----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 09:50:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.133114085010734 -2.543438125000000 0.000000000000000 b 6.133114085010734 2.543438125000000 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): *1 Dy 0.86649240951628 0.37142234429489 0.03673302649243 162.500 2 Dy 0.62857765570511 0.13350759048372 0.46326697350757 162.500 3 Dy 0.13350759048372 0.62857765570511 0.96326697350757 162.500 4 Dy 0.37142234429489 0.86649240951628 0.53673302649243 162.500 *5 Te 0.83966897865440 0.40822515130022 0.37134239858438 127.600 6 Te 0.59177484869978 0.16033102134560 0.12865760141562 127.600 7 Te 0.16033102134560 0.59177484869978 0.62865760141562 127.600 8 Te 0.40822515130022 0.83966897865440 0.87134239858438 127.600 *9 Te 0.40317498493340 0.84748064620159 0.20164741642559 127.600 10 Te 0.15251935379841 0.59682501506660 0.29835258357440 127.600 11 Te 0.59682501506660 0.15251935379841 0.79835258357440 127.600 12 Te 0.84748064620159 0.40317498493340 0.70164741642560 127.600 *13 O 0.18895096218017 0.31481487226543 0.37019590396609 15.999 14 O 0.68518512773457 0.81104903781983 0.12980409603391 15.999 15 O 0.81104903781983 0.68518512773457 0.62980409603391 15.999 16 O 0.31481487226543 0.18895096218017 0.87019590396609 15.999 *17 O 0.66293895294790 0.75366739995502 0.44685501280512 15.999 18 O 0.24633260004498 0.33706104705210 0.05314498719488 15.999 19 O 0.33706104705210 0.24633260004498 0.55314498719488 15.999 20 O 0.75366739995502 0.66293895294790 0.94685501280512 15.999 *21 O 0.95967156665053 0.17554763644987 0.45447856327712 15.999 22 O 0.82445236355013 0.04032843334947 0.04552143672288 15.999 23 O 0.04032843334947 0.82445236355013 0.54552143672288 15.999 24 O 0.17554763644987 0.95967156665053 0.95447856327712 15.999 *25 O 0.39767885587302 0.55517000496684 0.40336660131390 15.999 26 O 0.44482999503316 0.60232114412698 0.09663339868610 15.999 27 O 0.60232114412698 0.44482999503316 0.59663339868610 15.999 28 O 0.55517000496684 0.39767885587302 0.90336660131390 15.999 *29 O 0.78440711455047 0.91037233730869 0.33003650372842 15.999 30 O 0.08962766269131 0.21559288544953 0.16996349627158 15.999 31 O 0.21559288544953 0.08962766269131 0.66996349627158 15.999 32 O 0.91037233730869 0.78440711455047 0.83003650372842 15.999 *33 O 0.13542040694867 0.86457959305133 0.25000000000000 15.999 34 O 0.86457959305133 0.13542040694867 0.75000000000000 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.266228170021469 0.000000000000000 0.000000000000000 b 0.000000000000000 5.086876250000000 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): *1 Dy 0.61895737690558 0.75246496738931 0.03673302649243 162.500 > 1 2 Dy 0.88104262309442 0.25246496738931 0.46326697350757 162.500 > 2 3 Dy 0.38104262309442 0.24753503261069 0.96326697350757 162.500 > 3 4 Dy 0.11895737690558 0.74753503261069 0.53673302649243 162.500 > 4 5 Dy 0.11895737690558 0.25246496738931 0.03673302649243 162.500 > 1 6 Dy 0.38104262309442 0.75246496738931 0.46326697350757 162.500 > 2 7 Dy 0.88104262309442 0.74753503261069 0.96326697350757 162.500 > 3 8 Dy 0.61895737690558 0.24753503261069 0.53673302649243 162.500 > 4 *9 Te 0.12394706497731 0.28427808632291 0.37134239858438 127.600 > 5 10 Te 0.87605293502269 0.28427808632291 0.12865760141562 127.600 > 6 11 Te 0.87605293502269 0.71572191367709 0.62865760141562 127.600 > 7 12 Te 0.12394706497731 0.71572191367709 0.87134239858438 127.600 > 8 *13 Te 0.62532781556750 0.22215283063409 0.20164741642559 127.600 > 9 14 Te 0.87467218443250 0.72215283063409 0.29835258357440 127.600 > 10 15 Te 0.37467218443250 0.77784716936591 0.79835258357440 127.600 > 11 16 Te 0.12532781556750 0.27784716936591 0.70164741642560 127.600 > 12 17 Te 0.62394706497731 0.78427808632291 0.37134239858438 127.600 > 5 18 Te 0.37605293502269 0.78427808632291 0.12865760141562 127.600 > 6 19 Te 0.37605293502269 0.21572191367709 0.62865760141562 127.600 > 7 20 Te 0.62394706497731 0.21572191367709 0.87134239858438 127.600 > 8 21 Te 0.12532781556750 0.72215283063409 0.20164741642559 127.600 > 9 22 Te 0.37467218443250 0.22215283063409 0.29835258357440 127.600 > 10 23 Te 0.87467218443250 0.27784716936591 0.79835258357440 127.600 > 11 24 Te 0.62532781556750 0.77784716936591 0.70164741642560 127.600 > 12 *25 O 0.75188291722280 0.56293195504263 0.37019590396609 15.999 > 13 26 O 0.74811708277720 0.06293195504263 0.12980409603391 15.999 > 14 27 O 0.24811708277720 0.43706804495737 0.62980409603391 15.999 > 15 28 O 0.25188291722280 0.93706804495737 0.87019590396609 15.999 > 16 *29 O 0.20830317645146 0.54536422350356 0.44685501280512 15.999 > 17 30 O 0.79169682354854 0.54536422350356 0.05314498719488 15.999 > 18 31 O 0.79169682354854 0.45463577649644 0.55314498719488 15.999 > 19 32 O 0.20830317645146 0.45463577649644 0.94685501280512 15.999 > 20 *33 O 0.06760960155020 0.10793803489967 0.45447856327712 15.999 > 21 34 O 0.93239039844980 0.10793803489967 0.04552143672288 15.999 > 22 35 O 0.93239039844980 0.89206196510033 0.54552143672288 15.999 > 23 36 O 0.06760960155020 0.89206196510033 0.95447856327712 15.999 > 24 *37 O 0.97642443041993 0.57874557454691 0.40336660131390 15.999 > 25 38 O 0.02357556958007 0.57874557454691 0.09663339868610 15.999 > 26 39 O 0.02357556958007 0.42125442545309 0.59663339868610 15.999 > 27 40 O 0.97642443041993 0.42125442545309 0.90336660131390 15.999 > 28 *41 O 0.84738972592958 0.06298261137911 0.33003650372842 15.999 > 29 42 O 