -5.049 -0.736 1.582) 5.342 8.282 ( 0.902 -2.856 0.722) 3.081 8.379 ( 0.337 1.792 -1.939) 2.661 8.387 ( 2.749 4.271 1.912) 5.427 8.544 ( 2.228 -2.011 -2.999) 4.243 8.592 ( 2.085 -0.312 1.941) 2.866 8.670 ( -2.999 1.740 3.305) 4.790 8.790 ( -4.331 -1.505 -4.269) 6.265 8.878 ( -0.209 2.327 -1.871) 2.993 8.984 ( -4.381 -3.218 5.497) 7.731 9.142 ( 0.198 0.793 0.772) 1.124 9.169 ( -0.534 -2.590 2.854) 3.891 9.180 ( 3.187 4.393 -1.410) 5.607 9.297 ( -0.940 -2.899 3.652) 4.757 9.512 ( 1.230 -1.461 -1.614) 2.501 9.521 ( -0.732 -1.907 -1.690) 2.651 9.981 ( -1.412 -0.809 0.313) 1.657 10.034 ( -1.242 -3.090 -1.242) 3.554 10.236 ( -3.503 1.272 -0.551) 3.768 10.272 ( -5.197 -1.320 -5.414) 7.620 10.533 ( -8.932 1.495 -1.700) 9.214 10.632 ( -8.270 -4.269 -6.482) 11.342 11.031 ( -2.936 17.716 2.195) 18.092 11.752 ( 5.318 -16.377 6.059) 18.254 16.395 ( -3.096 0.181 -0.280) 3.114 16.407 ( -3.257 -0.310 0.286) 3.284 16.791 ( 2.605 -0.496 0.876) 2.793 16.805 ( 2.414 -1.032 -0.113) 2.628 17.453 ( 0.736 -0.281 -0.104) 0.794 17.493 ( 0.111 -1.975 -0.105) 1.981 17.594 ( 0.751 -1.240 0.134) 1.455 17.612 ( 1.655 -0.733 0.544) 1.890 17.717 ( 2.898 -0.020 -0.719) 2.986 17.749 ( 2.242 -1.247 -1.335) 2.892 17.795 ( 1.810 0.500 0.744) 2.020 17.833 ( 2.536 -2.137 -0.114) 3.318 18.796 ( 3.204 11.859 -0.374) 12.290 18.876 ( 4.213 14.830 -0.004) 15.416 19.178 ( 2.496 -7.209 -0.226) 7.632 19.302 ( 5.061 -6.630 0.420) 8.352 21.277 ( -1.396 0.527 -0.067) 1.494 21.334 ( -1.845 -2.655 0.444) 3.263 21.429 ( -0.290 -0.326 -0.630) 0.766 21.431 ( -0.363 -0.215 0.073) 0.428 21.959 ( -0.951 1.150 0.080) 1.494 21.993 ( -0.771 0.359 -0.614) 1.049 22.053 ( -0.635 0.223 0.597) 0.899 22.104 ( -0.700 -1.546 1.229) 2.095 26.976 ( -0.354 1.764 -0.271) 1.819 27.035 ( 1.219 0.822 1.061) 1.813 27.081 ( -0.351 -1.463 -1.223) 1.939 27.120 ( 0.952 -1.521 0.333) 1.825 27.671 ( 0.533 0.992 0.777) 1.368 27.702 ( -0.085 -0.157 0.064) 0.190 27.772 ( 2.241 0.759 0.402) 2.400 27.796 ( 1.306 -0.234 -0.203) 1.342 35.706 ( 2.465 3.669 0.273) 4.428 35.746 ( 3.464 1.541 0.776) 3.870 35.877 ( 5.652 3.818 -4.269) 8.047 36.003 ( 5.028 -1.944 -0.683) 5.434 36.311 ( 2.113 8.243 -3.691) 9.276 36.368 ( 1.084 1.142 2.547) 2.995 36.453 ( 5.088 -2.632 2.646) 6.310 36.856 ( 6.457 -8.202 -3.159) 10.907 37.103 ( -13.106 3.196 0.060) 13.490 37.231 ( -9.525 12.813 4.568) 16.606 37.736 ( -18.743 -20.833 3.386) 28.227 37.935 ( -12.065 -19.822 -5.369) 23.818 39.647 ( -8.182 4.773 -0.780) 9.504 39.767 ( -9.572 -1.510 0.769) 9.721 40.945 ( 15.125 10.336 -0.117) 18.320 41.131 ( 20.499 3.619 -1.788) 20.893 ======================= Grid point 89 (47/92) ======================= q-point: (-0.11 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( -24.646 16.257 3.689) 29.755 1.347 ( -10.405 17.856 18.628) 27.823 1.792 ( -8.374 -0.198 3.719) 9.165 1.944 ( 0.774 -4.504 0.096) 4.571 1.987 ( -7.479 -9.776 1.960) 12.463 2.063 ( 0.399 -1.066 -0.118) 1.145 2.079 ( -1.409 2.620 -1.506) 3.334 2.404 ( -6.514 -6.678 -0.125) 9.330 2.565 ( -6.610 3.119 3.014) 7.906 2.716 ( -9.276 -2.038 2.472) 9.814 2.804 ( 0.338 5.502 4.613) 7.188 2.913 ( -8.972 4.793 -0.291) 10.177 2.920 ( -6.190 28.609 1.559) 29.312 3.164 ( 0.167 4.063 5.363) 6.731 3.258 ( -8.438 6.959 -7.230) 13.111 3.291 ( -1.638 2.864 -0.851) 3.407 3.527 ( -1.820 -1.205 -1.552) 2.678 3.793 ( 0.861 2.086 -3.781) 4.403 3.911 ( 0.043 -1.146 -1.606) 1.974 4.003 ( 3.834 -6.767 1.264) 7.880 4.079 ( 6.622 4.524 3.961) 8.945 4.103 ( 2.016 5.217 0.885) 5.663 4.312 ( 0.486 2.131 -1.128) 2.460 4.369 ( 6.010 -1.642 0.062) 6.230 4.414 ( 3.749 -0.854 2.192) 4.426 4.478 ( 4.158 -5.131 0.659) 6.637 4.560 ( 3.605 -4.597 -2.148) 6.224 4.630 ( -2.066 -2.222 -5.673) 6.433 4.681 ( -3.229 0.337 2.386) 4.029 4.939 ( -3.772 -4.598 3.096) 6.705 5.103 ( 2.341 3.058 -1.389) 4.094 5.163 ( -3.689 5.545 3.883) 7.710 5.255 ( -9.998 5.035 -2.734) 11.523 5.313 ( 0.265 7.065 1.030) 7.144 5.328 ( 0.203 2.040 0.526) 2.116 5.429 ( 1.874 0.568 -2.083) 2.859 5.457 ( -2.706 1.718 1.037) 3.369 5.563 ( 2.158 1.479 -1.776) 3.162 5.574 ( 0.245 -0.519 -1.604) 1.704 5.655 ( -1.085 7.795 0.001) 7.870 5.696 ( -3.222 1.709 -1.257) 3.857 5.717 ( -0.820 -1.116 2.625) 2.968 5.824 ( 2.924 -1.824 0.399) 3.469 5.839 ( -0.461 -1.238 -2.536) 2.859 5.909 ( 0.680 -2.228 -2.160) 3.177 6.028 ( 0.676 -0.772 -2.779) 2.962 6.059 ( 0.828 -5.690 1.389) 5.916 6.111 ( 2.253 -2.924 -3.643) 5.186 6.196 ( -0.614 -0.268 -2.721) 2.802 6.271 ( 1.502 2.215 2.846) 3.907 6.330 ( -0.975 -6.457 -3.857) 7.585 6.372 ( 2.938 -1.764 0.753) 3.509 6.426 ( 0.403 2.460 1.873) 3.118 6.450 ( -1.816 2.408 1.638) 3.432 6.589 ( -1.934 -3.725 -3.471) 5.447 6.629 ( -2.229 -3.359 -1.145) 4.191 6.714 ( 4.011 0.083 -1.174) 4.180 6.760 ( -0.934 -1.521 0.745) 1.934 6.836 ( 4.250 -2.379 3.353) 5.913 6.909 ( 3.934 -2.772 2.187) 5.286 6.929 ( -2.241 -1.369 -0.161) 2.631 7.030 ( -1.827 -1.618 1.428) 2.828 7.065 ( -5.662 -1.307 -5.534) 8.024 7.187 ( -4.168 -1.417 -0.405) 4.421 7.315 ( 1.221 -2.741 1.108) 3.199 7.375 ( -5.327 -10.614 -8.865) 14.820 7.467 ( -4.596 3.756 -2.650) 6.500 7.546 ( -7.235 1.757 1.517) 7.598 7.705 ( -7.344 2.646 -1.050) 7.876 7.752 ( -2.378 0.424 -5.097) 5.640 7.993 ( -2.284 3.914 -2.961) 5.413 8.078 ( -1.180 2.459 -0.347) 2.750 8.185 ( -0.602 0.087 2.638) 2.707 8.253 ( -1.881 -4.711 -3.161) 5.977 8.418 ( 2.229 3.806 5.710) 7.215 8.510 ( 3.151 2.851 10.536) 11.361 8.543 ( -0.058 2.240 -0.112) 2.244 8.636 ( -2.473 -1.272 3.935) 4.819 8.653 ( 0.791 0.218 -1.656) 1.848 8.720 ( 2.008 0.476 -2.795) 3.475 8.865 ( 0.273 -1.683 -1.441) 2.232 8.941 ( -6.472 -4.981 7.408) 11.026 9.094 ( -3.855 0.404 -1.674) 4.222 9.145 ( 0.720 -1.260 -4.186) 4.430 9.305 ( 0.301 1.243 4.723) 4.894 9.321 ( 2.267 3.371 3.489) 5.355 9.470 ( 3.585 -0.905 -5.171) 6.357 9.599 ( -1.141 -7.431 9.757) 12.318 9.947 ( -2.727 -0.769 0.540) 2.884 10.010 ( -0.846 -3.145 1.032) 3.416 10.165 ( -2.199 -0.380 -1.127) 2.500 10.190 ( -2.054 -1.024 1.718) 2.867 10.402 ( -3.860 2.636 -2.127) 5.136 10.491 ( -2.383 -2.309 -3.610) 4.903 10.984 ( -2.490 19.818 -2.510) 20.131 11.787 ( -2.267 -18.541 -5.660) 19.518 16.357 ( -1.305 0.133 0.036) 1.312 16.368 ( -1.783 -0.354 0.394) 1.860 16.828 ( 1.017 -0.809 0.257) 1.325 16.832 ( 0.933 -0.918 -0.141) 1.316 17.470 ( 0.723 -1.096 -0.077) 1.315 17.497 ( 0.201 -1.907 0.266) 1.936 17.616 ( 1.697 0.862 0.519) 1.973 17.644 ( 1.303 0.022 0.496) 1.395 17.757 ( 2.121 -0.544 -0.850) 2.349 17.771 ( 1.500 -1.351 -0.830) 2.182 17.819 ( 0.450 0.191 0.552) 0.737 17.866 ( 1.442 -2.773 -0.240) 3.134 18.850 ( 2.951 11.584 -0.208) 11.955 18.948 ( 4.714 14.873 -1.954) 15.724 19.222 ( 2.153 -7.187 1.091) 7.581 19.379 ( 3.409 -6.726 -0.524) 7.559 21.257 ( -0.972 0.297 -0.011) 1.016 21.287 ( -2.951 -1.550 -0.403) 3.357 21.422 ( -0.217 0.015 -0.118) 0.247 21.428 ( -0.024 -0.208 -0.047) 0.215 21.947 ( -0.615 0.992 0.149) 1.176 21.976 ( -0.407 0.042 -0.520) 0.662 22.049 ( -0.076 0.388 -0.085) 0.404 22.090 ( -1.833 -1.695 0.222) 2.506 26.971 ( -0.107 1.874 0.042) 1.877 27.059 ( -0.213 0.952 -1.624) 1.895 27.069 ( 0.901 -1.259 1.327) 2.039 27.139 ( 0.942 -1.319 0.108) 1.625 27.689 ( 0.378 0.527 0.952) 1.152 27.704 ( 0.066 -0.090 0.228) 0.254 27.809 ( 1.146 0.624 0.565) 1.422 27.817 ( 1.308 0.309 -0.180) 1.356 35.770 ( 3.917 4.176 -0.930) 5.801 35.832 ( 3.870 1.562 1.665) 4.493 35.976 ( 5.948 1.000 6.852) 9.129 36.070 ( 3.940 -2.500 0.403) 4.684 36.301 ( 1.321 8.196 -3.593) 9.046 36.411 ( 0.967 4.867 1.671) 5.236 36.537 ( 2.854 -2.777 2.325) 4.612 36.862 ( -2.347 3.494 -4.135) 5.900 36.885 ( -11.568 -11.610 -0.883) 16.413 37.166 ( -5.254 10.199 11.049) 15.928 37.384 ( -16.500 -14.075 -3.995) 22.053 37.790 ( -5.758 -17.176 3.842) 18.518 39.549 ( -3.704 4.122 1.488) 5.738 39.652 ( -5.037 -1.364 1.580) 5.452 41.127 ( 8.095 10.674 -3.756) 13.913 41.422 ( 17.281 -0.331 -10.428) 20.186 ======================= Grid point 90 (48/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.283 ( 1.743 -18.017 3.144) 18.372 1.283 ( 1.743 18.017 3.144) 18.372 1.913 ( 0.253 -3.291 1.409) 3.588 1.913 ( 0.253 3.291 1.409) 3.588 2.032 ( -4.894 -14.322 11.711) 19.137 2.032 ( -4.894 14.322 11.711) 19.137 2.113 ( 1.548 -3.427 3.885) 5.407 2.113 ( 1.548 3.427 3.885) 5.407 2.561 ( -0.776 -4.432 3.374) 5.623 2.561 ( -0.776 4.432 3.374) 5.623 2.885 ( 1.752 -2.683 7.401) 8.065 2.885 ( 1.752 2.683 7.401) 8.065 3.102 ( -2.446 -0.725 -4.896) 5.521 3.102 ( -2.446 0.725 -4.896) 5.521 3.442 ( 4.252 -10.565 -4.460) 12.231 3.442 ( 4.252 10.565 -4.460) 12.231 3.665 ( 0.527 -13.620 -4.200) 14.263 3.665 ( 0.527 13.620 -4.200) 14.263 3.937 ( 1.439 -3.236 3.510) 4.986 3.937 ( 1.439 3.236 3.510) 4.986 4.170 ( -4.334 -7.958 -4.168) 9.974 4.170 ( -4.334 7.958 -4.168) 9.974 4.397 ( 0.539 -8.451 1.321) 8.571 4.397 ( 0.539 8.451 1.321) 8.571 4.469 ( 2.201 -6.354 0.956) 6.792 4.469 ( 2.201 6.354 0.956) 6.792 4.563 ( 4.203 -2.680 5.042) 7.090 4.563 ( 4.203 2.680 5.042) 7.090 4.784 ( -2.280 -9.820 11.051) 14.958 4.784 ( -2.280 9.820 11.051) 14.958 5.071 ( -2.033 -3.483 -4.465) 6.016 5.071 ( -2.033 3.483 -4.465) 6.016 5.300 ( 0.100 -3.823 -2.988) 4.853 5.300 ( 0.100 3.823 -2.988) 4.853 5.445 ( -3.823 -2.155 -0.148) 4.391 5.445 ( -3.823 2.155 -0.148) 4.391 5.478 ( -1.226 -2.812 -0.577) 3.121 5.478 ( -1.226 2.812 -0.577) 3.121 5.675 ( 1.272 -4.124 -0.394) 4.334 5.675 ( 1.272 4.124 -0.394) 4.334 5.702 ( 2.332 -4.466 -1.996) 5.419 5.702 ( 2.332 4.466 -1.996) 5.419 5.870 ( 0.376 -7.403 0.451) 7.426 5.870 ( 0.376 7.403 0.451) 7.426 5.926 ( 4.696 -5.112 0.483) 6.958 5.926 ( 4.696 5.112 0.483) 6.958 6.033 ( 0.788 -2.992 -1.470) 3.425 6.033 ( 0.788 2.992 -1.470) 3.425 6.233 ( -0.805 -7.407 -4.268) 8.587 6.233 ( -0.805 7.407 -4.268) 8.587 6.339 ( 0.880 -4.395 -4.333) 6.234 6.339 ( 0.880 4.395 -4.333) 6.234 6.436 ( -2.837 -1.419 -1.140) 3.370 6.436 ( -2.837 1.419 -1.140) 3.370 6.479 ( -3.212 -2.081 -0.025) 3.827 6.479 ( -3.212 2.081 -0.025) 3.827 6.715 ( -0.588 -2.400 -2.641) 3.616 6.715 ( -0.588 2.400 -2.641) 3.616 6.805 ( -3.856 -1.526 -0.769) 4.218 6.805 ( -3.856 1.526 -0.769) 4.218 6.957 ( -1.698 -2.301 -1.731) 3.343 6.957 ( -1.698 2.301 -1.731) 3.343 7.124 ( 9.055 -2.360 0.762) 9.389 7.124 ( 9.055 2.360 0.762) 9.389 7.296 ( -0.260 -3.151 -0.605) 3.219 7.296 ( -0.260 3.151 -0.605) 3.219 7.421 ( -1.428 -3.914 -7.777) 8.823 7.421 ( -1.428 3.914 -7.777) 8.823 7.712 ( 2.376 -1.627 1.661) 3.325 7.712 ( 2.376 1.627 1.661) 3.325 7.986 ( -3.864 -4.308 -5.379) 7.900 7.986 ( -3.864 4.308 -5.379) 7.900 8.165 ( -0.039 -1.813 1.457) 2.326 8.165 ( -0.039 1.813 1.457) 2.326 8.569 ( -0.899 -1.446 1.489) 2.262 8.569 ( -0.899 1.446 1.489) 2.262 8.646 ( -0.184 -4.967 7.153) 8.711 8.646 ( -0.184 4.967 7.153) 8.711 8.729 ( 0.982 -3.617 4.146) 5.590 8.729 ( 0.982 3.617 4.146) 5.590 8.850 ( 0.463 -4.590 3.608) 5.856 8.850 ( 0.463 4.590 3.608) 5.856 9.065 ( -1.404 -2.569 -2.635) 3.939 9.065 ( -1.404 2.569 -2.635) 3.939 9.409 ( -2.507 -6.267 3.576) 7.639 9.409 ( -2.507 6.267 3.576) 7.639 9.474 ( 2.373 -5.134 0.330) 5.665 9.474 ( 2.373 5.134 0.330) 5.665 9.978 ( 0.411 -2.437 3.985) 4.690 9.978 ( 0.411 2.437 3.985) 4.690 10.189 ( 2.140 -2.080 3.494) 4.595 10.189 ( 2.140 2.080 3.494) 4.595 10.426 ( 2.221 -3.196 -0.534) 3.928 10.426 ( 2.221 3.196 -0.534) 3.928 11.271 ( -2.715 -18.350 -12.293) 22.253 11.271 ( -2.715 18.350 -12.293) 22.253 16.350 ( -0.023 -0.075 0.341) 0.350 16.350 ( -0.023 0.075 0.341) 0.350 16.826 ( -0.189 -0.083 -0.278) 0.346 16.826 ( -0.189 0.083 -0.278) 0.346 17.469 ( -0.211 -0.753 0.250) 0.820 17.469 ( -0.211 0.753 0.250) 0.820 17.657 ( -0.475 -0.592 0.838) 1.131 17.657 ( -0.475 0.592 0.838) 1.131 17.767 ( 1.022 -0.353 -1.030) 1.494 17.767 ( 1.022 0.353 -1.030) 1.494 17.836 ( -0.225 -1.295 0.092) 1.317 17.836 ( -0.225 1.295 0.092) 1.317 19.091 ( 0.416 -9.548 1.382) 9.656 19.091 ( 0.416 9.548 1.382) 9.656 19.221 ( -0.281 -10.818 -2.282) 11.059 19.221 ( -0.281 10.818 -2.282) 11.059 21.253 ( -0.043 -0.325 -0.028) 0.329 21.253 ( -0.043 0.325 -0.028) 0.329 21.422 ( 0.050 -0.156 -0.108) 0.196 21.422 ( 0.050 0.156 -0.108) 0.196 21.961 ( 0.008 -0.815 0.119) 0.823 21.961 ( 0.008 0.815 0.119) 0.823 22.052 ( -0.257 -0.069 -0.579) 0.637 22.052 ( -0.257 0.069 -0.579) 0.637 27.012 ( -0.034 -1.984 -0.252) 2.001 27.012 ( -0.034 1.984 -0.252) 2.001 27.115 ( 0.035 -1.653 0.053) 1.654 27.115 ( 0.035 1.653 0.053) 1.654 27.704 ( -0.256 -0.293 0.716) 0.815 27.704 ( -0.256 0.293 0.716) 0.815 27.828 ( -0.187 -0.357 -0.049) 0.406 27.828 ( -0.187 0.357 -0.049) 0.406 35.855 ( -1.051 -2.063 -0.682) 2.414 35.855 ( -1.051 2.063 -0.682) 2.414 36.130 ( 2.067 -4.439 8.107) 9.471 36.130 ( 2.067 4.439 8.107) 9.471 36.492 ( 2.418 -1.990 -1.153) 3.338 36.492 ( 2.418 1.990 -1.153) 3.338 36.575 ( 1.050 -3.248 3.770) 5.086 36.575 ( 1.050 3.248 3.770) 5.086 36.918 ( -4.599 -10.464 -5.001) 12.476 36.918 ( -4.599 10.464 -5.001) 12.476 37.468 ( 0.969 -12.886 5.616) 14.090 37.468 ( 0.969 12.886 5.616) 14.090 39.599 ( 0.025 -1.942 3.081) 3.642 39.599 ( 0.025 1.942 3.081) 3.642 41.345 ( 0.408 -8.429 -9.764) 12.905 41.345 ( 0.408 8.429 -9.764) 12.905 ======================= Grid point 92 (49/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.528 ( 19.205 -10.070 0.615) 21.694 1.528 ( 19.205 10.070 0.615) 21.694 1.908 ( -0.485 -6.774 5.980) 9.049 1.908 ( -0.485 6.774 5.980) 9.049 2.026 ( -0.650 -1.893 0.626) 2.097 2.026 ( -0.650 1.893 0.626) 2.097 2.247 ( 5.366 -14.615 7.588) 17.320 2.247 ( 5.366 14.615 7.588) 17.320 2.711 ( 6.299 -10.442 12.267) 17.298 2.711 ( 6.299 10.442 12.267) 17.298 2.988 ( 1.885 -5.523 4.173) 7.175 2.988 ( 1.885 5.523 4.173) 7.175 3.085 ( 5.916 -7.096 -2.325) 9.527 3.085 ( 5.916 7.096 -2.325) 9.527 3.438 ( 1.975 -9.407 -7.925) 12.458 3.438 ( 1.975 9.407 -7.925) 12.458 3.654 ( 2.165 -8.794 -3.877) 9.852 3.654 ( 2.165 8.794 -3.877) 9.852 3.991 ( 0.080 -2.101 3.804) 4.346 3.991 ( 0.080 2.101 3.804) 4.346 4.047 ( -5.221 -12.746 -1.999) 13.918 4.047 ( -5.221 12.746 -1.999) 13.918 4.394 ( -1.770 -6.186 -1.224) 6.550 4.394 ( -1.770 6.186 -1.224) 6.550 4.495 ( -0.416 -4.961 1.372) 5.164 4.495 ( -0.416 4.961 1.372) 5.164 4.606 ( -1.176 -1.493 3.749) 4.203 4.606 ( -1.176 1.493 3.749) 4.203 4.911 ( 2.918 -8.851 9.720) 13.466 4.911 ( 2.918 8.851 9.720) 13.466 5.091 ( 7.537 -3.662 -2.917) 8.873 5.091 ( 7.537 3.662 -2.917) 8.873 5.220 ( -3.389 -4.598 -5.499) 7.929 5.220 ( -3.389 4.598 -5.499) 7.929 5.331 ( -4.456 -3.133 -1.234) 5.585 5.331 ( -4.456 3.133 -1.234) 5.585 5.514 ( 0.476 -4.916 -1.360) 5.123 5.514 ( 0.476 4.916 -1.360) 5.123 5.675 ( -0.122 -2.426 2.333) 3.368 5.675 ( -0.122 2.426 2.333) 3.368 5.755 ( 4.325 -8.185 -1.524) 9.382 5.755 ( 4.325 8.185 -1.524) 9.382 5.867 ( 0.796 -5.389 -2.350) 5.933 5.867 ( 0.796 5.389 -2.350) 5.933 5.983 ( -2.539 -5.903 -0.817) 6.478 5.983 ( -2.539 5.903 -0.817) 6.478 6.050 ( 2.922 -3.658 1.449) 4.901 6.050 ( 2.922 3.658 1.449) 4.901 6.144 ( 1.155 -11.709 -3.639) 12.315 6.144 ( 1.155 11.709 -3.639) 12.315 6.294 ( -0.033 -1.210 -4.429) 4.592 6.294 ( -0.033 1.210 -4.429) 4.592 6.412 ( -1.951 -1.305 -0.953) 2.534 6.412 ( -1.951 1.305 -0.953) 2.534 6.483 ( 3.362 -2.384 2.539) 4.841 6.483 ( 3.362 2.384 2.539) 4.841 6.686 ( -2.860 -3.035 0.917) 4.270 6.686 ( -2.860 3.035 0.917) 4.270 6.778 ( 1.004 -3.648 -0.156) 3.787 6.778 ( 1.004 3.648 -0.156) 3.787 6.902 ( -3.035 -2.378 -1.387) 4.098 6.902 ( -3.035 2.378 -1.387) 4.098 7.174 ( -1.903 -3.069 -2.114) 4.184 7.174 ( -1.903 3.069 -2.114) 4.184 7.280 ( 2.914 -2.475 -12.190) 12.775 7.280 ( 2.914 2.475 -12.190) 12.775 7.409 ( 6.712 -4.144 -0.597) 7.911 7.409 ( 6.712 4.144 -0.597) 7.911 7.816 ( 2.291 -2.766 -0.560) 3.635 7.816 ( 2.291 2.766 -0.560) 3.635 7.889 ( 1.793 -2.910 -1.086) 3.587 7.889 ( 1.793 2.910 -1.086) 3.587 8.208 ( 1.740 -4.010 3.593) 5.658 8.208 ( 1.740 4.010 3.593) 5.658 8.547 ( -1.451 -0.714 -0.584) 1.720 8.547 ( -1.451 0.714 -0.584) 1.720 8.661 ( -2.614 -6.810 4.023) 8.330 8.661 ( -2.614 6.810 4.023) 8.330 8.783 ( 0.736 -1.667 2.234) 2.883 8.783 ( 0.736 1.667 2.234) 2.883 8.945 ( 2.717 -5.004 7.446) 9.374 8.945 ( 2.717 5.004 7.446) 9.374 9.031 ( 1.030 -4.337 -2.455) 5.089 9.031 ( 1.030 4.337 -2.455) 5.089 9.354 ( -4.438 -5.711 0.196) 7.236 9.354 ( -4.438 5.711 0.196) 7.236 9.555 ( 4.075 -7.015 3.043) 8.665 9.555 ( 4.075 7.015 3.043) 8.665 10.030 ( 0.854 -2.220 4.124) 4.760 10.030 ( 0.854 2.220 4.124) 4.760 10.271 ( 3.570 -3.567 1.614) 5.298 10.271 ( 3.570 3.567 1.614) 5.298 10.522 ( 7.027 -6.508 2.653) 9.939 10.522 ( 7.027 6.508 2.653) 9.939 11.118 ( 0.483 -12.580 -13.130) 18.190 11.118 ( 0.483 12.580 -13.130) 18.190 16.366 ( 1.560 -0.291 0.340) 1.623 16.366 ( 1.560 0.291 0.340) 1.623 16.811 ( -1.205 -0.417 -0.176) 1.287 16.811 ( -1.205 0.417 -0.176) 1.287 17.467 ( -0.252 -0.679 0.312) 0.789 17.467 ( -0.252 0.679 0.312) 0.789 17.640 ( -2.185 -0.654 1.058) 2.514 17.640 ( -2.185 0.654 1.058) 2.514 17.764 ( -0.294 -0.192 -1.453) 1.495 17.764 ( -0.294 0.192 -1.453) 1.495 17.824 ( -1.334 -1.393 0.246) 1.944 17.824 ( -1.334 1.393 0.246) 1.944 19.090 ( -2.324 -10.297 1.835) 10.715 19.090 ( -2.324 10.297 1.835) 10.715 19.159 ( -3.671 -11.055 -2.640) 11.944 19.159 ( -3.671 11.055 -2.640) 11.944 21.263 ( 1.119 -0.464 -0.144) 1.220 21.263 ( 1.119 0.464 -0.144) 1.220 21.424 ( 0.339 -0.095 -0.077) 0.360 21.424 ( 0.339 0.095 -0.077) 0.360 21.968 ( 0.699 -0.810 0.090) 1.074 21.968 ( 0.699 0.810 0.090) 1.074 22.048 ( 0.384 -1.051 -0.445) 1.205 22.048 ( 0.384 1.051 -0.445) 1.205 27.010 ( -0.006 -1.021 -0.241) 1.049 27.010 ( -0.006 1.021 -0.241) 1.049 27.108 ( -0.821 -0.671 0.069) 1.063 27.108 ( -0.821 0.671 0.069) 1.063 27.703 ( -0.609 -0.563 0.704) 1.088 27.703 ( -0.609 0.563 0.704) 1.088 27.815 ( -1.153 -0.656 0.099) 1.330 27.815 ( -1.153 0.656 0.099) 1.330 35.815 ( -2.647 -0.755 0.215) 2.761 35.815 ( -2.647 0.755 0.215) 2.761 36.183 ( -3.395 -6.731 6.878) 10.205 36.183 ( -3.395 6.731 6.878) 10.205 36.444 ( -5.576 -4.200 -1.730) 7.192 36.444 ( -5.576 4.200 -1.730) 7.192 36.664 ( -2.569 -14.179 1.310) 14.469 36.664 ( -2.569 14.179 1.310) 14.469 36.912 ( 13.764 -5.372 -2.801) 15.039 36.912 ( 13.764 5.372 -2.801) 15.039 37.586 ( 6.429 -11.283 4.908) 13.883 37.586 ( 6.429 11.283 4.908) 13.883 39.666 ( 4.078 -1.293 3.271) 5.385 39.666 ( 4.078 1.293 3.271) 5.385 41.179 ( -8.432 -5.294 -9.140) 13.515 41.179 ( -8.432 5.294 -9.140) 13.515 ======================= Grid point 94 (50/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.754 ( 3.939 -3.123 0.862) 5.101 1.754 ( 3.939 3.123 0.862) 5.101 1.957 ( 0.642 -1.556 3.633) 4.005 1.957 ( 0.642 1.556 3.633) 4.005 2.146 ( 14.381 -7.411 -0.864) 16.201 2.146 ( 14.381 7.411 -0.864) 16.201 2.452 ( 10.093 -7.936 6.462) 14.374 2.452 ( 10.093 7.937 6.462) 14.374 2.876 ( 0.352 -7.543 8.453) 11.335 2.876 ( 0.352 7.543 8.453) 11.335 3.040 ( 2.646 -10.316 -0.861) 10.685 3.040 ( 2.646 10.316 -0.861) 10.685 3.209 ( 7.222 -3.891 -0.175) 8.205 3.209 ( 7.222 3.891 -0.175) 8.205 3.412 ( 3.324 -6.190 -3.318) 7.770 3.412 ( 3.324 6.190 -3.318) 7.770 3.657 ( 2.939 -8.764 -5.066) 10.541 3.657 ( 2.939 8.764 -5.066) 10.541 3.950 ( -3.213 -10.012 0.080) 10.515 3.950 ( -3.213 10.012 0.080) 10.515 4.024 ( -1.024 -4.437 3.637) 5.827 4.024 ( -1.024 4.437 3.637) 5.827 4.303 ( -4.150 -8.131 -3.691) 9.847 4.303 ( -4.150 8.131 -3.691) 9.847 4.507 ( -1.377 -3.332 2.828) 4.583 4.507 ( -1.377 3.332 2.828) 4.583 4.672 ( 4.965 -4.127 0.174) 6.459 4.672 ( 4.965 4.127 0.174) 6.459 4.933 ( -4.540 -7.992 -1.634) 9.335 4.933 ( -4.540 7.992 -1.634) 9.335 5.119 ( -0.062 -5.584 -1.575) 5.803 5.119 ( -0.062 5.584 -1.575) 5.803 5.242 ( 7.639 -5.275 -1.361) 9.382 5.242 ( 7.639 5.275 -1.361) 9.382 5.305 ( -0.733 -6.756 3.475) 7.632 5.305 ( -0.733 6.756 3.475) 7.632 5.455 ( -3.684 -4.416 -0.927) 5.825 5.455 ( -3.684 4.416 -0.927) 5.825 5.691 ( 1.348 -2.651 0.114) 2.976 5.691 ( 1.348 2.651 0.114) 2.976 5.800 ( 2.036 -4.460 -2.121) 5.342 5.800 ( 2.036 4.460 -2.121) 5.342 5.893 ( 1.195 -1.159 1.208) 2.057 5.893 ( 1.195 1.159 1.208) 2.057 5.957 ( 2.554 -9.343 0.338) 9.692 5.957 ( 2.554 9.343 0.338) 9.692 6.072 ( 1.354 -7.701 -2.765) 8.294 6.072 ( 1.354 7.701 -2.765) 8.294 6.199 ( 0.775 -7.622 0.303) 7.668 6.199 ( 0.775 7.622 0.303) 7.668 6.279 ( 0.884 -4.137 0.990) 4.344 6.279 ( 0.884 4.137 0.990) 4.344 6.363 ( 1.728 -1.724 -5.838) 6.327 6.363 ( 1.728 1.724 -5.838) 6.327 6.584 ( 3.522 -4.104 3.670) 6.536 6.584 ( 3.522 4.104 3.670) 6.536 6.647 ( -3.792 -4.535 4.916) 7.689 6.647 ( -3.792 4.535 4.916) 7.689 6.773 ( -3.213 -0.413 0.817) 3.340 6.773 ( -3.213 0.413 0.817) 3.340 6.885 ( 3.624 -2.960 0.610) 4.719 6.885 ( 3.624 2.960 0.610) 4.719 7.092 ( -2.401 -5.483 -7.298) 9.438 7.092 ( -2.401 5.483 -7.298) 9.438 7.222 ( 2.172 -2.451 -6.921) 7.656 7.222 ( 2.172 2.451 -6.921) 7.656 7.539 ( 6.425 -1.450 1.296) 6.713 7.539 ( 6.425 1.450 1.296) 6.713 7.723 ( -4.252 -2.615 -3.748) 6.242 7.723 ( -4.252 2.615 -3.748) 6.242 8.045 ( 8.669 -7.403 2.346) 11.638 8.045 ( 8.669 7.403 2.346) 11.638 8.253 ( 0.094 -3.630 0.733) 3.705 8.253 ( 0.094 3.630 0.733) 3.705 8.529 ( -0.028 -1.386 0.506) 1.476 8.529 ( -0.028 1.386 0.506) 1.476 8.653 ( -1.447 -6.389 1.744) 6.779 8.653 ( -1.447 6.389 1.744) 6.779 8.794 ( -0.803 -1.495 0.748) 1.854 8.794 ( -0.803 1.495 0.748) 1.854 8.996 ( -0.429 -2.396 1.520) 2.869 8.996 ( -0.429 2.396 1.520) 2.869 9.117 ( 7.292 -6.945 2.634) 10.409 9.117 ( 7.292 6.945 2.634) 10.409 9.294 ( -2.231 -5.089 0.498) 5.579 9.294 ( -2.231 5.089 0.498) 5.579 9.639 ( 1.908 -8.176 2.922) 8.889 9.639 ( 1.908 8.176 2.922) 8.889 10.069 ( -0.221 -3.550 2.187) 4.175 10.069 ( -0.221 3.550 2.187) 4.175 10.334 ( 3.824 -4.470 -1.638) 6.106 10.334 ( 3.824 4.470 -1.638) 6.106 10.644 ( 7.751 -4.818 -4.872) 10.346 10.644 ( 7.751 4.818 -4.872) 10.346 11.106 ( 5.400 -1.415 -0.287) 5.590 11.106 ( 5.400 1.415 -0.287) 5.590 16.410 ( 3.287 -0.526 0.202) 3.335 16.410 ( 3.287 0.526 0.202) 3.335 16.782 ( -2.277 -0.646 0.192) 2.374 16.782 ( -2.277 0.646 0.192) 2.374 17.466 ( -0.137 -0.810 0.261) 0.862 17.466 ( -0.137 0.810 0.261) 0.862 17.614 ( -2.012 -0.504 1.454) 2.532 17.614 ( -2.012 0.504 1.454) 2.532 17.725 ( -2.250 -0.294 -2.399) 3.302 17.725 ( -2.250 0.294 -2.399) 3.302 17.799 ( -1.990 -1.232 0.620) 2.421 17.799 ( -1.990 1.232 0.620) 2.421 19.044 ( -4.336 -7.840 0.529) 8.975 19.044 ( -4.336 7.840 0.529) 8.975 19.072 ( -3.748 -8.379 -1.075) 9.242 19.072 ( -3.748 8.379 -1.075) 9.242 21.284 ( 1.517 -0.426 -0.140) 1.582 21.284 ( 1.517 0.426 -0.140) 1.582 21.430 ( 0.282 -0.267 -0.076) 0.395 21.430 ( 0.282 0.267 -0.076) 0.395 21.984 ( 1.067 -0.713 -0.044) 1.284 21.984 ( 1.067 0.713 -0.044) 1.284 22.055 ( 0.557 -1.687 0.057) 1.777 22.055 ( 0.557 1.687 0.057) 1.777 27.008 ( 0.000 -0.975 -0.101) 0.980 27.008 ( 0.000 0.975 -0.101) 0.980 27.093 ( -0.898 -1.298 0.004) 1.578 27.093 ( -0.898 1.298 0.004) 1.578 27.698 ( -0.561 -0.673 0.605) 1.064 27.698 ( -0.561 0.673 0.605) 1.064 27.794 ( -1.481 -1.048 0.220) 1.828 27.794 ( -1.481 1.048 0.220) 1.828 35.781 ( -1.782 -1.006 0.884) 2.229 35.781 ( -1.782 1.006 0.884) 2.229 36.165 ( -4.829 -8.304 3.689) 10.290 36.165 ( -4.829 8.304 3.689) 10.290 36.289 ( -8.944 -4.593 -2.251) 10.304 36.289 ( -8.944 4.593 -2.251) 10.304 36.558 ( -5.697 -9.349 -2.818) 11.305 36.558 ( -5.697 9.349 -2.818) 11.305 37.219 ( 18.445 -8.142 1.679) 20.232 37.219 ( 18.445 8.142 1.679) 20.232 37.752 ( 8.465 -16.287 1.954) 18.459 37.752 ( 8.465 16.287 1.954) 18.459 39.792 ( 7.718 -0.988 1.773) 7.980 39.792 ( 7.718 0.988 1.773) 7.980 40.925 ( -12.831 -4.056 -4.739) 14.267 40.925 ( -12.831 4.056 -4.739) 14.267 ======================= Grid point 96 (51/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.754 ( -1.635 -5.426 -0.036) 5.667 1.754 ( -1.635 5.426 -0.036) 5.667 1.995 ( 1.032 -0.425 -0.317) 1.160 1.995 ( 1.032 0.425 -0.317) 1.160 2.394 ( 12.398 -1.853 1.066) 12.581 2.394 ( 12.398 1.853 1.066) 12.581 2.627 ( 4.118 -2.573 2.843) 5.626 2.627 ( 4.118 2.573 2.843) 5.626 2.891 ( -3.311 -2.816 -0.153) 4.349 2.891 ( -3.311 2.816 -0.153) 4.349 3.049 ( 2.705 -10.665 -5.699) 12.391 3.049 ( 2.705 10.665 -5.699) 12.391 3.278 ( 2.461 -6.889 0.846) 7.364 3.278 ( 2.461 6.889 0.846) 7.364 3.540 ( 8.296 -5.558 3.064) 10.446 3.540 ( 8.296 5.558 3.064) 10.446 3.658 ( 3.619 -10.094 -3.894) 11.408 3.658 ( 3.619 10.094 -3.894) 11.408 3.912 ( -1.397 -4.190 -0.803) 4.489 3.912 ( -1.397 4.190 -0.803) 4.489 4.043 ( -0.550 -4.189 -0.593) 4.266 4.043 ( -0.550 4.189 -0.593) 4.266 4.235 ( -1.010 -7.528 0.436) 7.608 4.235 ( -1.010 7.528 0.436) 7.608 4.483 ( -1.519 -6.537 -0.589) 6.737 4.483 ( -1.519 6.537 -0.589) 6.737 4.712 ( -1.743 -3.732 1.822) 4.504 4.712 ( -1.743 3.732 1.822) 4.504 4.846 ( -0.680 -3.234 -3.521) 4.829 4.846 ( -0.680 3.234 -3.521) 4.829 5.159 ( 4.264 -5.630 -1.385) 7.197 5.159 ( 4.264 5.630 -1.385) 7.197 5.268 ( -1.521 -1.387 0.518) 2.123 5.268 ( -1.521 1.387 0.518) 2.123 5.362 ( 2.513 -5.422 2.873) 6.631 5.362 ( 2.513 5.422 2.873) 6.631 5.448 ( 1.295 -2.920 3.656) 4.855 5.448 ( 1.295 2.920 3.656) 4.855 5.731 ( 0.955 -4.287 0.075) 4.392 5.731 ( 0.955 4.287 0.075) 4.392 5.781 ( -0.367 -4.191 -3.728) 5.621 5.781 ( -0.367 4.191 -3.728) 5.621 5.877 ( -1.218 -4.777 -0.399) 4.946 5.877 ( -1.219 4.777 -0.399) 4.946 6.000 ( -1.290 -6.358 -0.368) 6.498 6.000 ( -1.290 6.358 -0.368) 6.498 6.106 ( 4.786 -3.509 -0.406) 5.949 6.106 ( 4.786 3.509 -0.406) 5.949 6.182 ( -0.559 -5.733 -1.394) 5.927 6.182 ( -0.559 5.733 -1.394) 5.927 6.282 ( 1.707 -6.349 0.313) 6.582 6.282 ( 1.707 6.349 0.313) 6.582 6.392 ( 2.670 -2.142 -3.088) 4.610 6.392 ( 2.670 2.142 -3.088) 4.610 6.616 ( -0.101 -1.390 -0.728) 1.572 6.616 ( -0.101 1.390 -0.728) 1.572 6.645 ( -0.536 -7.500 1.771) 7.725 6.645 ( -0.536 7.500 1.771) 7.725 6.791 ( -0.811 -3.206 7.369) 8.077 6.791 ( -0.811 3.206 7.369) 8.077 6.937 ( -2.807 -6.988 1.451) 7.669 6.937 ( -2.807 6.988 1.451) 7.669 7.041 ( 5.687 -1.078 -0.540) 5.813 7.041 ( 5.687 1.078 -0.540) 5.813 7.214 ( 1.500 -3.140 -2.816) 4.477 7.214 ( 1.500 3.140 -2.816) 4.477 7.583 ( -2.366 -2.584 1.322) 3.744 7.583 ( -2.366 2.584 1.322) 3.744 7.703 ( 2.684 -2.507 3.165) 4.848 7.703 ( 2.684 2.507 3.165) 4.848 8.159 ( 2.962 -5.049 -2.659) 6.429 8.159 ( 2.962 5.049 -2.659) 6.429 8.242 ( 0.126 -2.719 1.190) 2.971 8.242 ( 0.126 2.719 1.190) 2.971 8.544 ( 0.731 -2.736 -0.954) 2.988 8.544 ( 0.731 2.736 -0.954) 2.988 8.645 ( -0.215 -3.487 -0.135) 3.496 8.645 ( -0.215 3.487 -0.135) 3.496 8.788 ( -0.149 -1.090 0.699) 1.304 8.788 ( -0.149 1.090 0.699) 1.304 9.003 ( -0.744 -3.886 2.509) 4.685 9.003 ( -0.744 3.886 2.509) 4.685 9.212 ( 1.688 -4.862 -2.203) 5.598 9.212 ( 1.688 4.862 -2.203) 5.598 9.340 ( 5.906 -7.404 3.281) 10.023 9.340 ( 5.906 7.404 3.281) 10.023 9.661 ( -0.469 -9.696 -1.321) 9.797 9.661 ( -0.469 9.696 -1.321) 9.797 10.057 ( -1.270 -2.447 -1.033) 2.944 10.057 ( -1.270 2.447 -1.033) 2.944 10.371 ( 3.585 -6.591 -3.126) 8.127 10.371 ( 3.585 6.591 -3.126) 8.127 10.748 ( 11.031 -2.138 -5.835) 12.661 10.748 ( 11.031 2.138 -5.835) 12.661 11.209 ( 0.782 -7.611 6.233) 9.868 11.209 ( 0.782 7.611 6.233) 9.868 16.480 ( 4.665 -0.487 -0.111) 4.692 16.480 ( 4.665 0.487 -0.111) 4.692 16.735 ( -3.538 -0.534 0.408) 3.601 16.735 ( -3.538 0.534 0.408) 3.601 17.466 ( 0.094 -0.924 -0.124) 0.937 17.466 ( 0.094 0.924 -0.124) 0.937 17.603 ( -1.257 -0.648 1.966) 2.422 17.603 ( -1.257 0.648 1.966) 2.422 17.652 ( -2.701 -0.545 -2.816) 3.940 17.652 ( -2.701 0.545 -2.816) 3.940 17.770 ( -1.935 -0.797 0.484) 2.148 17.770 ( -1.935 0.797 0.484) 2.148 18.978 ( -2.804 -8.112 -0.298) 8.588 18.978 ( -2.804 8.112 -0.298) 8.588 19.010 ( -3.315 -8.824 0.462) 9.438 19.010 ( -3.315 8.824 0.462) 9.438 21.309 ( 1.340 -0.654 0.097) 1.494 21.309 ( 1.340 0.654 0.097) 1.494 21.431 ( 0.019 -0.892 -0.122) 0.900 21.431 ( 0.019 0.892 -0.122) 0.900 22.002 ( 1.023 -0.525 -0.125) 1.157 22.002 ( 1.023 0.525 -0.125) 1.157 22.064 ( 0.211 -1.951 0.433) 2.009 22.064 ( 0.211 1.951 0.433) 2.009 27.008 ( 0.000 -1.807 0.057) 1.807 27.008 ( 0.000 1.807 0.057) 1.807 27.080 ( -0.536 -2.188 -0.099) 2.255 27.080 ( -0.536 2.188 -0.099) 2.255 27.697 ( -0.165 -0.357 0.473) 0.615 27.697 ( -0.165 0.357 0.473) 0.615 27.769 ( -1.445 -1.308 -0.111) 1.952 27.769 ( -1.445 1.308 -0.111) 1.952 35.772 ( -0.091 -1.387 0.593) 1.511 35.772 ( -0.091 1.387 0.593) 1.511 36.024 ( -8.441 -3.337 -5.811) 10.778 36.024 ( -8.441 3.337 -5.811) 10.778 36.203 ( -3.584 -8.906 5.119) 10.880 36.203 ( -3.584 8.906 5.119) 10.880 36.449 ( -4.401 -5.997 -1.472) 7.583 36.449 ( -4.401 5.997 -1.472) 7.583 37.513 ( 13.146 -14.033 1.764) 19.309 37.513 ( 13.146 14.033 1.764) 19.309 37.891 ( 6.878 -20.870 -1.067) 22.000 37.891 ( 6.878 20.870 -1.067) 22.000 39.960 ( 10.945 -2.520 0.133) 11.232 39.960 ( 10.945 2.520 0.133) 11.232 40.668 ( -14.272 -3.876 -0.446) 14.796 40.668 ( -14.272 3.876 -0.446) 14.796 ======================= Grid point 98 (52/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.735 ( -0.780 -6.512 0.725) 6.598 1.735 ( -0.780 6.512 0.725) 6.598 1.988 ( 0.457 -1.705 -3.428) 3.856 1.988 ( 0.457 1.705 -3.428) 3.856 2.523 ( 0.539 -9.571 -2.226) 9.841 2.523 ( 0.539 9.571 -2.226) 9.841 2.674 ( 1.494 -1.135 0.821) 2.048 2.674 ( 1.494 1.135 0.821) 2.048 2.779 ( -2.084 -3.316 -8.042) 8.945 2.779 ( -2.084 3.316 -8.042) 8.945 3.067 ( 3.563 -6.617 -3.099) 8.129 3.067 ( 3.563 6.617 -3.099) 8.129 3.351 ( -0.162 -15.134 9.931) 18.102 3.351 ( -0.162 15.134 9.931) 18.102 3.528 ( -0.945 -7.958 -10.622) 13.306 3.528 ( -0.945 7.958 -10.622) 13.306 3.823 ( 5.509 -5.386 4.517) 8.931 3.823 ( 5.509 5.386 4.517) 8.931 3.899 ( 1.662 -3.915 -1.978) 4.690 3.899 ( 1.662 3.915 -1.978) 4.690 3.979 ( 0.402 -3.810 -5.102) 6.380 3.979 ( 0.402 3.810 -5.102) 6.380 4.218 ( -1.305 -6.854 -0.640) 7.007 4.218 ( -1.305 6.854 -0.640) 7.007 4.504 ( -1.490 -4.679 6.256) 7.953 4.504 ( -1.490 4.679 6.256) 7.953 4.692 ( 0.354 -5.229 2.098) 5.645 4.692 ( 0.354 5.229 2.098) 5.645 4.842 ( 1.847 -3.279 0.006) 3.763 4.842 ( 1.847 3.279 0.006) 3.763 5.164 ( -0.215 -6.102 -4.310) 7.474 5.164 ( -0.215 6.102 -4.310) 7.474 5.291 ( 0.006 -6.472 2.659) 6.997 5.291 ( 0.006 6.472 2.659) 6.997 5.423 ( 2.356 -5.852 1.342) 6.450 5.423 ( 2.356 5.852 1.342) 6.450 5.481 ( -1.194 -1.055 0.505) 1.671 5.481 ( -1.194 1.055 0.505) 1.671 5.675 ( -2.904 -2.252 0.580) 3.720 5.675 ( -2.904 2.252 0.580) 3.720 5.780 ( 2.058 -2.888 -4.156) 5.463 5.780 ( 2.058 2.888 -4.156) 5.463 5.875 ( 0.849 -1.558 -0.230) 1.789 5.875 ( 0.849 1.558 -0.230) 1.789 5.975 ( -1.250 -5.665 0.322) 5.810 5.975 ( -1.250 5.665 0.322) 5.810 6.135 ( -2.088 -1.096 0.398) 2.392 6.135 ( -2.088 1.096 0.398) 2.392 6.186 ( 3.999 -7.406 0.140) 8.418 6.186 ( 3.999 7.406 0.140) 8.418 6.326 ( -0.320 -4.501 -1.367) 4.715 6.326 ( -0.320 4.501 -1.367) 4.715 6.393 ( 3.210 -3.907 -2.683) 5.724 6.393 ( 3.210 3.907 -2.683) 5.724 6.576 ( -1.907 -1.067 -4.193) 4.728 6.576 ( -1.907 1.067 -4.193) 4.728 6.685 ( 2.395 -6.266 4.389) 8.017 6.685 ( 2.395 6.266 4.389) 8.017 6.816 ( -0.994 -3.746 1.508) 4.159 6.816 ( -0.994 3.746 1.508) 4.159 6.903 ( -4.001 -5.683 5.077) 8.608 6.903 ( -4.001 5.683 5.077) 8.608 7.136 ( 1.472 -3.213 -1.493) 3.836 7.136 ( 1.472 3.213 -1.493) 3.836 7.264 ( 4.103 -5.084 8.832) 10.986 