0.65261027407042 0.56298261137911 0.16996349627158 15.999 > 30 43 O 0.15261027407042 0.93701738862089 0.66996349627158 15.999 > 31 44 O 0.34738972592958 0.43701738862089 0.83003650372842 15.999 > 32 *45 O 0.00000000000000 0.86457959305133 0.25000000000000 15.999 > 33 46 O 0.00000000000000 0.13542040694867 0.75000000000000 15.999 > 34 47 O 0.25188291722280 0.06293195504263 0.37019590396609 15.999 > 13 48 O 0.24811708277720 0.56293195504263 0.12980409603391 15.999 > 14 49 O 0.74811708277720 0.93706804495737 0.62980409603391 15.999 > 15 50 O 0.75188291722280 0.43706804495737 0.87019590396609 15.999 > 16 51 O 0.70830317645146 0.04536422350356 0.44685501280512 15.999 > 17 52 O 0.29169682354854 0.04536422350356 0.05314498719488 15.999 > 18 53 O 0.29169682354854 0.95463577649644 0.55314498719488 15.999 > 19 54 O 0.70830317645146 0.95463577649644 0.94685501280512 15.999 > 20 55 O 0.56760960155020 0.60793803489967 0.45447856327712 15.999 > 21 56 O 0.43239039844980 0.60793803489967 0.04552143672288 15.999 > 22 57 O 0.43239039844980 0.39206196510033 0.54552143672288 15.999 > 23 58 O 0.56760960155020 0.39206196510033 0.95447856327712 15.999 > 24 59 O 0.47642443041993 0.07874557454691 0.40336660131390 15.999 > 25 60 O 0.52357556958007 0.07874557454691 0.09663339868610 15.999 > 26 61 O 0.52357556958007 0.92125442545309 0.59663339868610 15.999 > 27 62 O 0.47642443041993 0.92125442545309 0.90336660131390 15.999 > 28 63 O 0.34738972592958 0.56298261137911 0.33003650372842 15.999 > 29 64 O 0.15261027407042 0.06298261137911 0.16996349627158 15.999 > 30 65 O 0.65261027407042 0.43701738862089 0.66996349627158 15.999 > 31 66 O 0.84738972592958 0.93701738862089 0.83003650372842 15.999 > 32 67 O 0.50000000000000 0.36457959305133 0.25000000000000 15.999 > 33 68 O 0.50000000000000 0.63542040694867 0.75000000000000 15.999 > 34 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.266228170021469 0.000000000000000 0.000000000000000 b 0.000000000000000 10.173752500000001 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): *1 Dy 0.61895737690558 0.37623248369465 0.03673302649243 162.500 > 1 2 Dy 0.61895737690558 0.87623248369465 0.03673302649243 162.500 > 1 3 Dy 0.88104262309442 0.12623248369465 0.46326697350757 162.500 > 2 4 Dy 0.88104262309442 0.62623248369465 0.46326697350757 162.500 > 2 5 Dy 0.38104262309442 0.12376751630535 0.96326697350757 162.500 > 3 6 Dy 0.38104262309442 0.62376751630535 0.96326697350757 162.500 > 3 7 Dy 0.11895737690558 0.37376751630535 0.53673302649243 162.500 > 4 8 Dy 0.11895737690558 0.87376751630535 0.53673302649243 162.500 > 4 9 Dy 0.11895737690558 0.12623248369465 0.03673302649243 162.500 > 1 10 Dy 0.11895737690558 0.62623248369465 0.03673302649243 162.500 > 1 11 Dy 0.38104262309442 0.37623248369465 0.46326697350757 162.500 > 2 12 Dy 0.38104262309442 0.87623248369465 0.46326697350757 162.500 > 2 13 Dy 0.88104262309442 0.37376751630535 0.96326697350757 162.500 > 3 14 Dy 0.88104262309442 0.87376751630535 0.96326697350757 162.500 > 3 15 Dy 0.61895737690558 0.12376751630535 0.53673302649243 162.500 > 4 16 Dy 0.61895737690558 0.62376751630535 0.53673302649243 162.500 > 4 *17 Te 0.12394706497731 0.14213904316145 0.37134239858438 127.600 > 5 18 Te 0.12394706497731 0.64213904316145 0.37134239858438 127.600 > 5 19 Te 0.87605293502269 0.14213904316145 0.12865760141562 127.600 > 6 20 Te 0.87605293502269 0.64213904316145 0.12865760141562 127.600 > 6 21 Te 0.87605293502269 0.35786095683855 0.62865760141562 127.600 > 7 22 Te 0.87605293502269 0.85786095683855 0.62865760141562 127.600 > 7 23 Te 0.12394706497731 0.35786095683855 0.87134239858438 127.600 > 8 24 Te 0.12394706497731 0.85786095683855 0.87134239858438 127.600 > 8 *25 Te 0.62532781556750 0.11107641531705 0.20164741642559 127.600 > 9 26 Te 0.62532781556750 0.61107641531705 0.20164741642559 127.600 > 9 27 Te 0.87467218443250 0.36107641531705 0.29835258357440 127.600 > 10 28 Te 0.87467218443250 0.86107641531705 0.29835258357440 127.600 > 10 29 Te 0.37467218443250 0.38892358468295 0.79835258357440 127.600 > 11 30 Te 0.37467218443250 0.88892358468295 0.79835258357440 127.600 > 11 31 Te 0.12532781556750 0.13892358468295 0.70164741642560 127.600 > 12 32 Te 0.12532781556750 0.63892358468295 0.70164741642560 127.600 > 12 33 Te 0.62394706497731 0.39213904316145 0.37134239858438 127.600 > 5 34 Te 0.62394706497731 0.89213904316145 0.37134239858438 127.600 > 5 35 Te 0.37605293502269 0.39213904316145 0.12865760141562 127.600 > 6 36 Te 0.37605293502269 0.89213904316145 0.12865760141562 127.600 > 6 37 Te 0.37605293502269 0.10786095683855 0.62865760141562 127.600 > 7 38 Te 0.37605293502269 0.60786095683855 0.62865760141562 127.600 > 7 39 Te 0.62394706497731 0.10786095683855 0.87134239858438 127.600 > 8 40 Te 0.62394706497731 0.60786095683855 0.87134239858438 127.600 > 8 41 Te 0.12532781556750 0.36107641531705 0.20164741642559 127.600 > 9 42 Te 0.12532781556750 0.86107641531705 0.20164741642559 127.600 > 9 43 Te 0.37467218443250 0.11107641531705 0.29835258357440 127.600 > 10 44 Te 0.37467218443250 0.61107641531705 0.29835258357440 127.600 > 10 45 Te 0.87467218443250 0.13892358468295 0.79835258357440 127.600 > 11 46 Te 0.87467218443250 0.63892358468295 0.79835258357440 127.600 > 11 47 Te 0.62532781556750 0.38892358468295 0.70164741642560 127.600 > 12 48 Te 0.62532781556750 0.88892358468295 0.70164741642560 127.600 > 12 *49 O 0.75188291722280 0.28146597752132 0.37019590396609 15.999 > 13 50 O 0.75188291722280 0.78146597752132 