7.264 ( 4.103 5.084 8.832) 10.986 7.598 ( -0.729 -1.674 8.467) 8.662 7.598 ( -0.729 1.674 8.467) 8.662 7.776 ( 0.424 -1.509 4.846) 5.093 7.776 ( 0.424 1.509 4.846) 5.093 8.142 ( 0.877 -3.524 -2.700) 4.525 8.142 ( 0.877 3.524 -2.700) 4.525 8.271 ( 0.983 -5.821 -0.219) 5.907 8.271 ( 0.983 5.821 -0.219) 5.907 8.516 ( -0.382 -3.343 -5.173) 6.170 8.516 ( -0.382 3.343 -5.173) 6.171 8.632 ( -1.011 -2.582 -1.376) 3.095 8.632 ( -1.011 2.582 -1.376) 3.095 8.810 ( 0.404 -5.030 3.001) 5.871 8.810 ( 0.404 5.030 3.001) 5.871 9.020 ( -0.482 -4.509 3.209) 5.556 9.020 ( -0.482 4.509 3.209) 5.556 9.194 ( -0.074 -2.965 -3.053) 4.257 9.194 ( -0.074 2.965 -3.053) 4.257 9.420 ( 0.149 -13.002 -3.229) 13.398 9.420 ( 0.149 13.002 -3.229) 13.398 9.619 ( 0.858 -13.260 -5.075) 14.224 9.619 ( 0.858 13.260 -5.075) 14.224 10.035 ( 0.071 -2.740 -0.918) 2.891 10.035 ( 0.071 2.740 -0.918) 2.891 10.410 ( 3.209 -7.715 -1.468) 8.484 10.410 ( 3.209 7.715 -1.468) 8.484 10.891 ( 9.587 -3.277 -3.727) 10.795 10.891 ( 9.587 3.277 -3.727) 10.795 11.212 ( -5.906 -6.765 4.924) 10.242 11.212 ( -5.906 6.765 4.924) 10.242 16.561 ( 4.792 -0.093 -0.349) 4.806 16.561 ( 4.792 0.093 -0.349) 4.806 16.667 ( -4.548 -0.213 0.081) 4.554 16.667 ( -4.548 0.213 0.081) 4.554 17.472 ( 0.807 -1.289 0.006) 1.521 17.472 ( 0.807 1.289 0.006) 1.521 17.564 ( -2.791 -0.485 -1.649) 3.278 17.564 ( -2.791 0.485 -1.649) 3.278 17.638 ( 1.266 -0.360 1.479) 1.980 17.638 ( 1.266 0.360 1.479) 1.980 17.742 ( -1.359 -0.351 -0.319) 1.439 17.742 ( -1.359 0.351 -0.319) 1.439 18.951 ( -0.614 -9.725 0.595) 9.762 18.951 ( -0.614 9.725 0.595) 9.762 18.972 ( -1.466 -10.438 0.519) 10.553 18.972 ( -1.466 10.438 0.519) 10.553 21.328 ( 0.533 -1.049 0.257) 1.204 21.328 ( 0.533 1.049 0.257) 1.204 21.430 ( 0.007 -1.379 -0.093) 1.382 21.430 ( 0.007 1.379 -0.093) 1.382 22.015 ( 0.545 -0.547 -0.065) 0.775 22.015 ( 0.545 0.547 -0.065) 0.775 22.069 ( -0.175 -1.886 0.496) 1.958 22.069 ( -0.175 1.886 0.496) 1.958 27.009 ( -0.001 -1.964 0.132) 1.968 27.009 ( -0.001 1.964 0.132) 1.968 27.073 ( -0.120 -2.322 -0.114) 2.328 27.073 ( -0.120 2.322 -0.114) 2.328 27.699 ( -0.184 -0.304 0.308) 0.470 27.699 ( -0.184 0.304 0.308) 0.470 27.747 ( -0.626 -1.496 -0.548) 1.712 27.747 ( -0.626 1.496 -0.548) 1.712 35.779 ( 0.357 -1.122 -1.981) 2.305 35.779 ( 0.357 1.122 -1.981) 2.305 35.864 ( -2.979 -0.372 -3.904) 4.925 35.864 ( -2.979 0.372 -3.904) 4.925 36.202 ( -2.264 -9.566 4.746) 10.916 36.202 ( -2.264 9.566 4.746) 10.916 36.395 ( -0.788 -6.374 0.227) 6.426 36.395 ( -0.788 6.374 0.227) 6.426 37.678 ( 4.068 -17.428 1.394) 17.950 37.678 ( 4.068 17.428 1.394) 17.950 37.955 ( 2.695 -23.004 -3.128) 23.372 37.955 ( 2.695 23.004 -3.128) 23.372 40.169 ( 12.716 -4.707 0.255) 13.562 40.169 ( 12.716 4.707 0.255) 13.562 40.431 ( -13.418 -2.694 1.171) 13.735 40.431 ( -13.418 2.694 1.171) 13.735 ======================= Grid point 100 (53/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.730 ( -0.887 -6.598 0.154) 6.659 1.730 ( -0.887 6.598 0.154) 6.659 1.952 ( -0.592 -2.471 -4.103) 4.826 1.952 ( -0.592 2.471 -4.103) 4.826 2.386 ( -8.577 -12.961 -4.635) 16.218 2.386 ( -8.577 12.961 -4.635) 16.218 2.703 ( 1.990 -3.720 -2.784) 5.055 2.703 ( 1.990 3.720 -2.784) 5.055 2.742 ( 1.791 -2.491 -2.237) 3.797 2.742 ( 1.791 2.491 -2.237) 3.797 3.053 ( -1.589 -5.098 -7.626) 9.310 3.053 ( -1.589 5.098 -7.626) 9.310 3.392 ( -4.616 -4.622 -3.295) 7.317 3.392 ( -4.616 4.622 -3.295) 7.317 3.448 ( 1.027 -8.597 7.620) 11.533 3.448 ( 1.026 8.597 7.620) 11.533 3.785 ( -3.055 -0.911 -3.838) 4.989 3.785 ( -3.055 0.911 -3.838) 4.989 3.908 ( 0.586 -1.328 -1.993) 2.466 3.908 ( 0.586 1.328 -1.993) 2.466 4.009 ( -0.343 -1.422 1.698) 2.241 4.009 ( -0.343 1.422 1.698) 2.241 4.270 ( 5.410 -6.354 1.274) 8.442 4.270 ( 5.410 6.354 1.274) 8.442 4.465 ( -4.861 -4.065 2.055) 6.661 4.465 ( -4.861 4.065 2.055) 6.661 4.795 ( 4.229 -2.819 5.038) 7.156 4.795 ( 4.229 2.819 5.038) 7.156 4.882 ( 1.022 -5.498 -2.342) 6.063 4.882 ( 1.022 5.498 -2.342) 6.063 5.099 ( -1.002 -3.349 -2.446) 4.266 5.099 ( -1.002 3.349 -2.446) 4.266 5.267 ( -3.854 -4.273 3.336) 6.651 5.267 ( -3.854 4.273 3.336) 6.651 5.414 ( -1.715 -4.097 -0.436) 4.463 5.414 ( -1.715 4.097 -0.436) 4.463 5.520 ( 1.851 -8.270 1.543) 8.614 5.520 ( 1.851 8.270 1.543) 8.614 5.655 ( 0.411 -5.450 -0.383) 5.479 5.655 ( 0.411 5.450 -0.383) 5.479 5.767 ( 1.329 -6.221 -5.142) 8.179 5.767 ( 1.329 6.221 -5.142) 8.179 5.875 ( 0.143 -3.045 -0.265) 3.060 5.875 ( 0.143 3.045 -0.265) 3.060 5.980 ( 1.005 -0.857 1.241) 1.813 5.980 ( 1.005 0.857 1.241) 1.813 6.092 ( -2.590 -4.684 -1.089) 5.462 6.092 ( -2.590 4.684 -1.089) 5.462 6.223 ( -1.200 -5.125 -2.970) 6.043 6.223 ( -1.200 5.125 -2.970) 6.043 6.323 ( 2.243 -1.611 3.499) 4.457 6.323 ( 2.243 1.611 3.499) 4.457 6.406 ( 0.015 -2.674 -1.486) 3.059 6.406 ( 0.015 2.674 -1.486) 3.059 6.531 ( 1.087 -1.223 -4.015) 4.335 6.531 ( 1.087 1.223 -4.015) 4.335 6.735 ( -2.936 -3.529 2.113) 5.054 6.735 ( -2.936 3.529 2.113) 5.054 6.791 ( -0.299 -7.730 -1.121) 7.816 6.791 ( -0.299 7.730 -1.121) 7.816 6.918 ( -1.274 -2.256 8.749) 9.124 6.918 ( -1.274 2.256 8.749) 9.124 7.128 ( 0.463 -1.024 -1.019) 1.517 7.128 ( 0.463 1.024 -1.019) 1.517 7.443 ( 2.262 -5.528 14.496) 15.678 7.443 ( 2.262 5.528 14.496) 15.678 7.686 ( 0.009 -3.448 9.452) 10.061 7.686 ( 0.009 3.448 9.452) 10.061 7.800 ( -2.304 -3.091 4.403) 5.852 7.800 ( -2.304 3.091 4.403) 5.852 8.163 ( 3.385 -2.984 -2.242) 5.039 8.163 ( 3.385 2.984 -2.242) 5.039 8.266 ( -0.976 -3.139 0.063) 3.287 8.266 ( -0.976 3.139 0.063) 3.287 8.447 ( -0.371 -2.924 -7.409) 7.973 8.447 ( -0.371 2.924 -7.409) 7.973 8.589 ( -2.088 -3.404 -1.451) 4.249 8.589 ( -2.088 3.404 -1.451) 4.249 8.833 ( -2.260 -6.823 3.909) 8.182 8.833 ( -2.260 6.823 3.909) 8.182 9.035 ( 0.276 -5.008 0.107) 5.017 9.035 ( 0.276 5.008 0.107) 5.017 9.171 ( -0.002 -2.881 -0.908) 3.020 9.171 ( -0.002 2.881 -0.908) 3.020 9.294 ( -5.955 -10.042 -7.919) 14.107 9.294 ( -5.955 10.042 -7.919) 14.107 9.600 ( 0.941 -8.209 -4.832) 9.571 9.600 ( 0.941 8.209 -4.832) 9.571 10.032 ( 0.190 -3.605 -1.090) 3.771 10.032 ( 0.190 3.605 -1.090) 3.771 10.430 ( -0.067 -5.991 -1.579) 6.196 10.430 ( -0.067 5.991 -1.579) 6.196 10.927 ( -3.908 -5.218 -3.188) 7.257 10.927 ( -3.908 5.218 -3.188) 7.257 11.189 ( 0.989 -3.522 5.000) 6.196 11.189 ( 0.989 3.522 5.000) 6.196 16.563 ( -5.038 -0.318 -0.388) 5.063 16.563 ( -5.038 0.318 -0.388) 5.063 16.657 ( 4.334 -0.462 -0.074) 4.359 16.657 ( 4.334 0.462 -0.074) 4.359 17.484 ( -0.860 -1.716 0.472) 1.976 17.484 ( -0.860 1.716 0.472) 1.976 17.524 ( 1.132 -0.534 -1.659) 2.078 17.524 ( 1.132 0.534 -1.659) 2.078 17.684 ( 1.682 -0.455 1.623) 2.381 17.684 ( 1.682 0.455 1.623) 2.381 17.725 ( 0.544 -0.869 -0.923) 1.380 17.725 ( 0.544 0.869 -0.923) 1.380 18.953 ( 0.179 -8.516 0.569) 8.537 18.953 ( 0.179 8.516 0.569) 8.537 18.984 ( 2.066 -8.770 0.870) 9.052 18.984 ( 2.066 8.770 0.870) 9.052 21.331 ( -0.498 -0.301 0.324) 0.666 21.331 ( -0.498 0.301 0.324) 0.666 21.430 ( 0.120 -0.989 -0.087) 1.000 21.430 ( 0.120 0.989 -0.087) 1.000 22.016 ( -0.372 -0.942 -0.036) 1.014 22.016 ( -0.372 0.942 -0.036) 1.014 22.070 ( -0.154 -1.562 0.537) 1.659 22.070 ( -0.154 1.562 0.537) 1.659 27.010 ( 0.039 -1.259 0.170) 1.271 27.010 ( 0.039 1.259 0.170) 1.271 27.073 ( 0.196 -1.625 -0.120) 1.641 27.073 ( 0.196 1.625 -0.120) 1.641 27.693 ( -0.621 -0.911 0.177) 1.117 27.693 ( -0.621 0.911 0.177) 1.117 27.743 ( 0.806 -1.318 -0.627) 1.667 27.743 ( 0.806 1.318 -0.627) 1.667 35.735 ( -0.904 -2.547 -2.457) 3.653 35.735 ( -0.904 2.547 -2.457) 3.653 35.860 ( 4.112 -1.252 -4.114) 5.950 35.860 ( 4.112 1.252 -4.114) 5.950 36.221 ( -0.329 -7.194 4.998) 8.766 36.221 ( -0.329 7.194 4.998) 8.766 36.428 ( 3.662 -9.040 0.669) 9.776 36.428 ( 3.662 9.040 0.669) 9.776 37.678 ( -5.591 -15.883 1.904) 16.946 37.678 ( -5.591 15.883 1.904) 16.946 37.919 ( -2.876 -21.606 -4.375) 22.231 37.919 ( -2.876 21.606 -4.375) 22.231 40.155 ( -13.529 -3.064 0.092) 13.871 40.155 ( -13.529 3.064 0.092) 13.871 40.473 ( 15.626 -3.810 1.942) 16.201 40.473 ( 15.626 3.810 1.942) 16.201 ======================= Grid point 102 (54/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.690 ( -2.944 -12.666 -1.958) 13.151 1.690 ( -2.944 12.666 -1.958) 13.151 1.897 ( -1.474 -3.485 -2.868) 4.747 1.897 ( -1.474 3.485 -2.868) 4.747 2.211 ( -8.973 -10.214 -1.233) 13.651 2.211 ( -8.973 10.214 -1.233) 13.651 2.647 ( -11.126 -3.339 -3.982) 12.280 2.647 ( -11.126 3.339 -3.982) 12.280 2.732 ( 1.432 -2.858 0.058) 3.197 2.732 ( 1.432 2.858 0.058) 3.197 2.919 ( -1.671 -5.100 -5.888) 7.967 2.919 ( -1.671 5.100 -5.888) 7.967 3.317 ( -3.987 -7.440 0.279) 8.446 3.317 ( -3.987 7.440 0.279) 8.446 3.536 ( 1.304 -6.029 5.741) 8.426 3.536 ( 1.304 6.029 5.741) 8.426 3.746 ( -1.035 -1.933 1.144) 2.473 3.746 ( -1.035 1.933 1.144) 2.473 3.857 ( 0.269 -4.033 -5.503) 6.828 3.857 ( 0.269 4.033 -5.503) 6.828 4.020 ( -1.334 -8.887 2.346) 9.288 4.020 ( -1.334 8.887 2.346) 9.288 4.313 ( 2.165 -5.090 -4.521) 7.144 4.313 ( 2.165 5.090 -4.521) 7.144 4.437 ( -1.704 -9.926 3.124) 10.544 4.437 ( -1.704 9.926 3.124) 10.544 4.730 ( -8.915 -3.407 -7.569) 12.181 4.730 ( -8.915 3.407 -7.569) 12.181 4.887 ( 1.782 -3.059 2.345) 4.247 4.887 ( 1.782 3.059 2.345) 4.247 5.164 ( 3.843 -5.638 2.179) 7.162 5.164 ( 3.843 5.638 2.179) 7.162 5.262 ( -1.257 -7.926 5.104) 9.510 5.262 ( -1.257 7.926 5.104) 9.510 5.410 ( 1.405 -3.501 1.446) 4.040 5.410 ( 1.405 3.501 1.446) 4.040 5.501 ( -2.424 -3.194 -0.992) 4.131 5.501 ( -2.424 3.194 -0.992) 4.131 5.679 ( 0.579 -6.626 -1.651) 6.854 5.679 ( 0.579 6.626 -1.651) 6.854 5.781 ( 5.064 -1.602 0.322) 5.321 5.781 ( 5.064 1.602 0.322) 5.321 5.861 ( -1.379 -3.441 -2.570) 4.511 5.861 ( -1.379 3.441 -2.570) 4.511 5.996 ( -1.516 -3.449 -0.035) 3.767 5.996 ( -1.516 3.449 -0.035) 3.767 6.023 ( -3.826 -5.150 0.139) 6.417 6.023 ( -3.826 5.150 0.139) 6.417 6.188 ( 0.637 -2.216 -1.138) 2.572 6.188 ( 0.637 2.216 -1.138) 2.572 6.344 ( -1.333 -2.120 -1.999) 3.204 6.344 ( -1.333 2.120 -1.999) 3.204 6.433 ( 4.495 -4.877 0.086) 6.633 6.433 ( 4.495 4.877 0.086) 6.633 6.523 ( -0.251 -2.172 0.877) 2.356 6.523 ( -0.251 2.172 0.877) 2.356 6.673 ( -3.694 -1.955 1.238) 4.359 6.673 ( -3.694 1.955 1.238) 4.359 6.786 ( -0.033 -5.526 -0.816) 5.586 6.786 ( -0.033 5.526 -0.816) 5.586 6.981 ( -1.356 -1.045 7.797) 7.983 6.981 ( -1.356 1.045 7.797) 7.983 7.132 ( 0.640 -2.536 -0.959) 2.786 7.132 ( 0.640 2.536 -0.959) 2.786 7.567 ( -2.376 -3.439 8.438) 9.417 7.567 ( -2.376 3.439 8.438) 9.417 7.717 ( -5.139 -3.100 5.519) 8.154 7.717 ( -5.139 3.100 5.519) 8.154 7.814 ( 0.368 -1.911 3.322) 3.850 7.814 ( 0.368 1.911 3.322) 3.850 8.166 ( -1.502 -4.488 -0.538) 4.763 8.166 ( -1.502 4.488 -0.538) 4.763 8.248 ( -1.689 -4.975 -0.650) 5.294 8.248 ( -1.689 4.975 -0.650) 5.294 8.404 ( 2.702 -1.470 -4.714) 5.629 8.404 ( 2.702 1.470 -4.714) 5.629 8.547 ( -1.325 -3.463 -0.235) 3.715 8.547 ( -1.325 3.463 -0.235) 3.715 8.793 ( -5.607 -6.716 2.833) 9.196 8.793 ( -5.607 6.716 2.833) 9.196 9.015 ( -1.604 -1.558 -4.178) 4.739 9.015 ( -1.604 1.558 -4.178) 4.739 9.150 ( -1.958 -1.908 -2.283) 3.562 9.150 ( -1.958 1.908 -2.283) 3.562 9.191 ( 0.597 -3.043 2.115) 3.754 9.191 ( 0.597 3.043 2.115) 3.754 9.551 ( -0.711 -4.025 -5.300) 6.693 9.551 ( -0.711 4.025 -5.300) 6.693 10.017 ( -0.653 -2.389 -1.256) 2.777 10.017 ( -0.653 2.389 -1.256) 2.777 10.367 ( -4.188 -3.307 -3.273) 6.260 10.367 ( -4.188 3.307 -3.273) 6.260 10.759 ( -9.814 -3.792 -3.556) 11.106 10.759 ( -9.814 3.792 -3.556) 11.106 11.301 ( 3.816 -12.766 6.545) 14.845 11.301 ( 3.816 12.766 6.545) 14.845 16.471 ( -4.790 -0.259 -0.318) 4.808 16.471 ( -4.790 0.259 -0.318) 4.808 16.732 ( 3.856 -0.645 0.324) 3.923 16.732 ( 3.856 0.645 0.324) 3.923 17.464 ( -0.629 -1.250 -0.343) 1.441 17.464 ( -0.629 1.250 -0.343) 1.441 17.555 ( 2.167 -0.414 0.202) 2.216 17.555 ( 2.167 0.414 0.202) 2.216 17.704 ( 1.428 -1.125 -1.198) 2.177 17.704 ( 1.428 1.125 -1.198) 2.177 17.761 ( 2.747 -0.976 0.652) 2.987 17.761 ( 2.747 0.976 0.652) 2.987 18.972 ( 1.782 -9.592 -0.125) 9.757 18.972 ( 1.782 9.592 -0.125) 9.757 19.046 ( 4.011 -10.048 0.977) 10.863 19.046 ( 4.011 10.048 0.977) 10.863 21.319 ( -1.238 -0.954 0.321) 1.595 21.319 ( -1.238 0.954 0.321) 1.595 21.431 ( -0.001 -0.225 -0.161) 0.277 21.431 ( -0.001 0.225 -0.161) 0.277 22.002 ( -1.056 -1.180 -0.093) 1.587 22.002 ( -1.056 1.180 -0.093) 1.587 22.073 ( -0.175 -1.470 0.640) 1.613 22.073 ( -0.175 1.470 0.640) 1.613 27.013 ( 0.090 -0.903 0.172) 0.923 27.013 ( 0.090 0.903 0.172) 0.923 27.078 ( 0.507 -0.779 -0.149) 0.941 27.078 ( 0.507 0.779 -0.149) 0.941 27.687 ( -0.242 -1.240 0.324) 1.304 27.687 ( -0.242 1.240 0.324) 1.304 27.759 ( 1.540 -1.163 -0.392) 1.969 27.759 ( 1.540 1.163 -0.392) 1.969 35.722 ( 1.171 -1.685 -1.030) 2.296 35.722 ( 1.171 1.685 -1.030) 2.296 35.897 ( 5.032 -2.150 -4.565) 7.126 35.897 ( 5.032 2.150 -4.565) 7.126 36.288 ( 3.096 -1.906 3.640) 5.145 36.288 ( 3.096 1.906 3.640) 5.145 36.514 ( 5.622 -12.198 -0.375) 13.437 36.514 ( 5.622 12.198 -0.375) 13.437 37.538 ( -13.287 -12.265 3.811) 18.480 37.538 ( -13.287 12.265 3.811) 18.480 37.780 ( -7.960 -16.895 -4.841) 19.293 37.780 ( -7.960 16.895 -4.841) 19.293 39.919 ( -12.858 -3.010 -0.614) 13.220 39.919 ( -12.858 3.010 -0.614) 13.220 40.788 ( 18.158 -4.262 2.019) 18.761 40.788 ( 18.158 4.262 2.019) 18.761 ======================= Grid point 104 (55/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.613 ( -3.996 -17.939 -1.218) 18.419 1.613 ( -3.996 17.939 -1.218) 18.419 1.847 ( -5.430 -6.016 1.756) 8.292 1.847 ( -5.430 6.016 1.756) 8.292 2.035 ( -9.622 -6.553 0.604) 11.657 2.035 ( -9.621 6.553 0.604) 11.657 2.371 ( -14.115 -7.796 -1.417) 16.187 2.371 ( -14.115 7.796 -1.417) 16.187 2.733 ( -4.831 -6.654 3.885) 9.094 2.733 ( -4.831 6.654 3.885) 9.094 2.892 ( 0.674 -6.854 -1.583) 7.067 2.892 ( 0.674 6.854 -1.583) 7.067 3.227 ( -5.740 -4.724 -0.180) 7.436 3.227 ( -5.740 4.724 -0.180) 7.436 3.569 ( -3.397 -2.551 -0.104) 4.249 3.569 ( -3.397 2.551 -0.104) 4.249 3.721 ( 1.890 -10.858 -0.840) 11.054 3.721 ( 1.890 10.858 -0.840) 11.054 3.861 ( 0.061 -7.338 -3.153) 7.987 3.861 ( 0.061 7.338 -3.153) 7.987 4.034 ( 4.714 -8.439 1.125) 9.732 4.034 ( 4.714 8.439 1.125) 9.732 4.318 ( 4.070 -3.683 -5.063) 7.467 4.318 ( 4.070 3.683 -5.063) 7.467 4.439 ( -0.877 -5.310 1.765) 5.664 4.439 ( -0.877 5.310 1.765) 5.664 4.552 ( -6.189 -10.146 -0.508) 11.896 4.552 ( -6.189 10.146 -0.508) 11.896 4.866 ( -6.255 -4.346 0.977) 7.679 4.866 ( -6.255 4.346 0.977) 7.679 5.202 ( 2.826 -5.413 -1.722) 6.344 5.202 ( 2.826 5.413 -1.722) 6.344 5.313 ( -1.418 -6.550 5.801) 8.863 5.313 ( -1.418 6.550 5.801) 8.863 5.437 ( -2.343 -2.722 1.924) 4.075 5.437 ( -2.343 2.722 1.924) 4.075 5.484 ( 2.617 -0.952 -1.530) 3.177 5.484 ( 2.617 0.952 -1.530) 3.177 5.651 ( -0.586 -4.899 -0.567) 4.966 5.651 ( -0.586 4.899 -0.567) 4.966 5.787 ( -0.467 -4.021 -5.049) 6.471 5.787 ( -0.467 4.021 -5.049) 6.471 5.873 ( -1.988 -4.324 -3.696) 6.026 5.873 ( -1.988 4.324 -3.696) 6.026 5.934 ( 0.257 -6.890 3.602) 7.779 5.934 ( 0.257 6.890 3.602) 7.779 6.003 ( -0.551 -2.007 1.143) 2.374 6.003 ( -0.551 2.007 1.143) 2.374 6.211 ( 2.010 -2.660 0.281) 3.345 6.211 ( 2.010 2.660 0.281) 3.345 6.311 ( 0.223 -1.574 -2.087) 2.623 6.311 ( 0.223 1.574 -2.087) 2.623 6.482 ( 1.137 -2.525 -0.999) 2.944 6.482 ( 1.137 2.525 -0.999) 2.944 6.553 ( 0.326 -5.522 3.079) 6.331 6.553 ( 0.326 5.522 3.079) 6.331 6.678 ( 4.081 -1.949 2.239) 5.046 6.678 ( 4.081 1.949 2.239) 5.046 6.772 ( -2.177 -3.474 1.655) 4.421 6.772 ( -2.177 3.474 1.655) 4.421 7.000 ( -2.252 -2.217 2.704) 4.159 7.000 ( -2.252 2.217 2.704) 4.159 7.133 ( 1.532 -3.845 -2.453) 4.811 7.133 ( 1.532 3.845 -2.453) 4.811 7.465 ( -9.530 -3.557 -4.704) 11.207 7.465 ( -9.530 3.557 -4.704) 11.207 7.658 ( -6.066 -0.983 1.610) 6.352 7.658 ( -6.066 0.983 1.610) 6.352 7.829 ( -2.550 -2.498 0.955) 3.695 7.829 ( -2.550 2.498 0.955) 3.695 8.119 ( -4.021 -2.772 1.651) 5.155 8.119 ( -4.021 2.772 1.651) 5.155 8.220 ( -1.000 -3.328 0.498) 3.511 8.220 ( -1.000 3.328 0.498) 3.511 8.413 ( 2.155 -1.312 -1.928) 3.176 8.413 ( 2.155 1.312 -1.928) 3.176 8.556 ( 1.665 -2.826 0.958) 3.417 8.556 ( 1.665 2.826 0.958) 3.417 8.729 ( -5.246 -3.602 4.553) 7.825 8.729 ( -5.246 3.602 4.553) 7.825 8.932 ( -3.500 -2.805 -2.008) 4.914 8.932 ( -3.500 2.805 -2.008) 4.914 9.128 ( -0.064 -1.290 -0.962) 1.610 9.128 ( -0.064 1.290 -0.962) 1.610 9.260 ( 2.890 -1.877 4.940) 6.023 9.260 ( 2.890 1.877 4.940) 6.023 9.495 ( -0.414 -0.611 -3.932) 4.001 9.495 ( -0.414 0.611 -3.932) 4.001 9.988 ( -1.622 -1.455 -0.579) 2.254 9.988 ( -1.622 1.455 -0.579) 2.254 10.253 ( -4.986 -0.739 -2.896) 5.813 10.253 ( -4.986 0.739 -2.896) 5.813 10.568 ( -7.946 -2.271 -3.197) 8.861 10.568 ( -7.946 2.271 -3.197) 8.861 11.399 ( 1.168 -18.967 3.759) 19.371 11.399 ( 1.168 18.967 3.759) 19.371 16.400 ( -3.215 -0.319 0.019) 3.231 16.400 ( -3.215 0.319 0.019) 3.231 16.789 ( 2.433 -0.406 0.355) 2.492 16.789 ( 2.433 0.406 0.355) 2.492 17.461 ( 0.271 -1.095 0.106) 1.133 17.461 ( 0.271 1.095 0.106) 1.133 17.593 ( 1.993 -0.898 0.643) 2.278 17.593 ( 1.993 0.898 0.643) 2.278 17.727 ( 2.485 -0.909 -1.395) 2.991 17.727 ( 2.485 0.909 -1.395) 2.991 17.807 ( 1.926 -0.804 0.228) 2.100 17.807 ( 1.926 0.804 0.228) 2.100 19.010 ( 2.788 -9.763 -0.353) 10.159 19.010 ( 2.788 9.763 -0.353) 10.159 19.131 ( 4.883 -10.832 0.314) 11.886 19.131 ( 4.883 10.832 0.314) 11.886 21.295 ( -1.701 -1.363 0.092) 2.182 21.295 ( -1.701 1.363 0.092) 2.182 21.428 ( -0.148 -0.122 -0.132) 0.233 21.428 ( -0.148 0.122 -0.132) 0.233 21.982 ( -1.114 -1.068 -0.065) 1.544 21.982 ( -1.114 1.068 -0.065) 1.544 22.073 ( -0.499 -1.487 0.436) 1.628 22.073 ( -0.499 1.487 0.436) 1.628 27.016 ( 0.038 -2.057 0.058) 2.058 27.016 ( 0.038 2.057 0.058) 2.058 27.089 ( 0.924 -1.516 -0.086) 1.778 27.089 ( 0.924 1.516 -0.086) 1.778 27.691 ( 0.136 -0.899 0.501) 1.038 27.691 ( 0.136 0.899 0.501) 1.038 27.787 ( 1.886 -0.656 0.071) 1.998 27.787 ( 1.886 0.656 0.071) 1.998 35.754 ( 3.000 -1.021 0.593) 3.224 35.754 ( 3.000 1.021 0.593) 3.224 35.948 ( 4.824 -3.397 -2.710) 6.492 35.948 ( 4.824 3.397 -2.710) 6.492 36.378 ( 4.369 -2.459 1.249) 5.167 36.378 ( 4.369 2.459 1.249) 5.167 36.586 ( 3.440 -14.405 -2.129) 14.962 36.586 ( 3.440 14.405 -2.129) 14.962 37.315 ( -16.584 -12.606 4.461) 21.304 37.315 ( -16.584 12.606 4.461) 21.304 37.588 ( -9.235 -13.870 -2.487) 16.848 37.588 ( -9.235 13.870 -2.487) 16.848 39.724 ( -9.155 -2.989 -0.005) 9.630 39.724 ( -9.155 2.989 -0.005) 9.630 41.104 ( 17.007 -5.476 -0.608) 17.877 41.104 ( 17.007 5.476 -0.608) 17.877 ======================= Grid point 106 (56/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.438 ( -17.344 -13.660 1.856) 22.155 1.438 ( -17.344 13.660 1.856) 22.155 1.803 ( 0.826 -8.486 7.855) 11.593 1.803 ( 0.826 8.486 7.855) 11.593 1.995 ( 0.281 -5.991 3.663) 7.028 1.995 ( 0.281 5.991 3.663) 7.028 2.177 ( -8.508 -8.639 0.534) 12.137 2.177 ( -8.508 8.639 0.534) 12.137 2.646 ( -8.433 -4.340 2.515) 9.812 2.646 ( -8.433 4.340 2.515) 9.812 2.856 ( -3.979 -3.493 2.552) 5.877 2.856 ( -3.979 3.493 2.552) 5.877 3.173 ( -1.737 -1.329 0.290) 2.207 3.173 ( -1.737 1.329 0.290) 2.207 3.455 ( -1.855 -6.253 -6.999) 9.567 3.455 ( -1.855 6.253 -6.999) 9.567 3.719 ( -1.769 -20.253 -4.193) 20.758 3.719 ( -1.769 20.253 -4.193) 20.758 3.871 ( 3.327 -4.836 2.339) 6.319 3.871 ( 3.327 4.836 2.339) 6.319 4.173 ( 6.520 -3.316 1.489) 7.465 4.173 ( 6.520 3.316 1.489) 7.465 4.354 ( 3.681 -2.682 -1.597) 4.826 4.354 ( 3.681 2.682 -1.597) 4.826 4.438 ( -0.493 -8.558 0.768) 8.606 4.438 ( -0.493 8.558 0.768) 8.606 4.499 ( -1.229 -9.013 1.467) 9.214 4.499 ( -1.229 9.013 1.467) 9.214 4.767 ( -5.796 -8.529 5.339) 11.612 4.767 ( -5.796 8.529 5.339) 11.612 5.197 ( -4.790 -5.347 -2.801) 7.706 5.197 ( -4.790 5.347 -2.801) 7.706 5.288 ( -0.640 -3.438 0.791) 3.585 5.288 ( -0.640 3.438 0.791) 3.585 5.445 ( 0.318 -3.673 3.459) 5.055 5.445 ( 0.318 3.673 3.459) 5.055 5.517 ( 0.930 -3.440 -0.122) 3.566 5.517 ( 0.930 3.440 -0.122) 3.566 5.662 ( 3.407 -6.701 -3.196) 8.169 5.662 ( 3.407 6.701 -3.196) 8.169 5.718 ( -3.538 -2.935 -3.438) 5.740 5.718 ( -3.538 2.935 -3.438) 5.740 5.823 ( 0.972 -3.879 1.664) 4.331 5.823 ( 0.972 3.879 1.664) 4.331 5.931 ( -1.435 -6.824 -2.127) 7.291 5.931 ( -1.435 6.824 -2.127) 7.291 6.026 ( 1.396 -3.642 -0.677) 3.959 6.026 ( 1.396 3.642 -0.677) 3.959 6.239 ( 1.137 -3.040 -0.744) 3.330 6.239 ( 1.137 3.040 -0.744) 3.330 6.326 ( 3.045 -2.999 -1.726) 4.609 6.326 ( 3.045 2.999 -1.726) 4.609 6.473 ( -1.447 -1.931 0.583) 2.482 6.473 ( -1.447 1.931 0.583) 2.482 6.555 ( -2.564 -2.952 0.142) 3.913 6.555 ( -2.564 2.952 0.142) 3.913 6.739 ( -0.628 -1.903 -1.573) 2.548 6.739 ( -0.628 1.903 -1.573) 2.548 6.828 ( 6.199 -1.574 3.569) 7.324 6.828 ( 6.199 1.574 3.569) 7.324 6.978 ( -0.423 -3.644 -0.925) 3.783 6.978 ( -0.423 3.644 -0.925) 3.783 7.085 ( -4.632 -4.203 -5.510) 8.336 7.085 ( -4.632 4.203 -5.510) 8.336 7.298 ( -1.959 -1.997 -1.225) 3.054 7.298 ( -1.959 1.997 -1.225) 3.054 7.542 ( -6.090 -2.671 -2.961) 7.279 7.542 ( -6.090 2.671 -2.961) 7.279 7.743 ( -4.653 -1.307 -1.977) 5.222 7.743 ( -4.653 1.307 -1.977) 5.222 8.076 ( -2.696 -3.275 -0.784) 4.314 8.076 ( -2.696 3.275 -0.784) 4.314 8.185 ( -1.288 -1.407 -2.828) 3.411 8.185 ( -1.288 1.407 -2.828) 3.411 8.491 ( 2.855 -2.894 8.667) 9.573 8.491 ( 2.855 2.894 8.667) 9.573 8.593 ( 1.571 -2.583 0.054) 3.024 8.593 ( 1.571 2.583 0.054) 3.024 8.704 ( -2.555 -2.684 4.747) 6.022 8.704 ( -2.555 2.684 4.747) 6.022 8.865 ( -3.556 -2.219 0.805) 4.268 8.865 ( -3.556 2.219 0.805) 4.268 9.109 ( -0.807 -1.815 -2.097) 2.889 9.109 ( -0.807 1.815 -2.097) 2.889 9.358 ( 2.091 -2.122 5.569) 6.316 9.358 ( 2.091 2.122 5.569) 6.316 9.469 ( -0.174 -3.986 -0.907) 4.091 9.469 ( -0.174 3.986 -0.907) 4.091 9.960 ( -1.387 -1.817 1.241) 2.601 9.960 ( -1.387 1.817 1.241) 2.601 10.171 ( -2.310 -0.789 0.088) 2.443 10.171 ( -2.310 0.789 0.088) 2.443 10.447 ( -2.951 -2.131 -2.316) 4.314 10.447 ( -2.951 2.131 -2.316) 4.314 11.393 ( -1.777 -21.015 -4.197) 21.504 11.393 ( -1.777 21.015 -4.197) 21.504 16.361 ( -1.572 -0.294 0.241) 1.618 16.361 ( -1.572 0.294 0.241) 1.618 16.820 ( 1.021 -0.111 0.016) 1.027 16.820 ( 1.021 0.111 0.016) 1.027 17.468 ( 0.091 -0.861 0.302) 0.917 17.468 ( 0.091 0.861 0.302) 0.917 17.635 ( 1.855 -0.854 0.838) 2.207 17.635 ( 1.855 0.854 0.838) 2.207 17.753 ( 1.811 -0.347 -1.114) 2.154 17.753 ( 1.811 0.347 -1.114) 2.154 17.831 ( 0.804 -1.051 0.031) 1.323 17.831 ( 0.804 1.051 0.031) 1.323 19.056 ( 2.454 -9.454 0.345) 9.774 19.056 ( 2.454 9.454 0.345) 9.774 19.205 ( 3.640 -10.951 -0.994) 11.583 19.205 ( 3.640 10.951 -0.994) 11.583 21.267 ( -1.414 -0.722 -0.074) 1.589 21.267 ( -1.414 0.722 -0.074) 1.589 21.424 ( -0.157 -0.177 -0.084) 0.251 21.424 ( -0.157 0.177 -0.084) 0.251 21.966 ( -0.702 -0.887 0.037) 1.131 21.966 ( -0.702 0.887 0.037) 1.131 22.064 ( -0.672 -1.059 -0.141) 1.263 22.064 ( -0.672 1.059 -0.141) 1.263 27.015 ( -0.050 -2.494 -0.134) 2.499 27.015 ( -0.050 2.494 -0.134) 2.499 27.106 ( 0.939 -2.062 0.027) 2.266 27.106 ( 0.939 2.062 0.027) 2.266 27.699 ( 0.099 -0.416 0.619) 0.752 27.699 ( 0.099 0.416 0.619) 0.752 27.818 ( 1.286 -0.214 0.180) 1.316 27.818 ( 1.286 0.214 0.180) 1.316 35.830 ( 3.675 -1.835 1.387) 4.336 35.830 ( 3.675 1.835 1.387) 4.336 36.014 ( 4.037 -2.814 1.896) 5.274 36.014 ( 4.037 2.814 1.896) 5.274 36.448 ( 3.111 -5.824 -0.366) 6.613 36.448 ( 3.111 5.824 -0.366) 6.613 36.585 ( -1.202 -12.784 -0.897) 12.871 36.585 ( -1.202 12.784 -0.897) 12.871 37.084 ( -12.163 -12.443 0.253) 17.402 37.084 ( -12.163 12.443 0.253) 17.402 37.462 ( -5.134 -15.359 2.994) 16.469 37.462 ( -5.134 15.359 2.994) 16.469 39.614 ( -4.471 -2.538 1.601) 5.385 39.614 ( -4.471 2.538 1.601) 5.385 41.321 ( 10.789 -8.420 -5.662) 14.811 41.321 ( 10.789 8.420 -5.662) 14.811 ======================= Grid point 126 (57/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( 11.924 0.000 25.557) 28.202 1.157 ( -4.890 0.000 28.923) 29.334 1.365 ( -7.031 0.000 -21.940) 23.039 1.618 ( 1.434 0.000 -12.512) 12.594 1.974 ( -1.044 0.000 -0.177) 1.059 1.981 ( 1.017 0.000 -0.527) 1.145 2.028 ( 1.917 0.000 -1.171) 2.247 2.072 ( -6.951 0.000 -4.405) 8.230 2.506 ( 5.159 0.000 32.191) 32.602 2.694 ( -1.823 0.000 0.313) 1.849 2.702 ( -8.671 0.000 17.060) 19.137 2.922 ( 2.288 0.000 2.233) 3.197 2.927 ( -2.193 0.000 1.702) 2.776 3.226 ( 0.113 0.000 1.376) 1.380 3.241 ( -3.493 0.000 -5.882) 6.841 3.304 ( 14.249 0.000 -17.705) 22.727 3.694 ( -2.353 0.000 3.158) 3.938 3.718 ( 3.036 0.000 3.555) 4.675 3.933 ( 6.416 0.000 4.587) 7.887 4.007 ( 2.831 0.000 9.537) 9.948 4.139 ( -4.801 0.000 -8.055) 9.378 4.171 ( -1.568 0.000 -6.058) 6.258 4.305 ( 4.277 0.000 4.884) 6.492 4.330 ( 2.049 0.000 -0.008) 2.049 4.442 ( -3.638 0.000 -6.070) 7.077 4.486 ( -10.549 0.000 -11.527) 15.625 4.630 ( -1.258 0.000 0.041) 1.258 4.682 ( 3.141 0.000 -3.987) 5.075 4.823 ( -10.537 0.000 0.565) 10.553 4.853 ( 9.982 0.000 -2.364) 10.258 4.976 ( -5.661 0.000 5.043) 7.581 5.003 ( 4.948 0.000 0.809) 5.013 5.015 ( 14.920 0.000 5.904) 16.046 5.139 ( -3.680 0.000 3.755) 5.257 5.174 ( -3.969 0.000 -5.651) 6.905 5.240 ( 5.677 0.000 -4.519) 7.256 5.364 ( -8.673 0.000 -4.045) 9.569 5.388 ( 1.360 0.000 -5.837) 5.994 5.546 ( 1.610 0.000 1.263) 2.046 5.574 ( -0.221 0.000 -2.296) 2.306 5.727 ( 0.297 0.000 11.764) 11.767 5.847 ( -2.267 0.000 6.891) 7.254 5.897 ( 0.021 0.000 3.960) 3.960 5.909 ( 2.731 0.000 -5.380) 6.034 6.011 ( 4.016 0.000 0.429) 4.039 6.020 ( -1.396 0.000 -0.219) 1.413 6.066 ( -0.109 0.000 2.987) 2.989 6.220 ( 0.625 0.000 -6.651) 6.680 6.281 ( 6.664 0.000 -1.328) 6.795 6.299 ( -5.170 0.000 1.240) 5.317 6.331 ( -3.502 0.000 -0.005) 3.502 6.392 ( 3.771 0.000 0.523) 3.807 6.395 ( -6.556 0.000 -3.950) 7.654 6.448 ( 2.873 0.000 -1.504) 3.242 6.574 ( 1.230 0.000 -2.500) 2.786 6.621 ( -2.404 0.000 -4.444) 5.052 6.665 ( -0.619 0.000 -0.528) 0.813 6.667 ( 0.882 0.000 -1.572) 1.802 6.866 ( -0.072 0.000 2.720) 2.721 6.867 ( 8.524 0.000 2.943) 9.018 6.927 ( -4.239 0.000 -1.890) 4.642 6.956 ( -4.238 0.000 -5.621) 7.039 7.044 ( -3.734 0.000 4.626) 5.945 7.130 ( -6.694 0.000 -2.854) 7.277 7.295 ( 6.848 0.000 2.226) 7.201 7.379 ( -5.052 0.000 -5.861) 7.738 7.417 ( -2.223 0.000 1.685) 2.790 7.506 ( 5.362 0.000 -5.432) 7.632 7.626 ( 4.225 0.000 3.976) 5.801 7.688 ( -1.113 0.000 -1.212) 1.645 8.118 ( -2.435 0.000 6.981) 7.394 8.138 ( -1.969 0.000 5.700) 6.031 8.261 ( 3.020 0.000 2.543) 3.948 8.302 ( -3.909 0.000 -3.362) 5.156 8.337 ( 1.788 0.000 -4.383) 4.733 8.339 ( 2.753 0.000 -3.756) 4.657 8.579 ( -2.028 0.000 4.735) 5.151 8.647 ( 0.052 0.000 -0.620) 0.622 8.725 ( 1.734 0.000 1.190) 2.103 8.730 ( -0.913 0.000 0.048) 0.915 8.823 ( 3.233 0.000 -0.589) 3.286 8.889 ( 0.963 0.000 -5.165) 5.254 9.133 ( -2.683 0.000 1.725) 3.189 9.191 ( -1.385 0.000 -3.019) 3.322 9.264 ( -4.665 0.000 2.814) 5.447 9.283 ( 4.026 0.000 0.637) 4.077 9.820 ( -17.170 0.000 1.503) 17.236 9.827 ( 22.312 0.000 0.224) 22.313 10.016 ( -8.767 0.000 2.595) 9.143 10.085 ( 4.362 0.000 -3.320) 5.481 10.129 ( 0.618 0.000 -1.021) 1.193 10.136 ( -0.215 0.000 -0.374) 0.431 10.317 ( 2.616 0.000 3.709) 4.539 10.381 ( 0.035 0.000 -2.618) 2.619 11.040 ( 12.895 0.000 18.576) 22.613 11.374 ( -15.634 0.000 -15.657) 22.126 16.356 ( 0.955 0.000 0.200) 0.976 16.358 ( -0.947 0.000 0.051) 0.949 16.857 ( 0.110 0.000 0.034) 0.115 16.859 ( 0.002 0.000 -0.172) 0.172 17.570 ( 0.065 0.000 1.390) 1.392 17.594 ( 0.246 0.000 -0.607) 0.655 17.617 ( 0.501 0.000 0.134) 0.519 17.632 ( -0.521 0.000 -0.760) 0.922 17.766 ( 0.016 0.000 -0.362) 0.363 17.773 ( -0.190 0.000 -1.193) 1.208 17.990 ( -1.224 0.000 4.393) 4.560 18.056 ( 1.221 0.000 -2.390) 2.684 18.370 ( -0.101 0.000 -0.146) 0.177 18.373 ( 0.034 0.000 -0.480) 0.481 19.505 ( 1.234 0.000 0.407) 1.300 19.515 ( -0.836 0.000 -0.616) 1.038 21.239 ( -0.286 0.000 0.304) 0.418 21.245 ( 0.103 0.000 -0.250) 0.271 21.424 ( 0.310 0.000 0.209) 0.374 21.429 ( -0.340 0.000 -0.289) 0.447 21.920 ( -0.195 0.000 0.045) 0.200 21.921 ( 0.204 0.000 -0.043) 0.208 22.048 ( -3.038 0.000 0.091) 3.040 22.049 ( 1.461 0.000 -0.074) 1.463 26.949 ( 0.088 0.000 0.694) 0.700 26.968 ( -0.221 0.000 -1.329) 1.347 27.158 ( 0.454 0.000 0.840) 0.955 27.168 ( -0.368 0.000 -0.235) 0.437 27.700 ( -0.780 0.000 0.491) 0.922 27.707 ( 0.889 0.000 -0.226) 0.918 27.798 ( -1.099 0.000 0.407) 1.172 27.807 ( 0.940 0.000 -0.506) 1.068 35.719 ( 2.152 0.000 7.046) 7.368 35.857 ( -1.758 0.000 -7.231) 7.442 35.913 ( -1.645 0.000 6.048) 6.267 36.045 ( 1.785 0.000 -7.559) 7.767 36.334 ( 2.327 0.000 0.112) 2.330 36.336 ( -1.654 0.000 -0.032) 1.655 36.830 ( -6.067 0.000 4.615) 7.622 36.855 ( 5.309 0.000 -0.288) 5.317 36.942 ( -5.566 0.000 9.429) 10.949 37.185 ( 2.595 0.000 -13.835) 14.077 38.483 ( -9.810 0.000 13.468) 16.662 38.718 ( 17.831 0.000 -10.912) 20.905 39.484 ( 2.505 0.000 3.609) 4.393 39.550 ( -1.230 0.000 -3.256) 3.480 40.513 ( -3.347 0.000 10.009) 10.553 40.715 ( 4.196 0.000 -10.694) 11.488 ======================= Grid point 127 (58/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 19.808 0.000 -17.299) 26.298 1.340 ( -1.804 0.000 23.796) 23.864 1.384 ( 12.256 0.000 8.794) 15.085 1.546 ( 11.676 0.000 -14.768) 18.827 1.941 ( -2.437 0.000 4.055) 4.731 1.971 ( -1.484 0.000 -0.992) 1.785 2.109 ( 10.829 0.000 4.486) 11.721 2.252 ( 19.236 0.000 2.583) 19.408 2.651 ( 4.426 0.000 -11.436) 12.263 2.715 ( -8.561 0.000 16.231) 18.350 2.895 ( 9.724 0.000 15.268) 18.101 2.933 ( 1.439 0.000 -0.368) 1.486 3.025 ( 8.792 0.000 -0.088) 8.792 3.122 ( 3.669 0.000 -18.434) 18.796 3.337 ( 9.292 0.000 2.277) 9.567 3.443 ( 18.914 0.000 -13.316) 23.131 3.716 ( 1.684 0.000 3.276) 3.683 3.772 ( 4.118 0.000 -2.085) 4.616 3.917 ( -6.072 0.000 -11.529) 13.030 4.032 ( -5.447 0.000 -9.278) 10.758 4.099 ( -3.980 0.000 4.807) 6.241 4.105 ( 0.544 0.000 7.226) 7.247 4.245 ( -4.395 0.000 -1.875) 4.778 4.272 ( -4.142 0.000 -2.493) 4.835 4.390 ( -3.112 0.000 7.461) 8.084 4.553 ( 9.705 0.000 11.220) 14.835 4.582 ( -9.725 0.000 -1.058) 9.783 4.666 ( -6.732 0.000 7.289) 9.923 4.679 ( 0.703 0.000 -3.159) 3.237 4.811 ( -9.258 0.000 -5.841) 10.947 4.885 ( -3.410 0.000 -1.919) 3.913 4.988 ( -1.042 0.000 -7.432) 7.505 5.088 ( 0.720 0.000 -1.065) 1.285 5.145 ( 8.201 0.000 -2.523) 8.580 5.231 ( 3.997 0.000 -2.466) 4.696 5.324 ( 1.592 0.000 3.293) 3.657 5.427 ( 15.212 0.000 2.648) 15.441 5.430 ( 0.979 0.000 3.613) 3.743 5.530 ( -2.388 0.000 -1.887) 3.043 5.593 ( 4.698 0.000 -0.504) 4.725 5.755 ( -5.668 0.000 6.122) 8.343 5.813 ( -6.683 0.000 -7.278) 9.881 5.859 ( -2.060 0.000 3.278) 3.871 5.914 ( 0.406 0.000 -0.483) 0.632 5.956 ( -4.519 0.000 -7.068) 8.389 6.037 ( -0.992 0.000 1.186) 1.546 6.093 ( -1.163 0.000 -8.221) 8.303 6.137 ( -7.501 0.000 0.967) 7.563 6.157 ( 0.945 0.000 6.760) 6.826 6.237 ( -3.071 0.000 1.601) 3.464 6.314 ( -0.410 0.000 2.539) 2.572 6.387 ( -4.784 0.000 -2.797) 5.542 6.475 ( 4.514 0.000 0.423) 4.533 6.556 ( 8.141 0.000 -2.267) 8.451 6.564 ( -2.525 0.000 0.967) 2.704 6.594 ( 4.333 0.000 3.057) 5.303 6.649 ( 0.382 0.000 -0.359) 0.525 6.658 ( -0.268 0.000 0.586) 0.645 6.836 ( -1.405 0.000 -1.613) 2.139 6.878 ( -1.435 0.000 1.050) 1.779 