0.37019590396609 15.999 > 13 51 O 0.74811708277720 0.03146597752132 0.12980409603391 15.999 > 14 52 O 0.74811708277720 0.53146597752132 0.12980409603391 15.999 > 14 53 O 0.24811708277720 0.21853402247868 0.62980409603391 15.999 > 15 54 O 0.24811708277720 0.71853402247868 0.62980409603391 15.999 > 15 55 O 0.25188291722280 0.46853402247868 0.87019590396609 15.999 > 16 56 O 0.25188291722280 0.96853402247868 0.87019590396609 15.999 > 16 *57 O 0.20830317645146 0.27268211175178 0.44685501280512 15.999 > 17 58 O 0.20830317645146 0.77268211175178 0.44685501280512 15.999 > 17 59 O 0.79169682354854 0.27268211175178 0.05314498719488 15.999 > 18 60 O 0.79169682354854 0.77268211175178 0.05314498719488 15.999 > 18 61 O 0.79169682354854 0.22731788824822 0.55314498719488 15.999 > 19 62 O 0.79169682354854 0.72731788824822 0.55314498719488 15.999 > 19 63 O 0.20830317645146 0.22731788824822 0.94685501280512 15.999 > 20 64 O 0.20830317645146 0.72731788824822 0.94685501280512 15.999 > 20 *65 O 0.06760960155020 0.05396901744983 0.45447856327712 15.999 > 21 66 O 0.06760960155020 0.55396901744983 0.45447856327712 15.999 > 21 67 O 0.93239039844980 0.05396901744983 0.04552143672288 15.999 > 22 68 O 0.93239039844980 0.55396901744983 0.04552143672288 15.999 > 22 69 O 0.93239039844980 0.44603098255017 0.54552143672288 15.999 > 23 70 O 0.93239039844980 0.94603098255017 0.54552143672288 15.999 > 23 71 O 0.06760960155020 0.44603098255017 0.95447856327712 15.999 > 24 72 O 0.06760960155020 0.94603098255017 0.95447856327712 15.999 > 24 *73 O 0.97642443041993 0.28937278727345 0.40336660131390 15.999 > 25 74 O 0.97642443041993 0.78937278727345 0.40336660131390 15.999 > 25 75 O 0.02357556958007 0.28937278727345 0.09663339868610 15.999 > 26 76 O 0.02357556958007 0.78937278727345 0.09663339868610 15.999 > 26 77 O 0.02357556958007 0.21062721272655 0.59663339868610 15.999 > 27 78 O 0.02357556958007 0.71062721272655 0.59663339868610 15.999 > 27 79 O 0.97642443041993 0.21062721272655 0.90336660131390 15.999 > 28 80 O 0.97642443041993 0.71062721272655 0.90336660131390 15.999 > 28 *81 O 0.84738972592958 0.03149130568956 0.33003650372842 15.999 > 29 82 O 0.84738972592958 0.53149130568956 0.33003650372842 15.999 > 29 83 O 0.65261027407042 0.28149130568956 0.16996349627158 15.999 > 30 84 O 0.65261027407042 0.78149130568956 0.16996349627158 15.999 > 30 85 O 0.15261027407042 0.46850869431044 0.66996349627158 15.999 > 31 86 O 0.15261027407042 0.96850869431044 0.66996349627158 15.999 > 31 87 O 0.34738972592958 0.21850869431044 0.83003650372842 15.999 > 32 88 O 0.34738972592958 0.71850869431044 0.83003650372842 15.999 > 32 *89 O 0.00000000000000 0.43228979652566 0.25000000000000 15.999 > 33 90 O 0.00000000000000 0.93228979652566 0.25000000000000 15.999 > 33 91 O 0.00000000000000 0.06771020347434 0.75000000000000 15.999 > 34 92 O 0.00000000000000 0.56771020347434 0.75000000000000 15.999 > 34 93 O 0.25188291722280 0.03146597752132 0.37019590396609 15.999 > 13 94 O 0.25188291722280 0.53146597752132 0.37019590396609 15.999 > 13 95 O 0.24811708277720 0.28146597752132 0.12980409603391 15.999 > 14 96 O 0.24811708277720 0.78146597752132 0.12980409603391 15.999 > 14 97 O 0.74811708277720 0.46853402247868 0.62980409603391 15.999 > 15 98 O 0.74811708277720 0.96853402247868 0.62980409603391 15.999 > 15 99 O 0.75188291722280 0.21853402247868 0.87019590396609 15.999 > 16 100 O 0.75188291722280 0.71853402247868 0.87019590396609 15.999 > 16 101 O 0.70830317645146 0.02268211175178 0.44685501280512 15.999 > 17 102 O 0.70830317645146 0.52268211175178 0.44685501280512 15.999 > 17 103 O 0.29169682354854 0.02268211175178 0.05314498719488 15.999 > 18 104 O 0.29169682354854 0.52268211175178 0.05314498719488 15.999 > 18 105 O 0.29169682354854 0.47731788824822 0.55314498719488 15.999 > 19 106 O 0.29169682354854 0.97731788824822 0.55314498719488 15.999 > 19 107 O 0.70830317645146 0.47731788824822 0.94685501280512 15.999 > 20 108 O 0.70830317645146 0.97731788824822 0.94685501280512 15.999 > 20 109 O 0.56760960155020 0.30396901744983 0.45447856327712 15.999 > 21 110 O 0.56760960155020 0.80396901744983 0.45447856327712 15.999 > 21 111 O 0.43239039844980 0.30396901744983 0.04552143672288 15.999 > 22 112 O 0.43239039844980 0.80396901744983 0.04552143672288 15.999 > 22 113 O 0.43239039844980 0.19603098255017 0.54552143672288 15.999 > 23 114 O 0.43239039844980 0.69603098255017 0.54552143672288 15.999 > 23 115 O 0.56760960155020 0.19603098255017 0.95447856327712 15.999 > 24 116 O 0.56760960155020 0.69603098255017 0.95447856327712 15.999 > 24 117 O 0.47642443041993 0.03937278727345 0.40336660131390 15.999 > 25 118 O 0.47642443041993 0.53937278727345 0.40336660131390 15.999 > 25 119 O 0.52357556958007 0.03937278727345 0.09663339868610 15.999 > 26 120 O 0.52357556958007 0.53937278727345 0.09663339868610 15.999 > 26 121 O 0.52357556958007 0.46062721272655 0.59663339868610 15.999 > 27 122 O 0.52357556958007 0.96062721272655 0.59663339868610 15.999 > 27 123 O 0.47642443041993 0.46062721272655 0.90336660131390 15.999 > 28 124 O 0.47642443041993 0.96062721272655 0.90336660131390 15.999 > 28 125 O 0.34738972592958 0.28149130568956 0.33003650372842 15.999 > 29 126 O 0.34738972592958 0.78149130568956 0.33003650372842 15.999 > 29 127 O 0.15261027407042 0.03149130568956 0.16996349627158 15.999 > 30 128 O 0.15261027407042 0.53149130568956 0.16996349627158 15.999 > 30 129 O 0.65261027407042 0.21850869431044 0.66996349627158 15.999 > 31 130 O 0.65261027407042 