6.976 ( 6.846 0.000 4.569) 8.231 7.052 ( 2.105 0.000 2.252) 3.082 7.114 ( 0.926 0.000 2.098) 2.294 7.123 ( 7.430 0.000 2.585) 7.867 7.272 ( 3.273 0.000 -0.517) 3.314 7.362 ( -2.025 0.000 2.351) 3.103 7.462 ( 6.006 0.000 1.662) 6.232 7.538 ( 3.020 0.000 -3.415) 4.559 7.623 ( -1.716 0.000 -7.250) 7.450 7.707 ( 4.039 0.000 -0.172) 4.043 8.142 ( -2.275 0.000 6.321) 6.718 8.168 ( 0.686 0.000 2.646) 2.734 8.231 ( -0.766 0.000 -1.362) 1.563 8.332 ( 1.068 0.000 0.033) 1.068 8.342 ( 5.146 0.000 -2.986) 5.949 8.357 ( 2.402 0.000 -3.187) 3.991 8.549 ( -4.153 0.000 1.243) 4.335 8.586 ( -4.948 0.000 0.070) 4.949 8.716 ( -0.072 0.000 -0.282) 0.291 8.758 ( 0.809 0.000 -2.018) 2.174 8.892 ( 3.934 0.000 -5.409) 6.688 8.896 ( 4.947 0.000 1.551) 5.185 9.146 ( -0.753 0.000 5.242) 5.296 9.159 ( -0.547 0.000 0.326) 0.637 9.196 ( -5.244 0.000 0.821) 5.308 9.345 ( 2.875 0.000 -0.082) 2.877 9.569 ( -9.356 0.000 -2.636) 9.720 9.913 ( -7.042 0.000 7.600) 10.361 10.097 ( 3.750 0.000 -1.705) 4.119 10.111 ( -0.054 0.000 1.216) 1.217 10.185 ( 10.415 0.000 0.781) 10.444 10.200 ( 8.360 0.000 -3.146) 8.932 10.357 ( 2.722 0.000 -3.993) 4.833 10.387 ( 3.127 0.000 -0.225) 3.135 11.108 ( 1.919 0.000 -19.643) 19.736 11.497 ( 16.434 0.000 21.266) 26.876 16.355 ( 0.780 0.000 -0.182) 0.801 16.386 ( 2.269 0.000 0.161) 2.275 16.855 ( -0.357 0.000 0.191) 0.405 16.855 ( -0.495 0.000 -0.247) 0.553 17.586 ( -0.212 0.000 -1.269) 1.286 17.587 ( -3.061 0.000 -0.794) 3.162 17.593 ( 0.585 0.000 0.321) 0.667 17.618 ( -0.467 0.000 0.966) 1.073 17.749 ( -1.910 0.000 -0.176) 1.918 17.753 ( -1.491 0.000 0.524) 1.580 17.976 ( -4.149 0.000 3.655) 5.530 18.016 ( -2.530 0.000 -3.676) 4.463 18.371 ( 0.151 0.000 0.179) 0.234 18.373 ( 0.196 0.000 -0.054) 0.204 19.457 ( -4.494 0.000 -1.104) 4.627 19.486 ( -3.480 0.000 0.683) 3.546 21.262 ( 2.003 0.000 -0.754) 2.141 21.268 ( 2.428 0.000 0.915) 2.595 21.427 ( 0.587 0.000 -0.290) 0.655 21.433 ( 0.226 0.000 0.203) 0.304 21.923 ( 0.428 0.000 0.083) 0.436 21.929 ( 0.780 0.000 -0.113) 0.788 22.025 ( -0.605 0.000 0.948) 1.125 22.092 ( 2.627 0.000 1.367) 2.961 26.954 ( -0.134 0.000 -0.904) 0.914 26.960 ( 0.273 0.000 1.105) 1.138 27.153 ( -0.811 0.000 -0.519) 0.963 27.167 ( -0.086 0.000 0.357) 0.367 27.685 ( -1.236 0.000 0.337) 1.281 27.713 ( 0.149 0.000 -0.578) 0.597 27.775 ( -1.911 0.000 0.748) 2.052 27.812 ( 0.070 0.000 -0.487) 0.492 35.753 ( -1.961 0.000 -7.221) 7.483 35.806 ( -0.923 0.000 6.671) 6.735 35.918 ( -2.555 0.000 6.505) 6.989 35.962 ( -2.767 0.000 -7.303) 7.809 36.343 ( 1.098 0.000 -1.184) 1.615 36.430 ( 8.076 0.000 -0.063) 8.077 36.678 ( -12.517 0.000 5.873) 13.826 36.882 ( -3.825 0.000 -5.300) 6.536 36.995 ( -3.779 0.000 12.963) 13.503 37.100 ( 2.960 0.000 -8.903) 9.382 38.433 ( -4.590 0.000 7.354) 8.668 38.808 ( 9.439 0.000 -16.351) 18.880 39.516 ( 1.529 0.000 -4.464) 4.718 39.579 ( 5.330 0.000 2.434) 5.860 40.533 ( -5.122 0.000 10.627) 11.797 40.650 ( -0.093 0.000 -11.551) 11.551 ======================= Grid point 128 (59/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( 11.560 0.000 -19.996) 23.097 1.507 ( -1.935 0.000 24.377) 24.454 1.650 ( 29.373 0.000 -8.994) 30.720 1.755 ( 9.734 0.000 2.285) 9.999 1.932 ( -0.769 0.000 -2.965) 3.063 1.984 ( 2.146 0.000 6.802) 7.132 2.394 ( 11.075 0.000 9.617) 14.668 2.612 ( 0.607 0.000 18.543) 18.553 2.686 ( 15.870 0.000 -17.007) 23.262 2.700 ( 5.645 0.000 -2.761) 6.284 2.939 ( 1.443 0.000 -3.440) 3.730 2.982 ( 3.428 0.000 -11.057) 11.576 3.101 ( 10.948 0.000 -11.809) 16.103 3.254 ( 10.935 0.000 1.917) 11.102 3.505 ( 6.094 0.000 -2.685) 6.660 3.642 ( 16.334 0.000 -12.632) 20.649 3.651 ( 0.802 0.000 -4.750) 4.817 3.792 ( 2.465 0.000 -6.581) 7.027 3.861 ( -3.788 0.000 -9.231) 9.978 3.931 ( -1.957 0.000 7.363) 7.619 4.018 ( -2.761 0.000 1.916) 3.361 4.048 ( -9.135 0.000 1.615) 9.276 4.187 ( -8.825 0.000 -2.001) 9.049 4.205 ( -0.021 0.000 -1.047) 1.047 4.291 ( -9.577 0.000 2.064) 9.797 4.379 ( -5.667 0.000 1.882) 5.971 4.612 ( -4.064 0.000 -8.960) 9.839 4.701 ( -0.042 0.000 3.163) 3.163 4.721 ( -3.238 0.000 -1.519) 3.576 4.848 ( 7.922 0.000 13.598) 15.737 4.856 ( -1.129 0.000 -2.143) 2.422 4.913 ( 7.531 0.000 14.849) 16.649 5.205 ( 5.526 0.000 -1.233) 5.662 5.291 ( 4.558 0.000 -0.168) 4.561 5.304 ( 10.813 0.000 -0.186) 10.815 5.383 ( 2.696 0.000 0.061) 2.696 5.442 ( -2.522 0.000 5.317) 5.885 5.447 ( -5.296 0.000 2.109) 5.700 5.505 ( -5.364 0.000 -15.660) 16.553 5.671 ( 2.375 0.000 -1.130) 2.630 5.674 ( -3.345 0.000 4.207) 5.375 5.715 ( 3.896 0.000 -0.703) 3.959 5.770 ( -4.601 0.000 0.085) 4.602 5.887 ( -1.126 0.000 -4.781) 4.912 5.914 ( -1.097 0.000 4.816) 4.939 5.989 ( -3.559 0.000 -1.630) 3.914 6.029 ( 1.544 0.000 -1.253) 1.989 6.069 ( -1.287 0.000 3.429) 3.663 6.218 ( -1.824 0.000 2.795) 3.337 6.235 ( -4.544 0.000 -4.940) 6.712 6.342 ( 1.248 0.000 0.385) 1.306 6.402 ( 2.950 0.000 16.666) 16.925 6.499 ( -4.351 0.000 -3.054) 5.316 6.522 ( -0.755 0.000 -1.104) 1.337 6.533 ( -2.153 0.000 2.517) 3.313 6.601 ( 0.791 0.000 1.279) 1.504 6.714 ( 5.137 0.000 -1.057) 5.245 6.814 ( 5.127 0.000 4.909) 7.098 6.876 ( 3.463 0.000 7.498) 8.259 6.880 ( 1.096 0.000 0.937) 1.441 7.040 ( -4.340 0.000 -7.961) 9.067 7.123 ( 5.296 0.000 -2.951) 6.063 7.143 ( 3.551 0.000 5.892) 6.879 7.160 ( 2.313 0.000 5.102) 5.602 7.332 ( -2.302 0.000 -1.560) 2.781 7.477 ( -3.182 0.000 -3.697) 4.878 7.542 ( 2.899 0.000 3.348) 4.429 7.560 ( 11.491 0.000 5.240) 12.629 7.646 ( 9.168 0.000 2.058) 9.396 7.788 ( 6.737 0.000 -2.075) 7.050 8.145 ( -2.760 0.000 3.226) 4.245 8.190 ( 3.067 0.000 -4.150) 5.160 8.263 ( 0.102 0.000 6.002) 6.003 8.350 ( 0.101 0.000 -4.933) 4.934 8.371 ( 3.327 0.000 -2.139) 3.955 8.383 ( 3.777 0.000 1.991) 4.270 8.481 ( -1.710 0.000 -3.934) 4.289 8.535 ( -1.507 0.000 1.618) 2.211 8.710 ( -0.165 0.000 -2.941) 2.945 8.722 ( -1.182 0.000 -3.310) 3.515 8.898 ( 3.011 0.000 -5.334) 6.125 8.998 ( 3.878 0.000 2.080) 4.401 9.082 ( -3.968 0.000 -4.281) 5.837 9.182 ( 0.688 0.000 4.167) 4.223 9.192 ( -1.718 0.000 6.870) 7.082 9.371 ( 0.878 0.000 -1.815) 2.016 9.485 ( 0.557 0.000 -1.337) 1.448 9.879 ( -6.875 0.000 9.170) 11.461 10.102 ( 0.169 0.000 -0.781) 0.799 10.123 ( 0.282 0.000 1.219) 1.252 10.251 ( 3.495 0.000 -6.361) 7.258 10.341 ( 3.151 0.000 -0.520) 3.194 10.470 ( 12.578 0.000 -3.159) 12.968 10.491 ( 14.408 0.000 -1.158) 14.454 11.014 ( 6.647 0.000 -18.366) 19.532 11.876 ( 3.013 0.000 17.773) 18.027 16.385 ( 2.965 0.000 -0.255) 2.976 16.435 ( 3.295 0.000 -0.155) 3.299 16.829 ( -2.180 0.000 -0.592) 2.259 16.844 ( -1.820 0.000 0.458) 1.877 17.491 ( -4.166 0.000 -2.323) 4.770 17.568 ( -1.040 0.000 0.140) 1.049 17.620 ( 0.471 0.000 -0.837) 0.960 17.629 ( 2.156 0.000 0.873) 2.326 17.708 ( -3.067 0.000 0.895) 3.195 17.731 ( -2.132 0.000 1.723) 2.741 17.920 ( -3.724 0.000 -4.076) 5.521 17.929 ( -4.600 0.000 2.530) 5.250 18.378 ( 0.340 0.000 0.483) 0.590 18.379 ( 0.283 0.000 0.357) 0.456 19.365 ( -4.479 0.000 -1.110) 4.614 19.416 ( -5.025 0.000 0.603) 5.061 21.280 ( 1.201 0.000 -0.988) 1.555 21.337 ( 2.893 0.000 3.107) 4.245 21.430 ( -0.653 0.000 -0.208) 0.685 21.443 ( 1.569 0.000 -0.485) 1.642 21.935 ( 0.741 0.000 0.209) 0.770 21.943 ( 0.959 0.000 -0.285) 1.000 22.034 ( 0.366 0.000 1.094) 1.153 22.149 ( 1.491 0.000 2.344) 2.778 26.947 ( 0.039 0.000 -0.508) 0.509 26.976 ( 0.232 0.000 1.101) 1.126 27.135 ( -0.583 0.000 -0.506) 0.772 27.165 ( -0.218 0.000 -0.003) 0.218 27.668 ( -0.938 0.000 0.302) 0.986 27.699 ( -0.673 0.000 -1.200) 1.376 27.755 ( -1.520 0.000 1.331) 2.021 27.799 ( -0.774 0.000 -0.834) 1.138 35.671 ( -0.275 0.000 -5.499) 5.506 35.796 ( -5.198 0.000 4.598) 6.940 35.836 ( -3.829 0.000 -6.915) 7.904 35.969 ( 0.742 0.000 4.279) 4.343 36.279 ( -7.170 0.000 -3.751) 8.092 36.519 ( -9.148 0.000 4.406) 10.154 36.583 ( 3.587 0.000 4.363) 5.649 36.636 ( -6.700 0.000 -14.839) 16.281 37.042 ( -3.507 0.000 11.066) 11.608 37.147 ( 6.319 0.000 -2.245) 6.706 38.541 ( 7.667 0.000 8.488) 11.438 38.803 ( 8.527 0.000 -15.522) 17.710 39.523 ( 3.845 0.000 -3.810) 5.413 39.722 ( 8.924 0.000 2.566) 9.286 40.501 ( -4.715 0.000 -10.943) 11.915 40.536 ( -6.328 0.000 10.640) 12.380 ======================= Grid point 129 (60/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 17.241 0.000 -19.103) 25.733 1.626 ( -9.383 0.000 19.888) 21.991 1.890 ( 6.250 0.000 -2.487) 6.726 1.912 ( 1.730 0.000 -1.060) 2.029 2.020 ( 20.659 0.000 -7.238) 21.890 2.135 ( 6.532 0.000 7.643) 10.054 2.515 ( -17.273 0.000 13.959) 22.209 2.578 ( 2.154 0.000 4.486) 4.976 2.841 ( 12.157 0.000 -10.738) 16.221 2.876 ( 2.758 0.000 -7.179) 7.690 2.928 ( 8.766 0.000 -8.723) 12.367 2.993 ( 14.499 0.000 -6.949) 16.078 3.199 ( 6.719 0.000 -3.609) 7.627 3.370 ( 5.023 0.000 -2.041) 5.422 3.486 ( -1.887 0.000 -3.805) 4.247 3.662 ( -2.415 0.000 -11.948) 12.189 3.737 ( 6.208 0.000 -14.761) 16.014 3.751 ( 3.449 0.000 5.732) 6.690 3.817 ( 2.979 0.000 -2.647) 3.986 3.868 ( -6.423 0.000 -3.981) 7.557 3.921 ( -2.899 0.000 -1.400) 3.219 3.968 ( -2.366 0.000 9.563) 9.851 4.053 ( -4.786 0.000 -0.524) 4.815 4.192 ( 1.037 0.000 -3.684) 3.827 4.228 ( -4.543 0.000 1.195) 4.697 4.389 ( 5.135 0.000 2.372) 5.656 4.424 ( -3.865 0.000 -7.495) 8.433 4.718 ( 0.266 0.000 -0.755) 0.800 4.732 ( -3.428 0.000 1.048) 3.585 4.796 ( 0.749 0.000 -3.777) 3.850 5.107 ( -3.820 0.000 -3.077) 4.905 5.147 ( 7.394 0.000 8.592) 11.336 5.166 ( 5.295 0.000 2.493) 5.853 5.319 ( -3.892 0.000 -2.811) 4.801 5.322 ( -5.591 0.000 -0.212) 5.595 5.391 ( 6.973 0.000 0.292) 6.980 5.400 ( 2.951 0.000 -3.046) 4.241 5.484 ( 0.741 0.000 5.284) 5.336 5.561 ( -2.427 0.000 7.040) 7.447 5.586 ( -4.111 0.000 8.356) 9.312 5.691 ( -0.641 0.000 6.543) 6.574 5.777 ( -2.170 0.000 -6.394) 6.752 5.791 ( 1.959 0.000 2.463) 3.147 5.841 ( 3.810 0.000 0.087) 3.811 5.904 ( -1.461 0.000 1.687) 2.231 5.938 ( 2.054 0.000 1.593) 2.600 6.050 ( -2.696 0.000 2.428) 3.628 6.116 ( 5.957 0.000 -5.870) 8.363 6.189 ( -4.314 0.000 3.912) 5.824 6.227 ( 3.211 0.000 4.738) 5.724 6.366 ( 2.039 0.000 -1.021) 2.280 6.388 ( -1.621 0.000 -5.447) 5.683 6.492 ( 1.174 0.000 9.933) 10.002 6.532 ( -1.340 0.000 2.078) 2.472 6.532 ( -2.471 0.000 1.244) 2.766 6.676 ( 2.129 0.000 6.578) 6.914 6.798 ( -0.108 0.000 2.582) 2.585 6.838 ( -1.087 0.000 -1.232) 1.643 6.914 ( -3.458 0.000 -1.601) 3.811 6.945 ( -4.422 0.000 3.437) 5.600 6.958 ( 3.173 0.000 3.644) 4.832 7.209 ( 1.145 0.000 2.775) 3.002 7.218 ( 7.682 0.000 -5.206) 9.280 7.254 ( 1.278 0.000 6.688) 6.808 7.289 ( 2.448 0.000 -0.217) 2.458 7.471 ( 4.751 0.000 3.081) 5.662 7.560 ( 1.473 0.000 0.114) 1.477 7.804 ( 6.792 0.000 3.899) 7.832 7.829 ( 4.469 0.000 8.716) 9.795 7.885 ( 6.480 0.000 -2.067) 6.801 8.117 ( -1.715 0.000 0.386) 1.758 8.208 ( 4.158 0.000 -5.894) 7.213 8.284 ( -3.334 0.000 -1.958) 3.867 8.302 ( -2.201 0.000 8.098) 8.392 8.385 ( -3.579 0.000 2.817) 4.554 8.464 ( 0.661 0.000 1.634) 1.762 8.493 ( 8.510 0.000 -6.932) 10.976 8.547 ( 2.971 0.000 -0.468) 3.007 8.636 ( -0.644 0.000 -8.425) 8.449 8.676 ( 0.964 0.000 -5.503) 5.586 8.917 ( 2.957 0.000 -2.244) 3.712 8.953 ( -3.067 0.000 -7.672) 8.262 9.081 ( 1.719 0.000 2.757) 3.249 9.242 ( 1.242 0.000 2.290) 2.605 9.253 ( -0.069 0.000 10.694) 10.694 9.341 ( -1.746 0.000 -0.793) 1.918 9.506 ( 1.808 0.000 -0.506) 1.877 9.827 ( -7.408 0.000 5.520) 9.238 10.097 ( -0.038 0.000 -0.476) 0.478 10.140 ( 0.355 0.000 0.846) 0.917 10.259 ( 5.668 0.000 -7.676) 9.542 10.340 ( 4.518 0.000 -10.077) 11.044 10.728 ( 15.041 0.000 4.270) 15.635 10.738 ( 14.927 0.000 -2.797) 15.187 10.973 ( 4.169 0.000 -10.468) 11.268 11.878 ( -14.462 0.000 5.557) 15.493 16.450 ( 4.923 0.000 -0.359) 4.936 16.493 ( 3.836 0.000 -0.505) 3.869 16.771 ( -3.651 0.000 -0.794) 3.737 16.787 ( -4.538 0.000 -0.665) 4.587 17.450 ( 0.089 0.000 1.359) 1.362 17.557 ( -0.784 0.000 1.008) 1.277 17.619 ( 1.078 0.000 -1.972) 2.248 17.665 ( -2.913 0.000 2.180) 3.638 17.682 ( 3.052 0.000 -0.170) 3.057 17.715 ( -1.985 0.000 2.323) 3.056 17.821 ( -3.890 0.000 -3.344) 5.130 17.868 ( -4.383 0.000 0.909) 4.477 18.388 ( 0.237 0.000 0.633) 0.676 18.390 ( 0.373 0.000 0.631) 0.732 19.296 ( -2.684 0.000 -0.299) 2.701 19.338 ( -4.186 0.000 0.278) 4.195 21.292 ( 1.042 0.000 -0.351) 1.100 21.402 ( -0.335 0.000 0.900) 0.961 21.411 ( 0.263 0.000 1.685) 1.705 21.466 ( 1.640 0.000 -0.707) 1.786 21.949 ( 0.548 0.000 0.295) 0.623 21.955 ( 0.846 0.000 -0.398) 0.935 22.055 ( 0.688 0.000 1.463) 1.617 22.172 ( -0.592 0.000 0.943) 1.113 26.947 ( 0.343 0.000 -0.090) 0.355 26.984 ( -0.250 0.000 0.468) 0.530 27.127 ( -0.019 0.000 -0.046) 0.050 27.161 ( -0.209 0.000 -0.120) 0.241 27.661 ( -0.329 0.000 0.342) 0.475 27.677 ( -0.352 0.000 -1.223) 1.272 27.745 ( -1.207 0.000 1.424) 1.867 27.774 ( -0.867 0.000 -1.100) 1.400 35.649 ( 2.127 0.000 -2.494) 3.278 35.714 ( -2.977 0.000 -6.288) 6.957 35.714 ( -5.625 0.000 -2.783) 6.276 35.983 ( -1.433 0.000 0.742) 1.614 36.103 ( -6.036 0.000 -2.597) 6.571 36.381 ( -11.418 0.000 5.914) 12.859 36.517 ( 2.821 0.000 -5.175) 5.893 36.664 ( 0.346 0.000 2.746) 2.768 37.092 ( -1.176 0.000 8.551) 8.632 37.234 ( 6.093 0.000 -3.122) 6.846 38.754 ( 4.710 0.000 9.690) 10.774 38.832 ( 10.326 0.000 -12.694) 16.363 39.581 ( 5.923 0.000 -1.395) 6.086 39.926 ( 11.124 0.000 2.933) 11.504 40.301 ( -6.495 0.000 -10.064) 11.978 40.501 ( -8.613 0.000 8.534) 12.124 ======================= Grid point 130 (61/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( -17.040 0.000 15.303) 22.903 1.654 ( 19.103 0.000 -14.765) 24.144 1.916 ( 1.022 0.000 -4.656) 4.767 1.929 ( 1.337 0.000 -2.395) 2.743 2.247 ( 13.013 0.000 -4.807) 13.872 2.277 ( -7.315 0.000 11.543) 13.666 2.377 ( -5.453 0.000 9.106) 10.613 2.565 ( -4.762 0.000 -1.004) 4.867 2.828 ( 3.239 0.000 -6.058) 6.870 2.881 ( 2.463 0.000 -3.053) 3.922 2.997 ( 2.214 0.000 -1.075) 2.461 3.215 ( 9.769 0.000 -1.105) 9.831 3.236 ( 5.751 0.000 -12.583) 13.835 3.383 ( -2.831 0.000 -1.061) 3.024 3.446 ( 3.378 0.000 -2.588) 4.255 3.526 ( -4.982 0.000 -4.557) 6.752 3.654 ( 5.156 0.000 -8.562) 9.994 3.743 ( -2.726 0.000 -0.769) 2.833 3.856 ( -0.965 0.000 -2.731) 2.896 3.879 ( 3.462 0.000 -1.877) 3.938 3.912 ( -4.589 0.000 9.690) 10.722 3.933 ( 6.243 0.000 -5.180) 8.112 4.062 ( -2.727 0.000 -2.477) 3.684 4.176 ( 1.286 0.000 -5.919) 6.057 4.243 ( 2.740 0.000 11.718) 12.034 4.366 ( 3.822 0.000 -4.027) 5.552 4.468 ( -2.769 0.000 -0.509) 2.815 4.578 ( -3.396 0.000 -10.022) 10.582 4.718 ( 6.554 0.000 -4.575) 7.993 4.792 ( -7.305 0.000 3.547) 8.121 5.039 ( 0.878 0.000 -2.455) 2.607 5.101 ( -7.834 0.000 -3.481) 8.573 5.263 ( 3.828 0.000 2.635) 4.647 5.278 ( -3.506 0.000 3.584) 5.013 5.328 ( 7.024 0.000 -3.739) 7.957 5.403 ( -8.434 0.000 3.124) 8.994 5.432 ( -0.576 0.000 5.525) 5.555 5.530 ( 2.182 0.000 1.072) 2.431 5.531 ( 1.331 0.000 2.214) 2.584 5.648 ( -4.355 0.000 -2.362) 4.954 5.696 ( 0.439 0.000 6.654) 6.668 5.745 ( -1.911 0.000 4.870) 5.232 5.841 ( -1.546 0.000 8.599) 8.737 5.869 ( 2.612 0.000 -4.569) 5.263 5.927 ( 4.236 0.000 -2.887) 5.126 5.990 ( -1.117 0.000 -0.178) 1.131 6.035 ( -2.948 0.000 -2.163) 3.657 6.156 ( 4.710 0.000 7.343) 8.724 6.266 ( 5.971 0.000 0.441) 5.987 6.314 ( 0.547 0.000 -6.088) 6.112 6.377 ( 3.289 0.000 4.416) 5.506 6.418 ( 5.552 0.000 2.584) 6.124 6.484 ( 0.032 0.000 0.720) 0.720 6.509 ( -1.794 0.000 -0.880) 1.999 6.560 ( -1.652 0.000 0.835) 1.851 6.700 ( -7.748 0.000 -1.181) 7.837 6.801 ( -0.726 0.000 -2.083) 2.206 6.826 ( -4.227 0.000 1.082) 4.363 6.868 ( 0.274 0.000 14.699) 14.702 6.918 ( -1.759 0.000 9.606) 9.766 7.045 ( 2.303 0.000 4.870) 5.387 7.175 ( -3.692 0.000 -0.728) 3.763 7.287 ( 0.146 0.000 -1.277) 1.285 7.292 ( 7.928 0.000 -7.848) 11.155 7.405 ( 5.529 0.000 3.528) 6.559 7.600 ( 0.331 0.000 4.792) 4.803 7.694 ( 9.622 0.000 9.666) 13.638 7.814 ( -1.638 0.000 -8.264) 8.425 7.919 ( -4.322 0.000 9.830) 10.738 7.997 ( 4.998 0.000 2.622) 5.644 8.129 ( 3.710 0.000 -2.214) 4.321 8.194 ( 0.816 0.000 -6.263) 6.316 8.211 ( -4.694 0.000 4.541) 6.531 8.326 ( -0.493 0.000 0.883) 1.011 8.403 ( -0.622 0.000 7.079) 7.106 8.417 ( -3.942 0.000 -1.942) 4.395 8.465 ( -1.381 0.000 -5.036) 5.222 8.558 ( -1.488 0.000 -4.058) 4.322 8.646 ( 6.428 0.000 -5.170) 8.249 8.694 ( 3.954 0.000 -0.555) 3.993 8.834 ( -1.181 0.000 -8.040) 8.126 8.914 ( -0.260 0.000 -6.023) 6.029 9.125 ( 0.730 0.000 2.017) 2.145 9.199 ( -1.941 0.000 -4.726) 5.109 9.379 ( 0.629 0.000 7.781) 7.807 9.386 ( 1.453 0.000 14.011) 14.086 9.518 ( 0.264 0.000 -1.147) 1.177 9.733 ( -5.872 0.000 -0.861) 5.935 10.094 ( -0.372 0.000 0.591) 0.698 10.144 ( -0.227 0.000 -0.291) 0.369 10.300 ( 6.648 0.000 -7.487) 10.012 10.312 ( 1.566 0.000 -8.044) 8.195 10.905 ( 8.364 0.000 -5.581) 10.055 10.905 ( -0.313 0.000 -1.187) 1.228 11.098 ( 18.312 0.000 3.483) 18.640 11.564 ( -21.472 0.000 -2.151) 21.579 16.535 ( 4.877 0.000 -0.695) 4.927 16.548 ( 2.449 0.000 -0.408) 2.482 16.697 ( -4.489 0.000 -0.283) 4.498 16.700 ( -3.002 0.000 -0.873) 3.126 17.493 ( 1.422 0.000 3.126) 3.434 17.557 ( -0.090 0.000 0.205) 0.224 17.632 ( 2.224 0.000 -0.739) 2.344 17.651 ( -0.941 0.000 3.002) 3.146 17.702 ( -1.827 0.000 1.571) 2.410 17.722 ( -2.379 0.000 -2.507) 3.456 17.744 ( 2.624 0.000 -1.079) 2.837 17.798 ( -3.761 0.000 -0.630) 3.813 18.397 ( 0.082 0.000 0.676) 0.681 18.401 ( 0.197 0.000 0.462) 0.502 19.268 ( -0.499 0.000 0.247) 0.557 19.286 ( -1.957 0.000 0.031) 1.957 21.312 ( 1.388 0.000 0.415) 1.448 21.366 ( -1.948 0.000 -1.023) 2.201 21.448 ( 0.190 0.000 2.380) 2.388 21.484 ( 1.281 0.000 -1.026) 1.641 21.957 ( 0.049 0.000 0.310) 0.314 21.963 ( 0.489 0.000 -0.417) 0.643 22.085 ( 0.820 0.000 2.062) 2.219 22.154 ( -1.359 0.000 -0.753) 1.553 26.956 ( 0.591 0.000 0.265) 0.647 26.977 ( -0.635 0.000 -0.162) 0.655 27.133 ( 0.382 0.000 0.392) 0.547 27.154 ( -0.355 0.000 -0.395) 0.531 27.659 ( -0.372 0.000 0.351) 0.512 27.668 ( 0.351 0.000 -0.886) 0.953 27.738 ( -1.101 0.000 1.247) 1.663 27.757 ( 0.228 0.000 -1.091) 1.115 35.597 ( -3.490 0.000 -2.751) 4.444 35.625 ( -0.951 0.000 -4.950) 5.040 35.699 ( 4.594 0.000 0.465) 4.617 35.903 ( -4.517 0.000 -6.547) 7.954 36.098 ( 3.222 0.000 5.155) 6.079 36.249 ( -8.635 0.000 3.169) 9.198 36.581 ( 6.553 0.000 -0.879) 6.611 36.647 ( -4.486 0.000 2.058) 4.936 37.149 ( -1.185 0.000 7.070) 7.169 37.281 ( 3.226 0.000 -4.284) 5.363 38.834 ( -4.831 0.000 7.321) 8.771 38.911 ( 10.290 0.000 -9.255) 13.840 39.707 ( 8.232 0.000 2.456) 8.590 40.003 ( -7.009 0.000 -5.080) 8.657 40.240 ( 11.585 0.000 -1.808) 11.725 40.393 ( -11.261 0.000 4.870) 12.269 ======================= Grid point 131 (62/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( -22.194 0.000 15.082) 26.834 1.805 ( 3.526 0.000 -0.892) 3.637 1.896 ( 5.965 0.000 -7.844) 9.854 1.907 ( -0.988 0.000 -2.575) 2.758 2.101 ( -18.002 0.000 10.795) 20.990 2.372 ( 1.067 0.000 -1.051) 1.498 2.458 ( -1.983 0.000 -0.328) 2.010 2.487 ( 3.419 0.000 6.245) 7.120 2.838 ( -1.563 0.000 0.819) 1.764 2.840 ( -4.061 0.000 -5.247) 6.635 2.985 ( -4.177 0.000 -0.071) 4.178 3.160 ( 2.864 0.000 -10.673) 11.050 3.342 ( 8.251 0.000 -2.547) 8.635 3.374 ( 5.242 0.000 -5.755) 7.785 3.428 ( -5.686 0.000 0.206) 5.689 3.454 ( -2.731 0.000 1.583) 3.156 3.626 ( -6.106 0.000 -3.888) 7.239 3.732 ( 5.052 0.000 -0.969) 5.144 3.842 ( 0.656 0.000 2.365) 2.454 3.860 ( 1.121 0.000 -3.289) 3.474 3.925 ( -5.781 0.000 -3.198) 6.606 4.009 ( 0.319 0.000 9.952) 9.957 4.049 ( 8.302 0.000 -3.471) 8.998 4.107 ( -0.010 0.000 -8.539) 8.539 4.282 ( -11.810 0.000 2.920) 12.165 4.426 ( -0.280 0.000 -5.982) 5.988 4.429 ( 5.198 0.000 6.944) 8.674 4.497 ( 5.339 0.000 -5.027) 7.333 4.642 ( -8.335 0.000 3.110) 8.896 4.852 ( 7.471 0.000 -2.193) 7.787 4.999 ( -2.210 0.000 1.498) 2.670 5.072 ( 4.604 0.000 -0.271) 4.612 5.219 ( -5.994 0.000 5.122) 7.884 5.296 ( -5.102 0.000 -0.500) 5.126 5.352 ( 1.216 0.000 -3.880) 4.066 5.415 ( 6.128 0.000 2.680) 6.688 5.493 ( 2.837 0.000 3.494) 4.501 5.548 ( -1.153 0.000 0.042) 1.153 5.565 ( 0.123 0.000 -5.636) 5.637 5.592 ( 3.714 0.000 2.568) 4.515 5.739 ( -1.116 0.000 3.686) 3.851 5.792 ( 3.500 0.000 4.755) 5.904 5.850 ( -0.400 0.000 -2.530) 2.562 5.864 ( -0.101 0.000 -1.967) 1.970 5.962 ( 0.291 0.000 3.578) 3.590 5.975 ( -0.394 0.000 0.407) 0.566 6.079 ( 3.244 0.000 6.343) 7.124 6.086 ( -4.487 0.000 -10.355) 11.285 6.293 ( -0.851 0.000 -2.051) 2.221 6.330 ( 1.498 0.000 -3.947) 4.222 6.445 ( -9.247 0.000 -2.387) 9.550 6.445 ( 1.144 0.000 3.811) 3.979 6.455 ( -2.001 0.000 -2.596) 3.278 6.513 ( 0.938 0.000 4.718) 4.810 6.541 ( -8.358 0.000 -2.339) 8.679 6.642 ( 7.789 0.000 6.931) 10.426 6.759 ( -1.073 0.000 2.018) 2.285 6.803 ( 2.938 0.000 0.202) 2.945 6.972 ( -3.239 0.000 8.661) 9.247 6.987 ( -2.244 0.000 3.332) 4.017 7.097 ( -1.322 0.000 3.014) 3.291 7.163 ( 1.501 0.000 4.432) 4.680 7.282 ( 3.878 0.000 -5.139) 6.438 7.304 ( 3.602 0.000 -9.974) 10.604 7.532 ( 3.516 0.000 5.685) 6.684 7.586 ( -3.268 0.000 -12.115) 12.548 7.708 ( -5.062 0.000 7.029) 8.662 7.806 ( -0.505 0.000 -3.398) 3.435 7.895 ( -8.761 0.000 10.097) 13.367 8.030 ( -3.691 0.000 -0.478) 3.722 8.158 ( 3.080 0.000 -8.395) 8.942 8.173 ( 4.458 0.000 -0.622) 4.502 8.263 ( 0.115 0.000 8.126) 8.127 8.298 ( -1.643 0.000 -1.038) 1.943 8.360 ( -2.565 0.000 5.021) 5.639 8.412 ( -1.952 0.000 0.803) 2.111 8.476 ( -2.066 0.000 -4.921) 5.337 8.480 ( 3.907 0.000 2.494) 4.635 8.678 ( -3.397 0.000 -3.075) 4.582 8.709 ( 2.950 0.000 1.626) 3.368 8.797 ( -2.961 0.000 -9.498) 9.948 8.826 ( 3.991 0.000 -1.004) 4.116 9.146 ( 0.079 0.000 1.732) 1.734 9.155 ( -0.392 0.000 -1.587) 1.635 9.448 ( -0.976 0.000 6.477) 6.550 9.479 ( -1.750 0.000 -1.739) 2.467 9.555 ( 1.389 0.000 14.276) 14.343 9.609 ( -4.654 0.000 -6.570) 8.051 10.097 ( -1.095 0.000 2.788) 2.996 10.134 ( 0.091 0.000 -1.213) 1.216 10.239 ( -3.465 0.000 -3.187) 4.707 10.315 ( 2.481 0.000 -7.466) 7.867 10.848 ( -6.076 0.000 0.887) 6.140 10.916 ( -1.377 0.000 -3.388) 3.657 11.179 ( -18.548 0.000 -4.685) 19.131 11.490 ( 21.566 0.000 5.173) 22.178 16.531 ( -3.937 0.000 -0.323) 3.951 16.549 ( -2.948 0.000 -0.540) 2.997 16.685 ( 3.168 0.000 0.638) 3.232 16.695 ( 3.065 0.000 -0.178) 3.070 17.535 ( 0.748 0.000 2.125) 2.252 17.550 ( -0.058 0.000 -2.100) 2.100 17.646 ( -2.861 0.000 -1.737) 3.347 17.679 ( 1.036 0.000 0.913) 1.381 17.687 ( 1.028 0.000 0.840) 1.328 17.693 ( 2.037 0.000 2.642) 3.336 17.735 ( -2.367 0.000 -1.124) 2.621 17.803 ( 4.623 0.000 -1.317) 4.807 18.402 ( -0.126 0.000 0.366) 0.387 18.404 ( -0.104 0.000 0.045) 0.113 19.272 ( 0.360 0.000 -0.159) 0.393 19.284 ( 1.970 0.000 0.303) 1.993 21.324 ( -1.825 0.000 -0.777) 1.983 21.346 ( 1.756 0.000 0.992) 2.017 21.461 ( -0.665 0.000 1.363) 1.517 21.489 ( 0.731 0.000 -1.745) 1.892 21.956 ( -0.454 0.000 0.316) 0.553 21.964 ( -0.035 0.000 -0.382) 0.384 22.119 ( -1.389 0.000 -1.444) 2.004 22.122 ( 1.008 0.000 2.575) 2.765 26.962 ( -0.718 0.000 -0.334) 0.791 26.971 ( 0.738 0.000 0.409) 0.844 27.143 ( -0.367 0.000 -0.603) 0.706 27.145 ( 0.551 0.000 0.482) 0.732 27.654 ( -0.547 0.000 0.476) 0.725 27.669 ( 0.429 0.000 -0.624) 0.757 27.735 ( -0.297 0.000 1.127) 1.166 27.761 ( 1.279 0.000 -1.135) 1.710 35.562 ( -0.094 0.000 1.421) 1.424 35.596 ( 1.993 0.000 -2.941) 3.552 35.761 ( -4.501 0.000 -5.881) 7.406 35.808 ( 5.915 0.000 3.036) 6.649 36.154 ( -3.976 0.000 -0.121) 3.978 36.247 ( 8.699 0.000 3.190) 9.266 36.566 ( -5.926 0.000 0.579) 5.954 36.686 ( 6.146 0.000 -1.757) 6.392 37.169 ( -4.238 0.000 6.920) 8.115 37.270 ( 1.123 0.000 -5.058) 5.181 38.748 ( -11.873 0.000 7.068) 13.818 38.986 ( 6.997 0.000 -7.986) 10.618 39.789 ( -9.558 0.000 -6.037) 11.305 39.897 ( 9.267 0.000 5.458) 10.754 40.211 ( -13.209 0.000 1.519) 13.296 40.458 ( 13.262 0.000 -1.673) 13.367 ======================= Grid point 132 (63/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.121 ( -22.078 0.000 18.651) 28.901 1.750 ( -19.157 0.000 18.944) 26.942 1.859 ( -2.912 0.000 -0.307) 2.928 1.860 ( -7.739 0.000 4.274) 8.841 2.018 ( 8.674 0.000 -15.052) 17.372 2.238 ( -8.476 0.000 -3.739) 9.264 2.500 ( -14.830 0.000 6.344) 16.130 2.542 ( 1.177 0.000 10.436) 10.503 2.705 ( -4.785 0.000 -2.946) 5.619 2.724 ( -8.390 0.000 -2.470) 8.746 2.880 ( -5.230 0.000 3.529) 6.309 3.126 ( 2.429 0.000 -12.176) 12.416 3.271 ( -9.464 0.000 -5.733) 11.065 3.321 ( -6.738 0.000 2.776) 7.288 3.446 ( 3.854 0.000 -1.377) 4.092 3.492 ( 3.415 0.000 4.414) 5.581 3.588 ( -2.143 0.000 0.601) 2.226 3.792 ( -3.591 0.000 0.186) 3.595 3.793 ( 3.846 0.000 0.467) 3.874 3.859 ( -0.203 0.000 -3.318) 3.324 3.892 ( 3.594 0.000 1.255) 3.807 4.064 ( 3.723 0.000 -4.629) 5.940 4.081 ( -1.172 0.000 6.174) 6.284 4.101 ( 1.680 0.000 -3.247) 3.655 4.270 ( 1.897 0.000 11.546) 11.700 4.335 ( 1.592 0.000 -9.119) 9.257 4.437 ( -2.011 0.000 -2.468) 3.184 4.577 ( 5.642 0.000 7.252) 9.188 4.706 ( 5.312 0.000 0.239) 5.318 4.871 ( -1.377 0.000 -1.533) 2.061 5.013 ( 0.991 0.000 0.879) 1.325 5.177 ( -5.424 0.000 4.009) 6.745 5.190 ( 6.765 0.000 1.640) 6.961 5.274 ( 2.862 0.000 1.248) 3.123 5.284 ( -5.500 0.000 -0.200) 5.504 5.447 ( -4.947 0.000 -5.526) 7.417 5.454 ( -1.579 0.000 -1.089) 1.918 5.587 ( 4.697 0.000 -4.646) 6.606 5.624 ( 8.350 0.000 0.789) 8.388 5.681 ( 2.355 0.000 2.414) 3.373 5.786 ( -2.858 0.000 0.928) 3.005 5.791 ( 0.544 0.000 -7.200) 7.220 5.811 ( -2.722 0.000 -3.991) 4.831 5.815 ( -3.357 0.000 -0.177) 3.361 5.970 ( 3.759 0.000 -5.676) 6.808 5.977 ( -2.450 0.000 0.311) 2.470 6.006 ( -1.700 0.000 3.874) 4.230 6.136 ( -2.408 0.000 -4.183) 4.826 6.226 ( -3.459 0.000 8.467) 9.146 6.250 ( 1.369 0.000 -3.234) 3.512 6.335 ( -5.269 0.000 -5.567) 7.665 6.384 ( -0.141 0.000 -1.700) 1.706 6.470 ( 1.223 0.000 3.854) 4.044 6.490 ( -1.792 0.000 5.043) 5.352 6.540 ( -1.141 0.000 3.265) 3.458 6.772 ( 2.366 0.000 1.256) 2.679 6.804 ( 2.104 0.000 2.192) 3.038 6.893 ( 1.974 0.000 -1.700) 2.605 6.928 ( -3.618 0.000 -0.643) 3.675 6.949 ( 0.494 0.000 2.888) 2.930 7.074 ( -4.759 0.000 0.538) 4.789 7.141 ( 0.104 0.000 -13.483) 13.483 7.307 ( 3.516 0.000 -5.206) 6.282 7.314 ( 1.633 0.000 1.860) 2.476 7.389 ( -3.318 0.000 -8.851) 9.452 7.572 ( -3.458 0.000 -0.340) 3.474 7.618 ( -8.486 0.000 -7.068) 11.043 7.742 ( -6.027 0.000 7.202) 9.391 7.841 ( -4.846 0.000 3.466) 5.957 7.947 ( -10.424 0.000 6.564) 12.318 8.050 ( -0.297 0.000 -10.394) 10.398 8.162 ( -1.852 0.000 -1.808) 2.588 8.320 ( 2.419 0.000 2.967) 3.828 8.332 ( -10.022 0.000 6.877) 12.155 8.397 ( 2.382 0.000 7.041) 7.433 8.423 ( 0.061 0.000 3.816) 3.817 8.427 ( 3.829 0.000 -3.748) 5.359 8.587 ( 5.071 0.000 1.415) 5.265 8.591 ( -0.021 0.000 -6.520) 6.520 8.626 ( -4.373 0.000 -7.393) 8.590 8.819 ( 3.360 0.000 5.163) 6.160 8.873 ( -0.493 0.000 2.185) 2.240 9.129 ( -0.941 0.000 -2.355) 2.536 9.183 ( 1.320 0.000 4.540) 4.728 9.404 ( -2.949 0.000 -4.269) 5.189 9.455 ( -3.094 0.000 -5.399) 6.222 9.463 ( -4.307 0.000 0.744) 4.370 9.734 ( 2.930 0.000 15.955) 16.222 10.105 ( -2.635 0.000 5.606) 6.195 10.129 ( 1.376 0.000 -2.324) 2.701 10.166 ( -1.973 0.000 -1.144) 2.280 10.252 ( -2.030 0.000 -4.902) 5.305 10.706 ( -11.238 0.000 0.562) 11.252 10.824 ( -14.307 0.000 2.251) 14.483 10.857 ( -7.875 0.000 -5.585) 9.655 11.895 ( 19.610 0.000 3.453) 19.912 16.449 ( -4.495 0.000 -0.333) 4.508 16.483 ( -4.063 0.000 0.496) 4.094 16.757 ( 3.866 0.000 0.532) 3.902 16.766 ( 4.018 0.000 1.156) 4.181 17.511 ( -0.735 0.000 -4.218) 4.282 17.568 ( 1.477 0.000 0.905) 1.732 17.595 ( -1.868 0.000 -0.383) 1.906 17.667 ( -2.170 0.000 1.150) 2.456 17.707 ( 1.528 0.000 -2.071) 2.573 17.745 ( 2.233 0.000 -0.108) 2.236 17.762 ( 3.291 0.000 2.723) 4.272 17.879 ( 5.406 0.000 -0.816) 5.467 18.398 ( -0.375 0.000 -0.326) 0.497 18.399 ( -0.309 0.000 -0.161) 0.348 19.292 ( 2.011 0.000 0.024) 2.011 19.340 ( 4.243 0.000 0.128) 4.245 21.291 ( -1.417 0.000 -0.254) 1.440 21.388 ( 1.791 0.000 1.089) 2.096 21.454 ( -1.142 0.000 0.638) 1.309 21.473 ( -0.136 0.000 -3.147) 3.150 21.948 ( -0.768 0.000 0.322) 0.833 21.955 ( -0.570 0.000 -0.340) 0.664 22.083 ( -1.185 0.000 -1.401) 1.835 22.165 ( 1.357 0.000 2.115) 2.513 26.948 ( -0.587 0.000 -0.172) 0.612 26.987 ( 0.732 0.000 0.147) 0.747 27.132 ( -0.270 0.000 -0.487) 0.557 27.158 ( 0.447 0.000 0.240) 0.507 27.655 ( 0.041 0.000 0.944) 0.945 27.669 ( 0.327 0.000 -0.528) 0.622 27.752 ( 0.907 0.000 1.176) 1.485 27.773 ( 1.319 0.000 -1.394) 1.919 35.601 ( 0.253 0.000 3.516) 3.525 35.648 ( 5.302 0.000 1.536) 5.520 35.665 ( -0.611 0.000 -2.365) 2.442 35.942 ( 5.579 0.000 3.652) 6.668 36.116 ( 0.875 0.000 -1.906) 2.097 36.425 ( 9.031 0.000 0.879) 9.074 36.469 ( -5.384 0.000 0.336) 5.395 36.730 ( 1.798 0.000 -3.956) 4.346 37.133 ( -7.455 0.000 7.207) 10.369 37.246 ( 3.050 0.000 -6.881) 7.527 38.602 ( -13.640 0.000 10.522) 17.227 38.965 ( 0.066 0.000 -11.616) 11.616 39.593 ( -7.835 0.000 -2.944) 8.370 39.981 ( -11.608 0.000 -2.408) 11.855 40.115 ( 7.017 0.000 8.887) 11.323 40.635 ( 10.784 0.000 -5.183) 11.965 ======================= Grid point 133 (64/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.984 ( -16.749 0.000 24.314) 29.525 1.494 ( -30.932 0.000 8.931) 32.195 1.747 ( -15.204 0.000 17.267) 23.007 1.797 ( -3.404 0.000 -1.901) 3.898 1.976 ( 5.522 0.000 -20.058) 20.804 2.075 ( -5.752 0.000 -3.247) 6.605 2.231 ( -17.920 0.000 17.793) 25.253 2.596 ( -5.727 0.000 -9.572) 11.155 2.626 ( -7.850 0.000 2.901) 8.369 2.646 ( -4.849 0.000 16.092) 16.807 2.830 ( -6.921 0.000 4.975) 8.524 2.988 ( -1.319 0.000 -11.319) 11.396 3.037 ( -11.667 0.000 -2.359) 11.903 3.298 ( 0.802 0.000 1.791) 1.963 3.397 ( -6.321 0.000 -1.865) 6.590 3.452 ( -11.832 0.000 7.620) 14.073 3.675 ( 7.516 0.000 5.971) 9.599 3.709 ( -7.448 0.000 -6.237) 9.715 3.720 ( -4.791 0.000 2.671) 5.485 3.933 ( 4.718 0.000 3.125) 5.659 4.056 ( 8.678 0.000 1.277) 8.771 4.099 ( 5.219 0.000 -2.316) 5.710 4.140 ( 1.450 0.000 5.490) 5.678 4.150 ( 5.760 0.000 -1.243) 5.893 4.355 ( 7.206 0.000 -3.601) 8.056 4.440 ( 8.030 0.000 7.922) 11.280 4.458 ( 8.863 0.000 -5.781) 10.582 4.746 ( 1.623 0.000 -2.606) 3.070 4.774 ( 5.533 0.000 6.710) 8.697 4.802 ( -0.459 0.000 -4.936) 4.957 5.089 ( 0.324 0.000 6.939) 6.947 5.106 ( -2.215 0.000 -0.152) 2.220 5.124 ( -7.213 0.000 -11.728) 13.768 5.217 ( -7.816 0.000 3.892) 8.731 5.297 ( -7.314 0.000 -1.480) 7.463 5.342 ( 2.235 0.000 1.779) 2.856 5.425 ( -1.688 0.000 -8.215) 8.386 5.549 ( -5.110 0.000 -5.738) 7.684 5.592 ( 2.439 0.000 -8.006) 8.370 5.656 ( -7.232 0.000 3.072) 7.857 5.679 ( -6.424 0.000 -1.993) 6.726 5.787 ( 7.666 0.000 -3.359) 8.369 5.796 ( 1.374 0.000 -1.909) 2.352 5.803 ( 0.150 0.000 2.434) 2.438 5.953 ( 1.070 0.000 1.137) 1.561 5.963 ( -4.412 0.000 0.853) 4.493 6.015 ( 4.893 0.000 -1.659) 5.166 6.147 ( 6.064 0.000 -2.414) 6.527 6.201 ( -3.371 0.000 -1.730) 3.789 6.302 ( 4.043 0.000 -1.997) 4.509 6.310 ( 1.123 0.000 3.733) 3.898 6.434 ( 4.811 0.000 4.655) 6.694 6.448 ( -6.667 0.000 4.406) 7.991 6.547 ( 1.693 0.000 2.528) 3.043 6.574 ( 2.418 0.000 0.936) 2.593 6.719 ( -2.278 0.000 -9.143) 9.423 6.776 ( -5.572 0.000 -10.656) 12.025 6.779 ( -5.563 0.000 1.547) 5.774 6.941 ( 3.265 0.000 -1.126) 3.453 6.986 ( -3.245 0.000 2.710) 4.227 7.012 ( -0.193 0.000 -8.890) 8.892 7.085 ( 3.319 0.000 3.836) 5.072 7.183 ( -9.001 0.000 -8.392) 12.306 7.291 ( -4.044 0.000 -5.015) 6.442 7.373 ( 5.110 0.000 -5.596) 7.578 7.454 ( -0.190 0.000 -1.510) 1.522 