0.71850869431044 0.66996349627158 15.999 > 31 131 O 0.84738972592958 0.46850869431044 0.83003650372842 15.999 > 32 132 O 0.84738972592958 0.96850869431044 0.83003650372842 15.999 > 32 133 O 0.50000000000000 0.18228979652566 0.25000000000000 15.999 > 33 134 O 0.50000000000000 0.68228979652566 0.25000000000000 15.999 > 33 135 O 0.50000000000000 0.31771020347434 0.75000000000000 15.999 > 34 136 O 0.50000000000000 0.81771020347434 0.75000000000000 15.999 > 34 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5370957 0.0000000 -0.5381906 0.0000000 4.9681742 0.0000000 -0.5381893 0.0000000 4.7049134 -------------------------- Born effective charges -------------------------- 1 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 2 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 3 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 4 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 5 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 6 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 7 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 8 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 9 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 10 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 11 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 12 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 13 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 14 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 15 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 16 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 17 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 18 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 19 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 20 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 21 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 22 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 23 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 24 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 25 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 26 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 27 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 28 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 29 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 30 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 31 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 32 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 33 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 34 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 ---------------------------------------------------------------------------- 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: 408/408 Permutation basis: 25986/25986 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5357 Number of blocks in projector: 5357 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: 1160 Use submatrix version of eigh solver. (1) Block: 500 / 1160 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1160 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 1160 / 1160 (1) 153 eigenvectors found. (1) Complementary block size: 37 (1) Compute compressed projector. (1) Use standard solver. (1) 20 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) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (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: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (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: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5357, 5281), data: False |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (1152, 1136), data: False |-- (1152, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1152, 1136), data: False |-- (1152, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1160, 1143), data: False |-- (1160, 20), data: (1160, 37) @ (37, 20) |-- (160, 153), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), data: True ----- Solver_atoms: 1 -- 136 / 136 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1040 - Time: 1.658 Solver_block: 200 / 1040 - Time: 1.480 Solver_block: 300 / 1040 - Time: 1.480 Solver_block: 400 / 1040 - Time: 1.480 Solver_block: 500 / 1040 - Time: 1.477 Solver_block: 600 / 1040 - Time: 1.484 Solver_block: 700 / 1040 - Time: 1.488 Solver_block: 800 / 1040 - Time: 1.484 Solver_block: 900 / 1040 - Time: 1.483 Solver_block: 1000 / 1040 - Time: 1.486 Solver_block: 1040 / 1040 - Time: 0.736 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 16.164 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 408/408 Permutation basis: 25986/25986 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5357 Number of blocks in projector: 5357 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: 1160 Use submatrix version of eigh solver. (1) Block: 500 / 1160 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1160 (2) Block: 250 / 500 (2) 237 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 24 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 487 eigenvectors found. (1) Block: 1160 / 1160 (1) 153 eigenvectors found. (1) Complementary block size: 37 (1) Compute compressed projector. (1) Use standard solver. (1) 20 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) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (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: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 