7.478 ( -6.751 0.000 5.237) 8.544 7.717 ( -4.111 0.000 3.222) 5.223 7.732 ( -12.865 0.000 -2.394) 13.085 7.742 ( -7.858 0.000 -5.194) 9.420 8.070 ( 1.168 0.000 4.915) 5.052 8.121 ( -3.282 0.000 2.059) 3.874 8.206 ( -9.453 0.000 9.734) 13.569 8.385 ( 1.937 0.000 -0.868) 2.122 8.398 ( -0.445 0.000 -4.790) 4.810 8.429 ( -1.807 0.000 0.703) 1.939 8.496 ( 5.285 0.000 -2.240) 5.740 8.508 ( -1.777 0.000 -2.152) 2.791 8.630 ( 4.868 0.000 2.319) 5.392 8.679 ( 3.841 0.000 0.468) 3.869 8.844 ( -3.613 0.000 0.868) 3.716 8.938 ( 3.904 0.000 7.362) 8.333 9.075 ( -2.031 0.000 -3.038) 3.654 9.238 ( 0.006 0.000 0.936) 0.936 9.326 ( -2.685 0.000 -0.169) 2.690 9.326 ( -1.967 0.000 -7.361) 7.619 9.431 ( -4.166 0.000 4.883) 6.419 9.933 ( 3.551 0.000 11.992) 12.506 10.121 ( 1.833 0.000 -7.401) 7.624 10.122 ( -1.244 0.000 5.927) 6.056 10.147 ( 0.109 0.000 -0.694) 0.702 10.218 ( -0.226 0.000 6.069) 6.073 10.489 ( -13.052 0.000 -1.169) 13.104 10.508 ( -15.734 0.000 -5.353) 16.620 10.773 ( -7.043 0.000 6.884) 9.849 12.139 ( 7.761 0.000 -8.570) 11.562 16.384 ( -2.776 0.000 -0.181) 2.782 16.425 ( -3.275 0.000 0.703) 3.349 16.818 ( 2.564 0.000 0.451) 2.604 16.838 ( 2.540 0.000 1.181) 2.801 17.479 ( 1.710 0.000 -1.644) 2.372 17.569 ( -0.805 0.000 0.059) 0.807 17.604 ( 1.506 0.000 0.703) 1.662 17.636 ( -1.886 0.000 0.250) 1.903 17.730 ( 2.470 0.000 -1.275) 2.780 17.770 ( 1.850 0.000 -1.771) 2.561 17.843 ( 2.608 0.000 3.757) 4.574 17.963 ( 5.159 0.000 -1.196) 5.296 18.387 ( -0.458 0.000 -0.431) 0.629 18.390 ( -0.320 0.000 -0.559) 0.644 19.342 ( 3.328 0.000 1.184) 3.533 19.423 ( 5.097 0.000 -0.151) 5.099 21.270 ( -1.066 0.000 0.174) 1.080 21.415 ( -1.582 0.000 -4.064) 4.361 21.424 ( 0.512 0.000 -0.419) 0.661 21.437 ( -1.130 0.000 0.210) 1.150 21.937 ( -0.820 0.000 0.281) 0.866 21.939 ( -0.837 0.000 -0.271) 0.880 22.055 ( -0.731 0.000 -1.066) 1.293 22.191 ( 0.305 0.000 -1.236) 1.273 26.941 ( -0.262 0.000 0.177) 0.316 26.994 ( 0.332 0.000 -0.714) 0.788 27.128 ( 0.107 0.000 0.192) 0.220 27.164 ( 0.209 0.000 0.004) 0.209 27.674 ( 0.775 0.000 1.392) 1.593 27.675 ( 0.878 0.000 -0.376) 0.955 27.780 ( 1.179 0.000 -1.357) 1.797 27.781 ( 1.071 0.000 1.019) 1.479 35.595 ( -1.214 0.000 2.296) 2.597 35.730 ( 4.282 0.000 3.974) 5.842 35.810 ( 9.165 0.000 3.916) 9.966 36.039 ( 3.749 0.000 -1.756) 4.140 36.180 ( 7.063 0.000 5.688) 9.069 36.412 ( -3.086 0.000 5.326) 6.155 36.518 ( -1.833 0.000 1.668) 2.479 36.710 ( 4.193 0.000 -6.354) 7.613 37.066 ( -7.521 0.000 7.140) 10.371 37.247 ( 5.847 0.000 -10.093) 11.664 38.507 ( -10.869 0.000 14.773) 18.340 38.753 ( -9.310 0.000 -15.133) 17.767 39.478 ( -4.602 0.000 0.850) 4.680 39.772 ( -9.414 0.000 -2.404) 9.716 40.307 ( 5.064 0.000 9.059) 10.378 40.723 ( 7.129 0.000 -8.673) 11.227 ======================= Grid point 134 (65/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 92 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.931 ( -36.549 0.000 13.512) 38.967 1.004 ( -9.688 0.000 28.315) 29.927 1.673 ( -6.841 0.000 -9.800) 11.951 1.697 ( -5.943 0.000 3.658) 6.978 1.924 ( 2.598 0.000 -1.098) 2.821 1.995 ( -1.265 0.000 -1.651) 2.080 2.231 ( -7.173 0.000 23.741) 24.801 2.283 ( -14.504 0.000 -12.514) 19.157 2.349 ( -18.122 0.000 -6.154) 19.138 2.693 ( -4.636 0.000 11.384) 12.292 2.732 ( -11.753 0.000 12.262) 16.985 2.910 ( -2.933 0.000 1.456) 3.274 2.961 ( -1.691 0.000 2.286) 2.843 3.266 ( 4.636 0.000 -13.062) 13.860 3.307 ( -11.030 0.000 4.616) 11.957 3.352 ( -5.550 0.000 5.739) 7.984 3.582 ( 0.463 0.000 3.010) 3.045 3.696 ( -2.334 0.000 4.992) 5.511 3.861 ( 4.669 0.000 8.889) 10.041 3.949 ( -1.434 0.000 -5.327) 5.516 4.169 ( 4.664 0.000 0.796) 4.732 4.191 ( 4.486 0.000 -1.938) 4.887 4.216 ( 2.670 0.000 1.157) 2.910 4.235 ( 6.667 0.000 -0.961) 6.736 4.483 ( 8.262 0.000 -2.928) 8.766 4.605 ( 11.346 0.000 -3.659) 11.921 4.631 ( 3.852 0.000 1.247) 4.049 4.719 ( -4.103 0.000 -3.555) 5.429 4.761 ( 4.111 0.000 -0.813) 4.190 4.879 ( 2.433 0.000 -1.335) 2.775 4.884 ( -3.543 0.000 -13.717) 14.167 4.980 ( -0.292 0.000 -5.069) 5.078 5.080 ( -10.476 0.000 3.314) 10.988 5.083 ( -6.036 0.000 -1.296) 6.174 5.239 ( -2.412 0.000 -5.186) 5.719 5.313 ( -1.934 0.000 6.893) 7.160 5.441 ( 4.281 0.000 8.661) 9.661 5.527 ( -4.601 0.000 -3.391) 5.716 5.529 ( -8.124 0.000 -1.841) 8.330 5.576 ( 0.524 0.000 -0.206) 0.563 5.583 ( 3.538 0.000 0.512) 3.575 5.830 ( -2.263 0.000 5.413) 5.867 5.840 ( 1.740 0.000 3.920) 4.289 5.861 ( 6.676 0.000 -5.092) 8.396 5.929 ( 2.748 0.000 -1.484) 3.123 5.999 ( 1.162 0.000 3.997) 4.163 6.103 ( -2.245 0.000 -4.770) 5.272 6.105 ( 6.269 0.000 0.396) 6.281 6.294 ( 1.430 0.000 -4.292) 4.524 6.297 ( 5.241 0.000 3.593) 6.355 6.348 ( 3.159 0.000 -0.268) 3.171 6.398 ( -7.292 0.000 7.704) 10.608 6.512 ( -3.859 0.000 -18.659) 19.054 6.516 ( -3.999 0.000 -1.598) 4.306 6.579 ( 3.854 0.000 3.440) 5.166 6.615 ( 1.689 0.000 -0.980) 1.953 6.679 ( 1.455 0.000 -3.502) 3.792 6.715 ( -5.746 0.000 2.185) 6.147 6.867 ( -1.252 0.000 -4.738) 4.900 6.882 ( -5.930 0.000 -5.986) 8.426 7.004 ( -3.413 0.000 3.298) 4.746 7.044 ( 0.565 0.000 -2.961) 3.015 7.125 ( -6.139 0.000 -1.579) 6.339 7.184 ( 0.624 0.000 0.006) 0.624 7.414 ( -13.371 0.000 -1.525) 13.458 7.439 ( 6.374 0.000 -0.999) 6.452 7.459 ( -5.849 0.000 -5.594) 8.094 7.494 ( 1.035 0.000 0.340) 1.090 7.538 ( -3.567 0.000 -2.896) 4.594 7.702 ( -1.405 0.000 1.584) 2.117 8.102 ( -2.981 0.000 5.851) 6.566 8.120 ( -1.533 0.000 5.733) 5.934 8.204 ( -1.939 0.000 7.628) 7.870 8.339 ( -1.575 0.000 -1.021) 1.877 8.352 ( 1.811 0.000 -6.343) 6.596 8.408 ( -0.097 0.000 -8.273) 8.274 8.531 ( 0.673 0.000 6.606) 6.640 8.584 ( 5.827 0.000 -0.358) 5.838 8.705 ( 1.672 0.000 0.323) 1.703 8.728 ( 1.371 0.000 0.139) 1.378 8.802 ( -2.175 0.000 2.482) 3.300 8.961 ( -3.025 0.000 -4.318) 5.272 9.157 ( 9.657 0.000 4.001) 10.453 9.192 ( -2.272 0.000 -3.494) 4.167 9.250 ( -1.413 0.000 -4.061) 4.300 9.304 ( -3.569 0.000 3.994) 5.356 9.478 ( 7.006 0.000 7.659) 10.380 10.020 ( -5.819 0.000 7.474) 9.473 10.070 ( 2.002 0.000 -8.092) 8.336 10.137 ( -1.022 0.000 -1.442) 1.767 10.152 ( -2.719 0.000 2.769) 3.881 10.213 ( -11.188 0.000 -1.287) 11.262 10.290 ( -6.733 0.000 1.634) 6.929 10.346 ( 4.345 0.000 3.420) 5.530 10.778 ( -0.709 0.000 13.021) 13.040 11.894 ( -18.474 0.000 -21.127) 28.065 16.353 ( -0.744 0.000 0.014) 0.744 16.383 ( -2.234 0.000 0.419) 2.273 16.851 ( 1.045 0.000 0.104) 1.050 16.859 ( -0.133 0.000 -0.210) 0.249 17.553 ( 4.742 0.000 1.652) 5.021 17.563 ( -0.511 0.000 1.022) 1.143 17.613 ( -0.452 0.000 -0.707) 0.839 17.630 ( 1.066 0.000 -0.207) 1.086 17.757 ( 1.638 0.000 -0.835) 1.839 17.779 ( 1.190 0.000 -1.878) 2.223 17.928 ( 2.419 0.000 5.241) 5.772 18.028 ( 3.944 0.000 -1.791) 4.331 18.377 ( -0.321 0.000 -0.348) 0.474 18.380 ( -0.142 0.000 -0.658) 0.673 19.432 ( 5.083 0.000 1.803) 5.393 19.496 ( 3.327 0.000 -0.425) 3.354 21.255 ( -0.901 0.000 0.109) 0.908 21.304 ( -5.110 0.000 -3.428) 6.154 21.424 ( -0.472 0.000 0.076) 0.478 21.435 ( 0.063 0.000 -0.056) 0.084 21.925 ( -0.537 0.000 -0.139) 0.555 21.927 ( -0.627 0.000 0.158) 0.647 22.041 ( 0.103 0.000 -0.700) 0.707 22.131 ( -4.170 0.000 -3.127) 5.212 26.942 ( 0.069 0.000 0.411) 0.417 26.985 ( -0.163 0.000 -1.427) 1.436 27.140 ( 0.593 0.000 0.866) 1.050 27.169 ( 0.244 0.000 0.097) 0.262 27.690 ( 1.197 0.000 -0.234) 1.219 27.698 ( 0.340 0.000 0.963) 1.021 27.792 ( 1.417 0.000 -0.896) 1.676 27.801 ( 0.204 0.000 0.626) 0.659 35.630 ( 1.040 0.000 5.305) 5.406 35.842 ( 3.222 0.000 5.186) 6.106 35.916 ( 2.608 0.000 -4.558) 5.252 36.053 ( 4.222 0.000 -7.388) 8.509 36.325 ( 0.574 0.000 0.559) 0.801 36.421 ( -7.742 0.000 0.733) 7.777 36.635 ( 12.777 0.000 18.924) 22.833 36.769 ( 6.799 0.000 -3.869) 7.823 37.022 ( -4.330 0.000 3.142) 5.350 37.240 ( 5.285 0.000 -12.650) 13.710 38.494 ( -8.465 0.000 16.348) 18.409 38.530 ( 1.565 0.000 -3.596) 3.922 39.443 ( -1.575 0.000 2.966) 3.358 39.626 ( -4.969 0.000 -2.406) 5.521 40.446 ( 0.796 0.000 9.556) 9.590 40.731 ( 4.555 0.000 -9.680) 10.698 ======================= Grid point 135 (66/92) ======================= q-point: ( 0.00 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.963 ( 9.717 6.720 22.069) 25.033 1.369 ( -4.821 1.674 -19.059) 19.730 1.622 ( -4.708 31.961 16.538) 36.293 1.825 ( -0.537 13.595 -2.060) 13.761 1.981 ( 0.309 -0.457 1.733) 1.819 2.013 ( -2.797 0.909 -0.730) 3.030 2.045 ( 1.756 3.801 0.502) 4.217 2.166 ( -1.298 16.304 -11.566) 20.032 2.525 ( 7.475 -0.909 13.225) 15.219 2.579 ( -3.964 -6.262 7.799) 10.759 2.761 ( -7.710 4.802 20.299) 22.238 2.928 ( 0.342 0.864 3.325) 3.452 2.937 ( -0.253 1.380 2.819) 3.149 3.196 ( -1.264 -3.259 -6.549) 7.423 3.232 ( 2.242 0.907 1.485) 2.838 3.345 ( 6.642 3.178 -8.092) 10.940 3.634 ( 3.101 -7.509 6.168) 10.201 3.705 ( -0.146 -0.723 1.209) 1.416 3.910 ( 0.036 0.949 -2.615) 2.782 4.004 ( 1.067 -5.652 0.314) 5.760 4.090 ( 1.234 0.413 -2.515) 2.832 4.142 ( -2.958 -2.460 -3.152) 4.974 4.332 ( 2.755 0.581 0.503) 2.860 4.389 ( 3.886 3.424 1.398) 5.365 4.444 ( -2.212 2.958 -2.481) 4.450 4.552 ( -6.668 3.747 -7.056) 10.407 4.627 ( -4.804 1.684 -1.037) 5.195 4.635 ( 1.021 -1.971 -1.071) 2.465 4.767 ( 4.509 -5.382 1.121) 7.110 4.827 ( -2.161 0.217 -5.188) 5.624 4.992 ( 11.774 -0.990 7.861) 14.192 5.090 ( -2.965 8.673 0.978) 9.218 5.110 ( -3.434 4.236 -0.064) 5.454 5.142 ( -1.505 1.605 -3.462) 4.102 5.214 ( 3.958 4.885 1.689) 6.511 5.287 ( 2.428 4.013 -4.100) 6.230 5.397 ( -3.568 3.287 -2.102) 5.287 5.435 ( -1.717 3.912 -3.560) 5.561 5.544 ( -0.318 0.599 1.534) 1.677 5.574 ( 1.222 0.621 -2.433) 2.792 5.717 ( -0.735 -0.800 9.515) 9.577 5.795 ( -0.960 -4.080 4.809) 6.379 5.822 ( -0.917 -5.155 -0.255) 5.242 5.907 ( 0.432 -0.560 -3.406) 3.479 5.937 ( 2.209 -4.164 0.854) 4.790 6.022 ( -2.035 -2.471 -3.358) 4.639 6.105 ( 4.774 1.717 3.839) 6.362 6.176 ( 2.914 -4.515 1.255) 5.518 6.264 ( -5.019 -4.626 -6.469) 9.404 6.294 ( 0.132 2.433 -6.659) 7.091 6.357 ( -2.314 2.873 3.130) 4.838 6.377 ( -1.328 -1.975 4.130) 4.767 6.422 ( 2.068 -0.062 -1.067) 2.328 6.464 ( -0.910 1.518 -2.627) 3.168 6.533 ( 0.517 -5.100 -0.697) 5.173 6.564 ( 1.740 -2.709 -3.956) 5.101 6.643 ( 0.810 -0.782 -1.388) 1.787 6.678 ( -0.738 1.541 -3.819) 4.184 6.843 ( 1.562 -0.986 4.184) 4.574 6.905 ( -1.407 -0.396 -0.900) 1.717 6.957 ( 4.145 5.094 2.067) 6.885 7.031 ( -4.109 0.595 0.502) 4.182 7.046 ( -5.345 3.117 1.788) 6.441 7.136 ( -6.016 0.629 -4.398) 7.479 7.262 ( 0.305 -2.645 3.001) 4.012 7.333 ( 5.189 -4.653 -4.050) 8.061 7.400 ( -3.394 -2.774 -2.942) 5.279 7.440 ( 2.844 -7.668 -5.967) 10.124 7.653 ( 3.853 2.600 2.618) 5.334 7.709 ( 0.012 1.828 -2.221) 2.876 7.964 ( -0.103 -8.392 8.803) 12.162 8.099 ( -3.504 -6.285 -2.604) 7.652 8.225 ( -0.227 -1.904 2.479) 3.134 8.320 ( -0.179 -0.236 0.973) 1.017 8.383 ( 1.312 6.782 -2.267) 7.271 8.405 ( 1.877 6.079 -1.888) 6.637 8.607 ( -3.465 2.326 5.030) 6.536 8.689 ( 3.459 1.979 -2.278) 4.590 8.727 ( 1.942 1.003 2.009) 2.969 8.754 ( -1.336 2.301 0.301) 2.678 8.845 ( -0.569 1.450 -1.394) 2.090 8.895 ( 1.061 0.352 -4.508) 4.645 9.079 ( -1.017 -3.312 4.037) 5.319 9.163 ( -1.676 -2.498 -3.647) 4.728 9.282 ( -1.580 2.500 5.066) 5.866 9.344 ( 0.645 3.146 -1.215) 3.434 9.752 ( 11.630 -6.688 2.404) 13.629 9.771 ( -8.915 -4.786 0.656) 10.140 9.998 ( -3.309 0.591 4.654) 5.741 10.076 ( 0.765 -0.505 -1.841) 2.056 10.191 ( -1.532 3.170 0.754) 3.601 10.215 ( 1.593 4.473 -2.951) 5.591 10.341 ( 1.928 2.188 2.952) 4.150 10.417 ( 1.294 4.445 -4.558) 6.497 10.960 ( 11.609 -6.514 19.029) 23.223 11.335 ( -13.103 -4.301 -19.995) 24.289 16.356 ( 0.760 -0.029 0.201) 0.787 16.357 ( -0.772 -0.046 0.055) 0.775 16.847 ( -0.123 -0.858 0.005) 0.866 16.849 ( 0.045 -0.861 -0.207) 0.887 17.517 ( 0.183 -3.099 1.226) 3.337 17.543 ( -0.370 -3.528 -1.253) 3.762 17.637 ( 0.429 1.580 1.407) 2.159 17.659 ( 0.026 1.134 -0.645) 1.305 17.763 ( 0.171 -0.435 -0.420) 0.628 17.772 ( -0.017 -0.383 -1.394) 1.446 17.902 ( -1.119 -4.653 3.146) 5.727 17.949 ( 0.774 -6.129 -1.819) 6.440 18.586 ( 0.109 16.563 -0.224) 16.565 18.596 ( 0.028 15.830 -1.460) 15.898 19.449 ( 1.027 -5.286 1.461) 5.580 19.474 ( -0.803 -4.076 -1.233) 4.334 21.242 ( -0.154 0.258 0.291) 0.418 21.248 ( 0.031 0.246 -0.312) 0.398 21.423 ( 0.281 -0.119 0.162) 0.345 21.427 ( -0.273 -0.195 -0.253) 0.421 21.929 ( -0.131 0.868 0.282) 0.922 21.938 ( 0.287 1.319 -0.662) 1.503 22.046 ( -1.942 -0.178 0.096) 1.953 22.049 ( 0.679 -0.096 -0.183) 0.710 26.958 ( 0.160 0.971 0.808) 1.274 26.980 ( -0.279 1.109 -1.450) 1.847 27.146 ( 0.522 -1.112 0.982) 1.573 27.159 ( -0.420 -0.858 -0.416) 1.042 27.704 ( -0.676 0.362 0.555) 0.947 27.710 ( 0.628 0.259 -0.110) 0.688 27.805 ( -1.041 0.678 0.301) 1.278 27.812 ( 0.804 0.518 -0.402) 1.038 35.758 ( 1.618 3.248 5.453) 6.550 35.851 ( -1.267 -0.053 -2.902) 3.167 35.982 ( -2.236 5.884 2.426) 6.746 36.083 ( 2.459 4.404 -6.486) 8.216 36.363 ( 1.185 2.809 0.401) 3.075 36.368 ( -0.192 3.066 0.031) 3.072 36.794 ( -5.739 -3.425 4.497) 8.056 36.827 ( 5.263 -2.948 -0.576) 6.060 36.897 ( -4.463 -4.476 9.317) 11.259 37.128 ( 1.777 -5.373 -12.854) 14.044 38.131 ( -1.035 -33.802 14.449) 36.775 38.234 ( 5.767 -24.914 1.971) 25.649 39.552 ( 0.794 4.891 5.421) 7.344 39.634 ( -0.358 3.004 -2.302) 3.802 40.812 ( -3.801 15.907 -4.025) 16.843 40.873 ( 5.469 16.265 -10.438) 20.085 ======================= Grid point 136 (67/92) ======================= q-point: ( 0.11 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( 20.391 5.177 -17.385) 27.292 1.432 ( 17.103 2.332 12.061) 21.057 1.706 ( -2.103 28.960 16.073) 33.188 1.820 ( 5.392 17.696 -8.969) 20.558 1.932 ( -3.892 -0.246 4.275) 5.787 2.001 ( -2.295 3.318 -0.366) 4.051 2.164 ( 10.329 9.439 -3.025) 14.316 2.237 ( 15.921 -0.959 3.404) 16.309 2.598 ( 5.710 -2.593 -3.984) 7.429 2.732 ( 5.410 -3.477 1.012) 6.511 2.900 ( -2.672 4.823 23.383) 24.024 2.944 ( 2.307 0.139 0.118) 2.314 3.031 ( 7.963 0.232 -2.282) 8.287 3.126 ( 3.529 1.943 -14.504) 15.053 3.289 ( 6.969 -1.593 -1.981) 7.418 3.446 ( 11.839 -0.329 -7.386) 13.958 3.698 ( 3.345 -3.938 -2.458) 5.721 3.750 ( 4.093 -2.947 -3.334) 6.046 3.887 ( -2.851 -3.842 0.942) 4.876 3.983 ( 0.815 -3.225 2.691) 4.278 4.045 ( -2.670 -1.764 -1.513) 3.540 4.167 ( 0.388 2.611 -0.988) 2.818 4.268 ( -5.908 -0.249 -2.943) 6.605 4.307 ( -5.973 6.611 -2.194) 9.176 4.418 ( -3.929 2.630 3.746) 6.032 4.508 ( -8.198 -2.557 0.426) 8.598 4.607 ( 5.610 3.057 8.270) 10.450 4.656 ( -0.221 -0.888 5.209) 5.289 4.679 ( -0.478 -0.268 -3.600) 3.641 4.815 ( -8.365 1.728 -5.707) 10.273 4.976 ( 6.021 -0.197 -4.384) 7.451 5.004 ( -5.616 8.374 -0.456) 10.094 5.127 ( -3.055 4.996 -2.204) 6.257 5.212 ( 1.121 1.898 -2.264) 3.160 5.261 ( 5.561 4.494 -1.803) 7.373 5.359 ( 2.498 1.230 4.855) 5.597 5.405 ( 11.454 0.299 -0.772) 11.484 5.471 ( 1.476 4.092 3.436) 5.543 5.552 ( 0.035 1.655 -0.735) 1.811 5.575 ( 2.339 -0.038 -0.591) 2.413 5.738 ( -4.769 -1.850 4.711) 6.954 5.791 ( -4.406 -4.331 2.191) 6.555 5.814 ( -0.795 -0.708 -8.653) 8.718 5.839 ( -1.275 -5.521 5.460) 7.869 5.948 ( -1.629 -0.915 -5.058) 5.392 5.987 ( -1.197 -3.990 2.323) 4.770 6.100 ( 0.085 -0.304 -4.309) 4.321 6.135 ( -6.380 0.613 -6.620) 9.214 6.207 ( 0.597 -0.128 6.473) 6.501 6.251 ( -0.654 3.412 3.426) 4.879 6.338 ( -2.607 1.455 1.178) 3.210 6.403 ( -1.337 0.835 0.079) 1.579 6.460 ( 3.893 -5.499 0.300) 6.745 6.480 ( 2.910 -2.148 1.109) 3.783 6.539 ( 0.221 -3.780 -1.556) 4.094 6.594 ( 0.358 -0.011 -2.861) 2.883 6.664 ( 6.398 3.015 1.704) 7.275 6.686 ( 3.428 0.718 -0.412) 3.526 6.805 ( -3.331 -2.358 1.934) 4.516 6.881 ( -4.559 2.147 -1.305) 5.205 6.977 ( 4.990 -2.041 -2.104) 5.787 7.008 ( -6.380 -3.839 7.423) 10.514 7.092 ( 3.021 1.099 2.683) 4.188 7.220 ( 11.856 2.745 6.893) 13.987 7.283 ( 1.754 3.985 -1.900) 4.750 7.344 ( -0.709 -5.152 1.421) 5.391 7.409 ( 5.381 -5.242 -1.778) 7.719 7.440 ( 2.184 -8.050 -3.599) 9.084 7.636 ( -0.837 2.514 -3.753) 4.594 7.750 ( 4.012 1.597 -2.397) 4.939 8.025 ( -0.445 -10.666 -4.486) 11.579 8.071 ( 2.151 -3.862 9.582) 10.553 8.261 ( -0.055 -0.894 5.304) 5.379 8.299 ( 0.016 1.013 -3.324) 3.475 8.414 ( 2.918 3.841 -5.828) 7.566 8.431 ( 3.608 7.512 0.700) 8.362 8.568 ( -4.092 1.554 1.891) 4.769 8.629 ( -5.132 2.819 -1.864) 6.145 8.711 ( -1.140 2.409 -1.181) 2.915 8.793 ( 1.226 2.050 -0.252) 2.402 8.884 ( 4.451 -0.742 1.159) 4.659 8.922 ( 4.360 1.488 -1.857) 4.967 9.077 ( -3.309 -3.372 -0.319) 4.735 9.136 ( 0.003 -1.822 4.440) 4.799 9.276 ( -2.413 3.680 1.223) 4.567 9.368 ( 2.026 2.482 -0.450) 3.236 9.545 ( -7.852 -2.568 -2.731) 8.701 9.926 ( -5.705 -0.458 5.010) 7.607 10.010 ( 7.535 -4.147 0.275) 8.605 10.115 ( 1.790 0.274 0.132) 1.816 10.220 ( 4.190 2.243 1.144) 4.888 10.284 ( 8.806 3.807 -0.567) 9.610 10.357 ( -0.553 1.388 -2.867) 3.233 10.415 ( 3.903 2.804 -3.735) 6.087 11.046 ( 1.234 -4.970 -20.308) 20.943 11.401 ( 15.185 -8.987 21.376) 27.718 16.357 ( 0.909 0.195 -0.143) 0.940 16.384 ( 2.209 -0.220 0.152) 2.225 16.837 ( -0.960 -1.176 0.218) 1.534 16.850 ( -0.237 -0.898 -0.040) 0.930 17.523 ( -0.611 -3.072 -0.977) 3.281 17.533 ( 0.001 -3.479 1.110) 3.651 17.632 ( -1.709 1.619 -1.320) 2.699 17.643 ( -0.697 1.176 0.540) 1.470 17.745 ( -1.854 -0.411 -0.233) 1.913 17.755 ( -1.266 -0.182 0.021) 1.280 17.891 ( -2.881 -4.783 2.281) 6.032 17.931 ( -0.974 -5.113 -1.689) 5.472 18.569 ( -1.859 15.445 -0.488) 15.564 18.572 ( -1.613 15.115 0.231) 15.202 19.413 ( -4.255 -4.370 -1.358) 6.248 19.442 ( -3.132 -4.362 1.133) 5.488 21.256 ( 1.602 -0.242 -0.111) 1.623 21.271 ( 2.162 0.058 0.245) 2.177 21.425 ( 0.422 -0.180 -0.213) 0.506 21.431 ( 0.315 -0.162 0.108) 0.370 21.934 ( 0.379 1.053 0.261) 1.149 21.942 ( 0.798 1.054 -0.491) 1.411 22.026 ( -0.544 0.112 0.878) 1.039 22.085 ( 2.326 -0.656 1.028) 2.626 26.962 ( -0.257 0.836 -0.598) 1.059 26.974 ( 0.428 1.275 0.787) 1.559 27.139 ( -1.083 -1.290 -0.573) 1.779 27.158 ( -0.074 -0.913 0.384) 0.994 27.693 ( -1.022 0.627 0.439) 1.277 27.714 ( 0.037 0.109 -0.383) 0.400 27.783 ( -1.897 0.739 0.586) 2.118 27.816 ( -0.099 0.387 -0.255) 0.474 35.776 ( -2.335 1.816 -4.634) 5.497 35.822 ( -0.135 0.914 3.956) 4.063 35.947 ( -4.987 4.085 4.556) 7.894 36.025 ( -1.803 6.069 -5.427) 8.339 36.367 ( -0.145 2.435 -1.076) 2.666 36.446 ( 6.442 0.821 -0.711) 6.533 36.649 ( -11.110 -2.190 5.707) 12.680 36.885 ( -3.177 -0.612 -7.288) 7.974 36.937 ( -1.997 -5.242 8.357) 10.065 37.074 ( 5.112 -2.239 -2.246) 6.016 38.066 ( -1.810 -26.692 0.309) 26.755 38.480 ( 14.359 -27.082 -5.629) 31.165 39.605 ( 1.566 5.486 -2.629) 6.281 39.648 ( 4.540 3.789 1.822) 6.188 40.690 ( -8.492 13.809 2.287) 16.371 40.833 ( -2.122 13.156 -4.583) 14.092 ======================= Grid point 137 (68/92) ======================= q-point: ( 0.22 0.17 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 12.922 6.943 -8.251) 16.830 1.744 ( 15.947 2.063 -0.985) 16.110 1.809 ( 0.504 16.601 3.109) 16.897 1.864 ( 7.023 18.949 2.601) 20.376 1.961 ( -1.082 3.737 3.100) 4.974 2.011 ( 6.443 5.267 2.655) 8.735 2.333 ( 9.073 -4.186 0.524) 10.006 2.591 ( 16.588 -3.233 6.712) 18.184 2.714 ( 10.850 3.955 -4.901) 12.545 2.768 ( 0.245 4.206 0.233) 4.220 2.934 ( -0.294 -0.391 -6.203) 6.222 2.987 ( 2.665 4.738 -8.029) 9.696 3.060 ( 9.332 -3.205 -6.782) 11.973 3.235 ( 9.830 -1.062 1.923) 10.072 3.423 ( 7.532 -4.869 -2.633) 9.347 3.558 ( 8.857 -5.998 -7.223) 12.907 3.641 ( 1.675 -0.654 -7.750) 7.956 3.777 ( 2.222 -3.456 -6.525) 7.711 3.851 ( -4.495 -2.547 -2.302) 5.656 3.995 ( -5.312 -5.535 2.940) 8.216 4.037 ( 0.909 3.618 -0.703) 3.796 4.104 ( -3.089 8.329 3.037) 9.388 4.163 ( -4.202 -0.145 -3.407) 5.412 4.256 ( -1.622 4.876 -0.158) 5.141 4.336 ( -6.040 -0.292 0.555) 6.072 4.340 ( -5.760 5.928 0.492) 8.280 4.599 ( -4.734 -3.051 -5.055) 7.568 4.683 ( 1.394 1.337 -3.244) 3.776 4.756 ( 0.487 -0.666 -1.842) 2.018 4.828 ( 7.052 -0.056 12.349) 14.221 4.936 ( -2.046 7.072 -0.733) 7.399 4.977 ( 2.364 6.039 11.220) 12.960 5.196 ( 2.992 0.221 0.769) 3.097 5.240 ( 3.441 -4.841 5.190) 7.888 5.350 ( 5.826 2.660 -3.019) 7.080 5.390 ( -0.960 1.105 -2.634) 3.013 5.467 ( -0.360 1.367 2.313) 2.710 5.499 ( -0.859 4.382 0.478) 4.491 5.532 ( -1.792 4.992 -8.757) 10.238 5.629 ( 4.277 -1.796 -0.271) 4.647 5.647 ( -6.816 -2.113 3.026) 7.751 5.730 ( -2.934 -0.393 2.163) 3.666 5.779 ( 1.452 0.640 -2.086) 2.621 5.833 ( 1.526 -2.142 1.466) 3.011 5.974 ( -2.176 0.639 1.848) 2.926 5.987 ( 7.421 0.645 0.545) 7.468 6.014 ( -3.420 0.925 -1.848) 3.996 6.091 ( -1.248 1.356 0.819) 2.016 6.211 ( -3.021 0.638 1.986) 3.671 6.303 ( -2.848 3.083 -2.339) 4.805 6.326 ( 0.212 -1.413 -0.243) 1.449 6.405 ( 1.094 -0.516 9.882) 9.955 6.430 ( -2.163 -5.867 -1.759) 6.496 6.533 ( -2.376 0.250 -3.080) 3.898 6.556 ( 0.547 2.017 5.038) 5.454 6.576 ( 1.555 -2.835 -0.376) 3.255 6.709 ( 4.499 -0.852 -0.211) 4.584 6.807 ( 0.229 -3.209 3.227) 4.557 6.831 ( 5.040 2.771 3.516) 6.741 6.908 ( 2.578 -1.020 4.243) 5.069 6.924 ( -2.665 -5.474 -1.761) 6.338 7.040 ( 3.887 -5.165 1.831) 6.718 7.184 ( 2.942 -2.428 2.619) 4.627 7.250 ( -3.841 3.301 1.596) 5.310 7.347 ( -0.332 3.032 -3.358) 4.536 7.385 ( 0.760 -6.526 -1.959) 6.856 7.510 ( 8.241 -4.499 2.474) 9.710 7.547 ( 7.794 -4.707 6.973) 11.468 7.672 ( 7.367 6.480 2.531) 10.133 7.777 ( 1.714 -2.132 -1.565) 3.152 8.021 ( 4.515 -11.362 -3.719) 12.780 8.184 ( 0.154 0.338 7.903) 7.911 8.268 ( -0.145 1.001 -1.930) 2.179 8.314 ( 0.567 -1.291 3.391) 3.672 8.400 ( 2.488 2.131 -5.172) 6.122 8.475 ( 0.636 6.828 -2.075) 7.165 8.507 ( -1.648 2.332 -3.704) 4.677 8.580 ( 1.865 3.225 1.083) 3.879 8.676 ( -0.798 1.558 -3.915) 4.288 8.782 ( -1.309 2.758 -1.074) 3.236 8.924 ( 2.857 1.128 -5.483) 6.285 9.008 ( 3.285 0.718 3.169) 4.621 9.032 ( -1.345 -2.336 1.692) 3.182 9.174 ( -1.314 -0.692 4.038) 4.302 9.236 ( -2.391 2.448 1.548) 3.756 9.365 ( -0.482 -0.089 -2.671) 2.716 9.497 ( 3.138 0.681 -1.635) 3.603 9.878 ( -5.190 -0.029 5.083) 7.264 10.092 ( 2.034 -2.315 1.580) 3.463 10.124 ( 0.437 1.628 -1.217) 2.079 10.295 ( -2.008 -2.686 -5.769) 6.673 10.310 ( 4.695 1.788 -1.821) 5.344 10.484 ( 10.892 0.444 -3.918) 11.584 10.493 ( 14.333 1.275 -0.096) 14.390 10.969 ( 7.302 -2.524 -14.734) 16.637 11.769 ( 3.801 -10.252 17.225) 20.402 16.388 ( 3.033 0.376 -0.246) 3.066 16.432 ( 3.308 -0.281 -0.145) 3.323 16.814 ( -2.181 -1.194 0.200) 2.494 16.833 ( -1.933 -1.091 0.018) 2.220 17.489 ( -2.432 -0.411 -1.581) 2.930 17.526 ( -0.615 -3.285 -0.084) 3.343 17.614 ( 0.914 -0.176 0.134) 0.940 17.629 ( -0.751 0.406 -0.678) 1.090 17.705 ( -3.025 -0.471 0.668) 3.134 17.729 ( -2.192 -0.743 1.127) 2.574 17.852 ( -3.074 -3.451 0.509) 4.650 17.887 ( -2.660 -3.636 -0.834) 4.582 18.531 ( -1.863 13.609 -0.076) 13.736 18.547 ( -1.549 12.960 0.632) 13.067 19.323 ( -4.262 -4.133 -1.179) 6.053 19.380 ( -4.893 -3.670 0.937) 6.187 21.278 ( 1.263 -0.154 -0.716) 1.460 21.326 ( 2.668 -0.976 2.335) 3.677 21.425 ( -0.517 -0.259 -0.311) 0.657 21.442 ( 1.283 -0.213 -0.302) 1.335 21.946 ( 0.717 1.116 0.254) 1.350 21.953 ( 0.963 0.917 -0.364) 1.378 22.035 ( 0.363 0.092 1.015) 1.082 22.134 ( 1.429 -1.424 1.780) 2.691 26.954 ( -0.011 0.754 -0.467) 0.887 26.991 ( 0.262 1.432 1.081) 1.813 27.116 ( -0.818 -1.781 -0.529) 2.029 27.155 ( -0.309 -0.976 -0.037) 1.025 27.681 ( -0.718 1.028 0.409) 1.319 27.703 ( -0.583 0.271 -0.944) 1.142 27.757 ( -1.842 0.384 0.917) 2.093 27.803 ( -0.908 0.316 -0.550) 1.107 35.703 ( -0.903 2.795 -4.343) 5.243 35.806 ( -3.011 0.493 -1.150) 3.260 35.883 ( -5.911 5.028 0.779) 7.799 35.982 ( -0.606 1.712 0.708) 1.949 36.270 ( -8.197 -0.805 -4.932) 9.600 36.463 ( -5.337 -3.746 1.223) 6.634 36.593 ( -3.573 0.831 2.637) 4.518 36.678 ( -3.391 0.810 -6.776) 7.620 37.006 ( 1.284 -1.280 6.849) 7.085 37.189 ( 6.914 4.144 0.445) 8.073 38.177 ( 11.911 -25.797 2.388) 28.514 38.613 ( 11.184 -20.413 -10.643) 25.594 39.613 ( 4.226 7.000 -4.565) 9.365 39.783 ( 8.568 3.207 2.524) 9.490 40.566 ( -9.600 9.302 2.960) 13.691 40.723 ( -8.245 11.944 1.071) 14.552 ======================= Grid point 138 (69/92) ======================= q-point: ( 0.33 0.17 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 8.171 6.241 -5.864) 11.836 1.824 ( -1.568 9.161 1.603) 9.432 1.900 ( 4.247 2.921 -1.959) 5.514 1.973 ( 1.362 8.962 0.412) 9.074 2.061 ( 8.628 4.454 3.524) 10.329 2.178 ( 10.317 5.551 -2.499) 11.980 2.451 ( 2.727 -6.330 2.545) 7.347 2.741 ( -8.989 15.144 9.941) 20.223 2.757 ( 2.244 -6.593 -9.780) 12.006 2.856 ( 5.331 -2.594 1.601) 6.141 2.893 ( 8.296 1.285 -9.514) 12.688 3.041 ( 14.436 5.137 -9.591) 18.077 3.227 ( 10.767 -0.625 0.864) 10.820 3.342 ( 2.422 -5.034 -1.737) 5.850 3.443 ( 1.913 2.049 -5.652) 6.309 3.584 ( -0.926 -8.401 -6.492) 10.658 3.662 ( 5.707 -3.570 -4.605) 8.156 3.734 ( 1.209 0.313 -1.028) 1.618 3.826 ( 5.358 -1.329 -4.557) 7.159 3.863 ( -7.547 -0.251 -0.800) 7.594 3.986 ( -2.769 4.022 -1.992) 5.274 4.029 ( -3.989 -1.664 -5.533) 7.021 4.140 ( -3.021 8.697 0.358) 9.213 4.194 ( -3.252 0.980 0.677) 3.464 4.234 ( -2.395 4.314 -3.043) 5.797 4.372 ( 6.754 0.713 0.998) 6.864 4.515 ( 0.117 6.350 -0.736) 6.393 4.681 ( 0.199 -1.232 -2.146) 2.482 4.751 ( -0.541 1.260 1.673) 2.163 4.881 ( -2.356 6.686 -3.525) 7.917 5.090 ( -4.666 -1.085 2.486) 5.398 5.099 ( 5.692 -2.824 2.565) 6.852 5.164 ( 4.955 -0.322 5.631) 7.507 5.278 ( -7.215 -2.392 -0.742) 7.637 5.366 ( 2.134 -2.343 4.583) 5.572 5.396 ( 1.312 1.404 -3.016) 3.576 5.440 ( -0.443 4.280 -2.807) 5.137 5.482 ( 2.993 4.746 -2.009) 5.960 5.574 ( -0.996 1.266 7.607) 7.776 5.629 ( -0.700 1.950 7.094) 7.390 5.674 ( 0.529 -2.889 -0.164) 2.942 5.714 ( 1.556 0.778 5.585) 5.850 5.841 ( 1.300 0.862 0.860) 1.781 5.860 ( 0.152 1.638 -1.539) 2.252 5.939 ( -2.598 3.100 1.680) 4.380 5.985 ( 3.528 3.759 0.208) 5.160 6.044 ( -3.690 -0.667 4.269) 5.682 6.132 ( 6.518 0.928 -4.820) 8.159 6.189 ( -3.209 -0.235 2.553) 4.107 6.235 ( -0.177 0.869 2.566) 2.715 6.344 ( -0.970 -2.888 -1.813) 3.545 6.364 ( 1.034 -1.045 -2.349) 2.771 6.458 ( 1.243 -2.402 0.475) 2.746 6.523 ( 0.283 -2.436 1.698) 2.983 6.572 ( -1.278 1.366 0.693) 1.995 6.609 ( 1.306 -4.541 6.032) 7.662 6.792 ( -2.166 -0.112 0.266) 2.186 6.807 ( -2.297 -5.341 1.734) 6.067 6.845 ( -1.714 -0.208 1.976) 2.624 6.949 ( 3.139 3.495 6.703) 8.185 7.012 ( 0.242 -3.768 1.155) 3.948 7.116 ( 5.495 -3.377 -1.956) 6.740 7.207 ( -2.495 -5.579 1.029) 6.197 7.250 ( 2.409 -2.639 4.830) 6.008 7.327 ( 3.133 4.227 -1.687) 5.525 7.438 ( 3.831 -0.933 6.086) 7.251 7.612 ( 4.452 1.047 0.591) 4.612 7.754 ( 7.618 -4.680 5.721) 10.614 7.789 ( -0.086 -5.179 2.278) 5.659 7.856 ( 5.736 3.650 6.249) 9.234 8.078 ( 4.963 -10.297 -3.797) 12.044 8.196 ( -3.927 2.652 4.159) 6.304 8.273 ( 0.832 -2.425 0.537) 2.619 8.321 ( -2.444 1.581 1.687) 3.365 8.386 ( -2.564 1.837 -0.253) 3.165 8.441 ( 1.561 -0.531 -5.646) 5.881 8.519 ( 5.693 3.323 -1.878) 6.855 8.587 ( -1.175 2.539 -5.475) 6.148 8.674 ( 5.838 4.215 -3.301) 7.921 8.719 ( -3.149 3.374 -3.727) 5.932 8.920 ( 1.997 1.391 -5.368) 5.894 9.029 ( 0.182 5.753 -1.691) 5.999 9.073 ( 1.380 -0.044 2.625) 2.966 9.183 ( -0.883 -3.162 4.959) 5.947 9.261 ( -0.776 -3.002 6.730) 7.410 9.320 ( -0.627 0.828 -2.237) 2.467 9.547 ( 3.176 2.013 -1.459) 4.033 9.828 ( -4.792 -0.102 1.753) 5.103 10.104 ( 0.057 -1.619 -3.174) 3.563 10.135 ( -0.260 1.924 1.453) 2.425 10.209 ( 3.320 -6.471 -9.628) 12.066 10.362 ( 5.634 2.613 -5.564) 8.339 10.689 ( 13.106 -2.030 1.356) 13.331 10.748 ( 14.382 -0.736 -0.326) 14.405 10.978 ( 5.141 2.001 -6.866) 8.808 11.801 ( -12.204 -7.638 6.108) 15.639 16.455 ( 4.938 0.422 -0.357) 4.969 16.492 ( 3.958 -0.189 -0.493) 3.993 16.762 ( -3.745 -0.810 -0.279) 3.842 16.777 ( -4.321 -0.945 -0.559) 4.459 17.453 ( -0.172 0.290 0.329) 0.471 17.529 ( 0.563 -2.995 0.736) 3.135 17.605 ( -0.356 -0.292 -1.844) 1.901 17.645 ( -0.071 -1.838 1.186) 2.189 17.664 ( -0.969 -0.792 1.202) 1.735 17.703 ( -2.191 -1.925 1.139) 3.131 17.798 ( -2.841 -1.254 -1.255) 3.349 17.829 ( -3.489 -2.875 -0.218) 4.526 18.511 ( -0.713 11.601 0.559) 11.636 18.532 ( -0.943 11.367 0.736) 11.429 19.257 ( -2.531 -3.915 -0.316) 4.672 19.305 ( -4.250 -3.348 0.549) 5.438 21.292 ( 1.089 0.098 -0.249) 1.121 21.388 ( 1.229 -1.921 2.036) 3.058 21.405 ( -0.906 0.293 -0.037) 0.953 21.462 ( 1.325 -0.522 -0.550) 1.526 21.960 ( 0.594 1.111 0.221) 1.279 21.966 ( 0.817 0.969 -0.310) 1.305 22.055 ( 0.657 -0.055 1.310) 1.467 22.156 ( -0.335 -1.586 0.744) 1.784 26.954 ( 0.308 0.714 -0.051) 0.779 26.998 ( -0.352 1.361 0.346) 1.448 27.106 ( -0.053 -1.977 0.124) 1.982 27.149 ( -0.253 -1.169 -0.234) 1.219 27.675 ( -0.263 1.272 -0.035) 1.299 27.684 ( -0.382 0.651 -0.782) 1.087 27.738 ( -1.361 -0.476 0.871) 1.684 27.779 ( -1.031 0.283 -0.735) 1.297 35.674 ( 1.330 2.473 -2.673) 3.877 35.721 ( -2.850 0.868 -4.739) 5.597 35.766 ( -5.896 4.573 -4.240) 8.582 35.966 ( -2.107 -1.619 0.605) 2.725 36.104 ( -5.203 0.518 -1.235) 5.372 36.369 ( -8.999 -0.810 4.860) 10.260 36.514 ( 1.336 -0.707 -4.480) 4.728 36.667 ( -3.210 -1.640 4.334) 5.637 37.108 ( 3.500 3.519 5.441) 7.365 37.294 ( 5.895 6.003 -2.370) 8.741 38.417 ( 9.559 -23.667 5.222) 26.053 38.691 ( 9.559 -17.747 -10.379) 22.673 39.681 ( 7.427 8.542 -1.832) 11.467 39.984 ( 12.164 2.520 2.216) 12.619 40.391 ( -11.134 8.797 -2.499) 14.408 40.588 ( -11.093 7.170 5.322) 14.240 ======================= Grid point 139 (70/92) ======================= q-point: ( 0.44 0.17 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 8.639 1.587 -1.326) 8.883 1.770 ( -9.834 12.994 8.048) 18.175 1.903 ( 0.880 -2.465 -4.992) 5.637 1.971 ( 2.496 7.811 -8.240) 11.625 2.183 ( 1.391 -0.822 4.361) 4.651 2.293 ( 6.487 0.130 -4.370) 7.823 2.472 ( -4.395 8.714 5.547) 11.226 2.602 ( -4.719 2.893 -2.743) 6.178 2.800 ( 3.774 -2.233 0.237) 4.392 2.883 ( -0.628 -1.384 -1.418) 2.078 2.940 ( 2.625 0.747 0.531) 2.781 3.188 ( 8.878 -2.063 -8.809) 12.676 3.284 ( -2.824 -7.561 -0.938) 8.126 3.399 ( -3.387 5.360 -4.443) 7.742 3.420 ( 9.246 3.902 -0.517) 10.049 3.532 ( -0.245 -1.573 -2.470) 2.938 3.673 ( 2.550 0.309 -4.649) 5.312 3.738 ( -1.765 2.247 -1.956) 3.462 3.817 ( 2.480 -0.891 0.721) 2.732 3.879 ( 1.455 2.234 -7.636) 8.088 3.901 ( -1.826 -1.763 -0.592) 2.606 3.976 ( 3.757 1.817 -2.350) 4.790 4.048 ( -2.134 -1.200 -0.971) 2.633 4.184 ( -1.640 2.281 -3.789) 4.717 4.273 ( 5.376 0.538 7.362) 9.131 4.453 ( -0.687 7.924 -0.110) 7.955 4.532 ( 0.532 7.570 -2.763) 8.076 4.671 ( -1.178 7.155 -3.794) 8.184 4.733 ( 3.858 1.334 -4.094) 5.781 4.787 ( -5.249 0.074 2.492) 5.811 5.019 ( 0.516 -0.260 0.336) 0.669 5.155 ( -4.366 2.756 -2.593) 5.778 5.210 ( 1.182 -3.227 3.829) 5.145 5.258 ( -2.197 -1.786 4.737) 5.518 5.340 ( -1.096 -0.127 -5.047) 5.166 5.367 ( -0.229 1.596 -0.272) 1.635 5.479 ( 1.621 0.087 3.363) 3.734 5.519 ( 0.473 2.412 3.215) 4.047 5.569 ( -3.168 0.187 2.145) 3.831 5.628 ( 0.028 1.427 -2.833) 3.172 5.722 ( 0.231 1.635 4.930) 5.199 5.785 ( -0.654 0.432 3.739) 3.820 5.849 ( -1.753 2.796 7.417) 8.118 5.894 ( -0.139 1.265 -4.027) 4.223 5.922 ( 4.421 -0.798 -0.626) 4.536 5.996 ( -0.223 1.116 0.223) 1.160 6.046 ( -4.254 1.492 -1.310) 4.695 6.158 ( 2.869 -0.800 2.751) 4.055 6.246 ( 4.315 -1.943 -0.391) 4.748 6.308 ( 1.121 -0.383 -5.110) 5.246 6.342 ( 4.141 -4.177 6.454) 8.732 6.377 ( 4.603 -2.566 -0.307) 5.278 6.443 ( -0.058 -1.941 -1.498) 2.453 6.535 ( -0.802 1.477 -0.298) 1.707 6.575 ( -1.514 -0.070 1.421) 2.077 6.698 ( -5.661 -1.642 1.173) 6.011 6.725 ( -1.847 -4.616 5.097) 7.120 6.751 ( -0.812 -4.609 -0.555) 4.713 6.867 ( -0.346 0.742 8.563) 8.602 6.987 ( -0.489 2.704 2.166) 3.499 7.041 ( 1.733 -4.918 0.485) 5.237 7.161 ( -3.771 -3.983 4.698) 7.223 7.187 ( 0.527 0.935 1.338) 1.716 7.327 ( 5.091 -3.968 -4.573) 7.910 7.413 ( 4.947 0.969 3.856) 6.346 7.583 ( 2.832 -0.126 8.254) 8.727 7.716 ( 2.754 -0.559 3.335) 4.361 7.765 ( 0.170 -0.757 -4.062) 4.136 7.930 ( 2.232 -1.892 9.320) 9.768 7.962 ( 3.470 0.489 3.890) 5.236 8.111 ( 1.435 -6.615 -0.191) 6.772 8.162 ( -2.803 0.875 1.780) 3.434 8.268 ( 0.425 -5.283 -5.083) 7.343 8.274 ( -4.238 1.240 1.316) 4.607 8.347 ( -0.874 0.360 0.429) 1.038 8.424 ( 0.758 -0.194 -1.866) 2.024 8.506 ( -2.238 3.127 -3.093) 4.935 8.602 ( -1.039 3.744 -3.345) 5.127 8.635 ( 4.359 0.960 -5.110) 6.785 8.750 ( 3.452 5.053 3.041) 6.834 8.850 ( -1.805 3.504 -9.299) 10.100 9.013 ( 0.189 7.515 -5.203) 9.143 9.110 ( 0.058 -0.883 2.067) 2.249 9.162 ( -1.627 -3.068 -3.389) 4.852 9.316 ( 0.493 -4.991 9.950) 11.143 9.393 ( 1.512 -0.268 10.687) 10.797 9.554 ( -0.246 1.048 -2.863) 3.059 9.742 ( -3.246 0.139 -5.316) 6.230 10.067 ( -0.563 -4.330 -2.722) 5.145 10.110 ( 0.034 -1.345 -3.180) 3.453 10.251 ( 4.100 -0.876 -0.330) 4.206 10.386 ( 3.311 3.829 -6.841) 8.510 10.875 ( 5.128 -1.587 -0.093) 5.369 10.908 ( 4.671 -0.916 -3.598) 5.967 11.104 ( 15.412 0.998 2.677) 15.675 11.528 ( -19.925 -3.660 -1.477) 20.312 16.540 ( 4.835 0.478 -0.548) 4.889 16.552 ( 3.088 0.308 -0.439) 3.134 16.690 ( -4.309 -0.792 -0.382) 4.398 16.691 ( -3.716 -0.806 -0.506) 3.836 17.482 ( 1.505 -0.890 2.083) 2.719 17.552 ( -0.287 -0.931 0.495) 1.092 17.583 ( 1.211 -3.785 -0.715) 4.038 17.639 ( -0.655 -2.229 1.179) 2.605 17.670 ( -2.012 -1.697 0.611) 2.702 17.699 ( 1.259 -1.558 1.072) 2.272 17.741 ( -1.465 -0.089 -1.942) 2.434 17.771 ( -2.417 -1.866 -0.847) 3.169 18.514 ( 0.010 10.746 0.914) 10.784 18.527 ( -0.339 10.484 0.353) 10.495 19.233 ( -0.313 -3.609 0.303) 3.635 19.253 ( -2.125 -3.363 0.160) 3.982 21.314 ( 1.328 0.137 0.437) 1.405 21.364 ( -1.804 -0.203 -0.976) 2.062 21.435 ( 0.578 -1.049 2.118) 2.433 21.474 ( 0.869 -0.940 -0.926) 1.580 21.968 ( 0.019 1.145 0.324) 1.190 21.974 ( 0.553 1.016 -0.438) 1.237 22.081 ( 0.744 -0.322 1.837) 2.008 22.142 ( -1.125 -1.210 -0.633) 1.769 26.963 ( 0.571 0.698 0.329) 0.960 26.987 ( -0.702 1.042 -0.340) 1.302 27.114 ( 0.413 -1.736 0.653) 1.900 27.141 ( -0.330 -1.284 -0.516) 1.422 27.671 ( -0.095 1.078 -0.240) 1.108 27.674 ( -0.206 0.660 -0.457) 0.829 27.731 ( -0.472 -0.557 1.041) 1.271 27.759 ( -0.344 0.013 -0.929) 0.991 35.624 ( -3.272 2.472 -2.681) 4.899 35.648 ( -0.793 2.213 -4.614) 5.178 35.722 ( 3.903 2.163 -0.144) 4.465 35.892 ( -4.260 -1.179 -5.080) 6.734 36.102 ( 2.204 0.920 5.508) 6.004 36.257 ( -7.152 0.918 1.922) 7.462 36.563 ( 6.088 -2.072 -0.988) 6.507 36.620 ( -5.710 -3.468 3.018) 7.331 37.203 ( 1.311 6.270 5.194) 8.247 37.335 ( 2.230 5.793 -3.911) 7.337 38.562 ( 0.793 -21.012 6.143) 21.906 38.735 ( 5.974 -18.030 -9.320) 21.157 39.835 ( 10.139 10.651 2.271) 14.880 40.145 ( -10.807 10.974 -3.238) 15.739 40.239 ( 13.349 -0.087 -0.762) 13.371 40.430 ( -12.674 3.121 3.989) 13.649 ======================= Grid point 140 (71/92) ======================= q-point: (-0.44 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -13.995 19.198 10.763) 26.081 1.757 ( -8.969 -4.293 3.195) 10.444 1.880 ( -0.183 -2.392 -2.668) 3.587 1.994 ( 10.353 3.499 -7.866) 13.465 2.160 ( -9.699 6.291 6.155) 13.097 2.317 ( 4.057 -1.776 -6.598) 7.946 2.497 ( -2.082 5.033 4.498) 7.064 2.524 ( -1.517 6.487 3.140) 7.365 2.811 ( -4.353 -3.297 0.773) 5.515 2.855 ( -0.597 -1.937 -2.432) 3.166 3.004 ( -0.174 2.650 4.050) 4.843 3.111 ( -0.639 -5.591 -12.656) 13.851 3.311 ( 1.649 -2.473 1.704) 3.426 3.325 ( -1.601 -4.767 -0.936) 5.116 3.466 ( -1.869 5.509 -4.480) 7.342 3.515 ( 1.261 4.875 0.152) 5.037 3.672 ( -3.170 4.350 -0.287) 5.390 3.683 ( -0.876 -0.026 0.481) 1.000 3.795 ( -0.836 -3.459 0.595) 3.608 3.880 ( 5.304 0.471 -4.436) 6.930 3.917 ( -2.382 -0.989 -1.280) 2.879 3.982 ( -3.950 -1.883 -1.819) 4.739 4.060 ( 5.179 1.143 -2.138) 5.719 4.124 ( 2.702 2.884 -1.614) 4.269 4.357 ( -8.307 2.627 -1.812) 8.899 4.450 ( 6.033 3.067 -2.235) 7.127 4.491 ( -0.854 8.770 6.153) 10.747 4.635 ( 7.446 10.452 -4.047) 13.456 4.675 ( -9.570 4.208 3.161) 10.921 4.874 ( 7.381 0.793 -4.434) 8.647 5.024 ( -5.973 2.148 0.558) 6.372 5.083 ( 2.486 1.550 2.734) 4.007 5.218 ( -3.636 -0.302 5.194) 6.347 5.275 ( -0.059 -0.464 -1.106) 1.201 5.331 ( 4.887 -4.841 2.467) 7.308 5.379 ( 2.143 0.706 -5.985) 6.396 5.496 ( -4.912 1.961 5.470) 7.609 5.535 ( -1.616 -1.239 -1.515) 2.538 5.557 ( 2.820 -1.400 2.686) 4.139 5.655 ( 6.844 4.797 -4.802) 9.639 5.754 ( -0.920 1.377 3.156) 3.564 5.805 ( 2.473 0.786 1.827) 3.173 5.857 ( -2.729 -0.248 0.072) 2.741 5.904 ( 1.625 1.912 1.627) 2.991 5.949 ( -0.117 -0.510 2.290) 2.349 5.977 ( -0.357 0.132 -1.736) 1.777 6.064 ( -2.320 -1.780 -2.831) 4.070 6.093 ( 1.807 1.750 0.980) 2.700 6.271 ( -1.359 -3.283 -1.624) 3.906 6.306 ( 1.729 -2.223 -3.596) 4.567 6.404 ( -6.700 -3.160 -0.141) 7.409 6.414 ( -3.230 -3.835 -0.780) 5.074 6.431 ( -2.065 0.550 -1.034) 2.374 6.503 ( 2.967 0.848 1.049) 3.259 6.591 ( -4.517 0.928 0.224) 4.616 6.626 ( 3.405 -0.659 6.408) 7.287 6.724 ( 0.102 -3.459 3.216) 4.725 6.771 ( 2.698 -3.209 -1.003) 4.311 6.928 ( -4.076 -4.068 5.339) 7.853 6.997 ( 0.636 -0.628 1.366) 1.632 7.086 ( -2.236 -1.095 0.556) 2.551 7.162 ( 6.026 -6.203 -1.462) 8.770 7.201 ( -2.445 0.579 5.254) 5.824 7.327 ( 2.875 -2.613 -7.197) 8.178 7.548 ( 2.299 1.521 9.082) 9.491 7.613 ( -5.448 0.859 -11.717) 12.950 7.670 ( -1.673 0.314 7.004) 7.208 7.740 ( -2.417 -1.743 -3.846) 4.865 7.963 ( -4.830 5.510 6.990) 10.127 8.083 ( -4.928 -3.653 -2.282) 6.545 8.117 ( 6.336 3.148 -0.385) 7.086 8.135 ( -0.539 -8.192 0.620) 8.233 8.229 ( -1.279 -5.257 2.457) 5.942 8.249 ( 1.606 -0.652 -1.572) 2.340 8.368 ( 0.000 0.372 3.873) 3.890 8.399 ( -1.499 -0.805 -2.042) 2.658 8.495 ( 1.041 2.689 3.255) 4.349 8.520 ( -1.341 4.352 -3.234) 5.585 8.687 ( 0.064 0.062 -2.713) 2.715 8.726 ( 1.803 4.023 -6.720) 8.037 8.845 ( -0.849 7.008 6.125) 9.346 8.923 ( -0.208 5.788 -6.827) 8.952 9.114 ( -1.104 -2.034 1.552) 2.787 9.140 ( 0.583 -1.070 -1.308) 1.788 9.414 ( -1.751 -4.747 9.500) 10.763 9.475 ( -1.569 -1.822 -1.094) 2.642 9.536 ( -0.134 -1.805 9.892) 10.056 9.618 ( -3.094 0.024 -9.478) 9.971 10.045 ( -1.158 -3.534 1.116) 3.883 10.089 ( 0.766 -2.935 -2.746) 4.092 10.283 ( -2.099 3.254 1.192) 4.051 10.349 ( 0.773 2.761 -7.050) 7.611 10.845 ( -6.285 -0.186 0.979) 6.363 10.929 ( 0.586 0.601 -4.005) 4.092 11.164 ( -18.575 -0.876 -3.263) 18.880 11.461 ( 19.926 -2.914 5.168) 20.791 16.537 ( -4.186 0.540 -0.233) 4.227 16.552 ( -3.429 0.285 -0.531) 3.482 16.679 ( 3.501 -0.579 0.580) 3.596 16.687 ( 3.519 -0.800 -0.117) 3.611 17.509 ( -1.313 -1.990 0.399) 2.418 17.543 ( 2.006 -0.863 -0.128) 2.188 17.596 ( -2.943 -4.119 -1.219) 5.207 17.639 ( 3.065 -4.437 0.824) 5.456 17.683 ( -0.889 0.257 0.298) 0.973 17.700 ( 1.964 0.404 1.366) 2.426 17.717 ( -1.413 -0.874 -0.208) 1.674 17.769 ( 3.394 -2.180 -1.234) 4.218 18.520 ( -0.154 10.351 0.385) 10.359 18.531 ( 0.749 10.990 -0.059) 11.016 19.235 ( 0.061 -3.691 0.106) 3.693 19.254 ( 2.257 -3.159 0.110) 3.884 21.325 ( -1.756 0.100 -0.723) 1.902 21.345 ( 1.572 -0.097 0.980) 1.855 21.453 ( -0.368 -0.759 1.226) 1.488 21.473 ( 0.259 -1.453 -1.575) 2.159 21.966 ( -0.563 1.006 0.312) 1.194 21.976 ( 0.143 1.202 -0.439) 1.288 22.107 ( -0.920 -0.979 0.457) 1.419 22.119 ( 0.497 -0.542 0.545) 0.915 26.971 ( -0.699 0.829 -0.370) 1.146 26.979 ( 0.776 0.809 0.420) 1.197 27.127 ( -0.156 -1.503 -0.150) 1.519 27.130 ( 0.327 -1.395 0.046) 1.434 27.659 ( -0.808 0.586 0.407) 1.078 27.679 ( 0.825 0.973 -0.496) 1.369 27.732 ( -0.457 -0.305 0.957) 1.103 27.758 ( 1.256 -0.321 -0.938) 1.600 35.589 ( -0.065 2.612 1.238) 2.891 35.623 ( 2.126 2.611 -2.807) 4.384 35.767 ( -4.108 0.577 -4.657) 6.237 35.818 ( 5.674 0.769 2.154) 6.118 36.172 ( -2.934 2.080 -1.241) 3.804 36.237 ( 7.565 -0.631 3.837) 8.506 36.535 ( -6.182 -3.302 1.690) 7.209 36.675 ( 7.521 -2.014 -2.156) 8.079 37.239 ( -3.122 7.196 5.631) 9.656 37.300 ( -1.539 3.916 -4.387) 6.078 38.553 ( -8.673 -17.371 7.422) 20.786 38.720 ( 1.503 -22.073 -8.426) 23.674 39.886 ( -11.891 8.466 -2.278) 14.773 40.074 ( 10.880 11.856 3.003) 16.369 40.234 ( -11.368 2.782 0.264) 11.706 40.484 ( 14.458 2.207 -1.278) 14.681 ======================= Grid point 141 (72/92) ======================= q-point: (-0.33 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -11.522 25.599 7.320) 29.011 1.628 ( -15.761 -5.347 16.130) 23.177 1.838 ( -4.270 -0.472 1.843) 4.675 2.041 ( -7.457 6.855 4.517) 11.091 2.065 ( 1.550 0.843 -5.392) 5.674 2.288 ( 1.781 9.001 -10.829) 14.194 2.441 ( -4.158 -7.117 3.356) 8.899 2.593 ( -1.918 1.188 6.817) 7.181 2.685 ( -17.319 7.596 4.481) 19.435 2.780 ( -3.349 3.752 -1.684) 5.304 2.914 ( -9.058 2.994 4.089) 10.380 3.040 ( -0.724 -5.009 -4.882) 7.032 3.216 ( -9.088 -4.393 1.431) 10.194 3.355 ( 1.353 -6.409 -3.788) 7.567 3.394 ( -3.842 5.516 -0.486) 6.740 3.541 ( -1.491 -1.937 -2.775) 3.698 3.608 ( -2.638 5.213 2.815) 6.485 3.704 ( 2.128 -3.387 3.942) 5.616 3.782 ( -2.760 -2.726 -6.435) 7.514 3.833 ( 4.790 0.349 0.641) 4.846 3.956 ( 4.384 2.123 2.341) 5.405 3.986 ( 2.606 -4.434 -1.442) 5.342 4.133 ( 6.452 0.725 -0.867) 6.550 4.182 ( 2.204 7.287 3.701) 8.465 4.232 ( -3.804 1.539 -0.229) 4.110 4.439 ( -6.045 3.817 -3.064) 7.778 4.519 ( 2.735 7.862 -2.086) 8.582 4.609 ( 2.338 4.696 3.295) 6.195 4.780 ( 4.350 6.270 -0.680) 7.661 4.857 ( -0.386 -0.722 -1.240) 1.486 5.005 ( 1.253 -0.694 2.465) 2.851 5.126 ( -1.173 -0.172 4.376) 4.534 5.255 ( 1.034 2.094 -3.304) 4.046 5.281 ( 0.784 0.658 1.478) 1.798 5.328 ( -0.686 4.451 1.439) 4.728 5.433 ( 4.011 -7.432 -2.919) 8.935 5.453 ( -2.551 0.586 -1.763) 3.155 5.491 ( -0.274 1.220 -1.520) 1.968 5.622 ( 0.044 -2.553 3.195) 4.090 5.716 ( 3.515 3.139 -6.085) 7.697 5.773 ( 0.523 -1.206 -0.854) 1.567 5.800 ( -3.879 0.754 -1.700) 4.302 5.838 ( -0.043 0.886 0.078) 0.891 5.862 ( -2.937 2.775 -5.512) 6.835 5.960 ( 0.025 0.015 0.266) 0.267 5.976 ( 0.819 1.051 0.052) 1.333 6.037 ( -1.958 0.919 4.387) 4.892 6.149 ( -0.317 0.138 -4.638) 4.651 6.194 ( -1.037 -1.052 4.564) 4.797 6.295 ( 2.831 3.537 -0.874) 4.614 6.307 ( -4.279 -4.720 -3.037) 7.058 6.336 ( 0.798 -3.770 -0.628) 3.905 6.389 ( -3.709 -1.229 2.082) 4.427 6.537 ( 0.425 0.992 1.399) 1.766 6.556 ( -2.412 -0.639 3.171) 4.035 6.738 ( 2.297 -2.587 3.981) 5.274 6.775 ( 1.098 -4.413 -1.941) 4.944 6.800 ( 2.094 -3.563 -0.896) 4.229 6.916 ( -2.513 -0.970 -1.347) 3.012 6.923 ( -2.997 -5.313 2.318) 6.526 7.037 ( -2.469 -1.291 -3.438) 4.425 7.210 ( 1.609 -7.572 1.290) 7.848 7.252 ( 3.101 3.777 -4.893) 6.916 7.323 ( 1.622 -2.991 -4.235) 5.433 7.371 ( -8.091 0.603 -8.445) 11.711 7.553 ( -7.175 0.911 -2.002) 7.505 7.641 ( -5.061 1.425 -0.328) 5.268 7.704 ( -0.907 -0.471 4.503) 4.617 7.918 ( -4.602 3.455 -6.676) 8.814 7.949 ( -8.757 0.719 4.772) 9.999 8.021 ( -1.672 -3.607 -6.067) 7.254 8.188 ( -4.456 -0.896 1.946) 4.944 8.258 ( 2.454 -2.770 2.102) 4.256 8.292 ( -1.481 -1.318 4.583) 4.993 8.380 ( 1.571 -1.667 2.154) 3.145 8.401 ( -1.141 -0.582 3.397) 3.631 8.492 ( 0.533 4.638 -0.262) 4.676 8.537 ( -0.031 -0.657 -2.268) 2.361 8.639 ( 2.878 5.351 -1.893) 6.364 8.746 ( -1.670 4.833 -5.503) 7.512 8.810 ( 1.447 0.735 3.862) 4.189 8.967 ( 0.505 8.543 4.370) 9.609 9.120 ( -0.621 -0.925 -0.550) 1.243 9.144 ( 1.200 -2.628 3.671) 4.672 9.353 ( -4.014 -4.749 -4.289) 7.554 9.450 ( -3.179 -1.925 -4.342) 5.715 9.485 ( -3.778 1.140 0.129) 3.948 9.683 ( 2.165 -5.022 15.702) 16.627 10.046 ( -1.203 -3.550 3.320) 5.008 10.086 ( 0.981 -2.963 -1.095) 3.307 10.215 ( -2.707 3.176 -3.776) 5.627 10.296 ( -2.625 3.026 -0.939) 4.115 10.699 ( -11.246 -0.677 0.121) 11.267 10.816 ( -11.390 -3.364 -6.956) 13.763 10.896 ( -8.441 7.065 2.690) 11.331 11.830 ( 17.129 -6.584 2.938) 18.584 16.453 ( -4.604 0.343 -0.236) 4.623 16.482 ( -4.166 -0.135 0.456) 4.193 16.757 ( 4.094 -0.238 0.626) 4.148 16.759 ( 4.004 -0.611 0.672) 4.106 17.478 ( -0.954 -2.271 -1.677) 2.980 17.545 ( -1.522 -3.464 -0.880) 3.885 17.582 ( 1.616 0.617 0.476) 1.794 17.658 ( -1.575 -2.266 0.103) 2.762 17.680 ( 1.941 -1.197 -0.829) 2.427 17.725 ( 2.571 -1.653 -0.708) 3.137 17.763 ( 2.709 0.108 1.961) 3.346 17.828 ( 4.136 -3.332 -0.289) 5.319 18.522 ( 0.558 11.042 -0.368) 11.062 18.545 ( 1.155 12.132 -0.466) 12.196 19.252 ( 1.867 -3.952 0.134) 4.373 19.312 ( 4.370 -2.951 -0.072) 5.273 21.293 ( -1.429 0.191 -0.255) 1.464 21.382 ( 1.440 -0.678 1.101) 1.935 21.444 ( -0.905 -1.253 -1.357) 2.057 21.455 ( -0.743 -0.982 -0.715) 1.424 21.957 ( -0.855 0.829 0.294) 1.226 21.970 ( -0.372 1.375 -0.456) 1.496 22.078 ( -1.166 -0.509 -1.019) 1.630 22.150 ( 0.896 -1.413 1.600) 2.315 26.956 ( -0.554 0.820 -0.249) 1.020 26.998 ( 0.878 1.050 0.298) 1.401 27.115 ( -0.306 -1.606 -0.712) 1.783 27.143 ( 0.444 -1.374 0.384) 1.495 27.659 ( 0.023 0.537 1.007) 1.141 27.685 ( 0.364 1.314 -0.358) 1.410 27.744 ( 1.079 -0.642 0.483) 1.346 27.774 ( 1.303 0.047 -0.490) 1.393 35.627 ( 0.666 2.547 3.022) 4.008 35.667 ( 2.989 1.742 0.172) 3.464 35.700 ( 2.167 3.247 -0.092) 3.905 35.940 ( 5.488 -0.482 2.375) 6.000 36.137 ( 1.133 2.539 -2.813) 3.956 36.405 ( 8.142 -1.771 0.853) 8.376 36.453 ( -4.232 -1.735 1.969) 4.980 36.755 ( 4.590 0.852 -4.399) 6.415 37.198 ( -6.038 4.848 2.563) 8.156 37.226 ( -2.825 1.421 -1.678) 3.580 38.441 ( -11.880 -14.632 8.104) 20.516 38.596 ( -8.698 -28.385 -6.644) 30.422 39.676 ( -9.557 7.012 -1.351) 11.930 39.996 ( -12.893 -0.301 1.123) 12.945 40.356 ( 15.368 17.657 0.779) 23.421 40.693 ( 12.846 5.145 -4.474) 14.543 ======================= Grid point 142 (73/92) ======================= q-point: (-0.22 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( -16.044 16.586 6.706) 24.031 1.541 ( -14.964 11.901 23.149) 30.024 1.713 ( -12.027 2.545 2.857) 12.621 1.948 ( -4.249 8.186 0.715) 9.250 2.036 ( -0.984 -1.944 -1.416) 2.599 2.193 ( 0.562 14.088 -14.622) 20.312 2.327 ( -15.150 -3.058 4.149) 16.003 2.417 ( -14.755 7.229 9.811) 19.137 2.581 ( -6.381 -5.514 8.755) 12.156 2.710 ( -8.440 3.153 0.336) 9.016 2.849 ( -7.322 2.028 6.686) 10.121 2.938 ( -4.741 -1.971 -1.375) 5.315 3.056 ( -7.173 0.388 -2.561) 7.627 3.308 ( -0.695 0.196 -0.155) 0.739 3.375 ( -4.551 -1.100 -2.930) 5.523 3.389 ( -10.370 -5.567 7.557) 13.987 3.603 ( -3.827 -4.956 -3.300) 7.078 3.693 ( -0.029 -0.318 1.874) 1.902 3.788 ( 3.092 3.756 0.928) 4.953 3.961 ( 5.350 3.008 3.681) 7.157 4.051 ( 3.950 -2.310 1.787) 4.913 4.071 ( 5.607 -3.908 2.052) 7.136 4.202 ( 3.439 7.530 -2.646) 8.691 4.240 ( 0.497 6.121 1.581) 6.341 4.309 ( 9.755 -1.137 2.377) 10.105 4.387 ( 7.493 -2.658 -3.634) 8.742 4.536 ( 2.908 2.606 -0.548) 3.943 4.680 ( 0.678 -0.177 0.158) 0.718 4.748 ( -2.175 -3.744 -0.559) 4.366 4.899 ( 2.649 7.396 0.977) 7.916 5.058 ( -2.834 -2.376 -4.615) 5.914 5.138 ( 0.366 3.955 3.988) 5.629 5.158 ( -1.447 1.949 -5.564) 6.071 5.264 ( -4.174 2.985 4.267) 6.674 5.330 ( -6.937 2.309 -3.689) 8.189 5.389 ( 1.801 5.225 1.716) 5.787 5.440 ( -3.115 -0.406 -8.440) 9.005 5.500 ( 5.946 -2.439 -0.525) 6.448 5.562 ( -6.636 -0.367 -3.107) 7.336 5.636 ( -2.652 0.285 -2.110) 3.401 5.712 ( -4.383 1.523 -0.779) 4.705 5.777 ( -1.534 -1.071 -1.462) 2.375 5.791 ( 4.285 -1.411 -4.092) 6.090 5.836 ( 0.373 1.912 -0.168) 1.955 5.961 ( -2.458 1.363 1.951) 3.421 5.980 ( -2.627 0.212 2.447) 3.596 6.016 ( 2.732 1.878 -3.062) 4.513 6.168 ( 3.330 -0.453 -4.564) 5.668 6.228 ( 0.812 1.648 1.216) 2.203 6.283 ( 4.125 0.906 2.050) 4.695 6.325 ( -2.761 -4.157 -1.235) 5.141 6.382 ( 1.894 -2.620 3.233) 4.572 6.421 ( 4.524 0.144 5.759) 7.325 6.535 ( -3.168 -4.123 2.660) 5.840 6.567 ( 2.934 -0.961 -0.684) 3.163 6.646 ( -3.180 -2.593 -9.576) 10.418 6.759 ( -5.214 -1.276 -3.514) 6.415 6.804 ( -3.002 -0.064 1.246) 3.251 6.871 ( 2.260 -2.810 2.172) 4.210 6.950 ( -2.730 -3.449 -8.064) 9.186 6.999 ( -1.356 -2.023 4.655) 5.253 7.088 ( -0.739 -1.323 -7.119) 7.279 7.205 ( -3.578 -2.191 -3.718) 5.606 7.296 ( -2.909 -4.462 -0.683) 5.371 7.328 ( 1.512 -0.148 -1.667) 2.256 7.419 ( -2.496 1.430 -2.865) 4.060 7.517 ( -4.870 2.078 -2.978) 6.075 7.685 ( -7.025 -3.060 -4.770) 9.026 7.751 ( -3.846 0.221 1.478) 4.126 7.822 ( -8.564 4.734 -7.222) 12.162 7.954 ( -3.710 -6.865 0.384) 7.813 8.151 ( -4.237 0.404 6.531) 7.795 8.240 ( -5.521 2.282 9.597) 11.304 8.311 ( 0.371 -2.772 -2.966) 4.077 8.395 ( -0.385 0.372 -0.490) 0.726 8.449 ( 3.443 2.509 0.434) 4.282 8.529 ( -0.400 1.869 1.877) 2.678 8.534 ( 3.652 2.635 -0.444) 4.525 8.614 ( 0.636 1.607 -2.341) 2.910 8.758 ( 1.154 2.427 1.541) 3.098 8.850 ( 0.285 -0.530 1.867) 1.962 9.014 ( 1.733 7.485 3.009) 8.251 9.074 ( -1.989 0.203 -3.536) 4.062 9.200 ( -0.471 -3.181 1.351) 3.488 9.293 ( 0.234 -2.566 2.407) 3.526 9.342 ( -1.301 0.592 -6.941) 7.087 9.435 ( -5.340 0.269 4.459) 6.962 9.874 ( 3.428 -5.350 11.538) 13.172 10.060 ( -1.865 -3.348 4.579) 5.971 10.100 ( -0.831 -3.553 1.443) 3.923 10.165 ( 1.842 0.421 -0.920) 2.101 10.255 ( -2.550 2.858 2.335) 4.486 10.476 ( -12.500 -0.084 -2.154) 12.684 10.552 ( -10.915 1.528 -5.666) 12.393 10.800 ( -7.672 5.436 4.372) 10.370 12.021 ( 5.063 -11.188 -8.072) 14.695 16.387 ( -2.873 0.290 -0.084) 2.889 16.424 ( -3.245 -0.232 0.653) 3.318 16.815 ( 2.546 -0.440 -0.055) 2.584 16.827 ( 2.400 -1.031 0.899) 2.762 17.470 ( 1.636 -0.806 0.065) 1.825 17.526 ( -0.268 -2.659 -0.222) 2.681 17.609 ( 0.935 0.135 0.240) 0.974 17.629 ( -0.917 -0.630 -0.210) 1.132 17.719 ( 2.847 -0.877 -0.719) 3.064 17.758 ( 2.223 -1.444 -1.417) 3.006 17.824 ( 2.001 -1.120 2.258) 3.218 17.894 ( 3.671 -4.637 -0.579) 5.943 18.539 ( 2.254 13.292 -0.794) 13.505 18.561 ( 1.437 13.455 -0.765) 13.554 19.301 ( 3.168 -4.127 1.109) 5.319 19.393 ( 5.065 -3.086 -0.455) 5.948 21.271 ( -1.117 0.098 0.111) 1.126 21.382 ( -2.529 -2.947 -2.948) 4.876 21.419 ( 0.711 0.009 0.045) 0.712 21.438 ( -0.974 -0.136 0.152) 0.995 21.944 ( -0.876 0.733 0.268) 1.173 21.957 ( -0.603 1.415 -0.503) 1.619 22.053 ( -0.698 -0.172 -0.840) 1.105 22.163 ( -0.474 -2.387 -0.640) 2.516 26.949 ( -0.238 0.831 0.124) 0.873 27.009 ( 0.422 1.419 -0.641) 1.614 27.109 ( 0.186 -1.798 0.069) 1.809 27.152 ( 0.374 -1.075 0.198) 1.156 27.678 ( 0.810 0.551 1.215) 1.561 27.690 ( 0.539 1.016 -0.145) 1.159 27.771 ( 1.758 -0.160 -0.274) 1.786 27.793 ( 1.043 0.485 0.245) 1.176 35.638 ( 0.132 3.860 1.867) 4.290 35.746 ( 4.195 1.507 3.220) 5.498 35.852 ( 9.364 3.790 5.562) 11.532 36.027 ( 3.796 -1.259 -1.585) 4.302 36.173 ( 4.536 0.401 2.611) 5.249 36.407 ( -2.426 -0.071 3.434) 4.206 36.541 ( 3.655 0.042 2.928) 4.683 36.743 ( 0.880 3.709 -5.981) 7.092 37.111 ( -5.379 1.215 0.537) 5.540 37.181 ( 0.027 -2.092 -2.336) 3.136 38.250 ( -16.762 -28.555 -6.255) 33.696 38.369 ( -14.466 -19.286 13.409) 27.587 39.548 ( -5.633 5.907 1.807) 8.360 39.807 ( -9.397 0.467 0.138) 9.410 40.617 ( 15.706 19.027 -3.282) 24.890 40.833 ( 10.151 10.561 -7.998) 16.689 ======================= Grid point 143 (74/92) ======================= q-point: (-0.11 0.17 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 135 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -30.375 9.207 13.252) 34.395 1.553 ( -6.962 34.088 18.117) 39.226 1.605 ( -5.902 -0.677 -1.641) 6.163 1.884 ( -4.515 11.171 0.842) 12.079 2.003 ( -1.316 1.069 -2.291) 2.850 2.041 ( -2.586 7.012 -7.966) 10.923 2.182 ( -10.487 -3.983 -2.593) 11.514 2.262 ( -7.312 3.841 12.218) 14.748 2.463 ( -11.068 13.068 -0.240) 17.126 2.583 ( -8.347 -7.707 10.701) 15.607 2.776 ( -8.100 3.674 9.476) 12.997 2.900 ( -2.230 -0.491 3.523) 4.198 2.973 ( -5.463 -0.063 3.681) 6.588 3.214 ( -1.953 -2.417 -2.685) 4.107 3.286 ( -5.234 -4.229 2.040) 7.031 3.362 ( -3.328 1.907 0.829) 3.924 3.523 ( 0.027 -4.702 3.528) 5.878 3.715 ( -1.337 -0.106 2.057) 2.455 3.884 ( 4.047 1.960 6.074) 7.557 3.997 ( -2.056 4.227 -4.660) 6.619 4.109 ( 3.546 -4.746 -1.258) 6.056 4.170 ( 1.530 -2.250 1.394) 3.057 4.248 ( 5.353 1.886 -0.742) 5.723 4.287 ( 5.040 6.158 -1.371) 8.075 4.482 ( 7.533 -1.259 -1.437) 7.771 4.527 ( 8.868 -2.836 -2.557) 9.655 4.620 ( -0.286 -2.022 2.062) 2.902 4.678 ( 2.264 -4.500 -0.799) 5.101 4.730 ( 3.838 -1.869 1.039) 4.394 4.859 ( -4.790 0.034 -10.976) 11.976 4.971 ( 0.145 7.332 -2.077) 7.622 5.051 ( -1.231 5.286 -3.396) 6.402 5.135 ( -1.943 6.093 -3.110) 7.111 5.193 ( -6.283 8.767 0.535) 10.799 5.214 ( -3.733 -2.248 -0.901) 4.450 5.351 ( -0.840 3.206 4.010) 5.203 5.478 ( -0.556 -1.895 -1.538) 2.503 5.503 ( 0.708 3.620 2.222) 4.306 5.527 ( -6.322 0.412 1.101) 6.430 5.578 ( 3.059 1.419 -3.703) 5.008 5.628 ( -2.144 2.751 4.090) 5.375 5.795 ( -0.117 -3.571 0.470) 3.604 5.825 ( 0.131 -0.992 -0.414) 1.083 5.871 ( 5.258 0.169 -0.655) 5.301 5.906 ( 1.797 -2.636 -1.988) 3.759 6.001 ( 0.730 0.191 2.113) 2.244 6.070 ( 4.668 -1.294 -0.794) 4.909 6.112 ( -1.874 -0.036 -3.213) 3.720 6.277 ( 0.808 -3.102 -0.861) 3.319 6.302 ( 1.948 0.260 3.096) 3.667 6.380 ( 4.210 1.459 0.345) 4.469 6.418 ( -2.373 0.026 2.859) 3.715 6.475 ( -3.757 -5.590 -7.491) 10.074 6.506 ( -3.010 -1.561 -0.967) 3.526 6.539 ( 2.855 -2.913 2.932) 5.023 6.564 ( -4.182 -0.782 -6.951) 8.150 6.676 ( 2.074 1.926 -0.442) 2.864 6.731 ( -3.150 1.160 -3.754) 5.036 6.818 ( -1.830 -1.516 0.082) 2.377 6.930 ( -1.641 2.141 -6.748) 7.267 6.969 ( 0.307 -2.053 -0.537) 2.144 7.048 ( -0.653 -4.911 -0.389) 4.970 7.116 ( -4.331 2.171 1.153) 4.980 7.265 ( -6.157 4.080 1.420) 7.521 7.305 ( 0.400 -9.071 1.981) 9.294 7.385 ( -7.150 -0.887 -4.673) 8.587 7.432 ( 3.662 -4.203 -5.136) 7.580 7.516 ( -4.273 -2.444 -8.393) 9.731 7.598 ( -4.595 4.642 -2.081) 6.856 7.731 ( -1.307 1.567 0.648) 2.141 7.920 ( -2.587 -9.571 5.156) 11.175 8.149 ( -4.123 -0.084 6.729) 7.892 8.240 ( -1.333 -0.984 -1.388) 2.161 8.291 ( -0.501 -0.398 3.341) 3.402 8.387 ( 1.387 3.817 -2.486) 4.761 8.438 ( -1.370 4.111 -4.247) 6.067 8.573 ( 0.923 3.534 5.525) 6.623 8.608 ( 4.903 1.813 0.288) 5.236 8.670 ( 4.452 -0.504 -0.196) 4.485 8.762 ( -2.415 1.562 3.869) 4.821 8.869 ( 0.687 1.648 -1.059) 2.076 8.977 ( -3.943 2.299 -4.510) 6.417 9.064 ( 0.953 -3.857 0.458) 3.999 9.202 ( -0.162 -2.579 0.262) 2.597 9.276 ( -1.718 1.659 -0.307) 2.408 9.353 ( 0.698 4.308 -0.264) 4.373 9.455 ( 7.204 -2.139 6.920) 10.216 9.961 ( -2.329 -5.549 3.723) 7.077 9.998 ( -7.477 -3.400 1.079) 8.284 10.093 ( -0.805 -0.772 1.713) 2.044 10.231 ( -2.593 1.114 3.755) 4.697 10.268 ( -2.370 -0.170 0.429) 2.414 10.308 ( -3.278 2.816 2.028) 4.774 10.388 ( 1.829 5.155 -3.419) 6.450 10.748 ( -3.122 0.316 9.146) 9.669 11.797 ( -14.133 -9.432 -20.149) 26.357 16.355 ( -0.875 0.180 0.068) 0.896 16.382 ( -2.181 -0.206 0.355) 2.219 16.842 ( 0.889 -0.850 -0.350) 1.279 16.850 ( 0.269 -0.848 -0.026) 0.890 17.506 ( 0.498 -2.805 0.624) 2.917 17.545 ( 1.665 -2.672 0.305) 3.163 17.608 ( 0.618 1.177 0.583) 1.452 17.646 ( 1.372 0.748 0.325) 1.596 17.752 ( 1.757 -0.586 -0.785) 2.011 17.775 ( 1.406 -0.732 -1.650) 2.288 17.873 ( 0.886 -2.898 2.962) 4.237 17.937 ( 2.354 -5.789 -1.277) 6.378 18.574 ( 1.969 16.745 -1.145) 16.899 18.585 ( 2.503 14.085 -1.156) 14.352 19.381 ( 4.144 -4.859 2.046) 6.705 19.462 ( 3.217 -3.514 -0.883) 4.845 21.254 ( -0.942 -0.027 0.044) 0.944 21.292 ( -3.988 -0.913 -1.978) 4.544 21.422 ( -0.340 -0.119 0.058) 0.365 21.432 ( -0.021 -0.241 -0.001) 0.241 21.933 ( -0.613 0.766 0.228) 1.007 21.944 ( -0.292 1.376 -0.559) 1.514 22.040 ( 0.092 -0.019 -0.618) 0.625 22.113 ( -3.435 -1.563 -1.928) 4.238 26.950 ( 0.078 0.835 0.465) 0.959 26.999 ( -0.238 1.346 -1.511) 2.038 27.124 ( 0.798 -1.480 0.956) 1.934 27.161 ( 0.375 -0.763 0.035) 0.851 27.698 ( 0.819 0.477 -0.016) 0.948 27.702 ( 0.254 0.421 0.763) 0.908 27.796 ( 1.629 0.511 -0.664) 1.833 27.810 ( 0.274 0.620 0.406) 0.790 35.683 ( 1.658 4.621 4.012) 6.340 35.839 ( 2.856 0.300 2.286) 3.670 35.984 ( 2.000 5.205 -1.117) 5.687 36.064 ( 6.049 2.050 -6.656) 9.225 36.331 ( 3.664 -0.324 3.732) 5.240 36.404 ( -3.898 -1.050 4.289) 5.889 36.648 ( 5.357 1.365 12.129) 13.329 36.747 ( 5.157 -1.726 -3.131) 6.275 37.018 ( -5.973 -3.013 -1.833) 6.937 37.176 ( 3.565 -3.367 -7.028) 8.570 37.958 ( -11.004 -33.852 11.420) 37.383 38.291 ( -10.777 -18.814 12.392) 24.973 39.513 ( -2.060 5.381 4.491) 7.305 39.686 ( -4.605 1.585 -0.442) 4.890 40.802 ( 11.544 14.128 -8.409) 20.089 40.885 ( 5.730 19.665 -10.403) 22.973 ======================= Grid point 144 (75/92) ======================= q-point: ( 0.00 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( 4.709 10.547 13.883) 18.059 1.400 ( -2.221 0.574 -12.191) 12.405 1.899 ( -1.281 -0.833 0.670) 1.668 1.920 ( 1.234 -0.893 -1.224) 1.954 2.011 ( -1.652 4.501 3.491) 5.930 2.041 ( -1.387 2.429 -0.842) 2.921 2.265 ( -9.109 5.390 16.045) 19.221 2.409 ( 7.040 -5.747 0.648) 9.111 2.538 ( 4.813 12.032 3.285) 13.369 2.698 ( -4.698 22.598 -8.895) 24.736 2.876 ( -1.455 5.233 8.323) 9.939 2.937 ( 2.247 -1.003 6.962) 7.384 3.042 ( 0.688 5.095 3.236) 6.075 3.139 ( 1.280 -1.545 -6.018) 6.344 3.280 ( -4.107 -12.089 14.858) 19.590 3.346 ( 0.403 13.881 7.321) 15.698 3.542 ( 7.275 -1.697 -5.162) 9.081 3.613 ( -0.275 -7.220 -8.482) 11.142 3.926 ( 0.163 1.896 0.359) 1.937 3.985 ( -2.574 4.499 -3.263) 6.125 4.076 ( -4.217 -2.108 0.576) 4.749 4.127 ( 2.855 0.900 -6.264) 6.942 4.334 ( 0.625 1.034 3.232) 3.451 4.403 ( 1.808 0.221 -2.368) 2.987 4.529 ( -2.438 -0.354 2.134) 3.260 4.571 ( 1.482 -0.872 -1.596) 2.346 4.622 ( 1.364 2.080 4.325) 4.989 4.678 ( 5.999 -2.577 2.257) 6.908 4.792 ( -4.779 12.637 -2.037) 13.663 4.876 ( -1.311 4.680 -3.183) 5.810 4.957 ( 3.651 -1.199 1.931) 4.300 5.049 ( -2.657 -4.076 -2.669) 5.549 5.243 ( 0.885 3.751 -0.270) 3.863 5.252 ( 2.868 2.208 -2.336) 4.308 5.327 ( -4.362 5.319 -0.904) 6.938 5.366 ( 2.004 4.344 -2.614) 5.451 5.458 ( -1.711 0.471 0.090) 1.777 5.490 ( -1.639 0.226 1.135) 2.006 5.608 ( 0.334 5.571 1.887) 5.891 5.625 ( -1.317 4.482 -1.493) 4.904 5.718 ( 1.627 1.234 3.838) 4.348 5.729 ( -0.958 0.645 6.161) 6.269 5.776 ( 0.081 0.673 -1.820) 1.942 5.854 ( 2.260 -2.566 -0.580) 3.468 5.902 ( -0.535 0.439 -3.480) 3.548 5.950 ( -1.045 -4.898 -2.941) 5.808 6.028 ( 3.796 -6.153 -0.722) 7.266 6.086 ( -0.652 -5.778 -5.565) 8.049 6.194 ( 0.367 -3.909 3.414) 5.203 6.262 ( 0.394 -4.623 -0.509) 4.668 6.347 ( -2.031 -1.275 -0.417) 2.434 6.381 ( -0.299 -5.094 -1.393) 5.289 6.409 ( 0.309 1.997 0.003) 2.021 6.464 ( 2.800 -1.416 0.519) 3.180 6.482 ( -0.918 -1.507 -4.459) 4.795 6.492 ( -3.218 -1.932 -0.643) 3.808 6.656 ( 0.404 1.320 0.372) 1.430 6.717 ( -1.049 0.997 -4.638) 4.859 6.815 ( 1.564 -1.910 2.707) 3.663 6.856 ( -4.312 -3.894 -0.687) 5.851 6.967 ( -3.624 -3.421 5.463) 7.395 7.022 ( -1.271 -3.257 4.451) 5.660 7.100 ( 5.565 0.417 -0.289) 5.588 7.140 ( 4.540 -9.350 -6.565) 12.294 7.167 ( 2.244 2.195 -3.147) 4.445 7.234 ( -6.911 1.851 -7.179) 10.136 7.313 ( -1.492 -2.403 -0.400) 2.857 7.363 ( 1.960 -1.634 -4.265) 4.970 7.707 ( 3.522 2.707 2.111) 4.918 7.748 ( 0.120 1.776 -1.523) 2.342 7.881 ( 1.946 -0.942 4.861) 5.320 7.987 ( -5.521 -4.527 -5.329) 8.909 8.216 ( -1.455 0.507 5.610) 5.818 8.283 ( 0.977 -2.586 0.908) 2.910 8.500 ( 1.946 4.056 -1.547) 4.757 8.523 ( -1.199 3.476 -2.510) 4.452 8.667 ( -4.431 3.728 4.461) 7.310 8.710 ( 3.784 1.544 0.386) 4.105 8.776 ( 3.098 1.188 1.928) 3.837 8.815 ( 0.051 3.376 0.163) 3.380 8.834 ( -0.758 -0.664 3.598) 3.736 8.933 ( -1.333 4.035 -4.970) 6.539 9.037 ( 0.043 -1.083 4.229) 4.366 9.111 ( -1.387 -3.079 -2.295) 4.083 9.338 ( -2.485 3.499 4.521) 6.233 9.395 ( 2.010 2.620 -0.937) 3.433 9.602 ( 7.155 -7.757 3.013) 10.975 9.643 ( -7.319 -7.959 -0.495) 10.824 10.029 ( 0.715 2.166 5.373) 5.837 10.079 ( -1.714 0.267 1.197) 2.107 10.220 ( -0.332 0.590 2.318) 2.415 10.258 ( 1.537 0.034 -2.381) 2.834 10.390 ( 1.318 2.933 4.308) 5.375 10.501 ( 4.813 0.842 -4.225) 6.460 10.885 ( 4.220 1.736 9.496) 10.535 11.204 ( -8.139 -8.635 -20.653) 23.819 16.356 ( 0.267 0.007 0.215) 0.343 16.357 ( -0.287 -0.032 0.121) 0.313 16.829 ( -0.354 -0.807 -0.088) 0.886 16.831 ( 0.129 -0.858 -0.235) 0.899 17.477 ( 0.137 -0.969 0.661) 1.181 17.491 ( -0.301 -1.606 -0.641) 1.755 17.664 ( -0.174 1.122 1.439) 1.833 17.676 ( -0.297 0.613 0.394) 0.788 17.748 ( 0.708 -0.921 -0.921) 1.483 17.754 ( 0.450 -1.263 -1.610) 2.095 17.847 ( -0.850 -1.232 1.397) 2.047 17.868 ( 0.445 -2.425 -0.746) 2.576 18.887 ( 0.335 13.683 0.718) 13.706 18.911 ( -0.140 15.069 -2.034) 15.206 19.313 ( 0.790 -8.301 2.427) 8.684 19.358 ( -0.750 -7.705 -2.263) 8.065 21.248 ( -0.045 0.301 0.191) 0.359 21.252 ( -0.018 0.141 -0.232) 0.272 21.421 ( 0.189 -0.108 0.056) 0.225 21.423 ( -0.144 -0.216 -0.171) 0.311 21.949 ( -0.110 0.979 0.456) 1.086 21.959 ( 0.256 0.711 -0.650) 0.997 22.042 ( -0.951 -0.141 -0.063) 0.963 22.046 ( 0.312 -0.211 -0.341) 0.508 26.984 ( 0.254 1.459 0.760) 1.664 27.004 ( -0.394 1.028 -1.363) 1.752 27.122 ( 0.578 -1.067 1.024) 1.588 27.137 ( -0.437 -1.270 -0.608) 1.474 27.711 ( -0.451 0.369 0.553) 0.804 27.715 ( 0.222 0.193 0.177) 0.343 27.819 ( -0.731 0.622 0.173) 0.975 27.823 ( 0.475 0.463 -0.258) 0.712 35.814 ( 0.442 2.087 1.976) 2.908 35.852 ( -0.893 -0.076 -1.714) 1.935 36.122 ( -0.998 8.308 5.005) 9.750 36.225 ( 1.783 8.925 -4.700) 10.243 36.416 ( 0.650 1.134 2.814) 3.103 36.444 ( 2.629 4.006 -0.226) 4.797 36.711 ( -8.741 -4.637 3.032) 10.349 36.745 ( 4.395 -3.652 0.125) 5.716 36.789 ( 4.612 -5.502 7.581) 10.441 36.988 ( -4.168 -8.858 -11.021) 14.741 37.634 ( 1.872 -13.870 15.004) 20.518 37.801 ( -0.115 -18.108 -2.836) 18.329 39.627 ( 0.406 2.700 4.181) 4.994 39.664 ( -0.358 0.561 0.679) 0.951 41.046 ( -0.182 9.284 -2.479) 9.611 41.132 ( 1.051 7.033 -12.169) 14.094 ======================= Grid point 145 (76/92) ======================= q-point: ( 0.11 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( 20.447 7.658 -8.601) 23.467 1.492 ( 17.416 3.952 4.972) 18.538 1.871 ( -1.771 -1.606 0.917) 2.560 1.990 ( -1.666 2.749 2.777) 4.247 2.021 ( 1.210 1.839 -0.437) 2.244 2.069 ( 12.089 -4.320 0.426) 12.845 2.279 ( -1.922 6.897 10.660) 12.841 2.519 ( 1.401 2.592 -1.655) 3.379 2.602 ( 8.764 13.300 -12.328) 20.142 2.723 ( 7.620 12.654 8.386) 16.985 2.952 ( 2.161 2.162 2.492) 3.944 3.022 ( 6.779 -0.454 -3.201) 7.511 3.062 ( 0.938 4.775 -0.561) 4.898 3.156 ( 5.031 1.316 -1.122) 5.320 3.385 ( 0.776 -9.663 8.470) 12.873 3.393 ( -0.681 10.795 -0.196) 10.818 3.531 ( 5.277 -13.382 -13.051) 19.423 3.625 ( 6.077 -2.958 -3.472) 7.598 3.851 ( -4.718 3.948 2.273) 6.558 4.010 ( -3.567 -0.498 -0.233) 3.609 4.040 ( 3.720 4.268 5.871) 8.156 4.146 ( 1.051 -2.664 -1.328) 3.156 4.283 ( -5.810 1.533 -0.302) 6.016 4.445 ( 4.474 2.893 -1.808) 5.626 4.466 ( -7.197 0.900 -0.034) 7.253 4.534 ( -6.642 6.502 -1.755) 9.459 4.609 ( 1.535 -2.348 -2.625) 3.842 4.629 ( -0.960 -1.109 0.537) 1.562 4.787 ( -2.934 9.167 -0.263) 9.629 4.868 ( 0.548 7.208 -1.804) 7.450 5.001 ( 7.717 2.854 1.608) 8.384 5.152 ( -2.262 2.896 -1.846) 4.112 5.167 ( -2.027 -2.624 -2.721) 4.289 5.229 ( -1.246 0.309 -1.793) 2.205 5.292 ( 0.772 -0.550 3.197) 3.334 5.391 ( 3.236 5.520 3.850) 7.467 5.476 ( 1.417 -3.244 2.512) 4.341 5.541 ( 3.641 2.340 -0.451) 4.352 5.610 ( 1.184 8.417 2.072) 8.748 5.650 ( 2.537 