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) 234 eigenvectors found. (2) Block: 500 / 500 (2) 236 eigenvectors found. (2) Complementary block size: 30 (2) Compute compressed projector. (2) Use standard solver. (2) 14 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1000 / 1152 (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: 1152 / 1152 (1) 136 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 28 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 631 Use submatrix version of eigh solver. (1) Block: 500 / 631 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 243 eigenvectors found. (2) Complementary block size: 16 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 631 / 631 (1) 122 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5357, 5281), data: False |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (631, 622), data: False |-- (631, 9), data: (631, 18) @ (18, 9) |-- (131, 122), data: True |-- (500, 491), data: False |-- (500, 7), data: (500, 16) @ (16, 7) |-- (250, 243), data: True |-- (250, 241), data: True |-- (1152, 1136), data: False |-- (1152, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1152, 1136), data: False |-- (1152, 28), data: (1152, 44) @ (44, 28) |-- (152, 136), data: True |-- (500, 488), data: False |-- (500, 10), data: (500, 22) @ (22, 10) |-- (250, 240), data: True |-- (250, 238), data: True |-- (500, 484), data: False |-- (500, 14), data: (500, 30) @ (30, 14) |-- (250, 236), data: True |-- (250, 234), data: True |-- (1160, 1143), data: False |-- (1160, 20), data: (1160, 37) @ (37, 20) |-- (160, 153), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) 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 09:51:43]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:51:44]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.133114085010734 -2.543438125000000 0.000000000000000 b 6.133114085010734 2.543438125000000 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): 1 Dy 0.86649240951628 0.37142234429489 0.03673302649243 162.500 2 Dy 0.62857765570511 0.13350759048372 0.46326697350757 162.500 3 Dy 0.13350759048372 0.62857765570511 0.96326697350757 162.500 4 Dy 0.37142234429489 0.86649240951628 0.53673302649243 162.500 5 Te 0.83966897865440 0.40822515130022 0.37134239858438 127.600 6 Te 0.59177484869978 0.16033102134560 0.12865760141562 127.600 7 Te 0.16033102134560 0.59177484869978 0.62865760141562 127.600 8 Te 0.40822515130022 0.83966897865440 0.87134239858438 127.600 9 Te 0.40317498493340 0.84748064620159 0.20164741642559 127.600 10 Te 0.15251935379841 0.59682501506660 0.29835258357440 127.600 11 Te 0.59682501506660 0.15251935379841 0.79835258357440 127.600 12 Te 0.84748064620159 0.40317498493340 0.70164741642560 127.600 13 O 0.18895096218017 0.31481487226543 0.37019590396609 15.999 14 O 0.68518512773457 0.81104903781983 0.12980409603391 15.999 15 O 0.81104903781983 0.68518512773457 0.62980409603391 15.999 16 O 0.31481487226543 0.18895096218017 0.87019590396609 15.999 17 O 0.66293895294790 0.75366739995502 0.44685501280512 15.999 18 O 0.24633260004498 0.33706104705210 0.05314498719488 15.999 19 O 0.33706104705210 0.24633260004498 0.55314498719488 15.999 20 O 0.75366739995502 0.66293895294790 0.94685501280512 15.999 21 O 0.95967156665053 0.17554763644987 0.45447856327712 15.999 22 O 0.82445236355013 0.04032843334947 0.04552143672288 15.999 23 O 0.04032843334947 0.82445236355013 0.54552143672288 15.999 24 O 0.17554763644987 0.95967156665053 0.95447856327712 15.999 25 O 0.39767885587302 0.55517000496684 0.40336660131390 15.999 26 O 0.44482999503316 0.60232114412698 0.09663339868610 15.999 27 O 0.60232114412698 0.44482999503316 0.59663339868610 15.999 28 O 0.55517000496684 0.39767885587302 0.90336660131390 15.999 29 O 0.78440711455047 0.91037233730869 0.33003650372842 15.999 30 O 0.08962766269131 0.21559288544953 0.16996349627158 15.999 31 O 0.21559288544953 0.08962766269131 0.66996349627158 15.999 32 O 0.91037233730869 0.78440711455047 0.83003650372842 15.999 33 O 0.13542040694867 0.86457959305133 0.25000000000000 15.999 34 O 0.86457959305133 0.13542040694867 0.75000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.266228170021469 0.000000000000000 0.000000000000000 b 0.000000000000000 10.173752500000001 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): 1 Dy 0.61895737690558 0.37623248369465 0.03673302649243 162.500 > 1 2 Dy 0.61895737690558 0.87623248369465 0.03673302649243 162.500 > 1 3 Dy 0.88104262309442 0.12623248369465 0.46326697350757 162.500 > 3 4 Dy 0.88104262309442 0.62623248369465 0.46326697350757 162.500 > 3 5 Dy 0.38104262309442 0.12376751630535 0.96326697350757 162.500 > 5 6 Dy 0.38104262309442 0.62376751630535 0.96326697350757 162.500 > 5 7 Dy 0.11895737690558 0.37376751630535 0.53673302649243 162.500 > 7 8 Dy 0.11895737690558 0.87376751630535 0.53673302649243 162.500 > 7 9 Dy 0.11895737690558 0.12623248369465 0.03673302649243 162.500 > 1 10 Dy 0.11895737690558 0.62623248369465 0.03673302649243 162.500 > 1 11 Dy 0.38104262309442 0.37623248369465 0.46326697350757 162.500 > 3 12 Dy 0.38104262309442 0.87623248369465 0.46326697350757 162.500 > 3 13 Dy 0.88104262309442 0.37376751630535 0.96326697350757 162.500 > 5 14 Dy 0.88104262309442 0.87376751630535 0.96326697350757 162.500 > 5 15 Dy 0.61895737690558 0.12376751630535 0.53673302649243 162.500 > 7 16 Dy 0.61895737690558 0.62376751630535 0.53673302649243 162.500 > 7 17 Te 0.12394706497731 0.14213904316145 0.37134239858438 127.600 > 17 18 Te 0.12394706497731 0.64213904316145 0.37134239858438 127.600 > 17 19 Te 0.87605293502269 0.14213904316145 0.12865760141562 127.600 > 19 20 Te 0.87605293502269 0.64213904316145 0.12865760141562 127.600 > 19 21 Te 0.87605293502269 0.35786095683855 0.62865760141562 127.600 > 21 22 Te 0.87605293502269 0.85786095683855 0.62865760141562 127.600 > 21 23 Te 0.12394706497731 0.35786095683855 0.87134239858438 127.600 > 23 24 Te 0.12394706497731 0.85786095683855 0.87134239858438 127.600 > 23 25 Te 0.62532781556750 0.11107641531705 0.20164741642559 127.600 > 25 26 Te 0.62532781556750 0.61107641531705 0.20164741642559 127.600 > 25 27 Te 0.87467218443250 0.36107641531705 0.29835258357440 127.600 > 27 28 Te 0.87467218443250 0.86107641531705 0.29835258357440 127.600 > 27 29 Te 0.37467218443250 0.38892358468295 0.79835258357440 127.600 > 29 30 Te 0.37467218443250 0.88892358468295 0.79835258357440 127.600 > 29 31 Te 0.12532781556750 0.13892358468295 0.70164741642560 127.600 > 31 32 Te 0.12532781556750 0.63892358468295 0.70164741642560 127.600 > 31 33 Te 0.62394706497731 0.39213904316145 0.37134239858438 127.600 > 17 34 Te 0.62394706497731 0.89213904316145 0.37134239858438 127.600 > 17 35 Te 0.37605293502269 0.39213904316145 0.12865760141562 127.600 > 19 36 Te 0.37605293502269 0.89213904316145 0.12865760141562 127.600 > 19 37 Te 0.37605293502269 0.10786095683855 0.62865760141562 127.600 > 21 38 Te 0.37605293502269 0.60786095683855 0.62865760141562 127.600 > 21 39 Te 0.62394706497731 0.10786095683855 0.87134239858438 127.600 > 23 40 Te 0.62394706497731 0.60786095683855 0.87134239858438 127.600 > 23 41 Te 0.12532781556750 0.36107641531705 0.20164741642559 127.600 > 25 42 Te 0.12532781556750 0.86107641531705 0.20164741642559 127.600 > 25 43 Te 0.37467218443250 0.11107641531705 0.29835258357440 127.600 > 27 44 Te 0.37467218443250 0.61107641531705 0.29835258357440 127.600 > 27 45 Te 0.87467218443250 0.13892358468295 0.79835258357440 127.600 > 29 46 Te 0.87467218443250 0.63892358468295 0.79835258357440 127.600 > 29 47 Te 0.62532781556750 0.38892358468295 0.70164741642560 127.600 > 31 48 Te 0.62532781556750 0.88892358468295 0.70164741642560 127.600 > 31 49 O 0.75188291722280 0.28146597752132 0.37019590396609 15.999 > 49 50 O 0.75188291722280 0.78146597752132 0.37019590396609 15.999 > 49 51 O 0.74811708277720 0.03146597752132 0.12980409603391 15.999 > 51 52 O 0.74811708277720 0.53146597752132 0.12980409603391 15.999 > 51 53 O 0.24811708277720 0.21853402247868 0.62980409603391 15.999 > 53 54 O 0.24811708277720 0.71853402247868 0.62980409603391 15.999 > 53 55 O 0.25188291722280 0.46853402247868 0.87019590396609 15.999 > 55 56 O 0.25188291722280 0.96853402247868 0.87019590396609 15.999 > 55 57 O 0.20830317645146 0.27268211175178 0.44685501280512 15.999 > 57 58 O 0.20830317645146 0.77268211175178 0.44685501280512 15.999 > 57 59 O 0.79169682354854 0.27268211175178 0.05314498719488 15.999 > 59 60 O 0.79169682354854 0.77268211175178 0.05314498719488 15.999 > 59 61 O 0.79169682354854 0.22731788824822 0.55314498719488 15.999 > 61 62 O 0.79169682354854 0.72731788824822 0.55314498719488 15.999 > 61 63 O 0.20830317645146 0.22731788824822 0.94685501280512 15.999 > 63 64 O 0.20830317645146 0.72731788824822 0.94685501280512 15.999 > 63 65 O 0.06760960155020 0.05396901744983 0.45447856327712 15.999 > 65 66 O 0.06760960155020 0.55396901744983 0.45447856327712 15.999 > 65 67 O 0.93239039844980 0.05396901744983 0.04552143672288 15.999 > 67 68 O 0.93239039844980 0.55396901744983 0.04552143672288 15.999 > 67 69 O 0.93239039844980 0.44603098255017 0.54552143672288 15.999 > 69 70 O 0.93239039844980 0.94603098255017 0.54552143672288 15.999 > 69 71 O 0.06760960155020 0.44603098255017 0.95447856327712 15.999 > 71 72 O 0.06760960155020 0.94603098255017 0.95447856327712 15.999 > 71 73 O 0.97642443041993 0.28937278727345 0.40336660131390 15.999 > 73 74 O 0.97642443041993 0.78937278727345 0.40336660131390 15.999 > 73 75 O 0.02357556958007 0.28937278727345 0.09663339868610 15.999 > 75 76 O 0.02357556958007 0.78937278727345 0.09663339868610 15.999 > 75 77 O 0.02357556958007 0.21062721272655 0.59663339868610 15.999 > 77 78 O 0.02357556958007 0.71062721272655 0.59663339868610 15.999 > 77 79 O 0.97642443041993 0.21062721272655 0.90336660131390 15.999 > 79 80 O 0.97642443041993 0.71062721272655 0.90336660131390 15.999 > 79 81 O 0.84738972592958 0.03149130568956 0.33003650372842 15.999 > 81 82 O 0.84738972592958 0.53149130568956 0.33003650372842 15.999 > 81 83 O 0.65261027407042 0.28149130568956 0.16996349627158 15.999 > 83 84 O 0.65261027407042 0.78149130568956 0.16996349627158 15.999 > 83 85 O 0.15261027407042 0.46850869431044 0.66996349627158 15.999 > 85 86 O 0.15261027407042 0.96850869431044 0.66996349627158 15.999 > 85 87 O 0.34738972592958 0.21850869431044 0.83003650372842 15.999 > 87 88 O 0.34738972592958 0.71850869431044 0.83003650372842 15.999 > 87 89 O 0.00000000000000 0.43228979652566 0.25000000000000 15.999 > 89 90 O 0.00000000000000 0.93228979652566 0.25000000000000 15.999 > 89 91 O 0.00000000000000 0.06771020347434 0.75000000000000 15.999 > 91 92 O 0.00000000000000 0.56771020347434 0.75000000000000 15.999 > 91 93 O 0.25188291722280 0.03146597752132 0.37019590396609 15.999 > 49 94 O 0.25188291722280 0.53146597752132 0.37019590396609 15.999 > 49 95 O 0.24811708277720 0.28146597752132 0.12980409603391 15.999 > 51 96 O 0.24811708277720 0.78146597752132 0.12980409603391 15.999 > 51 97 O 0.74811708277720 