4.016 0.243) 4.756 5.683 ( -4.282 0.277 -0.582) 4.330 5.737 ( -5.146 -1.566 -1.732) 5.651 5.762 ( -1.476 0.444 2.724) 3.129 5.810 ( 0.950 0.332 -3.966) 4.092 5.915 ( 0.941 -3.030 -1.478) 3.500 5.936 ( 1.273 0.625 1.941) 2.404 6.071 ( 6.117 -2.305 -2.496) 6.997 6.113 ( 3.192 -3.841 -0.106) 4.996 6.179 ( -4.098 -1.572 -1.884) 4.777 6.261 ( 0.067 -7.546 -1.837) 7.766 6.305 ( -3.182 -4.152 1.535) 5.451 6.364 ( 0.673 -2.002 4.177) 4.680 6.383 ( 0.179 -1.095 -2.015) 2.300 6.436 ( -2.127 -2.644 0.395) 3.416 6.506 ( 4.016 1.002 1.562) 4.424 6.587 ( 4.725 -1.303 -1.968) 5.282 6.695 ( 2.259 0.962 2.914) 3.811 6.725 ( 4.850 1.868 1.017) 5.296 6.762 ( -4.096 -1.446 2.229) 4.882 6.913 ( 0.120 -1.827 2.331) 2.964 6.922 ( -5.134 -3.771 1.741) 6.603 6.965 ( -5.724 -2.291 1.119) 6.266 7.035 ( -2.359 -1.639 0.915) 3.014 7.129 ( 2.686 -10.824 -5.279) 12.339 7.194 ( 4.470 -7.967 -4.858) 10.347 7.288 ( -0.464 -5.787 1.279) 5.945 7.353 ( 9.648 5.443 4.523) 11.965 7.411 ( 6.055 3.037 -0.958) 6.841 7.697 ( -0.269 2.793 -3.928) 4.828 7.767 ( 0.716 0.496 -1.523) 1.754 7.885 ( -0.928 -1.640 -1.044) 2.155 8.036 ( 7.870 -2.129 6.097) 10.181 8.238 ( -1.332 -0.218 4.132) 4.347 8.297 ( 1.228 -1.408 -2.574) 3.181 8.483 ( -0.495 2.856 -3.109) 4.251 8.538 ( 2.286 1.506 1.602) 3.171 8.615 ( -4.517 3.821 2.908) 6.593 8.697 ( -2.662 4.535 -4.846) 7.151 8.792 ( -1.202 -0.059 -1.043) 1.592 8.811 ( 0.840 0.566 0.818) 1.301 8.901 ( 4.341 3.774 0.735) 5.799 8.961 ( 5.349 4.586 0.616) 7.072 9.038 ( -2.787 -0.784 -2.253) 3.668 9.098 ( 0.754 -2.063 4.867) 5.340 9.304 ( -3.567 0.246 0.904) 3.688 9.450 ( 0.385 4.946 0.513) 4.987 9.468 ( -2.703 -4.463 -2.711) 5.880 9.801 ( 6.145 -9.924 2.805) 12.005 10.026 ( -1.118 3.256 -0.021) 3.442 10.123 ( 2.250 -0.136 2.053) 3.049 10.240 ( 1.030 0.341 0.688) 1.285 10.291 ( 4.945 -1.329 -3.071) 5.971 10.430 ( 0.327 4.107 -0.411) 4.141 10.478 ( 3.554 2.510 -9.473) 10.425 10.976 ( 2.258 -1.014 -13.551) 13.775 11.192 ( 11.453 -10.833 18.878) 24.595 16.362 ( 1.199 0.358 -0.057) 1.252 16.378 ( 1.954 -0.372 0.088) 1.991 16.816 ( -1.181 -0.741 0.324) 1.432 16.827 ( -0.600 -1.180 0.067) 1.325 17.478 ( -0.378 -1.263 -0.298) 1.352 17.488 ( 0.076 -1.245 0.510) 1.348 17.655 ( -1.968 0.689 -0.039) 2.086 17.660 ( -1.485 0.594 0.908) 1.840 17.733 ( -1.240 -0.660 -1.260) 1.887 17.742 ( -0.853 -0.958 -0.832) 1.529 17.835 ( -1.854 -1.179 1.281) 2.543 17.859 ( -0.763 -2.304 -0.554) 2.490 18.866 ( -3.021 14.013 -1.343) 14.398 18.874 ( -2.532 14.600 1.014) 14.852 19.293 ( -3.821 -7.749 -1.875) 8.841 19.319 ( -2.644 -7.997 1.858) 8.625 21.256 ( 1.055 0.170 0.010) 1.069 21.268 ( 1.514 -0.283 0.087) 1.543 21.422 ( 0.320 -0.065 -0.125) 0.350 21.427 ( 0.357 -0.233 0.012) 0.426 21.956 ( 0.466 1.020 0.460) 1.212 21.962 ( 0.771 0.817 -0.715) 1.332 22.031 ( -0.225 0.458 0.584) 0.776 22.067 ( 1.572 -1.067 0.468) 1.957 26.985 ( -0.378 1.332 -0.550) 1.490 27.002 ( 0.598 1.178 0.789) 1.539 27.112 ( -1.435 -1.122 -0.686) 1.946 27.134 ( -0.193 -1.427 0.434) 1.504 27.705 ( -0.757 0.549 0.453) 1.039 27.716 ( -0.226 0.018 -0.040) 0.230 27.801 ( -1.577 1.014 0.371) 1.911 27.822 ( -0.466 0.128 -0.018) 0.483 35.806 ( -2.386 1.106 -1.267) 2.919 35.828 ( -0.937 -0.111 1.922) 2.141 36.083 ( -5.556 8.881 1.781) 10.626 36.190 ( -2.697 10.266 -4.509) 11.533 36.407 ( -2.465 -5.209 -2.646) 6.341 36.433 ( -2.303 3.553 -0.019) 4.235 36.622 ( -5.889 -1.385 6.358) 8.776 36.773 ( -6.933 -8.303 -7.424) 13.120 36.887 ( 9.315 -0.235 -1.264) 9.403 37.030 ( 12.594 -2.559 7.323) 14.791 37.651 ( -0.158 -12.287 -1.129) 12.340 37.961 ( 13.652 -22.972 -1.158) 26.747 39.678 ( 2.792 2.296 -1.488) 3.910 39.697 ( 4.219 1.357 1.473) 4.671 40.946 ( -9.227 10.319 0.097) 13.843 41.033 ( -5.017 6.173 -1.666) 8.128 ======================= Grid point 146 (77/92) ======================= q-point: ( 0.22 0.33 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( 5.086 4.824 -4.100) 8.121 1.811 ( 15.341 4.083 -4.271) 16.440 1.871 ( 3.373 0.469 0.994) 3.548 1.998 ( -1.670 0.158 0.759) 1.841 2.060 ( 8.874 -1.989 2.471) 9.424 2.304 ( 9.752 -5.942 -6.182) 12.986 2.368 ( 2.289 18.358 7.310) 19.892 2.566 ( 12.235 10.044 -6.118) 16.971 2.660 ( 5.408 -5.137 -5.918) 9.521 2.875 ( 2.908 3.708 2.489) 5.330 2.993 ( 5.157 -1.908 -3.408) 6.469 3.093 ( 6.313 8.971 -1.963) 11.144 3.118 ( 4.944 2.783 -3.158) 6.493 3.235 ( 0.482 3.194 4.728) 5.726 3.403 ( 6.648 -2.714 -5.252) 8.896 3.444 ( 2.875 -0.269 1.282) 3.160 3.561 ( 8.640 -8.642 -9.286) 15.348 3.670 ( 3.419 -3.175 -2.573) 5.328 3.826 ( -3.921 0.755 3.104) 5.058 3.932 ( -4.230 2.393 -1.642) 5.130 4.045 ( -4.315 -2.090 -0.078) 4.795 4.146 ( -3.203 0.036 -1.403) 3.497 4.229 ( -0.298 1.222 3.560) 3.776 4.324 ( -6.712 2.551 1.887) 7.425 4.436 ( -2.210 7.717 -5.153) 9.539 4.521 ( 4.764 2.745 -2.380) 5.991 4.560 ( -2.770 4.851 -10.034) 11.484 4.657 ( 4.644 -2.361 0.929) 5.292 4.791 ( -2.354 5.868 1.370) 6.469 4.854 ( 5.476 3.661 3.676) 7.544 5.039 ( -4.073 -2.946 -0.577) 5.059 5.107 ( -1.953 6.438 2.700) 7.249 5.177 ( 2.528 3.810 8.400) 9.564 5.242 ( -0.465 4.665 3.011) 5.571 5.337 ( 2.660 -3.181 -0.915) 4.246 5.463 ( -0.082 2.722 0.341) 2.745 5.476 ( -1.553 -0.853 0.112) 1.775 5.552 ( -2.048 -1.093 -0.529) 2.381 5.637 ( 0.695 2.352 3.142) 3.986 5.653 ( 0.866 3.389 -0.936) 3.621 5.667 ( -0.115 5.538 -2.376) 6.027 5.730 ( 0.779 5.037 0.043) 5.097 5.769 ( 2.698 -0.462 3.151) 4.174 5.814 ( 4.284 -0.787 -4.648) 6.370 5.953 ( 3.758 0.035 1.734) 4.139 6.023 ( 4.137 1.233 4.894) 6.526 6.067 ( -3.244 4.383 0.501) 5.476 6.099 ( 0.344 -1.588 -4.585) 4.864 6.191 ( 4.104 -6.514 -0.605) 7.723 6.208 ( -1.658 -8.569 -1.254) 8.818 6.310 ( -3.031 -0.798 -0.342) 3.153 6.358 ( -2.353 -0.800 3.270) 4.107 6.371 ( -0.328 -3.371 -1.882) 3.874 6.452 ( 0.815 -6.192 0.668) 6.281 6.577 ( -0.555 2.215 -2.006) 3.039 6.604 ( 1.573 2.293 1.728) 3.274 6.708 ( -0.157 -0.331 3.978) 3.995 6.775 ( -0.166 -0.803 -0.618) 1.027 6.830 ( -3.979 -3.376 1.897) 5.552 6.843 ( 3.893 -2.143 2.310) 5.008 6.907 ( 3.421 2.994 4.260) 6.230 6.992 ( 4.072 -1.580 -1.718) 4.693 7.052 ( -1.449 -8.976 7.026) 11.491 7.163 ( -0.737 -10.194 2.864) 10.614 7.215 ( 3.869 -8.312 -2.842) 9.599 7.296 ( 1.173 -7.252 2.828) 7.872 7.507 ( 4.393 4.589 1.293) 6.483 7.556 ( 8.465 2.876 3.732) 9.688 7.714 ( -1.198 -1.158 2.058) 2.648 7.746 ( 4.815 -1.790 1.103) 5.254 7.927 ( 3.509 4.436 0.698) 5.699 8.201 ( 5.290 -1.415 2.123) 5.873 8.236 ( -1.450 -1.862 -0.112) 2.362 8.297 ( 0.496 -1.901 1.284) 2.347 8.448 ( 0.044 3.571 -3.542) 5.030 8.547 ( -1.996 1.141 -2.640) 3.501 8.576 ( -2.378 3.515 0.727) 4.305 8.661 ( 4.358 4.512 -1.947) 6.568 8.740 ( -1.961 1.567 -3.644) 4.425 8.810 ( -1.121 -1.092 -0.923) 1.817 8.971 ( 4.577 5.238 -5.618) 8.941 9.007 ( 1.360 1.393 3.016) 3.590 9.054 ( 2.713 2.733 3.567) 5.249 9.161 ( 1.544 -0.414 2.983) 3.384 9.252 ( -2.917 -0.498 0.297) 2.974 9.381 ( -2.026 0.767 -1.379) 2.568 9.510 ( 4.075 1.942 -3.132) 5.495 9.842 ( -1.669 -5.973 -0.236) 6.206 10.042 ( 2.360 -1.438 0.025) 2.763 10.133 ( -1.273 -3.631 -4.319) 5.784 10.218 ( -1.256 0.991 -3.641) 3.977 10.335 ( 4.504 -1.343 -3.820) 6.056 10.493 ( 9.553 0.856 -3.635) 10.257 10.519 ( 10.310 0.549 -3.168) 10.800 11.008 ( 6.961 7.287 -2.204) 10.316 11.511 ( 4.855 -14.863 15.262) 21.850 16.398 ( 3.145 0.580 -0.220) 3.206 16.423 ( 3.295 -0.592 -0.166) 3.352 16.793 ( -2.221 -0.783 0.561) 2.421 16.806 ( -2.053 -1.377 0.092) 2.474 17.471 ( -0.011 -0.958 -0.519) 1.090 17.485 ( -1.040 -0.986 0.087) 1.436 17.622 ( -0.978 0.762 -0.410) 1.305 17.638 ( -1.345 0.319 -0.305) 1.415 17.689 ( -2.874 -0.860 -0.052) 3.001 17.704 ( -2.889 -1.386 -0.113) 3.207 17.811 ( -2.118 -0.944 0.856) 2.472 17.831 ( -1.899 -1.925 -0.461) 2.743 18.798 ( -3.240 12.801 -0.811) 13.229 18.831 ( -3.477 14.544 1.320) 15.012 19.207 ( -3.915 -7.609 -1.362) 8.665 19.271 ( -4.588 -7.406 1.580) 8.854 21.277 ( 1.358 0.157 -0.229) 1.386 21.304 ( 2.049 -1.129 1.053) 2.566 21.424 ( -0.217 0.074 -0.208) 0.310 21.435 ( 0.778 -0.416 -0.136) 0.892 21.971 ( 0.967 1.123 -0.269) 1.506 21.972 ( 0.884 0.897 0.097) 1.263 22.040 ( 0.369 0.575 0.794) 1.048 22.099 ( 1.131 -1.965 0.950) 2.458 26.976 ( -0.120 1.444 -0.311) 1.482 27.022 ( 0.583 1.150 1.217) 1.773 27.079 ( -1.455 -1.350 -0.829) 2.151 27.128 ( -0.545 -1.683 -0.000) 1.769 27.698 ( -0.398 0.597 0.397) 0.820 27.707 ( -0.514 0.127 -0.339) 0.629 27.773 ( -2.053 1.177 0.289) 2.384 27.806 ( -1.224 -0.130 -0.282) 1.263 35.758 ( -1.623 2.367 -1.299) 3.150 35.810 ( -2.161 -0.184 -0.676) 2.272 35.996 ( -5.153 5.266 -0.094) 7.368 36.063 ( -6.507 6.342 -5.702) 10.727 36.246 ( -7.344 -1.083 -4.408) 8.633 36.419 ( -3.968 -0.582 3.632) 5.411 36.579 ( -5.494 -3.588 -6.044) 8.921 36.598 ( -5.561 -6.638 6.424) 10.782 37.071 ( 11.471 7.756 0.954) 13.880 37.316 ( 12.010 7.636 4.016) 14.787 37.729 ( 11.209 -17.013 -1.505) 20.429 38.147 ( 11.992 -24.091 -6.117) 27.597 39.728 ( 6.223 4.458 -3.506) 8.420 39.813 ( 8.472 0.074 0.183) 8.474 40.777 ( -12.581 9.976 3.982) 16.542 40.900 ( -11.477 5.046 3.142) 12.925 ======================= Grid point 147 (78/92) ======================= q-point: ( 0.33 0.33 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.658 ( 2.339 1.732 -2.648) 3.935 1.879 ( 1.649 -4.216 0.369) 4.542 1.908 ( 0.353 0.481 -5.096) 5.130 2.012 ( 1.359 -3.449 -1.296) 3.927 2.293 ( 9.282 7.276 -3.850) 12.407 2.343 ( 5.721 3.568 -1.219) 6.852 2.431 ( 5.054 15.182 -3.793) 16.444 2.639 ( 4.433 -4.544 -7.557) 9.869 2.755 ( 5.468 -4.370 -0.854) 7.052 2.854 ( -2.960 -1.048 -3.578) 4.760 3.115 ( 6.649 -7.544 2.338) 10.324 3.133 ( -0.484 6.853 0.006) 6.870 3.187 ( -3.515 -1.661 -4.882) 6.241 3.247 ( 7.306 9.062 4.074) 12.332 3.500 ( 7.080 -2.135 -4.253) 8.531 3.536 ( 6.770 2.874 0.594) 7.378 3.627 ( 5.312 0.892 -2.705) 6.028 3.731 ( 3.304 3.411 1.185) 4.895 3.788 ( 2.441 -1.179 -0.562) 2.768 3.872 ( -2.009 1.085 -0.181) 2.290 3.959 ( -2.061 -3.236 -3.742) 5.359 4.029 ( -2.761 -0.823 -5.052) 5.815 4.168 ( -7.320 2.283 -4.397) 8.839 4.328 ( -4.244 1.297 -6.002) 7.465 4.380 ( 2.627 8.377 -3.857) 9.589 4.452 ( 4.425 7.925 7.912) 12.041 4.608 ( 7.295 5.683 -3.649) 9.941 4.702 ( -1.806 1.878 -0.660) 2.688 4.775 ( 0.524 1.390 4.288) 4.538 4.962 ( -8.624 -2.290 3.698) 9.659 5.038 ( 3.357 -2.417 3.555) 5.454 5.109 ( 2.279 2.403 -2.415) 4.099 5.219 ( 1.134 9.078 4.988) 10.420 5.261 ( -2.377 2.974 2.613) 4.617 5.393 ( 1.666 -1.230 0.363) 2.102 5.416 ( 2.557 4.775 -3.135) 6.258 5.489 ( -3.434 0.771 -0.567) 3.565 5.539 ( -0.783 -2.822 5.416) 6.157 5.611 ( -0.614 4.409 -2.329) 5.024 5.645 ( -1.285 0.817 0.949) 1.794 5.681 ( 1.842 3.268 -0.898) 3.857 5.785 ( 4.128 5.543 0.752) 6.952 5.848 ( 1.782 -1.530 2.130) 3.171 5.869 ( 3.914 -1.150 0.734) 4.145 5.982 ( -2.810 1.281 1.678) 3.515 6.011 ( -4.210 -2.073 2.990) 5.564 6.068 ( 2.926 4.827 -0.001) 5.645 6.138 ( 1.899 -1.895 -4.937) 5.619 6.193 ( -0.212 0.962 2.422) 2.615 6.234 ( -1.092 -2.894 -0.634) 3.158 6.263 ( 1.269 -3.807 0.928) 4.119 6.337 ( 1.908 -1.296 0.071) 2.308 6.391 ( -2.174 -3.347 -4.415) 5.952 6.416 ( 1.968 -5.966 3.044) 6.981 6.576 ( 2.123 0.288 -1.548) 2.643 6.600 ( -1.923 0.644 1.822) 2.727 6.702 ( -3.848 -5.112 1.369) 6.543 6.770 ( 1.120 -3.587 -2.465) 4.494 6.844 ( 0.052 -3.132 3.497) 4.695 6.884 ( 0.189 -0.121 -0.712) 0.747 7.024 ( 4.875 0.390 -1.452) 5.102 7.071 ( -1.224 -7.779 -0.202) 7.877 7.110 ( -2.491 -8.321 3.421) 9.336 7.119 ( 3.857 3.734 11.914) 13.068 7.280 ( 3.562 -8.291 1.670) 9.177 7.426 ( 4.763 -3.963 10.631) 12.305 7.604 ( 4.517 1.621 5.101) 7.003 7.714 ( 0.679 -1.119 6.635) 6.763 7.734 ( 5.301 1.243 3.188) 6.309 7.891 ( 3.977 -4.285 7.923) 9.847 7.969 ( 1.556 5.018 -1.845) 5.569 8.196 ( -1.754 -3.337 -1.206) 3.958 8.245 ( -1.211 0.354 1.099) 1.674 8.322 ( 0.231 -2.141 0.211) 2.163 8.412 ( 0.242 2.067 -4.704) 5.143 8.479 ( -0.971 2.726 -5.641) 6.340 8.579 ( 0.965 2.313 -0.272) 2.521 8.640 ( -0.135 2.488 -2.554) 3.568 8.758 ( -1.577 0.715 -2.155) 2.764 8.780 ( 5.105 3.853 -2.086) 6.728 8.992 ( 2.986 4.858 -3.830) 6.869 9.074 ( 2.241 1.574 2.263) 3.553 9.128 ( 1.534 0.184 4.673) 4.922 9.164 ( -0.762 2.358 -4.080) 4.773 9.219 ( -2.927 1.566 3.337) 4.707 9.355 ( 0.875 3.704 -1.840) 4.227 9.537 ( 2.682 -3.193 -4.288) 5.981 9.773 ( -1.387 -8.050 -8.004) 11.436 10.031 ( -1.725 -3.919 -5.439) 6.922 10.076 ( 1.808 -3.941 -1.524) 4.596 10.219 ( 2.363 5.321 0.859) 5.885 10.388 ( 5.557 -1.077 -3.843) 6.842 10.665 ( 11.818 -0.302 0.224) 11.824 10.711 ( 12.514 -2.282 -1.330) 12.790 11.095 ( 3.211 9.651 0.446) 10.181 11.594 ( -7.214 -12.754 6.682) 16.105 16.465 ( 4.853 0.529 -0.345) 4.894 16.485 ( 4.219 -0.475 -0.449) 4.269 16.746 ( -3.756 -0.681 0.195) 3.822 16.755 ( -3.895 -1.079 -0.211) 4.047 17.459 ( -0.216 0.248 -0.913) 0.970 17.477 ( 0.348 -1.658 0.486) 1.763 17.607 ( -1.684 0.020 -1.698) 2.392 17.612 ( -0.938 -1.229 -0.900) 1.789 17.648 ( -1.266 -0.783 1.752) 2.299 17.660 ( -2.228 -1.714 1.351) 3.119 17.779 ( -2.119 -0.715 -0.084) 2.238 17.788 ( -2.584 -1.260 -0.456) 2.910 18.753 ( -1.408 12.005 -0.054) 12.087 18.788 ( -2.879 13.526 1.387) 13.899 19.145 ( -2.197 -7.363 -0.301) 7.690 19.205 ( -4.258 -6.961 1.052) 8.228 21.298 ( 1.199 0.516 0.008) 1.305 21.347 ( 1.354 -2.002 1.019) 2.623 21.414 ( -0.477 0.601 0.026) 0.768 21.447 ( 0.694 -0.919 -0.323) 1.196 21.985 ( 1.076 1.131 -0.488) 1.635 21.989 ( 0.604 1.217 0.424) 1.424 22.055 ( 0.457 0.289 0.919) 1.067 22.117 ( 0.001 -2.224 0.505) 2.281 26.975 ( 0.168 1.432 0.077) 1.443 27.033 ( -0.613 2.117 -0.036) 2.204 27.059 ( 0.017 -2.590 0.430) 2.625 27.118 ( -0.423 -1.875 -0.313) 1.948 27.693 ( -0.189 0.570 -0.662) 0.894 27.702 ( 0.151 0.643 0.474) 0.813 27.738 ( -2.054 0.806 -0.068) 2.207 27.779 ( -1.337 -0.395 -0.594) 1.515 35.731 ( 0.344 2.674 -2.157) 3.452 35.747 ( -2.589 1.622 -3.055) 4.321 35.859 ( -6.815 3.863 -6.827) 10.391 35.929 ( -3.707 -1.839 -1.003) 4.258 36.152 ( -3.678 5.113 3.026) 6.988 36.363 ( -5.840 0.218 2.908) 6.528 36.475 ( -0.260 -3.298 -4.107) 5.274 36.561 ( -6.573 -7.907 6.805) 12.330 37.268 ( 9.397 12.086 1.575) 15.390 37.481 ( 6.646 13.342 -1.761) 15.010 37.955 ( 11.533 -22.047 3.368) 25.108 38.263 ( 9.415 -23.403 -8.290) 26.553 39.840 ( 10.205 6.868 -2.148) 12.487 39.993 ( 12.593 -1.167 -0.226) 12.649 40.581 ( -14.573 8.961 3.322) 17.427 40.707 ( -14.619 3.608 3.933) 15.563 ======================= Grid point 148 (79/92) ======================= q-point: ( 0.44 0.33 -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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 2.927 -0.937 1.473) 3.408 1.833 ( -2.728 -2.699 -3.849) 5.435 1.906 ( 0.719 -1.108 -1.138) 1.744 1.989 ( -0.510 -5.011 -3.806) 6.313 2.282 ( -4.398 10.412 3.250) 11.760 2.383 ( 5.249 6.458 -10.472) 13.376 2.579 ( 10.212 -0.832 -3.643) 10.874 2.668 ( 1.359 1.625 -0.060) 2.119 2.730 ( -1.037 -4.736 -3.393) 5.917 2.802 ( -1.838 -2.515 1.770) 3.583 3.055 ( -2.667 -10.752 -5.120) 12.204 3.097 ( -1.880 6.440 -7.306) 9.919 3.200 ( -0.366 2.007 6.242) 6.567 3.353 ( -1.760 2.659 0.539) 3.234 3.522 ( 1.796 -1.948 1.406) 2.999 3.642 ( 6.694 6.688 0.787) 9.495 3.722 ( -0.499 4.637 -5.135) 6.936 3.766 ( 0.906 -3.502 6.150) 7.135 3.817 ( 1.912 2.743 -1.502) 3.665 3.886 ( -2.964 1.191 -4.511) 5.528 3.928 ( 8.492 2.346 -4.809) 10.037 4.004 ( -0.426 1.642 -0.833) 1.890 4.059 ( 2.345 3.636 -1.048) 4.452 4.255 ( -3.950 0.779 -1.127) 4.181 4.362 ( 7.997 13.639 -3.768) 16.254 4.568 ( -6.360 3.810 -0.000) 7.414 4.717 ( 5.179 7.341 8.042) 12.057 4.728 ( 3.825 -0.154 1.225) 4.019 4.803 ( -0.761 2.125 -0.714) 2.367 4.819 ( -3.707 3.366 -1.555) 5.243 5.009 ( 1.078 0.447 -2.316) 2.593 5.183 ( -1.061 -1.376 9.934) 10.085 5.236 ( -6.170 6.158 -1.810) 8.903 5.270 ( -0.400 4.985 0.591) 5.036 5.353 ( 2.189 4.345 -3.989) 6.291 5.436 ( 0.153 1.117 -4.081) 4.234 5.481 ( 3.215 1.196 0.756) 3.513 5.547 ( -2.127 0.317 0.339) 2.177 5.566 ( -1.971 -0.753 2.946) 3.624 5.648 ( 0.904 -0.293 0.164) 0.965 5.746 ( 0.811 0.590 3.076) 3.235 5.781 ( -1.486 -0.566 0.915) 1.835 5.866 ( -1.631 -0.872 0.947) 2.078 5.898 ( 1.053 -1.539 -3.412) 3.889 5.961 ( -0.057 4.082 1.907) 4.506 6.004 ( -2.528 0.111 -2.133) 3.310 6.086 ( -2.341 1.550 0.496) 2.851 6.119 ( 2.386 -0.993 0.277) 2.599 6.194 ( 0.669 -3.583 -1.833) 4.080 6.267 ( 1.438 -1.411 2.214) 2.993 6.306 ( 1.798 -1.145 -1.702) 2.728 6.340 ( 6.954 -1.495 0.538) 7.133 6.408 ( 1.237 -2.766 1.652) 3.451 6.497 ( 2.550 -7.145 2.104) 7.872 6.546 ( -3.383 -2.547 -2.109) 4.730 6.577 ( -3.544 -5.974 0.136) 6.947 6.689 ( 0.515 0.919 1.695) 1.995 6.733 ( -1.799 0.099 -1.603) 2.412 6.855 ( 0.810 -4.645 -0.064) 4.716 6.932 ( 0.565 -0.532 5.329) 5.386 6.976 ( -2.742 -2.292 -0.770) 3.656 7.063 ( -1.985 -3.356 2.112) 4.435 7.127 ( 4.065 -10.456 -0.636) 11.236 7.252 ( -1.136 -3.505 2.082) 4.232 7.422 ( 5.281 2.801 13.077) 14.378 7.595 ( 2.230 0.280 10.194) 10.439 7.748 ( 4.202 -2.763 6.600) 8.298 7.758 ( 1.065 5.360 0.962) 5.548 7.872 ( 2.942 -5.218 8.442) 10.351 7.927 ( -2.525 0.264 -0.023) 2.539 8.027 ( 2.410 -2.234 5.129) 6.092 8.159 ( -1.679 -2.964 -0.523) 3.447 8.206 ( 0.365 2.446 -5.353) 5.897 8.301 ( -1.551 -0.312 -2.790) 3.207 8.362 ( -1.648 1.329 -2.990) 3.663 8.415 ( 0.715 -0.589 -5.667) 5.743 8.563 ( -1.541 3.175 1.316) 3.767 8.671 ( -1.351 1.350 -0.382) 1.947 8.712 ( 1.452 6.116 -0.084) 6.287 8.841 ( 3.727 3.167 -1.904) 5.249 8.962 ( 0.446 6.218 -8.148) 10.260 9.103 ( -1.346 -2.616 -0.179) 2.947 9.127 ( -0.452 3.640 -0.320) 3.682 9.172 ( -1.345 6.861 -1.412) 7.133 9.209 ( -0.133 -4.409 6.962) 8.242 9.372 ( 0.336 -1.165 1.964) 2.308 9.508 ( -0.169 -5.293 -4.905) 7.218 9.678 ( 0.893 -7.397 -11.181) 13.436 9.998 ( -0.208 -0.796 0.380) 0.907 10.070 ( 0.664 -2.770 -3.785) 4.737 10.296 ( 3.209 4.595 3.602) 6.662 10.430 ( 3.255 0.060 -4.770) 5.775 10.853 ( 7.358 -0.465 0.868) 7.424 10.879 ( 6.944 -1.610 -1.404) 7.265 11.156 ( 5.705 4.507 2.028) 7.548 11.423 ( -14.801 -6.826 0.185) 16.300 16.550 ( 4.897 0.414 -0.303) 4.924 16.556 ( 4.291 0.059 -0.366) 4.307 16.672 ( -4.410 -0.767 -0.215) 4.482 16.675 ( -4.676 -0.748 -0.343) 4.748 17.468 ( 1.499 -0.278 0.523) 1.612 17.503 ( 2.051 -2.542 0.743) 3.349 17.541 ( -3.114 -1.132 -1.511) 3.641 17.575 ( -2.461 -3.116 -0.965) 4.086 17.661 ( 0.866 0.157 1.835) 2.035 17.677 ( 1.450 -0.676 1.460) 2.166 17.736 ( -1.902 -0.322 -1.240) 2.293 17.743 ( -1.921 -0.978 -0.659) 2.254 18.747 ( 0.446 11.814 0.346) 11.827 18.760 ( -1.711 12.421 0.985) 12.577 19.128 ( 0.107 -6.962 0.419) 6.975 19.153 ( -2.403 -6.789 0.457) 7.216 21.319 ( 1.091 0.493 0.442) 1.276 21.354 ( -0.805 -0.891 -0.375) 1.257 21.421 ( 0.484 -0.204 1.070) 1.192 21.451 ( 0.254 -1.297 -0.639) 1.468 21.997 ( 0.075 1.542 0.201) 1.557 21.998 ( 0.667 1.222 -0.283) 1.421 22.073 ( 0.469 -0.376 1.240) 1.378 22.111 ( -0.679 -1.831 -0.290) 1.974 26.983 ( 0.432 1.287 0.448) 1.429 27.013 ( -0.822 1.271 -0.787) 1.706 27.075 ( 0.531 -1.845 1.089) 2.207 27.108 ( -0.324 -1.922 -0.618) 2.045 27.688 ( 0.169 0.829 -0.379) 0.927 27.701 ( -1.041 1.661 -0.418) 2.004 27.719 ( 0.172 -0.581 0.804) 1.007 27.753 ( -0.772 -0.633 -0.875) 1.328 35.681 ( -2.199 3.037 -2.159) 4.327 35.701 ( -0.704 2.589 -3.969) 4.791 35.770 ( 1.799 2.269 -1.474) 3.250 35.856 ( -3.280 -2.380 -2.478) 4.750 36.158 ( -0.249 5.149 5.598) 7.610 36.291 ( -3.593 2.575 -0.238) 4.426 36.490 ( 3.532 -6.047 -1.008) 7.075 36.504 ( -5.393 -6.974 4.264) 9.793 37.404 ( 3.912 13.592 2.596) 14.381 37.524 ( 1.422 13.680 -3.708) 14.244 38.125 ( 2.999 -22.064 5.278) 22.884 38.309 ( 4.646 -23.281 -8.279) 25.142 40.037 ( 13.128 8.808 0.744) 15.827 40.224 ( 12.265 -1.336 -1.146) 12.391 40.349 ( -11.940 8.449 0.964) 14.659 40.483 ( -14.982 1.468 2.862) 15.323 ======================= Grid point 149 (80/92) ======================= q-point: (-0.44 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -8.915 -0.279 3.988) 9.770 1.819 ( 3.488 -2.406 -3.017) 5.202 1.887 ( -3.333 0.938 2.542) 4.296 1.955 ( 0.988 -4.023 -2.392) 4.783 2.216 ( -7.065 4.395 4.104) 9.278 2.407 ( 6.579 6.316 -7.220) 11.632 2.554 ( -7.367 -4.627 -2.024) 8.932 2.664 ( 2.275 0.277 -0.993) 2.497 2.749 ( -4.835 0.009 -0.864) 4.911 2.815 ( 2.391 0.665 1.231) 2.771 2.975 ( -2.163 -5.561 0.443) 5.983 3.023 ( 0.461 -5.683 -3.091) 6.485 3.263 ( 0.077 3.324 5.489) 6.417 3.301 ( 0.422 3.957 -1.031) 4.111 3.565 ( -3.953 0.498 1.442) 4.237 3.623 ( -0.591 1.361 -0.810) 1.691 3.740 ( -4.466 2.188 2.135) 5.412 3.752 ( -3.835 2.871 -1.676) 5.075 3.786 ( 0.376 4.807 4.154) 6.364 3.881 ( 3.603 -1.157 -2.895) 4.764 3.935 ( -2.204 5.171 0.998) 5.709 4.011 ( 0.263 5.952 -8.869) 10.684 4.089 ( -2.742 3.308 -4.134) 5.963 4.218 ( 9.144 6.264 0.888) 11.120 4.372 ( -10.181 1.301 -3.430) 10.822 4.561 ( 10.475 8.201 -0.366) 13.309 4.704 ( -6.786 6.898 3.337) 10.236 4.725 ( -0.903 3.969 4.170) 5.827 4.848 ( -0.033 -0.147 -3.617) 3.620 4.883 ( 7.490 5.023 -4.154) 9.929 5.025 ( -7.367 -0.462 -2.352) 7.747 5.115 ( 5.981 1.314 3.466) 7.036 5.234 ( -4.613 4.365 6.743) 9.263 5.294 ( 1.931 3.869 8.727) 9.739 5.372 ( 2.204 6.640 -5.315) 8.786 5.389 ( 1.118 0.179 -8.236) 8.314 5.493 ( -2.230 -0.430 -0.370) 2.301 5.533 ( -0.306 -0.439 2.535) 2.591 5.552 ( -2.920 0.661 2.765) 4.075 5.697 ( 6.505 -0.969 -2.995) 7.227 5.779 ( 1.305 -2.057 2.197) 3.280 5.785 ( 0.387 -2.221 -0.704) 2.362 5.833 ( -2.071 -0.310 2.628) 3.360 5.913 ( 2.602 -2.642 -4.245) 5.637 5.951 ( -1.481 3.038 1.376) 3.650 5.993 ( 1.604 1.143 -0.626) 2.066 6.045 ( -3.467 0.874 4.218) 5.529 6.126 ( 1.610 1.236 -1.349) 2.437 6.189 ( -2.735 -4.344 -0.064) 5.134 6.251 ( 2.059 -3.418 -2.357) 4.635 6.358 ( -4.793 -0.840 -0.707) 4.917 6.370 ( -3.668 -1.071 -1.670) 4.171 6.445 ( -0.374 -1.599 -2.155) 2.709 6.489 ( 3.928 -1.764 2.409) 4.934 6.530 ( 0.179 -7.333 -0.544) 7.355 6.563 ( 2.240 -7.639 1.516) 8.104 6.680 ( -2.107 0.802 1.501) 2.708 6.721 ( 1.489 0.245 0.095) 1.512 6.828 ( -5.126 -5.099 1.002) 7.299 6.941 ( 5.316 -5.637 -1.417) 7.877 6.991 ( -5.590 -3.140 4.516) 7.843 7.116 ( 3.994 -0.200 3.125) 5.076 7.182 ( -0.418 -5.155 -1.136) 5.295 7.187 ( -1.478 -6.488 -1.712) 6.871 7.602 ( 0.117 3.899 10.203) 10.923 7.646 ( -1.927 2.850 0.006) 3.440 7.733 ( -3.389 5.313 -0.003) 6.302 7.790 ( -1.314 3.693 -3.727) 5.409 7.920 ( -2.541 -7.791 4.806) 9.501 7.966 ( 0.962 -6.372 2.561) 6.935 8.080 ( 1.638 -2.381 1.768) 3.388 8.121 ( 0.105 1.847 -3.578) 4.029 8.209 ( -1.939 -1.127 -5.888) 6.300 8.232 ( 4.245 3.751 1.629) 5.894 8.360 ( 0.640 -0.843 2.049) 2.306 8.377 ( -0.224 -1.409 -4.117) 4.357 8.562 ( -3.043 3.658 6.254) 7.858 8.623 ( -1.527 4.284 -1.653) 4.840 8.744 ( 0.008 4.823 4.372) 6.510 8.823 ( 1.242 4.454 -9.979) 10.998 8.965 ( -2.735 3.415 0.646) 4.422 9.008 ( 0.143 2.288 -0.661) 2.386 9.130 ( -1.173 4.565 0.724) 4.768 9.149 ( 0.219 2.628 -0.904) 2.787 9.270 ( -2.839 -8.510 8.803) 12.569 9.368 ( -0.313 -8.487 -2.124) 8.755 9.493 ( -0.845 -1.928 4.063) 4.576 9.579 ( -1.072 -3.802 -9.682) 10.457 10.008 ( -0.385 -0.299 1.904) 1.965 10.042 ( 0.355 -1.801 -3.324) 3.797 10.350 ( -1.508 3.183 2.579) 4.366 10.395 ( -1.098 1.380 -5.739) 6.004 10.847 ( -6.631 0.714 0.074) 6.669 10.919 ( -1.375 -1.596 -3.910) 4.442 11.178 ( -10.390 2.724 -0.060) 10.742 11.379 ( 14.333 -5.269 4.459) 15.909 16.548 ( -4.753 0.517 -0.134) 4.783 16.557 ( -4.431 0.081 -0.461) 4.456 16.665 ( 3.971 -0.689 0.524) 4.064 16.670 ( 4.532 -0.775 -0.007) 4.598 17.477 ( -2.170 -0.898 -0.152) 2.353 17.520 ( -0.555 -2.095 -0.260) 2.183 17.524 ( 1.426 -1.866 -0.519) 2.405 17.554 ( 2.561 -3.349 0.945) 4.321 17.686 ( -1.262 0.016 -0.226) 1.283 17.702 ( -0.374 -0.628 -0.898) 1.158 17.710 ( 1.924 0.477 1.142) 2.287 17.736 ( 2.592 -1.120 -0.395) 2.851 18.748 ( -0.382 11.849 0.309) 11.859 18.770 ( 1.923 12.328 0.030) 12.477 19.130 ( -0.381 -6.901 0.228) 6.915 19.157 ( 2.628 -6.657 0.111) 7.158 21.329 ( -1.408 0.288 -0.478) 1.514 21.342 ( 0.840 -0.244 0.762) 1.160 21.436 ( 0.083 -0.760 0.751) 1.072 21.443 ( -0.205 -1.294 -1.020) 1.660 21.992 ( -0.745 1.455 0.212) 1.648 22.004 ( 0.281 1.364 -0.407) 1.450 22.085 ( -0.938 -1.029 0.613) 1.521 22.101 ( 0.553 -1.205 0.142) 1.333 26.992 ( -0.514 1.284 -0.252) 1.405 27.000 ( 0.678 1.154 0.276) 1.367 27.091 ( -0.018 -1.851 0.340) 1.883 27.097 ( 0.211 -1.813 -0.415) 1.872 27.677 ( -0.963 1.153 0.504) 1.584 27.703 ( 1.405 1.269 -0.464) 1.949 27.723 ( -0.928 -0.647 0.649) 1.304 27.749 ( 1.286 -0.654 -0.633) 1.575 35.652 ( 0.001 3.410 0.771) 3.496 35.683 ( 1.884 2.843 -2.322) 4.126 35.780 ( -2.073 0.737 -2.528) 3.351 35.825 ( 4.467 -0.370 0.298) 4.492 36.236 ( 1.547 2.624 1.149) 3.256 36.252 ( 2.718 4.488 0.449) 5.266 36.440 ( -4.961 -5.741 3.423) 8.324 36.580 ( 7.535 -7.456 -2.665) 10.930 37.441 ( -3.688 12.706 2.726) 13.508 37.469 ( -3.197 13.835 -2.242) 14.375 38.157 ( -5.550 -21.305 6.982) 23.096 38.254 ( -2.664 -23.724 -7.844) 25.129 40.052 ( -14.506 7.427 -0.589) 16.308 40.191 ( -9.963 0.741 1.841) 10.159 40.365 ( 11.565 8.602 -0.333) 14.417 40.520 ( 16.355 0.749 -0.621) 16.384 ======================= Grid point 150 (81/92) ======================= q-point: (-0.33 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( -9.587 2.369 8.006) 12.713 1.820 ( -1.369 2.303 1.853) 3.258 1.871 ( -1.897 0.871 2.407) 3.186 1.965 ( -0.477 -5.690 1.563) 5.919 2.134 ( -7.803 3.462 5.891) 10.372 2.302 ( -14.293 -2.215 -0.187) 14.465 2.509 ( 5.886 8.567 -7.302) 12.703 2.588 ( -9.323 -0.639 -0.492) 9.358 2.709 ( -1.258 -0.906 2.006) 2.536 2.800 ( -2.360 -7.474 1.795) 8.041 2.998 ( -3.065 1.136 9.132) 9.699 3.053 ( 0.573 -8.995 3.669) 9.732 3.231 ( -3.075 -1.314 -3.098) 4.559 3.307 ( -7.689 24.606 3.072) 25.962 3.460 ( -7.477 -5.554 -0.213) 9.317 3.538 ( -6.718 7.007 -3.701) 10.389 3.688 ( -7.055 0.734 2.317) 7.462 3.746 ( -0.259 3.678 3.928) 5.388 3.782 ( 2.776 1.299 -6.194) 6.911 3.825 ( 4.199 4.210 -0.903) 6.014 3.932 ( 3.085 -1.241 -3.104) 4.549 3.985 ( -1.246 2.091 2.014) 3.159 4.120 ( 7.271 -0.298 -2.651) 7.745 4.248 ( -0.422 3.140 0.693) 3.243 4.342 ( 3.263 5.011 0.632) 6.013 4.572 ( -8.775 5.129 -1.380) 10.257 4.589 ( -5.750 2.857 0.152) 6.422 4.717 ( -0.090 0.921 -3.379) 3.503 4.838 ( -0.086 4.402 -3.280) 5.490 4.961 ( 2.815 4.675 5.749) 7.927 5.003 ( 6.763 1.960 -0.374) 7.051 5.162 ( -3.100 3.255 1.146) 4.639 5.273 ( -1.132 0.905 -2.376) 2.783 5.318 ( 3.289 -0.058 0.574) 3.339 5.342 ( 1.057 5.708 -5.139) 7.753 5.437 ( 2.190 2.729 2.347) 4.214 5.459 ( 1.468 -3.000 -0.467) 3.373 5.517 ( -1.714 4.423 4.271) 6.383 5.590 ( 0.701 -0.881 1.670) 2.014 5.705 ( -1.343 -2.933 -3.065) 4.450 5.761 ( -1.010 -2.509 -5.833) 6.430 5.801 ( -0.476 0.416 -2.113) 2.206 5.851 ( -1.729 0.430 1.521) 2.343 5.873 ( -1.009 -1.433 -0.499) 1.822 5.973 ( -0.325 1.662 1.976) 2.603 6.019 ( 0.154 2.019 3.053) 3.664 6.048 ( -0.854 -0.069 3.289) 3.399 6.112 ( -1.470 -1.952 -3.255) 4.070 6.181 ( 0.205 -2.772 3.503) 4.472 6.231 ( -1.214 -1.073 -1.616) 2.288 6.283 ( 1.199 -0.934 -1.066) 1.856 6.351 ( 5.205 0.976 -1.356) 5.467 6.369 ( -4.722 -3.441 -2.954) 6.547 6.490 ( -1.747 -3.330 -0.960) 3.881 6.553 ( -1.283 0.436 0.617) 1.489 6.630 ( 3.221 -9.174 -0.429) 9.733 6.694 ( 1.608 -2.662 1.526) 3.464 6.747 ( -0.991 -4.407 -0.511) 4.546 6.795 ( 0.664 -1.680 5.619) 5.902 6.923 ( -5.689 -0.917 4.126) 7.087 7.003 ( -5.028 -0.627 -9.184) 10.489 7.041 ( 4.667 -5.642 0.536) 7.341 7.181 ( 0.940 -7.965 -2.555) 8.417 7.243 ( 0.078 -6.111 5.497) 8.220 7.447 ( -7.819 5.954 -13.854) 16.986 7.602 ( -6.066 0.970 -5.427) 8.197 7.691 ( -5.259 -0.190 -3.089) 6.102 7.725 ( -1.559 6.412 2.513) 7.061 7.841 ( -6.422 -4.801 -1.960) 8.254 7.974 ( -0.355 0.129 -3.145) 3.168 8.045 ( -2.673 -1.174 -6.428) 7.060 8.136 ( -0.425 4.671 7.398) 8.760 8.214 ( 3.152 -5.081 -1.240) 6.107 8.286 ( -0.476 0.161 0.547) 0.743 8.377 ( 0.759 -0.717 2.588) 2.791 8.394 ( 2.936 0.625 2.707) 4.042 8.555 ( -3.780 2.847 5.210) 7.039 8.590 ( -1.457 4.461 -0.453) 4.715 8.780 ( -0.093 2.679 1.180) 2.929 8.787 ( 0.931 4.212 -5.015) 6.616 8.846 ( -4.754 3.319 2.662) 6.380 9.082 ( -0.722 -1.781 4.527) 4.918 9.128 ( -0.746 0.585 -2.157) 2.356 9.164 ( 2.673 9.134 6.199) 11.358 9.230 ( -4.294 -6.986 -1.643) 8.363 9.370 ( -1.004 -5.006 2.240) 5.575 9.483 ( -2.121 -1.543 -4.025) 4.804 9.552 ( 0.895 -7.316 10.183) 12.571 10.002 ( -0.753 -0.787 -0.251) 1.118 10.037 ( -0.018 -2.044 0.846) 2.212 10.275 ( -3.911 2.772 -4.389) 6.499 10.333 ( -4.258 0.409 1.157) 4.431 10.689 ( -10.652 -0.160 -1.237) 10.724 10.743 ( -10.783 -3.391 -4.702) 12.243 11.098 ( -2.893 12.876 0.873) 13.226 11.643 ( 11.214 -12.108 1.691) 16.589 16.461 ( -4.731 0.426 -0.028) 4.750 16.477 ( -4.387 -0.350 0.321) 4.413 16.744 ( 3.938 -0.645 0.774) 4.065 16.748 ( 4.048 -0.639 0.013) 4.099 17.450 ( -0.583 -0.391 -0.040) 0.703 17.490 ( -0.469 -2.127 -0.713) 2.292 17.581 ( 1.992 -0.640 1.085) 2.357 17.596 ( 1.407 -2.581 0.780) 3.041 17.672 ( 0.688 -0.109 -0.822) 1.077 17.694 ( 1.945 -1.352 -1.966) 3.078 17.765 ( 2.474 0.125 0.966) 2.658 17.784 ( 2.895 -1.271 0.037) 3.162 18.755 ( 1.231 11.842 -0.154) 11.906 18.810 ( 3.075 13.554 -0.711) 13.917 19.142 ( 1.579 -7.222 0.094) 7.393 19.219 ( 4.482 -6.616 -0.303) 7.997 21.301 ( -1.428 0.658 -0.237) 1.590 21.355 ( -0.316 -1.898 0.302) 1.948 21.425 ( -0.270 -0.287 -1.035) 1.108 21.440 ( -0.389 -0.697 0.351) 0.872 21.978 ( -1.035 1.258 0.229) 1.645 21.998 ( -0.459 1.100 -0.521) 1.301 22.068 ( -0.854 -0.224 -0.289) 0.929 22.116 ( 0.294 -1.897 0.638) 2.023 26.980 ( -0.391 1.539 -0.370) 1.631 27.022 ( 1.152 1.113 0.782) 1.782 27.077 ( -0.460 -1.785 -1.138) 2.166 27.110 ( 0.613 -1.826 0.493) 1.988 27.676 ( -0.033 1.102 1.015) 1.498 27.708 ( -0.436 0.411 -0.084) 0.605 27.736 ( 2.067 0.314 0.200) 2.101 27.771 ( 1.470 -0.453 0.061) 1.540 35.687 ( 1.336 3.017 2.291) 4.017 35.706 ( 1.977 1.919 0.517) 2.803 35.776 ( 3.814 4.133 0.623) 5.659 35.913 ( 4.960 -2.305 0.544) 5.497 36.229 ( 2.345 6.553 -4.350) 8.207 36.373 ( 6.461 -1.181 2.031) 6.875 36.408 ( -2.017 -1.949 3.013) 4.117 36.681 ( 8.088 -8.618 -5.213) 12.918 37.303 ( -10.196 10.635 -1.760) 14.838 37.414 ( -6.503 13.397 4.426) 15.535 38.050 ( -13.334 -25.575 -3.321) 29.032 38.097 ( -9.316 -19.036 5.123) 21.804 39.817 ( -11.841 6.538 0.096) 13.527 39.976 ( -13.240 -1.781 1.300) 13.423 40.640 ( 17.700 10.644 -2.081) 20.759 40.787 ( 16.792 3.040 -3.381) 17.397 ======================= Grid point 151 (82/92) ======================= q-point: (-0.22 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -10.171 6.721 11.206) 16.558 1.744 ( -15.719 5.190 3.328) 16.885 1.859 ( -0.624 2.710 4.016) 4.885 1.977 ( 1.026 -2.234 4.592) 5.208 2.076 ( -6.444 3.255 9.063) 11.586 2.098 ( -6.307 -4.872 -0.610) 7.993 2.356 ( -18.190 -4.546 2.994) 18.987 2.525 ( -2.141 1.175 -0.462) 2.485 2.631 ( -5.794 6.954 -2.851) 9.490 2.838 ( 0.823 -0.902 7.015) 7.121 2.926 ( -9.879 -1.348 2.936) 10.394 3.047 ( -6.660 -0.090 2.386) 7.075 3.100 ( -10.475 22.805 -0.227) 25.097 3.270 ( 3.776 -0.219 5.029) 6.293 3.299 ( -9.568 -1.250 1.425) 9.754 3.402 ( -9.452 5.554 1.107) 11.018 3.546 ( -4.883 -2.786 -6.007) 8.227 3.732 ( -0.281 3.688 -6.362) 7.359 3.845 ( 4.993 2.802 -0.995) 5.811 3.940 ( 4.943 -5.484 -0.191) 7.385 3.984 ( 6.067 -2.113 4.226) 7.690 4.062 ( 6.134 3.024 4.873) 8.397 4.248 ( 5.685 -1.598 1.145) 6.015 4.333 ( 3.145 6.565 