0.46853402247868 0.62980409603391 15.999 > 53 98 O 0.74811708277720 0.96853402247868 0.62980409603391 15.999 > 53 99 O 0.75188291722280 0.21853402247868 0.87019590396609 15.999 > 55 100 O 0.75188291722280 0.71853402247868 0.87019590396609 15.999 > 55 101 O 0.70830317645146 0.02268211175178 0.44685501280512 15.999 > 57 102 O 0.70830317645146 0.52268211175178 0.44685501280512 15.999 > 57 103 O 0.29169682354854 0.02268211175178 0.05314498719488 15.999 > 59 104 O 0.29169682354854 0.52268211175178 0.05314498719488 15.999 > 59 105 O 0.29169682354854 0.47731788824822 0.55314498719488 15.999 > 61 106 O 0.29169682354854 0.97731788824822 0.55314498719488 15.999 > 61 107 O 0.70830317645146 0.47731788824822 0.94685501280512 15.999 > 63 108 O 0.70830317645146 0.97731788824822 0.94685501280512 15.999 > 63 109 O 0.56760960155020 0.30396901744983 0.45447856327712 15.999 > 65 110 O 0.56760960155020 0.80396901744983 0.45447856327712 15.999 > 65 111 O 0.43239039844980 0.30396901744983 0.04552143672288 15.999 > 67 112 O 0.43239039844980 0.80396901744983 0.04552143672288 15.999 > 67 113 O 0.43239039844980 0.19603098255017 0.54552143672288 15.999 > 69 114 O 0.43239039844980 0.69603098255017 0.54552143672288 15.999 > 69 115 O 0.56760960155020 0.19603098255017 0.95447856327712 15.999 > 71 116 O 0.56760960155020 0.69603098255017 0.95447856327712 15.999 > 71 117 O 0.47642443041993 0.03937278727345 0.40336660131390 15.999 > 73 118 O 0.47642443041993 0.53937278727345 0.40336660131390 15.999 > 73 119 O 0.52357556958007 0.03937278727345 0.09663339868610 15.999 > 75 120 O 0.52357556958007 0.53937278727345 0.09663339868610 15.999 > 75 121 O 0.52357556958007 0.46062721272655 0.59663339868610 15.999 > 77 122 O 0.52357556958007 0.96062721272655 0.59663339868610 15.999 > 77 123 O 0.47642443041993 0.46062721272655 0.90336660131390 15.999 > 79 124 O 0.47642443041993 0.96062721272655 0.90336660131390 15.999 > 79 125 O 0.34738972592958 0.28149130568956 0.33003650372842 15.999 > 81 126 O 0.34738972592958 0.78149130568956 0.33003650372842 15.999 > 81 127 O 0.15261027407042 0.03149130568956 0.16996349627158 15.999 > 83 128 O 0.15261027407042 0.53149130568956 0.16996349627158 15.999 > 83 129 O 0.65261027407042 0.21850869431044 0.66996349627158 15.999 > 85 130 O 0.65261027407042 0.71850869431044 0.66996349627158 15.999 > 85 131 O 0.84738972592958 0.46850869431044 0.83003650372842 15.999 > 87 132 O 0.84738972592958 0.96850869431044 0.83003650372842 15.999 > 87 133 O 0.50000000000000 0.18228979652566 0.25000000000000 15.999 > 89 134 O 0.50000000000000 0.68228979652566 0.25000000000000 15.999 > 89 135 O 0.50000000000000 0.31771020347434 0.75000000000000 15.999 > 91 136 O 0.50000000000000 0.81771020347434 0.75000000000000 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5370957 0.0000000 -0.5381906 0.0000000 4.9681742 0.0000000 -0.5381893 0.0000000 4.7049134 -------------------------- Born effective charges -------------------------- 1 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 2 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 3 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 4 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 5 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 6 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 7 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 8 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 9 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 10 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 11 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 12 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 13 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 14 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 15 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 16 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 17 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 18 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 19 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 20 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 21 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 22 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 23 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 24 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 25 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 26 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 27 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 28 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 29 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 30 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 31 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 32 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 33 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 34 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 ---------------------------------------------------------------------------- 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Computing fc3[ 89, 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] [-0.0028 0.0000 0.0096] [ 0.0028 0.0000 -0.0096] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xy) -0.00000000 (xy) 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 09:52:39]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 09:52:40]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.133114085010734 -2.543438125000000 0.000000000000000 b 6.133114085010734 