6.315) 9.636 4.361 ( 1.598 3.726 -1.151) 4.214 4.454 ( -0.515 3.742 -1.770) 4.172 4.504 ( -1.846 -2.791 -0.684) 3.416 4.660 ( -4.429 -1.177 -1.320) 4.770 4.788 ( -3.910 5.441 2.138) 7.033 4.983 ( -3.761 -2.043 -6.350) 7.657 5.055 ( 1.908 3.810 0.532) 4.294 5.191 ( 4.804 -0.254 -2.738) 5.536 5.255 ( 3.910 7.746 -0.287) 8.682 5.316 ( -3.532 -0.940 -5.187) 6.346 5.350 ( 1.112 5.999 4.538) 7.604 5.406 ( -2.563 3.102 -5.753) 7.021 5.504 ( 0.138 1.566 1.614) 2.253 5.553 ( 2.225 1.652 1.962) 3.395 5.572 ( -4.300 0.951 2.040) 4.853 5.668 ( 0.661 0.841 -1.865) 2.150 5.706 ( -0.251 -0.686 -4.346) 4.407 5.753 ( -1.712 0.137 0.064) 1.718 5.767 ( -3.194 0.607 -1.927) 3.779 5.834 ( -2.227 -1.905 -2.355) 3.759 5.951 ( -4.244 0.184 1.936) 4.669 6.037 ( -1.203 2.432 1.031) 2.902 6.072 ( -0.761 1.246 -1.125) 1.843 6.093 ( 1.595 -7.214 3.626) 8.230 6.183 ( -3.126 -3.548 -3.011) 5.606 6.246 ( 1.555 -0.882 -1.725) 2.484 6.310 ( 2.313 -1.374 -1.406) 3.036 6.315 ( 1.979 -3.476 1.873) 4.417 6.419 ( 1.025 -1.571 -1.828) 2.619 6.499 ( 5.353 0.854 0.219) 5.425 6.521 ( -0.987 -1.553 -0.670) 1.958 6.635 ( 0.527 0.944 -2.480) 2.705 6.706 ( -3.383 -4.263 0.864) 5.510 6.781 ( 5.018 -5.612 1.584) 7.693 6.798 ( -4.660 -2.310 0.371) 5.215 6.887 ( -0.889 -1.356 0.690) 1.762 6.931 ( 0.800 -0.785 2.355) 2.608 7.083 ( -1.612 -4.562 -2.890) 5.636 7.138 ( -4.762 -5.760 -1.975) 7.730 7.195 ( -3.182 4.330 -9.129) 10.593 7.275 ( 2.245 -10.258 -2.822) 10.873 7.413 ( -7.239 -3.744 -7.886) 11.341 7.542 ( -6.668 3.416 -3.696) 8.354 7.642 ( -7.540 -0.459 -3.278) 8.234 7.742 ( -1.252 1.471 -3.080) 3.636 7.849 ( -9.182 -1.094 -5.033) 10.528 7.964 ( -1.160 5.264 -4.879) 7.271 8.167 ( -2.230 2.058 4.717) 5.609 8.236 ( -2.914 -4.839 2.206) 6.064 8.269 ( -1.475 -1.059 1.315) 2.242 8.424 ( 3.069 2.540 3.010) 4.993 8.485 ( 3.029 0.885 0.655) 3.223 8.587 ( 1.290 2.363 0.788) 2.805 8.592 ( 2.397 3.503 8.558) 9.552 8.686 ( -3.216 2.955 -4.305) 6.132 8.817 ( -1.112 -2.582 1.083) 3.013 8.824 ( -3.255 6.984 5.910) 9.711 9.069 ( -2.825 0.158 -1.571) 3.237 9.112 ( -0.160 -2.279 2.108) 3.108 9.137 ( -3.557 -1.814 -2.668) 4.803 9.287 ( 4.956 3.194 3.886) 7.062 9.357 ( -0.569 2.673 -1.035) 2.923 9.428 ( -3.254 -1.495 2.108) 4.156 9.712 ( 2.703 -11.134 13.704) 17.862 9.999 ( -1.165 -1.665 2.806) 3.464 10.037 ( -0.875 -2.609 1.489) 3.129 10.190 ( -2.106 1.990 -1.067) 3.088 10.272 ( -4.535 -1.074 2.532) 5.304 10.487 ( -9.387 1.007 -2.626) 9.800 10.539 ( -8.091 -1.682 -3.335) 8.911 11.028 ( -5.037 16.099 -1.973) 16.984 11.735 ( 1.349 -17.047 -7.310) 18.597 16.394 ( -3.059 0.475 0.132) 3.098 16.416 ( -3.228 -0.529 0.531) 3.314 16.801 ( 2.368 -0.783 -0.323) 2.515 16.805 ( 2.269 -1.056 0.402) 2.534 17.458 ( 0.766 -0.193 0.609) 0.998 17.489 ( 0.719 -1.417 -0.264) 1.611 17.603 ( 0.535 -0.010 0.945) 1.086 17.625 ( 1.340 -0.119 0.758) 1.544 17.702 ( 3.001 -0.686 -0.947) 3.221 17.722 ( 2.754 -1.785 -1.415) 3.574 17.809 ( 1.658 -0.412 0.778) 1.877 17.830 ( 2.361 -1.887 -0.199) 3.029 18.791 ( 3.110 12.128 -0.044) 12.521 18.859 ( 3.748 14.995 -1.474) 15.527 19.185 ( 2.962 -7.487 0.842) 8.096 19.296 ( 4.949 -6.890 -0.972) 8.538 21.276 ( -1.287 0.489 -0.046) 1.377 21.327 ( -2.301 -2.328 -1.078) 3.446 21.421 ( 0.252 0.180 -0.067) 0.316 21.433 ( -0.583 -0.326 0.111) 0.677 21.963 ( -0.991 1.074 0.306) 1.493 21.982 ( -0.761 0.791 -0.548) 1.227 22.053 ( -0.540 0.374 -0.462) 0.803 22.114 ( -0.882 -2.373 -0.305) 2.550 26.973 ( -0.122 1.678 -0.033) 1.683 27.045 ( 0.387 2.016 -0.722) 2.176 27.064 ( 0.502 -2.460 0.264) 2.524 27.126 ( 0.776 -1.615 0.257) 1.810 27.691 ( 0.477 0.677 1.021) 1.315 27.704 ( 0.082 0.296 0.046) 0.311 27.777 ( 2.355 0.695 -0.011) 2.455 27.798 ( 1.340 -0.019 0.442) 1.411 35.724 ( 1.846 4.278 1.653) 4.944 35.780 ( 3.920 1.552 2.044) 4.685 35.922 ( 8.333 2.513 7.890) 11.748 35.993 ( 4.326 -2.005 -0.197) 4.772 36.237 ( 2.715 6.424 -3.114) 7.638 36.426 ( 0.423 2.538 2.781) 3.788 36.493 ( 5.360 -4.282 2.054) 7.161 36.745 ( 5.943 -7.635 -7.523) 12.256 37.092 ( -12.159 6.348 -1.057) 13.757 37.331 ( -7.205 12.225 3.508) 14.618 37.720 ( -19.626 -22.879 -2.040) 30.213 37.993 ( -10.608 -19.495 8.631) 23.813 39.664 ( -7.367 5.262 2.494) 9.390 39.793 ( -9.368 -1.561 1.697) 9.647 40.884 ( 14.311 9.923 -5.677) 18.316 41.022 ( 16.393 5.429 -8.051) 19.053 ======================= Grid point 152 (83/92) ======================= q-point: (-0.11 0.33 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 136 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( -25.729 14.508 9.744) 31.103 1.592 ( -7.433 0.357 0.163) 7.443 1.893 ( 1.366 -1.172 -0.215) 1.813 2.016 ( -9.678 -6.044 0.729) 11.434 2.020 ( -3.568 4.435 0.670) 5.731 2.055 ( 0.256 -2.229 0.577) 2.316 2.164 ( -6.423 8.708 22.881) 25.311 2.448 ( -7.170 -1.164 -0.337) 7.272 2.526 ( -2.495 9.360 -2.401) 9.980 2.822 ( -4.873 4.890 5.893) 9.076 2.872 ( -2.622 5.962 0.503) 6.532 2.922 ( -10.211 6.453 2.268) 12.290 2.995 ( -1.320 7.224 5.471) 9.158 3.188 ( -5.374 -2.048 1.449) 5.930 3.289 ( -6.309 6.710 7.775) 12.053 3.327 ( -5.363 0.311 4.676) 7.122 3.475 ( 4.711 -1.868 -4.787) 6.971 3.673 ( 0.156 -2.966 -5.185) 5.975 3.915 ( 2.804 0.377 -1.075) 3.026 3.988 ( 2.148 -2.246 -0.969) 3.255 4.099 ( 2.674 -0.652 0.600) 2.817 4.175 ( 0.487 5.552 0.245) 5.578 4.283 ( 2.477 2.122 -1.121) 3.449 4.390 ( -0.551 2.423 2.324) 3.402 4.457 ( 7.140 0.445 1.502) 7.310 4.500 ( 6.263 -1.658 1.606) 6.675 4.558 ( 1.013 -6.303 2.049) 6.705 4.608 ( -0.395 -0.142 2.204) 2.244 4.746 ( 0.082 5.020 4.146) 6.511 4.900 ( 0.021 4.210 -6.030) 7.354 5.092 ( 0.880 1.482 -0.219) 1.737 5.137 ( -7.781 2.626 -5.305) 9.776 5.197 ( -1.108 2.687 -1.924) 3.485 5.264 ( -0.352 3.960 -8.379) 9.274 5.331 ( 2.405 2.983 -0.453) 3.858 5.432 ( -2.574 6.724 4.089) 8.280 5.482 ( 0.847 3.130 -0.781) 3.336 5.545 ( -3.729 -0.081 -0.625) 3.782 5.569 ( -3.134 2.877 4.129) 5.928 5.652 ( 0.035 4.554 -0.514) 4.583 5.685 ( -0.246 1.603 2.856) 3.284 5.719 ( 0.295 -2.292 -1.802) 2.930 5.772 ( 1.012 -3.636 -4.690) 6.020 5.823 ( 4.772 -2.353 -1.549) 5.542 5.893 ( -1.076 1.268 0.040) 1.663 5.995 ( -2.758 -1.380 -1.595) 3.473 6.064 ( -4.074 -6.149 -1.717) 7.573 6.081 ( 1.573 1.719 1.054) 2.557 6.158 ( 1.615 -7.168 1.646) 7.530 6.245 ( 2.238 -5.688 -2.726) 6.693 6.328 ( 1.005 -0.412 2.533) 2.756 6.384 ( 0.798 -4.215 -1.417) 4.518 6.440 ( 2.622 0.416 -0.441) 2.691 6.479 ( -1.847 -1.905 -6.926) 7.417 6.526 ( -2.444 1.491 4.316) 5.179 6.575 ( -4.096 0.757 -4.332) 6.009 6.701 ( -1.293 -1.319 0.525) 1.921 6.757 ( 0.309 0.426 -0.690) 0.867 6.821 ( -1.864 3.184 -3.537) 5.111 6.935 ( 0.955 -2.458 2.553) 3.670 6.939 ( 5.784 -5.194 -0.139) 7.774 6.949 ( -2.736 -1.338 -5.876) 6.619 7.067 ( -3.590 -5.208 2.107) 6.667 7.145 ( -2.223 -8.235 -3.349) 9.164 7.206 ( 0.247 -6.992 -7.217) 10.052 7.331 ( 0.232 -2.100 -1.436) 2.555 7.416 ( -5.273 2.497 -1.291) 5.975 7.474 ( -7.400 -0.203 -8.103) 10.975 7.668 ( -3.633 2.744 -0.943) 4.649 7.729 ( 0.103 -0.514 1.665) 1.745 7.894 ( -2.438 4.464 -2.567) 5.697 8.132 ( -6.616 -2.940 -1.343) 7.364 8.190 ( -0.654 -0.939 2.637) 2.875 8.268 ( -1.521 -2.831 3.184) 4.524 8.481 ( 2.607 5.001 -2.041) 5.997 8.570 ( -0.407 7.147 4.387) 8.396 8.588 ( 2.785 -0.912 -0.833) 3.047 8.665 ( 4.528 1.974 -1.189) 5.081 8.722 ( -0.199 4.451 6.407) 7.804 8.794 ( -3.757 1.859 8.614) 9.580 8.832 ( 1.033 -2.706 -1.324) 3.184 9.005 ( -2.132 -0.527 -1.914) 2.913 9.049 ( -3.179 1.808 -2.582) 4.477 9.128 ( -0.896 -4.485 2.260) 5.101 9.330 ( 0.349 4.178 -1.434) 4.431 9.398 ( -1.420 -0.711 3.412) 3.764 9.430 ( 5.857 1.458 1.876) 6.320 9.789 ( -6.604 -11.471 5.570) 14.360 9.980 ( -1.553 1.190 3.066) 3.637 10.082 ( -0.794 -1.717 5.983) 6.275 10.202 ( -0.088 -1.301 4.271) 4.466 10.245 ( -0.307 -2.112 3.189) 3.838 10.362 ( -2.692 2.756 0.063) 3.853 10.433 ( 0.127 -0.570 -2.041) 2.123 10.905 ( -5.067 14.270 -3.667) 15.581 11.548 ( -8.536 -15.224 -17.368) 24.623 16.360 ( -1.185 0.326 0.203) 1.246 16.375 ( -1.955 -0.412 0.337) 2.027 16.824 ( 0.948 -0.781 -0.453) 1.309 16.830 ( 0.653 -1.043 -0.152) 1.240 17.470 ( 0.267 -0.709 0.259) 0.801 17.498 ( 0.212 -1.836 -0.265) 1.867 17.636 ( 1.629 1.433 1.437) 2.602 17.659 ( 1.396 0.471 0.840) 1.696 17.735 ( 1.843 -0.935 -1.027) 2.308 17.750 ( 1.761 -1.512 -1.348) 2.684 17.837 ( 0.621 -0.928 1.084) 1.556 17.858 ( 1.373 -2.342 -0.555) 2.771 18.850 ( 3.104 12.558 0.331) 12.940 18.904 ( 3.077 15.604 -2.130) 16.046 19.254 ( 3.186 -7.902 1.990) 8.749 19.356 ( 3.041 -7.320 -1.716) 8.110 21.256 ( -0.942 0.245 -0.037) 0.974 21.276 ( -2.172 -0.698 -0.629) 2.366 21.421 ( -0.239 -0.002 0.009) 0.240 21.427 ( -0.176 -0.262 -0.026) 0.317 21.952 ( -0.665 0.987 0.389) 1.252 21.966 ( -0.385 0.685 -0.540) 0.953 22.042 ( -0.060 0.314 -0.540) 0.627 22.081 ( -2.040 -1.526 -0.865) 2.691 26.975 ( 0.122 1.623 0.349) 1.664 27.026 ( -0.536 0.769 -1.615) 1.867 27.094 ( 1.316 -0.907 1.180) 1.987 27.139 ( 0.575 -1.423 -0.138) 1.541 27.705 ( 0.380 0.349 0.497) 0.717 27.710 ( 0.189 0.264 0.417) 0.528 27.810 ( 1.575 0.721 -0.420) 1.783 27.819 ( 0.532 0.305 0.321) 0.692 35.776 ( 2.083 4.160 1.508) 4.890 35.850 ( 2.416 0.315 -0.017) 2.436 36.052 ( 3.023 2.939 2.615) 4.961 36.182 ( 10.957 6.432 1.233) 12.765 36.277 ( 2.256 -1.729 6.536) 7.128 36.441 ( -0.908 4.262 0.821) 4.435 36.615 ( 4.763 -5.446 6.507) 9.731 36.743 ( 2.052 -3.277 -6.518) 7.578 36.889 ( -10.798 -1.406 -0.025) 10.889 37.190 ( -8.108 0.062 -8.164) 11.507 37.498 ( -7.791 -11.280 13.379) 19.156 37.893 ( -8.958 -19.712 5.443) 22.326 39.608 ( -3.118 3.924 4.368) 6.648 39.692 ( -4.612 -0.591 1.974) 5.052 41.018 ( 8.068 9.696 -6.317) 14.107 41.161 ( 10.526 5.974 -13.367) 18.032 ======================= Grid point 153 (84/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.335 ( 0.302 -7.700 1.843) 7.924 1.335 ( 0.302 7.700 1.843) 7.924 1.888 ( 1.262 -1.090 -1.642) 2.340 1.888 ( 1.262 1.090 -1.642) 2.340 2.068 ( -0.605 -0.438 -0.161) 0.764 2.068 ( -0.605 0.438 -0.161) 0.764 2.301 ( -3.013 -3.658 3.621) 5.964 2.301 ( -3.013 3.658 3.621) 5.964 2.813 ( 1.701 -12.216 21.211) 24.536 2.813 ( 1.701 12.216 21.211) 24.536 2.989 ( 1.487 -6.042 0.310) 6.229 2.989 ( 1.487 6.042 0.310) 6.229 3.047 ( -4.845 -9.064 2.276) 10.526 3.047 ( -4.845 9.064 2.276) 10.526 3.270 ( 4.226 -15.310 -14.455) 21.476 3.270 ( 4.226 15.310 -14.455) 21.476 3.600 ( 0.833 -4.313 -1.925) 4.796 3.600 ( 0.833 4.313 -1.925) 4.796 4.000 ( 2.210 -2.245 2.842) 4.243 4.000 ( 2.210 2.245 2.842) 4.243 4.106 ( -3.502 -4.278 -2.427) 6.037 4.106 ( -3.502 4.278 -2.427) 6.037 4.415 ( 0.289 -3.569 0.348) 3.598 4.415 ( 0.289 3.569 0.348) 3.598 4.482 ( 0.299 -2.540 0.401) 2.588 4.482 ( 0.299 2.540 0.401) 2.588 4.664 ( 2.390 -0.777 3.821) 4.573 4.664 ( 2.390 0.777 3.821) 4.573 4.948 ( -1.506 -2.141 1.692) 3.117 4.948 ( -1.506 2.141 1.692) 3.117 5.017 ( -0.510 -2.884 2.603) 3.918 5.017 ( -0.510 2.884 2.603) 3.918 5.212 ( 0.169 -1.908 -4.725) 5.099 5.212 ( 0.169 1.908 -4.725) 5.099 5.414 ( -4.910 -3.834 -1.559) 6.422 5.414 ( -4.910 3.834 -1.559) 6.422 5.459 ( 2.166 -3.516 -2.773) 4.974 5.459 ( 2.166 3.516 -2.773) 4.974 5.662 ( 1.216 -2.047 -1.598) 2.867 5.662 ( 1.216 2.047 -1.598) 2.867 5.737 ( 1.304 -2.113 6.919) 7.351 5.737 ( 1.304 2.113 6.919) 7.351 5.846 ( -0.221 -3.891 0.359) 3.914 5.846 ( -0.221 3.891 0.359) 3.914 5.929 ( 3.645 -3.153 -3.752) 6.108 5.929 ( 3.645 3.153 -3.752) 6.108 6.004 ( 0.602 -6.298 -1.089) 6.420 6.004 ( 0.602 6.298 -1.089) 6.420 6.149 ( -1.968 -11.403 -2.096) 11.760 6.149 ( -1.968 11.403 -2.096) 11.760 6.273 ( -1.749 -4.463 -2.301) 5.317 6.273 ( -1.749 4.463 -2.301) 5.317 6.437 ( 2.129 -1.096 1.128) 2.647 6.437 ( 2.129 1.096 1.128) 2.647 6.483 ( -3.989 -0.632 -1.225) 4.220 6.483 ( -3.989 0.632 -1.225) 4.220 6.691 ( 0.865 -2.327 0.786) 2.604 6.691 ( 0.865 2.327 0.786) 2.604 6.799 ( -2.512 -1.125 -0.608) 2.818 6.799 ( -2.512 1.125 -0.608) 2.818 6.954 ( -2.156 -2.114 2.360) 3.832 6.954 ( -2.156 2.114 2.360) 3.832 7.058 ( 6.054 -1.683 -7.362) 9.679 7.058 ( 6.054 1.683 -7.362) 9.679 7.263 ( 2.824 -3.416 -1.136) 4.576 7.263 ( 2.824 3.416 -1.136) 4.576 7.310 ( -4.330 -3.508 -2.324) 6.038 7.310 ( -4.330 3.508 -2.324) 6.038 7.752 ( 3.199 -1.499 1.933) 4.027 7.752 ( 3.199 1.499 1.933) 4.027 7.908 ( -3.294 -3.356 -2.735) 5.440 7.908 ( -3.294 3.356 -2.735) 5.440 8.239 ( -0.301 -1.751 4.133) 4.498 8.239 ( -0.301 1.751 4.133) 4.498 8.543 ( -0.155 -0.656 -2.568) 2.655 8.543 ( -0.155 0.656 -2.568) 2.655 8.738 ( 0.867 -2.252 0.810) 2.546 8.738 ( 0.867 2.252 0.810) 2.546 8.761 ( -0.947 -1.217 2.031) 2.550 8.761 ( -0.947 1.217 2.031) 2.550 8.964 ( 1.720 -4.658 4.830) 6.927 8.964 ( 1.720 4.658 4.830) 6.927 9.036 ( -1.581 -2.554 -0.648) 3.073 9.036 ( -1.581 2.554 -0.648) 3.073 9.435 ( -1.001 -3.869 -0.001) 3.997 9.435 ( -1.001 3.869 -0.001) 3.997 9.499 ( 0.227 -3.031 1.241) 3.283 9.499 ( 0.227 3.031 1.241) 3.283 10.069 ( -0.318 -1.465 4.097) 4.363 10.069 ( -0.318 1.465 4.097) 4.363 10.238 ( 1.100 -1.386 0.468) 1.830 10.238 ( 1.100 1.386 0.468) 1.830 10.455 ( 3.873 -3.556 3.758) 6.463 10.455 ( 3.873 3.556 3.758) 6.463 11.019 ( -3.154 -9.509 -10.861) 14.776 11.019 ( -3.154 9.509 -10.861) 14.776 16.356 ( -0.008 -0.024 0.200) 0.202 16.356 ( -0.008 0.024 0.200) 0.202 16.821 ( -0.113 -0.050 -0.172) 0.212 16.821 ( -0.113 0.050 -0.172) 0.212 17.473 ( -0.118 -0.387 0.166) 0.437 17.473 ( -0.118 0.387 0.166) 0.437 17.680 ( -0.671 -0.372 1.270) 1.484 17.680 ( -0.671 0.372 1.270) 1.484 17.738 ( 0.995 -0.121 -1.628) 1.912 17.738 ( 0.995 0.121 -1.628) 1.912 17.841 ( -0.151 -0.485 0.234) 0.559 17.841 ( -0.151 0.485 0.234) 0.559 19.126 ( 0.631 -10.558 2.150) 10.793 19.126 ( 0.631 10.558 2.150) 10.793 19.172 ( -0.546 -11.113 -2.616) 11.430 19.172 ( -0.546 11.113 -2.616) 11.430 21.252 ( -0.023 -0.113 -0.012) 0.116 21.252 ( -0.023 0.113 -0.012) 0.116 21.420 ( 0.026 -0.058 -0.063) 0.089 21.420 ( 0.026 0.058 -0.063) 0.089 21.963 ( 0.009 -0.346 0.081) 0.356 21.963 ( 0.009 0.346 0.081) 0.356 22.042 ( -0.153 -0.115 -0.327) 0.379 22.042 ( -0.153 0.115 -0.327) 0.379 27.008 ( -0.021 -0.718 -0.149) 0.734 27.008 ( -0.021 0.718 -0.149) 0.734 27.116 ( 0.019 -0.594 0.027) 0.595 27.116 ( 0.019 0.594 0.027) 0.595 27.716 ( -0.143 -0.088 0.424) 0.456 27.716 ( -0.143 0.088 0.424) 0.456 27.827 ( -0.112 -0.118 -0.043) 0.168 27.827 ( -0.112 0.118 -0.043) 0.168 35.842 ( -0.398 -0.916 -0.467) 1.103 35.842 ( -0.398 0.916 -0.467) 1.103 36.285 ( 0.114 -6.313 6.433) 9.014 36.285 ( 0.114 6.313 6.433) 9.014 36.448 ( 1.661 -4.620 -2.995) 5.751 36.448 ( 1.661 4.620 -2.995) 5.751 36.678 ( 5.650 -3.376 6.440) 9.209 36.678 ( 5.650 3.376 6.440) 9.209 36.806 ( -6.970 -7.813 -6.466) 12.305 36.806 ( -6.970 7.813 -6.466) 12.305 37.564 ( 0.431 -5.310 3.256) 6.244 37.564 ( 0.431 5.310 3.256) 6.244 39.662 ( 0.010 -0.870 2.478) 2.626 39.662 ( 0.010 0.870 2.478) 2.626 41.167 ( 0.255 -2.672 -6.443) 6.979 41.167 ( 0.255 2.672 -6.443) 6.979 ======================= Grid point 155 (85/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.545 ( 18.971 -0.939 0.407) 18.999 1.545 ( 18.971 0.939 0.407) 18.999 1.909 ( 4.087 -6.659 -2.934) 8.346 1.909 ( 4.087 6.659 -2.934) 8.346 2.034 ( -2.829 -0.961 0.701) 3.069 2.034 ( -2.829 0.961 0.701) 3.069 2.384 ( 6.988 -6.246 5.325) 10.780 2.384 ( 6.988 6.246 5.325) 10.780 2.936 ( 0.012 -7.333 -4.336) 8.519 2.936 ( 0.012 7.333 -4.336) 8.519 3.035 ( -1.291 -10.260 4.910) 11.447 3.035 ( -1.291 10.260 4.910) 11.447 3.070 ( 6.056 -7.812 3.233) 10.400 3.070 ( 6.056 7.812 3.233) 10.400 3.249 ( 8.155 -9.119 -7.629) 14.417 3.249 ( 8.155 9.119 -7.629) 14.417 3.591 ( 0.368 -5.734 -1.774) 6.014 3.591 ( 0.368 5.734 -1.774) 6.014 3.982 ( -2.702 -5.248 -2.481) 6.403 3.982 ( -2.702 5.248 -2.481) 6.403 4.098 ( -0.731 -2.996 4.635) 5.567 4.098 ( -0.731 2.996 4.635) 5.567 4.363 ( -4.926 -7.541 -1.435) 9.121 4.363 ( -4.926 7.541 -1.435) 9.121 4.527 ( 3.004 -4.215 1.411) 5.365 4.527 ( 3.004 4.215 1.411) 5.365 4.617 ( -2.770 -1.353 -2.804) 4.168 4.617 ( -2.770 1.353 -2.804) 4.168 5.012 ( -2.592 -7.698 -0.283) 8.127 5.012 ( -2.592 7.698 -0.283) 8.127 5.066 ( 5.978 -5.958 -1.137) 8.516 5.066 ( 5.978 5.958 -1.137) 8.516 5.152 ( -0.142 -8.475 1.982) 8.705 5.152 ( -0.142 8.475 1.982) 8.705 5.352 ( -2.104 -3.730 3.457) 5.504 5.352 ( -2.104 3.730 3.457) 5.504 5.495 ( 1.031 -5.429 0.956) 5.608 5.495 ( 1.031 5.429 0.956) 5.608 5.664 ( 0.898 -1.152 -1.704) 2.244 5.664 ( 0.898 1.152 -1.704) 2.244 5.755 ( -0.324 -2.805 -2.063) 3.497 5.755 ( -0.324 2.805 -2.063) 3.497 5.861 ( 1.408 -4.345 1.044) 4.685 5.861 ( 1.408 4.345 1.044) 4.685 5.937 ( 1.707 -12.750 -4.524) 13.636 5.937 ( 1.707 12.750 -4.524) 13.636 5.992 ( 0.939 -6.003 -1.239) 6.201 5.992 ( 0.939 6.003 -1.239) 6.201 6.175 ( 3.195 -8.307 -0.175) 8.901 6.175 ( 3.195 8.307 -0.175) 8.901 6.258 ( -0.249 -5.938 3.693) 6.997 6.258 ( -0.249 5.938 3.693) 6.997 6.391 ( -3.528 -1.647 -0.079) 3.894 6.391 ( -3.528 1.647 -0.079) 3.894 6.543 ( 4.690 -2.480 2.654) 5.932 6.543 ( 4.690 2.480 2.654) 5.932 6.714 ( 1.739 -1.938 1.350) 2.933 6.714 ( 1.739 1.938 1.350) 2.933 6.817 ( 2.351 -5.471 3.514) 6.915 6.817 ( 2.351 5.471 3.514) 6.915 6.894 ( -7.273 -0.936 0.838) 7.380 6.894 ( -7.273 0.936 0.838) 7.380 7.032 ( 0.801 -0.163 -7.391) 7.436 7.032 ( 0.801 0.163 -7.391) 7.436 7.181 ( -2.241 -4.807 -0.308) 5.313 7.181 ( -2.241 4.807 -0.308) 5.313 7.429 ( 8.450 -1.536 2.168) 8.858 7.429 ( 8.450 1.536 2.168) 8.858 7.744 ( -2.021 -2.134 -3.692) 4.719 7.744 ( -2.021 2.134 -3.692) 4.719 7.949 ( 5.835 -5.710 3.876) 9.037 7.949 ( 5.835 5.710 3.876) 9.037 8.261 ( 0.004 -1.945 0.494) 2.007 8.261 ( 0.004 1.945 0.494) 2.007 8.527 ( -0.142 -1.736 -0.167) 1.750 8.527 ( -0.142 1.736 -0.167) 1.750 8.708 ( -2.679 -4.607 0.377) 5.343 8.708 ( -2.679 4.607 0.377) 5.343 8.785 ( 0.369 -2.586 -0.748) 2.717 8.785 ( 0.369 2.586 -0.748) 2.717 9.001 ( 1.760 -4.347 -1.307) 4.868 9.001 ( 1.760 4.347 -1.307) 4.868 9.055 ( 2.372 -2.738 2.085) 4.180 9.055 ( 2.372 2.738 2.085) 4.180 9.352 ( -4.783 -5.273 0.676) 7.151 9.352 ( -4.783 5.273 0.676) 7.151 9.599 ( 5.620 -9.436 0.779) 11.010 9.599 ( 5.620 9.436 0.779) 11.010 10.091 ( -0.100 -2.891 0.712) 2.979 10.091 ( -0.100 2.891 0.712) 2.979 10.260 ( 2.409 -1.595 -1.886) 3.450 10.260 ( 2.409 1.595 -1.886) 3.450 10.488 ( 1.996 -1.489 -7.436) 7.842 10.488 ( 1.996 1.489 -7.436) 7.842 11.023 ( 6.433 -5.736 5.766) 10.369 11.023 ( 6.433 5.736 5.766) 10.369 16.370 ( 1.563 -0.412 0.016) 1.616 16.370 ( 1.563 0.412 0.016) 1.616 16.812 ( -1.006 -0.301 0.202) 1.070 16.812 ( -1.006 0.301 0.202) 1.070 17.472 ( -0.182 -0.437 0.186) 0.509 17.472 ( -0.182 0.437 0.186) 0.509 17.663 ( -2.142 -0.280 1.046) 2.400 17.663 ( -2.142 0.280 1.046) 2.400 17.728 ( -0.599 -0.283 -1.655) 1.782 17.728 ( -0.599 0.283 -1.655) 1.782 17.832 ( -1.177 -0.629 0.286) 1.365 17.832 ( -1.177 0.629 0.286) 1.365 19.110 ( -3.563 -10.651 -2.127) 11.431 19.110 ( -3.563 10.651 -2.127) 11.431 19.130 ( -2.443 -11.123 2.001) 11.562 19.130 ( -2.443 11.123 2.001) 11.562 21.262 ( 1.015 -0.370 0.041) 1.081 21.262 ( 1.015 0.370 0.041) 1.081 21.423 ( 0.342 -0.140 -0.053) 0.373 21.423 ( 0.342 0.140 -0.053) 0.373 21.969 ( 0.625 -0.178 -0.028) 0.651 21.969 ( 0.625 0.178 -0.028) 0.651 22.046 ( 0.603 -1.011 0.268) 1.207 22.046 ( 0.603 1.011 0.268) 1.207 27.007 ( 0.020 -0.687 0.036) 0.689 27.007 ( 0.020 0.687 0.036) 0.689 27.108 ( -0.823 -0.825 -0.037) 1.166 27.108 ( -0.823 0.825 -0.037) 1.166 27.713 ( -0.526 -0.308 0.261) 0.663 27.713 ( -0.526 0.308 0.261) 0.663 27.818 ( -0.986 -0.580 0.159) 1.155 27.818 ( -0.986 0.580 0.159) 1.155 35.822 ( -1.846 -0.549 0.584) 2.012 35.822 ( -1.846 0.549 0.584) 2.012 36.263 ( -5.372 -8.793 -1.086) 10.361 36.263 ( -5.372 8.793 -1.086) 10.361 36.397 ( -4.249 -9.043 -1.077) 10.049 36.397 ( -4.249 9.043 -1.077) 10.049 36.633 ( -5.802 -5.253 -3.216) 8.462 36.633 ( -5.802 5.253 -3.216) 8.462 36.945 ( 15.620 -5.354 4.736) 17.178 36.945 ( 15.620 5.354 4.736) 17.178 37.632 ( 5.720 -9.385 -0.639) 11.010 37.632 ( 5.720 9.385 -0.639) 11.010 39.705 ( 3.675 -0.482 0.023) 3.706 39.705 ( 3.675 0.482 0.023) 3.706 41.070 ( -7.334 -2.269 -0.524) 7.694 41.070 ( -7.334 2.269 -0.524) 7.694 ======================= Grid point 157 (86/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.751 ( 2.591 -5.477 -1.584) 6.262 1.751 ( 2.591 5.477 -1.584) 6.262 1.991 ( -1.422 -1.774 -1.769) 2.881 1.991 ( -1.422 1.774 -1.769) 2.881 2.086 ( 19.537 -10.498 -1.898) 22.260 2.086 ( 19.537 10.498 -1.898) 22.260 2.560 ( 7.216 -5.176 0.810) 8.918 2.560 ( 7.216 5.176 0.810) 8.918 2.872 ( 3.992 -11.590 -9.735) 15.654 2.872 ( 3.992 11.590 -9.735) 15.654 3.010 ( -4.090 -10.111 -1.734) 11.043 3.010 ( -4.090 10.111 -1.734) 11.043 3.217 ( 5.864 -4.382 6.203) 9.595 3.217 ( 5.864 4.382 6.203) 9.595 3.365 ( 9.472 -5.796 -4.715) 12.064 3.365 ( 9.472 5.796 -4.715) 12.064 3.609 ( 2.689 -7.115 2.521) 8.013 3.609 ( 2.689 7.115 2.521) 8.013 3.916 ( -2.272 -6.399 -3.495) 7.637 3.916 ( -2.272 6.399 -3.495) 7.637 4.089 ( -4.627 -5.674 0.573) 7.344 4.089 ( -4.627 5.674 0.573) 7.344 4.280 ( -2.607 -5.535 2.259) 6.522 4.280 ( -2.607 5.535 2.259) 6.522 4.494 ( -2.712 -2.902 -4.651) 6.116 4.494 ( -2.712 2.902 -4.651) 6.116 4.666 ( 7.024 -0.492 -0.700) 7.076 4.666 ( 7.024 0.492 -0.700) 7.076 4.911 ( -6.175 -7.192 -0.304) 9.484 4.911 ( -6.175 7.192 -0.304) 9.484 5.065 ( 1.587 -11.839 -1.281) 12.013 5.065 ( 1.587 11.839 -1.281) 12.013 5.277 ( 2.716 -3.100 3.506) 5.411 5.277 ( 2.716 3.100 3.506) 5.411 5.394 ( 0.913 -7.161 7.111) 10.133 5.394 ( 0.913 7.161 7.111) 10.133 5.480 ( -1.930 -3.487 1.058) 4.124 5.480 ( -1.930 3.487 1.058) 4.124 5.680 ( 2.144 -4.179 -2.376) 5.264 5.680 ( 2.144 4.179 -2.376) 5.264 5.741 ( 2.230 -3.412 -3.313) 5.253 5.741 ( 2.230 3.412 -3.313) 5.253 5.886 ( -2.029 -11.612 -3.859) 12.404 5.886 ( -2.029 11.612 -3.859) 12.404 5.961 ( 7.117 -5.757 2.123) 9.397 5.961 ( 7.117 5.757 2.123) 9.397 6.022 ( 2.768 -4.796 -0.701) 5.582 6.022 ( 2.768 4.796 -0.701) 5.582 6.187 ( -0.602 -3.263 0.547) 3.363 6.187 ( -0.602 3.263 0.547) 3.363 6.271 ( -0.963 -3.148 -1.102) 3.472 6.271 ( -0.963 3.148 -1.102) 3.472 6.366 ( -1.375 -1.557 3.195) 3.811 6.366 ( -1.375 1.557 3.195) 3.811 6.627 ( 2.119 -1.948 1.615) 3.301 6.627 ( 2.119 1.948 1.615) 3.301 6.706 ( -6.468 -0.980 -0.584) 6.567 6.706 ( -6.468 0.980 -0.584) 6.567 6.823 ( 2.944 -5.046 -1.282) 5.982 6.823 ( 2.944 5.046 -1.282) 5.982 6.943 ( 4.469 -6.570 7.231) 10.744 6.943 ( 4.469 6.570 7.231) 10.744 6.999 ( 0.571 -2.982 2.234) 3.769 6.999 ( 0.571 2.982 2.234) 3.769 7.178 ( 0.382 -3.819 1.312) 4.056 7.178 ( 0.382 3.819 1.312) 4.056 7.576 ( 5.531 -1.493 1.769) 5.996 7.576 ( 5.531 1.493 1.769) 5.996 7.713 ( 0.668 -1.026 3.042) 3.279 7.713 ( 0.668 1.026 3.042) 3.279 8.074 ( 4.558 -8.466 0.609) 9.634 8.074 ( 4.558 8.466 0.609) 9.634 8.257 ( 0.132 -1.846 -0.240) 1.867 8.257 ( 0.132 1.846 -0.240) 1.867 8.521 ( -0.426 -3.188 -1.213) 3.437 8.521 ( -0.426 3.188 -1.213) 3.437 8.664 ( -2.372 -4.286 -0.617) 4.937 8.664 ( -2.372 4.286 -0.617) 4.937 8.766 ( 0.880 -2.525 -2.646) 3.762 8.766 ( 0.880 2.525 -2.646) 3.762 9.043 ( 1.284 -1.671 2.766) 3.478 9.043 ( 1.284 1.671 2.766) 3.478 9.111 ( 4.986 -5.152 -3.716) 8.075 9.111 ( 4.986 5.152 -3.716) 8.075 9.320 ( -0.477 -6.272 2.685) 6.839 9.320 ( -0.477 6.272 2.685) 6.839 9.643 ( 0.382 -10.941 -3.940) 11.635 9.643 ( 0.382 10.941 -3.940) 11.635 10.061 ( -1.370 -2.697 -3.463) 4.598 10.061 ( -1.370 2.697 -3.463) 4.598 10.279 ( 3.191 -3.593 -3.325) 5.844 10.279 ( 3.191 3.593 -3.325) 5.844 10.513 ( 8.945 -0.923 -4.427) 10.023 10.513 ( 8.945 0.923 -4.427) 10.023 11.224 ( 5.647 -13.587 9.401) 17.461 11.224 ( 5.647 13.587 9.401) 17.461 16.410 ( 3.224 -0.661 -0.194) 3.297 16.410 ( 3.224 0.661 -0.194) 3.297 16.788 ( -2.161 -0.376 0.375) 2.225 16.788 ( -2.161 0.376 0.375) 2.225 17.469 ( -0.352 -0.586 -0.042) 0.685 17.469 ( -0.352 0.586 -0.042) 0.685 17.636 ( -1.508 -0.504 0.143) 1.596 17.636 ( -1.508 0.504 0.143) 1.596 17.684 ( -2.919 -0.466 -0.887) 3.086 17.684 ( -2.919 0.466 -0.887) 3.086 17.808 ( -1.849 -0.541 0.231) 1.940 17.808 ( -1.849 0.541 0.231) 1.940 19.027 ( -3.730 -10.285 -1.226) 11.009 19.027 ( -3.730 10.285 -1.226) 11.009 19.088 ( -4.166 -11.056 1.693) 11.935 19.088 ( -4.166 11.056 1.693) 11.935 21.286 ( 1.553 -0.706 0.268) 1.727 21.286 ( 1.553 0.706 0.268) 1.727 21.428 ( 0.237 -0.327 -0.108) 0.418 21.428 ( 0.237 0.327 -0.108) 0.418 21.983 ( 1.006 -0.089 -0.080) 1.013 21.983 ( 1.006 0.089 -0.080) 1.013 22.062 ( 0.648 -1.657 0.637) 1.890 22.062 ( 0.648 1.657 0.637) 1.890 27.009 ( 0.014 -1.772 0.198) 1.783 27.009 ( 0.014 1.772 0.198) 1.783 27.091 ( -0.940 -1.888 -0.137) 2.114 27.091 ( -0.940 1.888 -0.137) 2.114 27.706 ( -0.445 -0.247 0.127) 0.524 27.706 ( -0.445 0.247 0.127) 0.524 27.796 ( -1.662 -0.927 -0.075) 1.904 27.796 ( -1.662 0.927 -0.075) 1.904 35.794 ( -1.859 -1.377 0.381) 2.344 35.794 ( -1.859 1.377 0.381) 2.344 36.090 ( -7.774 -3.784 -8.288) 11.977 36.090 ( -7.774 3.784 -8.288) 11.977 36.333 ( -4.891 -8.919 4.107) 10.970 36.333 ( -4.891 8.919 4.107) 10.970 36.524 ( -5.150 -2.558 -0.475) 5.770 36.524 ( -5.150 2.558 -0.475) 5.770 37.272 ( 17.043 -11.252 3.446) 20.711 37.272 ( 17.043 11.252 3.446) 20.711 37.734 ( 8.190 -16.132 -3.867) 18.501 37.734 ( 8.190 16.132 -3.867) 18.501 39.792 ( 7.705 -2.123 -1.755) 8.182 39.792 ( 7.705 2.123 -1.755) 8.182 40.914 ( -12.649 -3.467 3.729) 13.635 40.914 ( -12.649 3.467 3.729) 13.635 ======================= Grid point 159 (87/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.748 ( 0.268 -7.009 -0.652) 7.045 1.748 ( 0.268 7.009 -0.652) 7.045 1.940 ( -0.344 -2.794 -5.058) 5.788 1.940 ( -0.344 2.794 -5.058) 5.788 2.364 ( 13.472 -3.332 -3.627) 14.343 2.364 ( 13.472 3.332 -3.627) 14.343 2.624 ( 4.518 -2.326 -4.632) 6.876 2.624 ( 4.518 2.326 -4.632) 6.876 2.807 ( -8.258 -9.773 -6.004) 14.133 2.807 ( -8.258 9.773 -6.004) 14.133 2.969 ( 4.928 -3.284 -1.716) 6.166 2.969 ( 4.928 3.284 -1.716) 6.166 3.376 ( 5.245 -3.647 1.128) 6.487 3.376 ( 5.245 3.647 1.128) 6.487 3.454 ( 4.590 -4.719 3.296) 7.362 3.454 ( 4.590 4.719 3.296) 7.362 3.744 ( 6.432 -5.184 4.882) 9.596 3.744 ( 6.432 5.184 4.882) 9.596 3.847 ( 0.532 -5.428 -5.140) 7.494 3.847 ( 0.533 5.428 -5.140) 7.494 3.961 ( -5.422 -4.515 -4.003) 8.112 3.961 ( -5.422 4.515 -4.003) 8.112 4.249 ( -3.707 -5.382 -2.414) 6.967 4.249 ( -3.707 5.382 -2.414) 6.967 4.508 ( 5.879 -3.273 3.928) 7.791 4.508 ( 5.879 3.273 3.928) 7.791 4.740 ( 3.449 -1.132 -3.785) 5.244 4.740 ( 3.449 1.132 -3.785) 5.244 4.840 ( -6.050 -6.687 5.928) 10.791 4.840 ( -6.050 6.687 5.928) 10.791 5.091 ( 3.019 -5.769 -3.076) 7.201 5.091 ( 3.019 5.769 -3.076) 7.201 5.315 ( 0.811 -2.199 4.179) 4.791 5.315 ( 0.811 2.199 4.179) 4.791 5.424 ( -1.215 -2.419 1.550) 3.119 5.424 ( -1.215 2.419 1.550) 3.119 5.519 ( -0.628 -1.785 1.774) 2.594 5.519 ( -0.628 1.785 1.774) 2.594 5.662 ( 0.832 -7.080 -3.855) 8.104 5.662 ( 0.832 7.080 -3.855) 8.104 5.759 ( 0.176 -6.735 -1.224) 6.848 5.759 ( 0.176 6.735 -1.224) 6.848 5.842 ( 1.834 -2.295 -0.814) 3.049 5.842 ( 1.834 2.295 -0.814) 3.049 6.017 ( -0.461 -6.577 0.515) 6.613 6.017 ( -0.461 6.577 0.515) 6.613 6.095 ( 3.422 -7.036 0.044) 7.825 6.095 ( 3.422 7.036 0.044) 7.825 6.185 ( -0.946 -4.259 0.751) 4.427 6.185 ( -0.946 4.259 0.751) 4.427 6.272 ( 2.594 -4.376 -0.145) 5.089 6.272 ( 2.594 4.376 -0.145) 5.089 6.353 ( -1.471 -0.888 -0.917) 1.948 6.353 ( -1.471 0.888 -0.917) 1.948 6.589 ( -2.605 -1.586 -2.097) 3.701 6.589 ( -2.605 1.586 -2.097) 3.701 6.679 ( 0.992 -3.038 0.832) 3.302 6.679 ( 0.992 3.038 0.832) 3.302 6.869 ( 1.053 -7.815 4.374) 9.018 6.869 ( 1.053 7.815 4.374) 9.018 6.966 ( -1.370 -5.263 -0.720) 5.486 6.966 ( -1.370 5.263 -0.720) 5.486 7.090 ( 1.677 -4.838 0.343) 5.132 7.090 ( 1.677 4.838 0.343) 5.132 7.291 ( 5.538 -7.435 14.062) 16.843 7.291 ( 5.538 7.435 14.062) 16.843 7.669 ( 2.799 -3.385 5.886) 7.345 7.669 ( 2.799 3.385 5.886) 7.345 7.806 ( 2.521 -4.458 6.446) 8.233 7.806 ( 2.521 4.458 6.446) 8.233 8.096 ( 0.107 -6.415 -2.640) 6.938 8.096 ( 0.107 6.415 -2.640) 6.938 8.269 ( 0.342 -2.162 0.823) 2.339 8.269 ( 0.342 2.162 0.823) 2.339 8.474 ( -1.161 -2.976 -5.845) 6.661 8.474 ( -1.161 2.976 -5.845) 6.661 8.635 ( -0.290 -3.025 -0.115) 3.041 8.635 ( -0.290 3.025 -0.115) 3.041 8.787 ( 2.964 -2.362 -0.604) 3.838 8.787 ( 2.964 2.362 -0.604) 3.838 9.066 ( -1.114 -3.130 1.184) 3.527 9.066 ( -1.114 3.130 1.184) 3.527 9.151 ( 3.361 -3.733 -2.342) 5.542 9.151 ( 3.361 3.733 -2.342) 5.542 9.366 ( 2.159 -8.920 -0.249) 9.181 9.366 ( 2.159 8.920 -0.249) 9.181 9.550 ( -1.568 -10.283 -9.774) 14.274 9.550 ( -1.568 10.283 -9.774) 14.274 10.023 ( 0.039 -1.775 -1.673) 2.440 10.023 ( 0.039 1.775 -1.673) 2.440 10.323 ( 4.518 -4.834 -1.598) 6.806 10.323 ( 4.518 4.834 -1.598) 6.806 10.676 ( 11.694 -1.260 -1.018) 11.805 10.676 ( 11.694 1.260 -1.018) 11.805 11.330 ( -1.795 -13.450 5.136) 14.509 11.330 ( -1.795 13.450 5.136) 14.509 16.475 ( 4.547 -0.519 -0.370) 4.591 16.475 ( 4.547 0.519 -0.370) 4.591 16.741 ( -3.686 -0.269 0.108) 3.697 16.741 ( -3.686 0.269 0.108) 3.697 17.462 ( -0.020 -0.210 -0.319) 0.383 17.462 ( -0.020 0.210 -0.319) 0.383 17.602 ( -2.540 -0.175 -1.918) 3.188 17.602 ( -2.540 0.175 -1.918) 3.188 17.643 ( -0.947 -0.315 1.734) 2.001 17.643 ( -0.947 0.315 1.734) 2.001 17.773 ( -2.229 -0.236 -0.097) 2.243 17.773 ( -2.229 0.236 -0.097) 2.243 18.972 ( -1.826 -10.112 -0.175) 10.277 18.972 ( -1.826 10.112 -0.175) 10.277 19.030 ( -3.905 -10.722 1.348) 11.491 19.030 ( -3.905 10.722 1.348) 11.491 21.315 ( 1.320 -1.257 0.396) 1.865 21.315 ( 1.320 1.257 0.396) 1.865 21.429 ( 0.032 -0.860 -0.116) 0.868 21.429 ( 0.032 0.860 -0.116) 0.868 22.000 ( 1.026 -0.250 -0.024) 1.056 22.000 ( 1.026 0.250 -0.024) 1.056 22.075 ( 0.128 -1.765 0.569) 1.858 22.075 ( 0.128 1.765 0.569) 1.858 27.011 ( -0.045 -2.172 0.217) 2.184 27.011 ( -0.045 2.172 0.217) 2.184 27.077 ( -0.517 -2.236 -0.138) 2.299 27.077 ( -0.517 2.236 -0.138) 2.299 27.703 ( -0.032 -0.352 0.057) 0.358 27.703 ( -0.032 0.352 0.057) 0.358 27.763 ( -1.748 -1.237 -0.510) 2.201 27.763 ( -1.748 1.237 -0.510) 2.201 35.764 ( -1.146 -0.465 -1.622) 2.040 35.764 ( -1.146 0.465 -1.622) 2.040 35.902 ( -5.840 -1.086 -5.277) 7.946 35.902 ( -5.840 1.086 -5.277) 7.946 36.299 ( -3.421 -8.275 3.952) 9.788 36.299 ( -3.421 8.275 3.952) 9.788 36.445 ( -4.371 -2.794 0.953) 5.274 36.445 ( -4.371 2.794 0.953) 5.274 37.557 ( 12.097 -16.807 2.756) 20.891 37.557 ( 12.097 16.807 2.756) 20.891 37.827 ( 7.279 -19.783 -5.269) 21.728 37.827 ( 7.279 19.783 -5.269) 21.728 39.944 ( 11.969 -3.817 -1.426) 12.644 39.944 ( 11.969 3.817 -1.426) 12.644 40.708 ( -15.528 -3.469 4.003) 16.406 40.708 ( -15.528 3.469 4.003) 16.406 ======================= Grid point 161 (88/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.751 ( -0.319 -4.863 0.513) 4.901 1.751 ( -0.319 4.863 0.513) 4.901 1.904 ( 1.221 -2.549 -4.040) 4.931 1.904 ( 1.221 2.549 -4.040) 4.931 2.466 ( 2.084 -3.034 -3.630) 5.169 2.466 ( 2.084 3.034 -3.630) 5.169 2.569 ( -3.716 -5.764 -9.168) 11.449 2.569 ( -3.716 5.764 -9.168) 11.449 2.724 ( 3.902 -4.987 4.135) 7.563 2.724 ( 3.902 4.987 4.135) 7.563 3.002 ( 0.443 -5.689 -5.292) 7.782 3.002 ( 0.443 5.689 -5.292) 7.782 3.378 ( 0.421 -7.956 -3.423) 8.671 3.378 ( 0.421 7.956 -3.423) 8.671 3.572 ( -3.406 -11.523 8.341) 14.627 3.572 ( -3.406 11.523 8.341) 14.627 3.735 ( 2.427 -3.331 -4.612) 6.185 3.735 ( 2.427 3.331 -4.612) 6.185 3.886 ( 0.581 -1.442 -1.870) 2.431 3.886 ( 0.581 1.442 -1.870) 2.431 3.994 ( 5.795 -3.028 3.675) 7.501 3.994 ( 5.795 3.028 3.675) 7.501 4.187 ( 1.150 -6.947 -0.584) 7.066 4.187 ( 1.150 6.947 -0.584) 7.066 4.614 ( -2.721 -2.102 3.811) 5.133 4.614 ( -2.721 2.102 3.811) 5.133 4.744 ( 3.394 -4.400 -3.511) 6.573 4.744 ( 3.394 4.400 -3.511) 6.573 4.819 ( 0.367 -0.836 2.282) 2.458 4.819 ( 0.367 0.836 2.282) 2.458 5.106 ( -0.239 -6.370 -0.046) 6.374 5.106 ( -0.239 6.370 -0.046) 6.374 5.342 ( -2.125 -4.880 0.026) 5.323 5.342 ( -2.125 4.880 0.026) 5.323 5.440 ( 1.532 -4.473 2.880) 5.536 5.440 ( 1.532 4.473 2.880) 5.536 5.483 ( -0.021 -3.048 0.140) 3.052 5.483 ( -0.021 3.048 0.140) 3.052 5.648 ( 0.614 -5.793 -3.902) 7.012 5.648 ( 0.614 5.793 -3.902) 7.012 5.728 ( -2.357 -1.551 -0.669) 2.900 5.728 ( -2.357 1.551 -0.669) 2.900 5.865 ( 0.022 -1.135 -0.765) 1.369 5.865 ( 0.022 1.135 -0.765) 1.369 6.017 ( -1.316 -2.984 2.908) 4.370 6.017 ( -1.316 2.984 2.908) 4.370 6.110 ( 0.037 -4.054 -2.378) 4.700 6.110 ( 0.037 4.054 -2.378) 4.700 6.190 ( 0.994 -5.883 -1.414) 6.131 6.190 ( 0.994 5.883 -1.414) 6.131 6.302 ( 2.871 -1.890 0.897) 3.552 6.302 ( 2.871 1.890 0.897) 3.552 6.364 ( 2.297 -0.331 0.409) 2.357 6.364 ( 2.297 0.331 0.409) 2.357 6.524 ( -3.359 -1.139 -2.155) 4.150 6.524 ( -3.359 1.139 -2.155) 4.150 6.711 ( 2.149 -1.105 -0.697) 2.515 6.711 ( 2.149 1.105 -0.697) 2.515 6.876 ( -4.084 -5.180 0.614) 6.625 6.876 ( -4.084 5.180 0.614) 6.625 6.971 ( 1.678 -2.526 3.284) 4.470 6.971 ( 1.678 2.526 3.284) 4.470 7.117 ( 0.928 -7.336 2.185) 7.711 7.117 ( 0.928 7.336 2.185) 7.711 7.526 ( 4.676 -5.856 14.723) 16.521 7.526 ( 4.676 5.856 14.723) 16.521 7.773 ( 1.175 -4.355 6.939) 8.276 7.773 ( 1.175 4.355 6.939) 8.276 7.874 ( -0.975 -5.298 4.418) 6.967 7.874 ( -0.975 5.298 4.418) 6.967 8.069 ( 1.456 -4.978 -4.274) 6.721 8.069 ( 1.456 4.978 -4.274) 6.721 8.271 ( -0.272 -2.599 -0.384) 2.641 8.271 ( -0.272 2.599 -0.384) 2.641 8.394 ( -0.970 -1.657 -5.930) 6.233 8.394 ( -0.970 1.657 -5.930) 6.233 8.636 ( -1.483 -3.778 2.693) 4.870 8.636 ( -1.483 3.778 2.693) 4.870 8.835 ( 2.973 -4.551 -1.763) 5.715 8.835 ( 2.973 4.551 -1.763) 5.715 9.040 ( -0.888 -3.388 -0.800) 3.592 9.040 ( -0.888 3.388 -0.800) 3.592 9.192 ( 1.007 -2.383 2.413) 3.538 9.192 ( 1.007 2.383 2.413) 3.538 9.291 ( -4.386 -8.585 -8.289) 12.714 9.291 ( -4.386 8.585 -8.289) 12.714 9.509 ( 3.276 -7.765 -5.022) 9.811 9.509 ( 3.276 7.765 -5.022) 9.811 10.019 ( 0.346 -2.162 -0.632) 2.278 10.019 ( 0.346 2.162 -0.632) 2.278 10.387 ( 3.328 -3.949 -0.644) 5.205 10.387 ( 3.328 3.949 -0.644) 5.205 10.856 ( 8.500 -0.642 0.033) 8.525 10.856 ( 8.500 0.642 0.033) 8.525 11.277 ( -6.027 -7.375 1.540) 9.648 11.277 ( -6.027 7.375 1.540) 9.648 16.555 ( 4.867 -0.131 -0.223) 4.874 16.555 ( 4.867 0.131 -0.223) 4.874 16.665 ( -4.752 -0.131 -0.258) 4.761 16.665 ( -4.752 0.131 -0.258) 4.761 17.473 ( 1.571 -0.737 0.116) 1.739 17.473 ( 1.571 0.737 0.116) 1.739 17.535 ( -3.111 -0.790 -1.203) 3.428 17.535 ( -3.111 0.790 -1.203) 3.428 17.668 ( 1.601 -0.409 1.398) 2.164 17.668 ( 1.601 0.409 1.398) 2.164 17.732 ( -2.045 -0.106 -0.615) 2.138 17.732 ( -2.045 0.106 -0.615) 2.138 18.961 ( 0.216 -8.906 0.333) 8.915 18.961 ( 0.216 8.906 0.333) 8.915 18.987 ( -2.142 -9.233 0.878) 9.518 18.987 ( -2.142 9.233 0.878) 9.518 21.334 ( 0.476 -0.965 0.273) 1.110 21.334 ( 0.476 0.965 0.273) 1.110 21.428 ( 0.035 -0.881 -0.056) 0.883 21.428 ( 0.035 0.881 -0.055) 0.883 22.014 ( 0.540 -0.142 0.026) 0.559 22.014 ( 0.540 0.142 0.026) 0.559 22.078 ( -0.198 -1.139 0.354) 1.208 22.078 ( -0.198 1.139 0.354) 1.208 27.012 ( -0.032 -1.414 0.138) 1.421 27.012 ( -0.032 1.414 0.138) 1.421 27.071 ( -0.109 -1.510 -0.078) 1.516 27.071 ( -0.109 1.510 -0.078) 1.516 27.705 ( -0.006 -0.792 0.217) 0.822 27.705 ( -0.006 0.792 0.217) 0.822 27.733 ( -0.798 -1.385 -0.697) 1.743 27.733 ( -0.798 1.385 -0.697) 1.743 35.725 ( -0.804 -0.670 -2.628) 2.828 35.725 ( -0.804 0.670 -2.628) 2.828 35.808 ( -1.440 -2.071 -1.824) 3.113 35.808 ( -1.440 2.071 -1.824) 3.113 36.292 ( -1.771 -6.793 3.761) 7.964 36.292 ( -1.771 6.793 3.761) 7.964 36.400 ( -1.108 -3.174 0.123) 3.364 36.400 ( -1.108 3.174 0.123) 3.364 37.719 ( 3.608 -17.814 2.841) 18.397 37.719 ( 3.608 17.814 2.841) 18.397 37.871 ( 3.166 -19.934 -5.099) 20.818 37.871 ( 3.166 19.934 -5.099) 20.818 40.168 ( 14.135 -4.560 -0.242) 14.854 40.168 ( 14.135 4.560 -0.242) 14.854 40.467 ( -15.081 -3.375 2.114) 15.598 40.467 ( -15.081 3.375 2.114) 15.598 ======================= Grid point 163 (89/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.740 ( -1.820 -5.496 1.092) 5.891 1.740 ( -1.820 5.496 1.092) 5.891 1.886 ( -0.508 -2.025 -2.081) 2.947 1.886 ( -0.508 2.025 -2.081) 2.947 2.369 ( -8.359 -9.353 3.267) 12.962 2.369 ( -8.359 9.353 3.267) 12.962 2.557 ( 7.144 -6.579 -5.806) 11.315 2.557 ( 7.144 6.579 -5.806) 11.315 2.814 ( -3.526 -3.000 0.563) 4.663 2.814 ( -3.526 3.000 0.563) 4.663 2.904 ( -0.507 -2.108 -2.066) 2.995 2.904 ( -0.507 2.108 -2.066) 2.995 3.363 ( -1.450 -3.884 -0.270) 4.155 3.363 ( -1.450 3.884 -0.270) 4.155 3.565 ( 0.995 -3.986 3.555) 5.433 3.565 ( 0.995 3.986 3.555) 5.433 3.770 ( -0.535 -0.842 0.403) 1.076 3.770 ( -0.535 0.842 0.403) 1.076 3.851 ( -2.493 -2.189 -1.836) 3.792 3.851 ( -2.493 2.189 -1.836) 3.792 4.037 ( 0.042 -2.600 0.071) 2.601 4.037 ( 0.042 2.600 0.071) 2.601 4.232 ( 1.514 -5.774 -4.454) 7.448 4.232 ( 1.514 5.774 -4.454) 7.448 4.560 ( -6.120 -14.490 7.871) 17.589 4.560 ( -6.120 14.490 7.871) 17.589 4.748 ( 0.091 -7.861 -7.172) 10.642 4.748 ( 0.091 7.861 -7.172) 10.642 4.857 ( 2.941 -4.609 0.181) 5.471 4.857 ( 2.941 4.609 0.181) 5.471 5.114 ( 2.065 -3.693 1.515) 4.494 5.114 ( 2.065 3.693 1.515) 4.494 5.326 ( -0.591 -2.955 -0.005) 3.013 5.326 ( -0.591 2.955 -0.005) 3.013 5.438 ( -3.180 -8.048 4.685) 9.840 5.438 ( -3.180 8.048 4.685) 9.840 5.515 ( -0.497 -4.792 -1.822) 5.151 5.515 ( -0.497 4.792 -1.822) 5.151 5.628 ( 2.123 -7.451 -3.496) 8.499 5.628 ( 2.123 7.451 -3.496) 8.499 5.713 ( 2.703 -0.299 0.906) 2.867 5.713 ( 2.703 0.299 0.906) 2.867 5.858 ( 0.038 -2.043 -0.528) 2.111 5.858 ( 0.038 2.043 -0.528) 2.111 6.029 ( -0.425 -2.769 2.605) 3.826 6.029 ( -0.425 2.769 2.605) 3.826 6.078 ( -2.218 -4.601 -0.372) 5.121 6.078 ( -2.218 4.601 -0.372) 5.121 6.176 ( 0.279 -3.236 -0.958) 3.387 6.176 ( 0.279 3.236 -0.958) 3.387 6.342 ( -1.413 -2.131 -2.085) 3.299 6.342 ( -1.413 2.131 -2.085) 3.299 6.391 ( -0.063 -3.024 -0.824) 3.135 6.391 ( -0.063 3.024 -0.824) 3.135 6.490 ( 3.415 -1.088 0.308) 3.598 6.490 ( 3.415 1.088 0.308) 3.598 6.714 ( -1.234 -2.156 -1.212) 2.764 6.714 ( -1.234 2.156 -1.212) 2.764 6.828 ( -2.403 -5.117 3.381) 6.587 6.828 ( -2.403 5.117 3.381) 6.587 7.017 ( 1.769 -5.309 -0.466) 5.615 7.017 ( 1.769 5.309 -0.466) 5.615 7.143 ( -1.121 -1.578 1.847) 2.676 7.143 ( -1.121 1.578 1.847) 2.676 7.673 ( -1.066 -1.910 4.795) 5.271 7.673 ( -1.066 1.910 4.795) 5.271 7.801 ( -2.122 -0.705 0.736) 2.354 7.801 ( -2.122 0.705 0.736) 2.354 7.875 ( -1.830 -3.847 4.960) 6.538 7.875 ( -1.830 3.847 4.960) 6.538 8.077 ( 4.209 -3.222 -5.923) 7.949 8.077 ( 4.209 3.222 -5.923) 7.949 8.257 ( -0.291 -1.995 -0.440) 2.063 8.257 ( -0.291 1.995 -0.440) 2.063 8.355 ( 0.375 -0.516 -1.359) 1.501 8.355 ( 0.375 0.516 -1.359) 1.501 8.635 ( -3.018 -2.918 5.389) 6.831 8.635 ( -3.018 2.918 5.389) 6.831 8.833 ( 0.785 -3.493 -4.452) 5.713 8.833 ( 0.785 3.493 -4.452) 5.713 9.031 ( -2.920 -3.740 1.973) 5.139 9.031 ( -2.920 3.740 1.973) 5.139 9.165 ( -1.421 -2.624 -2.431) 3.849 9.165 ( -1.421 2.624 -2.431) 3.849 9.228 ( -0.354 -3.515 3.497) 4.971 9.228 ( -0.354 3.515 3.497) 4.971 9.499 ( 0.417 -3.080 -4.417) 5.401 9.499 ( 0.417 3.080 -4.417) 5.401 10.016 ( -0.190 -0.888 -0.368) 0.979 10.016 ( -0.190 0.888 -0.368) 0.979 10.395 ( -1.658 -1.277 -1.473) 2.559 10.395 ( -1.658 1.277 -1.473) 2.559 10.878 ( -6.010 -2.202 -1.954) 6.692 10.878 ( -6.010 2.202 -1.954) 6.692 11.266 ( 4.037 -5.736 2.614) 7.486 11.266 ( 4.037 5.736 2.614) 7.486 16.555 ( -4.980 -0.205 -0.259) 4.990 16.555 ( -4.980 0.205 -0.259) 4.990 16.660 ( 4.574 -0.181 0.279) 4.586 16.660 ( 4.574 0.181 0.279) 4.586 17.480 ( -1.942 -1.203 -0.656) 2.377 17.480 ( -1.942 1.203 -0.656) 2.377 17.517 ( 2.759 -0.600 0.681) 2.905 17.517 ( 2.759 0.600 0.681) 2.905 17.690 ( -0.916 -0.436 -0.868) 1.335 17.690 ( -0.916 0.436 -0.868) 1.335 17.721 ( 2.343 -0.584 0.532) 2.472 17.721 ( 2.343 0.584 0.532) 2.472 18.962 ( -0.325 -8.326 0.238) 8.336 18.962 ( -0.325 8.326 0.238) 8.336 18.995 ( 2.359 -8.460 0.146) 8.784 18.995 ( 2.359 8.460 0.146) 8.784 21.336 ( -0.456 -0.398 0.112) 0.616 21.336 ( -0.456 0.398 0.112) 0.616 21.429 ( 0.047 -0.111 -0.084) 0.147 21.429 ( 0.047 0.111 -0.084) 0.147 22.015 ( -0.451 -0.541 -0.056) 0.706 22.015 ( -0.451 0.541 -0.056) 0.706 22.079 ( 0.015 -0.648 0.270) 0.702 22.079 ( 0.015 0.648 0.270) 0.702 27.013 ( 0.059 -0.336 0.043) 0.344 27.013 ( 0.059 0.336 0.043) 0.344 27.071 ( 0.153 -0.308 -0.062) 0.350 27.071 ( 0.153 0.308 -0.062) 0.350 27.701 ( -0.701 -1.139 0.538) 1.441 27.701 ( -0.701 1.139 0.538) 1.441 27.731 ( 1.111 -1.120 -0.489) 1.652 27.731 ( 1.111 1.120 -0.489) 1.652 35.703 ( 0.211 -1.200 -0.477) 1.308 35.703 ( 0.211 1.200 -0.477) 1.308 35.802 ( 2.215 -1.570 -1.407) 3.057 35.802 ( 2.215 1.570 -1.407) 3.057 36.302 ( -0.526 -3.979 2.764) 4.873 36.302 ( -0.526 3.979 2.764) 4.873 36.417 ( 3.754 -7.463 -1.538) 8.494 36.417 ( 3.754 7.463 -1.538) 8.494 37.733 ( -5.077 -10.908 3.052) 12.413 37.733 ( -5.077 10.908 3.052) 12.413 37.834 ( -2.747 -12.574 -3.298) 13.287 37.834 ( -2.747 12.574 -3.298) 13.287 40.161 ( -14.561 -3.580 0.454) 15.002 40.161 ( -14.561 3.580 0.454) 15.002 40.492 ( 16.371 -3.889 -0.195) 16.828 40.492 ( 16.371 3.889 -0.195) 16.828 ======================= Grid point 165 (90/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.709 ( -3.973 -11.078 3.305) 12.224 1.709 ( -3.973 11.078 3.305) 12.225 1.868 ( 0.284 -3.463 0.721) 3.549 1.868 ( 0.284 3.463 0.721) 3.549 2.260 ( -10.682 -4.760 5.737) 13.026 2.260 ( -10.682 4.760 5.737) 13.026 2.575 ( -8.022 -2.454 -1.351) 8.497 2.575 ( -8.022 2.454 -1.351) 8.497 2.737 ( 5.424 -5.766 1.100) 7.992 2.737 ( 5.424 5.766 1.100) 7.992 2.926 ( -3.164 -2.724 3.604) 5.515 2.926 ( -3.164 2.724 3.604) 5.515 3.320 ( -4.041 -7.219 1.141) 8.352 3.320 ( -4.041 7.219 1.141) 8.352 3.637 ( -4.267 -2.964 -1.884) 5.527 3.637 ( -4.267 2.964 -1.884) 5.527 3.681 ( 0.990 -7.731 -0.649) 7.821 3.681 ( 0.990 7.731 -0.648) 7.821 3.847 ( -0.101 -4.244 1.937) 4.667 3.847 ( -0.101 4.244 1.937) 4.667 3.974 ( -1.183 -3.695 -6.452) 7.528 3.974 ( -1.183 3.695 -6.452) 7.528 4.223 ( 3.444 -7.147 -1.526) 8.079 4.223 ( 3.444 7.147 -1.526) 8.079 4.526 ( -6.046 -11.045 3.660) 13.113 4.526 ( -6.046 11.045 3.660) 13.113 4.654 ( -4.823 -4.334 1.142) 6.584 4.654 ( -4.823 4.334 1.142) 6.584 4.928 ( 2.588 -4.126 0.036) 4.871 4.928 ( 2.588 4.126 0.036) 4.871 5.120 ( 0.762 -6.420 -5.771) 8.666 5.120 ( 0.762 6.420 -5.771) 8.666 5.352 ( 1.152 -4.056 3.719) 5.622 5.352 ( 1.152 4.056 3.719) 5.622 5.425 ( -0.879 -2.134 -1.991) 3.048 5.425 ( -0.879 2.134 -1.991) 3.048 5.491 ( 1.124 -6.305 2.838) 7.005 5.491 ( 1.124 6.305 2.838) 7.005 5.643 ( 0.771 -5.821 -1.264) 6.006 5.643 ( 0.771 5.821 -1.264) 6.006 5.759 ( -0.051 -4.023 -1.884) 4.443 5.759 ( -0.051 4.023 -1.884) 4.443 5.855 ( -0.440 -0.931 -0.281) 1.067 5.855 ( -0.440 0.931 -0.281) 1.067 6.011 ( -3.405 -1.999 1.249) 4.142 6.011 ( -3.405 1.999 1.249) 4.142 6.053 ( -1.934 -3.848 3.125) 5.321 6.053 ( -1.934 3.848 3.125) 5.321 6.189 ( 1.190 -3.293 0.598) 3.552 6.189 ( 1.190 3.293 0.598) 3.552 6.292 ( -0.221 -2.010 -2.127) 2.935 6.292 ( -0.221 2.010 -2.127) 2.935 6.388 ( 3.228 -4.508 -3.920) 6.790 6.388 ( 3.228 4.508 -3.920) 6.790 6.557 ( 1.924 -0.932 1.502) 2.613 6.557 ( 1.924 0.932 1.502) 2.613 6.676 ( -1.492 -1.669 0.259) 2.254 6.676 ( -1.492 1.669 0.259) 2.254 6.847 ( -1.659 -4.674 5.638) 7.509 6.847 ( -1.659 4.674 5.638) 7.509 7.020 ( 0.855 -1.782 -4.131) 4.579 7.020 ( 0.855 1.782 -4.131) 4.579 7.109 ( -1.876 -4.482 -1.290) 5.027 7.109 ( -1.876 4.482 -1.290) 5.027 7.553 ( -7.058 -4.418 -9.840) 12.890 7.553 ( -7.058 4.418 -9.840) 12.890 7.737 ( -5.313 -3.491 -1.339) 6.497 7.737 ( -5.313 3.491 -1.339) 6.497 7.890 ( -2.001 -7.144 0.378) 7.429 7.890 ( -2.001 7.144 0.378) 7.429 8.096 ( 3.277 -5.967 -3.214) 7.528 8.096 ( 3.277 5.967 -3.214) 7.528 8.256 ( -1.433 -4.110 1.291) 4.540 8.256 ( -1.433 4.110 1.291) 4.540 8.378 ( 2.312 -1.361 2.502) 3.668 8.378 ( 2.312 1.361 2.502) 3.668 8.619 ( -3.639 -2.116 3.836) 5.695 8.619 ( -3.639 2.116 3.836) 5.695 8.798 ( -1.043 -1.534 -2.843) 3.395 8.798 ( -1.043 1.534 -2.843) 3.395 8.997 ( -2.890 -8.106 4.941) 9.923 8.997 ( -2.890 8.106 4.941) 9.923 9.140 ( -2.730 -1.394 0.783) 3.164 9.140 ( -2.730 1.394 0.783) 3.164 9.296 ( 2.375 -3.383 7.489) 8.554 9.296 ( 2.375 3.383 7.489) 8.554 9.456 ( -0.495 -1.032 -3.088) 3.294 9.456 ( -0.495 1.032 -3.088) 3.294 10.006 ( -0.772 -0.994 0.143) 1.267 10.006 ( -0.772 0.994 0.143) 1.267 10.319 ( -4.831 -1.619 -1.290) 5.255 10.319 ( -4.831 1.619 -1.290) 5.255 10.698 ( -10.480 -1.232 -2.653) 10.880 10.698 ( -10.480 1.232 -2.653) 10.880 11.375 ( 4.234 -14.565 0.733) 15.186 11.375 ( 4.234 14.565 0.733) 15.186 16.469 ( -4.620 -0.397 0.158) 4.640 16.469 ( -4.620 0.397 0.158) 4.640 16.739 ( 3.883 -0.178 0.321) 3.901 16.739 ( 3.883 0.178 0.321) 3.901 17.459 ( -0.189 -1.099 -0.077) 1.118 17.459 ( -0.189 1.099 -0.077) 1.118 17.571 ( 2.189 -0.214 1.340) 2.576 17.571 ( 2.189 0.214 1.340) 2.576 17.675 ( 1.129 -0.516 -1.661) 2.074 17.675 ( 1.129 0.516 -1.661) 2.074 17.770 ( 2.535 -0.381 0.267) 2.577 17.770 ( 2.535 0.381 0.267) 2.577 18.971 ( 1.406 -9.835 -0.023) 9.935 18.971 ( 1.406 9.835 -0.023) 9.935 19.051 ( 4.135 -10.382 -0.548) 11.189 19.051 ( 4.135 10.382 -0.548) 11.189 21.321 ( -1.254 -1.429 -0.142) 1.906 21.321 ( -1.254 1.429 -0.142) 1.906 21.428 ( -0.024 -0.479 -0.064) 0.484 21.428 ( -0.024 0.479 -0.064) 0.484 22.001 ( -1.050 -0.795 -0.081) 1.319 22.001 ( -1.050 0.795 -0.081) 1.319 22.081 ( -0.092 -1.482 0.050) 1.486 22.081 ( -0.092 1.482 0.050) 1.486 27.014 ( 0.103 -1.749 -0.086) 1.754 27.014 ( 0.103 1.749 -0.086) 1.754 27.076 ( 0.494 -1.481 -0.011) 1.562 27.076 ( 0.494 1.481 -0.011) 1.562 27.697 ( -0.259 -1.003 0.562) 1.179 27.697 ( -0.259 1.003 0.562) 1.179 27.755 ( 1.852 -1.097 0.112) 2.155 27.755 ( 1.852 1.097 0.112) 2.155 35.725 ( 1.720 -0.452 1.542) 2.354 35.725 ( 1.720 0.452 1.542) 2.354 35.853 ( 4.400 -3.624 0.011) 5.700 35.853 ( 4.400 3.624 0.011) 5.700 36.331 ( 2.207 -2.970 0.609) 3.750 36.331 ( 2.207 2.970 0.609) 3.750 36.481 ( 5.373 -9.519 -2.512) 11.216 36.481 ( 5.373 9.519 -2.512) 11.216 37.598 ( -12.400 -17.311 0.102) 21.295 37.598 ( -12.400 17.311 0.102) 21.295 37.734 ( -7.687 -15.862 2.145) 17.757 37.734 ( -7.687 15.862 2.145) 17.757 39.921 ( -13.078 -3.962 0.797) 13.689 39.921 ( -13.078 3.962 0.797) 13.689 40.781 ( 17.870 -3.789 -2.703) 18.466 40.781 ( 17.870 3.789 -2.703) 18.466 ======================= Grid point 167 (91/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.682 ( -4.836 -9.942 5.593) 12.389 1.682 ( -4.836 9.942 5.593) 12.389 1.907 ( -0.833 -5.531 4.522) 7.192 1.907 ( -0.833 5.531 4.522) 7.193 2.079 ( -12.578 -4.233 1.800) 13.393 2.079 ( -12.578 4.233 1.800) 13.393 2.412 ( -11.234 -9.243 8.470) 16.834 2.412 ( -11.234 9.243 8.470) 16.834 2.806 ( -6.681 -8.248 0.675) 10.636 2.806 ( -6.681 8.248 0.675) 10.636 2.918 ( 2.471 -8.457 5.358) 10.312 2.918 ( 2.471 8.457 5.358) 10.312 3.251 ( -5.521 -2.054 3.542) 6.873 3.251 ( -5.521 2.054 3.542) 6.873 3.433 ( -6.282 -6.686 -11.495) 14.707 3.433 ( -6.282 6.686 -11.495) 14.707 3.703 ( -3.247 -13.283 -5.195) 14.628 3.703 ( -3.247 13.283 -5.195) 14.628 3.836 ( 3.672 -3.963 3.698) 6.547 3.836 ( 3.672 3.963 3.698) 6.547 4.060 ( 8.310 -3.971 2.158) 9.460 4.060 ( 8.310 3.971 2.158) 9.460 4.292 ( 3.398 -6.441 1.438) 7.423 4.292 ( 3.398 6.441 1.438) 7.423 4.448 ( -2.215 -3.428 -0.482) 4.109 4.448 ( -2.215 3.428 -0.482) 4.109 4.607 ( -5.585 -9.148 4.798) 11.743 4.607 ( -5.585 9.148 4.798) 11.743 4.893 ( -4.198 -6.722 1.383) 8.045 4.893 ( -4.198 6.722 1.383) 8.045 5.122 ( 4.479 -3.769 -5.630) 8.122 5.122 ( 4.479 3.769 -5.630) 8.122 5.345 ( -1.236 -0.719 -2.935) 3.264 5.345 ( -1.236 0.719 -2.935) 3.264 5.453 ( 2.739 -4.565 2.380) 5.832 5.453 ( 2.739 4.565 2.380) 5.832 5.547 ( -1.602 -1.264 0.345) 2.069 5.547 ( -1.602 1.264 0.345) 2.069 5.582 ( -2.761 -8.127 -0.894) 8.630 5.582 ( -2.761 8.127 -0.894) 8.630 5.726 ( -0.876 -2.578 -1.327) 3.029 5.726 ( -0.876 2.578 -1.327) 3.029 5.833 ( 0.254 -3.978 0.426) 4.009 5.833 ( 0.254 3.978 0.426) 4.009 5.975 ( -3.806 -6.297 0.316) 7.365 5.975 ( -3.806 6.297 0.316) 7.365 6.034 ( -2.695 -4.956 1.005) 5.730 6.034 ( -2.695 4.956 1.005) 5.730 6.218 ( 1.072 -4.994 -0.695) 5.155 6.218 ( 1.072 4.994 -0.695) 5.155 6.270 ( 1.128 -2.354 -1.706) 3.118 6.270 ( 1.128 2.354 -1.706) 3.118 6.430 ( 4.137 -2.567 -3.742) 6.141 6.430 ( 4.137 2.567 -3.742) 6.141 6.603 ( 0.275 -5.132 3.224) 6.067 6.603 ( 0.275 5.132 3.224) 6.067 6.687 ( 3.415 -4.004 0.012) 5.263 6.687 ( 3.415 4.004 0.012) 5.263 6.821 ( -4.028 -4.819 0.482) 6.299 6.821 ( -4.028 4.819 0.482) 6.299 6.986 ( -0.784 -4.438 -1.825) 4.862 6.986 ( -0.784 4.438 -1.825) 4.862 7.089 ( -0.451 -3.418 -2.408) 4.205 7.089 ( -0.451 3.418 -2.408) 4.205 7.324 ( -5.832 -5.972 -10.599) 13.491 7.324 ( -5.832 5.972 -10.599) 13.491 7.611 ( -6.416 -2.726 -2.982) 7.582 7.611 ( -6.416 2.726 -2.982) 7.582 7.801 ( -4.854 -3.383 -4.418) 7.384 7.801 ( -4.854 3.383 -4.418) 7.384 8.097 ( -0.873 -7.613 -2.496) 8.059 8.097 ( -0.873 7.613 -2.496) 8.059 8.228 ( -3.138 -2.851 2.459) 4.901 8.228 ( -3.138 2.851 2.459) 4.901 8.477 ( 4.695 -2.055 4.035) 6.523 8.477 ( 4.695 2.055 4.035) 6.523 8.617 ( -0.548 -0.763 4.389) 4.489 8.617 ( -0.548 0.763 4.389) 4.489 8.748 ( -1.600 -3.823 -1.734) 4.492 8.748 ( -1.600 3.823 -1.734) 4.492 8.992 ( -5.745 -7.792 6.960) 11.923 8.992 ( -5.745 7.792 6.960) 11.923 9.098 ( -0.873 -1.778 -1.872) 2.726 9.098 ( -0.873 1.778 -1.872) 2.726 9.369 ( 0.769 -4.296 -0.157) 4.367 9.369 ( 0.769 4.296 -0.157) 4.367 9.488 ( 1.716 -10.009 8.257) 13.088 9.488 ( 1.716 10.009 8.257) 13.088 9.998 ( -0.887 -1.235 1.901) 2.434 9.998 ( -0.887 1.235 1.901) 2.434 10.234 ( -4.282 -2.306 0.961) 4.958 10.234 ( -4.282 2.306 0.961) 4.958 10.510 ( -7.853 -1.252 -2.531) 8.345 10.510 ( -7.853 1.252 -2.531) 8.345 11.378 ( -1.693 -18.676 -5.535) 19.553 11.378 ( -1.693 18.676 -5.535) 19.553 16.405 ( -3.180 -0.570 0.350) 3.249 16.405 ( -3.180 0.570 0.350) 3.249 16.793 ( 2.263 -0.070 -0.048) 2.265 16.793 ( 2.263 0.070 -0.048) 2.265 17.465 ( 0.493 -0.880 0.282) 1.048 17.465 ( 0.493 0.880 0.282) 1.048 17.615 ( 1.647 -0.852 1.492) 2.380 17.615 ( 1.647 0.852 1.492) 2.380 17.699 ( 2.862 -0.473 -1.490) 3.261 17.699 ( 2.862 0.473 -1.490) 3.261 17.809 ( 1.812 -0.462 0.057) 1.871 17.809 ( 1.812 0.462 0.057) 1.871 19.011 ( 2.977 -10.118 0.473) 10.558 19.011 ( 2.977 10.118 0.473) 10.558 19.119 ( 4.647 -11.169 -1.379) 12.176 19.119 ( 4.647 11.169 -1.379) 12.176 21.292 ( -1.671 -1.238 -0.337) 2.106 21.292 ( -1.671 1.238 -0.337) 2.106 21.426 ( -0.154 -0.318 0.011) 0.354 21.426 ( -0.154 0.318 0.011) 0.354 21.982 ( -1.042 -0.669 0.006) 1.238 21.982 ( -1.042 0.669 0.006) 1.238 22.074 ( -0.608 -1.674 -0.391) 1.823 22.074 ( -0.608 1.674 -0.391) 1.823 27.014 ( 0.010 -2.368 -0.233) 2.379 27.014 ( 0.010 2.368 -0.233) 2.379 27.089 ( 0.956 -2.095 0.103) 2.305 27.089 ( 0.956 2.095 0.103) 2.305 27.702 ( 0.169 -0.411 0.510) 0.676 27.702 ( 0.169 0.411 0.510) 0.676 27.791 ( 1.941 -0.624 0.306) 2.062 27.791 ( 1.941 0.624 0.306) 2.062 35.785 ( 3.037 -1.497 1.659) 3.770 35.785 ( 3.037 1.497 1.659) 3.770 35.956 ( 5.779 -1.569 4.151) 7.286 35.956 ( 5.779 1.569 4.151) 7.286 36.384 ( 3.741 -6.801 -0.979) 7.824 36.384 ( 3.741 6.801 -0.979) 7.824 36.541 ( 4.017 -9.528 -2.076) 10.547 36.541 ( 4.017 9.528 -2.076) 10.547 37.333 ( -16.333 -16.076 -2.356) 23.038 37.333 ( -16.333 16.076 -2.356) 23.038 37.629 ( -8.544 -16.908 5.858) 19.829 37.629 ( -8.544 16.908 5.858) 19.829 39.747 ( -8.670 -3.231 2.257) 9.523 39.747 ( -8.670 3.231 2.257) 9.523 41.027 ( 15.269 -4.222 -6.519) 17.131 41.027 ( 15.269 4.222 -6.519) 17.131 ======================= Grid point 169 (92/92) ======================= 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 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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| 1.511 ( -19.596 -10.888 3.924) 22.758 1.511 ( -19.596 10.888 3.924) 22.758 1.874 ( 0.054 -2.371 0.927) 2.546 1.874 ( 0.054 2.371 0.927) 2.546 2.048 ( 2.944 -0.568 -0.460) 3.033 2.048 ( 2.944 0.568 -0.460) 3.033 2.363 ( -9.162 -7.452 12.878) 17.473 2.363 ( -9.162 7.452 12.878) 17.473 2.681 ( -6.300 -8.227 7.503) 12.793 2.681 ( -6.300 8.227 7.503) 12.793 2.973 ( -2.619 -1.854 6.297) 7.067 2.973 ( -2.619 1.854 6.297) 7.067 3.164 ( -8.115 -7.747 -0.623) 11.236 3.164 ( -8.115 7.747 -0.623) 11.236 3.304 ( 3.289 -12.443 -8.627) 15.495 3.304 ( 3.289 12.443 -8.627) 15.495 3.617 ( -0.285 -8.066 -4.488) 9.235 3.617 ( -0.285 8.066 -4.488) 9.235 3.930 ( 2.629 -3.534 3.011) 5.335 3.930 ( 2.629 3.534 3.011) 5.335 4.167 ( 1.588 -5.675 -2.086) 6.252 4.167 ( 1.588 5.675 -2.086) 6.252 4.352 ( 4.433 -4.463 0.034) 6.290 4.352 ( 4.433 4.463 0.034) 6.290 4.491 ( 1.387 -2.282 4.849) 5.536 4.491 ( 1.387 2.282 4.849) 5.536 4.548 ( -1.757 -7.204 3.133) 8.050 4.548 ( -1.757 7.204 3.133) 8.050 4.904 ( -0.086 -9.053 7.980) 12.068 4.904 ( -0.086 9.053 7.980) 12.068 5.114 ( -2.308 -6.619 -4.708) 8.444 5.114 ( -2.308 6.619 -4.708) 8.444 5.248 ( -2.457 -2.238 -5.255) 6.218 5.248 ( -2.457 2.238 -5.255) 6.218 5.453 ( 0.157 -5.424 -4.944) 7.340 5.453 ( 0.157 5.424 -4.944) 7.340 5.523 ( -0.890 -2.991 -0.825) 3.228 5.523 ( -0.890 2.991 -0.825) 3.228 5.620 ( 2.339 -3.603 3.351) 5.448 5.620 ( 2.339 3.603 3.351) 5.448 5.689 ( -1.086 -2.195 0.800) 2.577 5.689 ( -1.086 2.195 0.800) 2.577 5.871 ( -2.544 -9.491 -1.699) 9.972 5.871 ( -2.544 9.491 -1.699) 9.972 5.886 ( 0.458 -4.618 2.130) 5.106 5.886 ( 0.458 4.618 2.130) 5.106 6.005 ( 0.131 -3.702 -1.619) 4.043 6.005 ( 0.131 3.702 -1.619) 4.043 6.207 ( -0.211 -6.194 -2.851) 6.822 6.207 ( -0.211 6.194 -2.851) 6.822 6.292 ( 1.307 -1.445 -0.791) 2.103 6.292 ( 1.307 1.445 -0.791) 2.103 6.442 ( 1.084 -0.768 -3.659) 3.893 6.442 ( 1.084 0.768 -3.659) 3.893 6.567 ( -5.163 -1.920 0.549) 5.536 6.567 ( -5.163 1.920 0.549) 5.536 6.709 ( -2.558 -3.433 0.266) 4.290 6.709 ( -2.558 3.433 0.266) 4.290 6.850 ( 2.650 -1.308 -0.863) 3.079 6.850 ( 2.650 1.308 -0.863) 3.079 6.951 ( 1.465 -4.731 -1.610) 5.207 6.951 ( 1.465 4.731 -1.610) 5.207 6.995 ( -1.647 -4.898 -3.435) 6.205 6.995 ( -1.647 4.898 -3.435) 6.205 7.245 ( 2.638 -5.169 -6.096) 8.416 7.245 ( 2.638 5.169 -6.096) 8.416 7.466 ( -8.050 -1.504 -2.115) 8.458 7.466 ( -8.050 1.504 -2.115) 8.458 7.711 ( -1.146 -1.573 -0.440) 1.995 7.711 ( -1.146 1.573 -0.440) 1.995 8.018 ( -4.507 -7.179 -3.632) 9.222 8.018 ( -4.507 7.179 -3.632) 9.222 8.215 ( -1.743 -2.335 4.000) 4.949 8.215 ( -1.743 2.335 4.000) 4.949 8.556 ( 2.114 -2.530 -1.705) 3.712 8.556 ( 2.114 2.530 -1.705) 3.712 8.679 ( 1.964 -2.915 4.523) 5.728 8.679 ( 1.964 2.915 4.523) 5.728 8.744 ( 1.022 -1.702 2.439) 3.144 8.744 ( 1.022 1.702 2.439) 3.144 8.939 ( -5.219 -7.014 5.090) 10.116 8.939 ( -5.219 7.014 5.090) 10.116 9.071 ( -1.077 -0.869 -1.244) 1.861 9.071 ( -1.077 0.869 -1.244) 1.861 9.386 ( 3.395 -0.651 -2.097) 4.043 9.386 ( 3.395 0.651 -2.097) 4.043 9.550 ( -4.250 -11.173 6.301) 13.513 9.550 ( -4.250 11.173 6.301) 13.513 10.026 ( -0.125 -3.118 5.520) 6.341 10.026 ( -0.125 3.118 5.520) 6.341 10.208 ( -0.812 -1.423 3.337) 3.718 10.208 ( -0.812 1.423 3.337) 3.718 10.407 ( -1.665 -1.801 -0.697) 2.550 10.407 ( -1.665 1.801 -0.697) 2.550 11.224 ( -5.720 -17.083 -12.044) 21.670 11.224 ( -5.720 17.083 -12.044) 21.670 16.367 ( -1.576 -0.412 0.311) 1.658 16.367 ( -1.576 0.412 0.311) 1.658 16.817 ( 0.896 -0.140 -0.312) 0.959 16.817 ( 0.896 0.140 -0.312) 0.959 17.473 ( 0.084 -0.794 0.168) 0.816 17.473 ( 0.084 0.794 0.168) 0.816 17.658 ( 1.569 -0.649 1.333) 2.159 17.658 ( 1.569 0.649 1.333) 2.159 17.728 ( 1.862 -0.448 -1.334) 2.334 17.728 ( 1.862 0.448 -1.334) 2.334 17.833 ( 0.896 -0.484 0.124) 1.026 17.833 ( 0.896 0.484 0.124) 1.026 19.074 ( 2.992 -10.224 1.485) 10.756 19.074 ( 2.992 10.224 1.485) 10.756 19.172 ( 3.049 -11.451 -2.218) 12.056 19.172 ( 3.049 11.451 -2.218) 12.056 21.264 ( -1.188 -0.511 -0.179) 1.306 21.264 ( -1.188 0.511 -0.179) 1.306 21.423 ( -0.237 -0.185 -0.029) 0.302 21.423 ( -0.237 0.185 -0.029) 0.302 21.967 ( -0.630 -0.485 0.093) 0.801 21.967 ( -0.630 0.485 0.093) 0.801 22.056 ( -0.780 -1.030 -0.625) 1.435 22.056 ( -0.780 1.030 -0.625) 1.435 27.011 ( -0.055 -1.808 -0.264) 1.828 27.011 ( -0.055 1.808 -0.264) 1.828 27.107 ( 0.894 -1.663 0.100) 1.890 27.107 ( 0.894 1.663 0.100) 1.890 27.711 ( 0.226 -0.151 0.494) 0.564 27.711 ( 0.226 0.151 0.494) 0.564 27.820 ( 1.058 -0.266 -0.004) 1.091 27.820 ( 1.058 0.266 -0.004) 1.091 35.836 ( 2.000 -1.899 -0.654) 2.834 35.836 ( 2.000 1.899 -0.654) 2.834 36.134 ( 6.867 -5.088 9.139) 12.512 36.134 ( 6.867 5.088 9.139) 12.512 36.427 ( 2.839 -9.656 -2.073) 10.276 36.427 ( 2.839 9.656 -2.073) 10.276 36.587 ( 2.229 -7.153 1.291) 7.603 36.587 ( 2.229 7.153 1.291) 7.603 37.037 ( -13.650 -11.250 -4.284) 18.200 37.037 ( -13.650 11.250 -4.284) 18.200 37.563 ( -5.252 -12.873 5.894) 15.101 37.563 ( -5.252 12.873 5.894) 15.101 39.666 ( -4.008 -2.043 3.292) 5.575 39.666 ( -4.008 2.043 3.292) 5.575 41.164 ( 8.817 -4.511 -8.843) 13.278 41.164 ( 8.817 4.511 -8.843) 13.278 =================== 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 10.0 218.764 104.351 232.889 0.000 -26.823 0.000 3/38880 20.0 49.645 44.274 48.630 0.000 -10.488 0.000 3/38880 30.0 20.105 20.282 18.732 0.000 -3.982 0.000 3/38880 40.0 11.112 11.383 10.089 0.000 -2.057 0.000 3/38880 50.0 7.243 7.397 6.508 0.000 -1.264 0.000 3/38880 60.0 5.230 5.315 4.687 0.000 -0.867 0.000 3/38880 70.0 4.048 4.097 3.632 0.000 -0.640 0.000 3/38880 80.0 3.290 3.321 2.962 0.000 -0.498 0.000 3/38880 90.0 2.771 2.792 2.505 0.000 -0.404 0.000 3/38880 100.0 2.397 2.413 2.176 0.000 -0.337 0.000 3/38880 110.0 2.115 2.128 1.929 0.000 -0.288 0.000 3/38880 120.0 1.896 1.908 1.736 0.000 -0.251 0.000 3/38880 130.0 1.721 1.733 1.581 0.000 -0.222 0.000 3/38880 140.0 1.577 1.590 1.454 0.000 -0.198 0.000 3/38880 150.0 1.458 1.472 1.347 0.000 -0.180 0.000 3/38880 160.0 1.356 1.372 1.256 0.000 -0.164 0.000 3/38880 170.0 1.269 1.287 1.177 0.000 -0.151 0.000 3/38880 180.0 1.193 1.213 1.108 0.000 -0.139 0.000 3/38880 190.0 1.126 1.149 1.047 0.000 -0.130 0.000 3/38880 200.0 1.067 1.092 0.993 0.000 -0.121 0.000 3/38880 210.0 1.014 1.041 0.944 0.000 -0.114 0.000 3/38880 220.0 0.966 0.996 0.901 0.000 -0.107 0.000 3/38880 230.0 0.923 0.955 0.861 0.000 -0.101 0.000 3/38880 240.0 0.884 0.918 0.825 0.000 -0.096 0.000 3/38880 250.0 0.849 0.884 0.791 0.000 -0.092 0.000 3/38880 260.0 0.816 0.854 0.761 0.000 -0.087 0.000 3/38880 270.0 0.786 0.825 0.733 0.000 -0.083 0.000 3/38880 280.0 0.758 0.799 0.707 0.000 -0.080 0.000 3/38880 290.0 0.733 0.775 0.682 0.000 -0.077 0.000 3/38880 300.0 0.709 0.752 0.660 0.000 -0.074 0.000 3/38880 310.0 0.687 0.732 0.639 0.000 -0.071 0.000 3/38880 320.0 0.666 0.712 0.619 0.000 -0.068 0.000 3/38880 330.0 0.647 0.694 0.601 0.000 -0.066 0.000 3/38880 340.0 0.628 0.676 0.584 0.000 -0.064 0.000 3/38880 350.0 0.611 0.660 0.567 0.000 -0.062 0.000 3/38880 360.0 0.595 0.645 0.552 0.000 -0.060 0.000 3/38880 370.0 0.580 0.631 0.538 0.000 -0.058 0.000 3/38880 380.0 0.566 0.617 0.524 0.000 -0.056 0.000 3/38880 390.0 0.553 0.604 0.511 0.000 -0.055 0.000 3/38880 400.0 0.540 0.592 0.499 0.000 -0.053 0.000 3/38880 410.0 0.528 0.580 0.487 0.000 -0.052 0.000 3/38880 420.0 0.516 0.569 0.476 0.000 -0.051 0.000 3/38880 430.0 0.505 0.558 0.465 0.000 -0.049 0.000 3/38880 440.0 0.495 0.548 0.455 0.000 -0.048 0.000 3/38880 450.0 0.485 0.539 0.446 0.000 -0.047 0.000 3/38880 460.0 0.475 0.529 0.436 0.000 -0.046 0.000 3/38880 470.0 0.466 0.520 0.428 0.000 -0.045 0.000 3/38880 480.0 0.457 0.512 0.419 0.000 -0.044 0.000 3/38880 490.0 0.449 0.504 0.411 0.000 -0.043 0.000 3/38880 500.0 0.441 0.496 0.403 0.000 -0.042 0.000 3/38880 510.0 0.433 0.488 0.396 0.000 -0.041 0.000 3/38880 520.0 0.426 0.481 0.389 0.000 -0.040 0.000 3/38880 530.0 0.419 0.473 0.382 0.000 -0.040 0.000 3/38880 540.0 0.412 0.467 0.375 0.000 -0.039 0.000 3/38880 550.0 0.405 0.460 0.369 0.000 -0.038 0.000 3/38880 560.0 0.399 0.453 0.362 0.000 -0.037 0.000 3/38880 570.0 0.393 0.447 0.356 0.000 -0.037 0.000 3/38880 580.0 0.387 0.441 0.351 0.000 -0.036 0.000 3/38880 590.0 0.381 0.435 0.345 0.000 -0.035 0.000 3/38880 600.0 0.375 0.430 0.340 0.000 -0.035 0.000 3/38880 610.0 0.370 0.424 0.334 0.000 -0.034 0.000 3/38880 620.0 0.365 0.419 0.329 0.000 -0.034 0.000 3/38880 630.0 0.360 0.414 0.325 0.000 -0.033 0.000 3/38880 640.0 0.355 0.408 0.320 0.000 -0.033 0.000 3/38880 650.0 0.350 0.404 0.315 0.000 -0.032 0.000 3/38880 660.0 0.346 0.399 0.311 0.000 -0.032 0.000 3/38880 670.0 0.341 0.394 0.306 0.000 -0.031 0.000 3/38880 680.0 0.337 0.389 0.302 0.000 -0.031 0.000 3/38880 690.0 0.332 0.385 0.298 0.000 -0.030 0.000 3/38880 700.0 0.328 0.381 0.294 0.000 -0.030 0.000 3/38880 710.0 0.324 0.376 0.290 0.000 -0.029 0.000 3/38880 720.0 0.320 0.372 0.286 0.000 -0.029 0.000 3/38880 730.0 0.317 0.368 0.283 0.000 -0.028 0.000 3/38880 740.0 0.313 0.364 0.279 0.000 -0.028 0.000 3/38880 750.0 0.309 0.360 0.276 0.000 -0.028 0.000 3/38880 760.0 0.306 0.357 0.272 0.000 -0.027 0.000 3/38880 770.0 0.302 0.353 0.269 0.000 -0.027 0.000 3/38880 780.0 0.299 0.349 0.266 0.000 -0.027 0.000 3/38880 790.0 0.296 0.346 0.263 0.000 -0.026 0.000 3/38880 800.0 0.292 0.342 0.260 0.000 -0.026 0.000 3/38880 810.0 0.289 0.339 0.257 0.000 -0.026 0.000 3/38880 820.0 0.286 0.336 0.254 0.000 -0.025 0.000 3/38880 830.0 0.283 0.332 0.251 0.000 -0.025 0.000 3/38880 840.0 0.280 0.329 0.248 0.000 -0.025 0.000 3/38880 850.0 0.278 0.326 0.245 0.000 -0.024 0.000 3/38880 860.0 0.275 0.323 0.243 0.000 -0.024 0.000 3/38880 870.0 0.272 0.320 0.240 0.000 -0.024 0.000 3/38880 880.0 0.269 0.317 0.238 0.000 -0.024 0.000 3/38880 890.0 0.267 0.314 0.235 0.000 -0.023 0.000 3/38880 900.0 0.264 0.311 0.233 0.000 -0.023 0.000 3/38880 910.0 0.262 0.309 0.230 0.000 -0.023 0.000 3/38880 920.0 0.259 0.306 0.228 0.000 -0.023 0.000 3/38880 930.0 0.257 0.303 0.226 0.000 -0.022 0.000 3/38880 940.0 0.254 0.300 0.223 0.000 -0.022 0.000 3/38880 950.0 0.252 0.298 0.221 0.000 -0.022 0.000 3/38880 960.0 0.250 0.295 0.219 0.000 -0.022 0.000 3/38880 970.0 0.248 0.293 0.217 0.000 -0.021 0.000 3/38880 980.0 0.245 0.290 0.215 0.000 -0.021 0.000 3/38880 990.0 0.243 0.288 0.213 0.000 -0.021 0.000 3/38880 1000.0 0.241 0.286 0.211 0.000 -0.021 0.000 3/38880 Thermal conductivity related properties were written into "kappa-m965.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:25:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|