2.543438125000000 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): 1 Dy 0.86649240951628 0.37142234429489 0.03673302649243 162.500 2 Dy 0.62857765570511 0.13350759048372 0.46326697350757 162.500 3 Dy 0.13350759048372 0.62857765570511 0.96326697350757 162.500 4 Dy 0.37142234429489 0.86649240951628 0.53673302649243 162.500 5 Te 0.83966897865440 0.40822515130022 0.37134239858438 127.600 6 Te 0.59177484869978 0.16033102134560 0.12865760141562 127.600 7 Te 0.16033102134560 0.59177484869978 0.62865760141562 127.600 8 Te 0.40822515130022 0.83966897865440 0.87134239858438 127.600 9 Te 0.40317498493340 0.84748064620159 0.20164741642559 127.600 10 Te 0.15251935379841 0.59682501506660 0.29835258357440 127.600 11 Te 0.59682501506660 0.15251935379841 0.79835258357440 127.600 12 Te 0.84748064620159 0.40317498493340 0.70164741642560 127.600 13 O 0.18895096218017 0.31481487226543 0.37019590396609 15.999 14 O 0.68518512773457 0.81104903781983 0.12980409603391 15.999 15 O 0.81104903781983 0.68518512773457 0.62980409603391 15.999 16 O 0.31481487226543 0.18895096218017 0.87019590396609 15.999 17 O 0.66293895294790 0.75366739995502 0.44685501280512 15.999 18 O 0.24633260004498 0.33706104705210 0.05314498719488 15.999 19 O 0.33706104705210 0.24633260004498 0.55314498719488 15.999 20 O 0.75366739995502 0.66293895294790 0.94685501280512 15.999 21 O 0.95967156665053 0.17554763644987 0.45447856327712 15.999 22 O 0.82445236355013 0.04032843334947 0.04552143672288 15.999 23 O 0.04032843334947 0.82445236355013 0.54552143672288 15.999 24 O 0.17554763644987 0.95967156665053 0.95447856327712 15.999 25 O 0.39767885587302 0.55517000496684 0.40336660131390 15.999 26 O 0.44482999503316 0.60232114412698 0.09663339868610 15.999 27 O 0.60232114412698 0.44482999503316 0.59663339868610 15.999 28 O 0.55517000496684 0.39767885587302 0.90336660131390 15.999 29 O 0.78440711455047 0.91037233730869 0.33003650372842 15.999 30 O 0.08962766269131 0.21559288544953 0.16996349627158 15.999 31 O 0.21559288544953 0.08962766269131 0.66996349627158 15.999 32 O 0.91037233730869 0.78440711455047 0.83003650372842 15.999 33 O 0.13542040694867 0.86457959305133 0.25000000000000 15.999 34 O 0.86457959305133 0.13542040694867 0.75000000000000 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.266228170021469 0.000000000000000 0.000000000000000 b 0.000000000000000 10.173752500000001 0.000000000000000 c -4.468379982970076 0.000000000000000 15.308980849728975 Atomic positions (fractional): 1 Dy 0.61895737690558 0.37623248369465 0.03673302649243 162.500 > 1 2 Dy 0.61895737690558 0.87623248369465 0.03673302649243 162.500 > 1 3 Dy 0.88104262309442 0.12623248369465 0.46326697350757 162.500 > 3 4 Dy 0.88104262309442 0.62623248369465 0.46326697350757 162.500 > 3 5 Dy 0.38104262309442 0.12376751630535 0.96326697350757 162.500 > 5 6 Dy 0.38104262309442 0.62376751630535 0.96326697350757 162.500 > 5 7 Dy 0.11895737690558 0.37376751630535 0.53673302649243 162.500 > 7 8 Dy 0.11895737690558 0.87376751630535 0.53673302649243 162.500 > 7 9 Dy 0.11895737690558 0.12623248369465 0.03673302649243 162.500 > 1 10 Dy 0.11895737690558 0.62623248369465 0.03673302649243 162.500 > 1 11 Dy 0.38104262309442 0.37623248369465 0.46326697350757 162.500 > 3 12 Dy 0.38104262309442 0.87623248369465 0.46326697350757 162.500 > 3 13 Dy 0.88104262309442 0.37376751630535 0.96326697350757 162.500 > 5 14 Dy 0.88104262309442 0.87376751630535 0.96326697350757 162.500 > 5 15 Dy 0.61895737690558 0.12376751630535 0.53673302649243 162.500 > 7 16 Dy 0.61895737690558 0.62376751630535 0.53673302649243 162.500 > 7 17 Te 0.12394706497731 0.14213904316145 0.37134239858438 127.600 > 17 18 Te 0.12394706497731 0.64213904316145 0.37134239858438 127.600 > 17 19 Te 0.87605293502269 0.14213904316145 0.12865760141562 127.600 > 19 20 Te 0.87605293502269 0.64213904316145 0.12865760141562 127.600 > 19 21 Te 0.87605293502269 0.35786095683855 0.62865760141562 127.600 > 21 22 Te 0.87605293502269 0.85786095683855 0.62865760141562 127.600 > 21 23 Te 0.12394706497731 0.35786095683855 0.87134239858438 127.600 > 23 24 Te 0.12394706497731 0.85786095683855 0.87134239858438 127.600 > 23 25 Te 0.62532781556750 0.11107641531705 0.20164741642559 127.600 > 25 26 Te 0.62532781556750 0.61107641531705 0.20164741642559 127.600 > 25 27 Te 0.87467218443250 0.36107641531705 0.29835258357440 127.600 > 27 28 Te 0.87467218443250 0.86107641531705 0.29835258357440 127.600 > 27 29 Te 0.37467218443250 0.38892358468295 0.79835258357440 127.600 > 29 30 Te 0.37467218443250 0.88892358468295 0.79835258357440 127.600 > 29 31 Te 0.12532781556750 0.13892358468295 0.70164741642560 127.600 > 31 32 Te 0.12532781556750 0.63892358468295 0.70164741642560 127.600 > 31 33 Te 0.62394706497731 0.39213904316145 0.37134239858438 127.600 > 17 34 Te 0.62394706497731 0.89213904316145 0.37134239858438 127.600 > 17 35 Te 0.37605293502269 0.39213904316145 0.12865760141562 127.600 > 19 36 Te 0.37605293502269 0.89213904316145 0.12865760141562 127.600 > 19 37 Te 0.37605293502269 0.10786095683855 0.62865760141562 127.600 > 21 38 Te 0.37605293502269 0.60786095683855 0.62865760141562 127.600 > 21 39 Te 0.62394706497731 0.10786095683855 0.87134239858438 127.600 > 23 40 Te 0.62394706497731 0.60786095683855 0.87134239858438 127.600 > 23 41 Te 0.12532781556750 0.36107641531705 0.20164741642559 127.600 > 25 42 Te 0.12532781556750 0.86107641531705 0.20164741642559 127.600 > 25 43 Te 0.37467218443250 0.11107641531705 0.29835258357440 127.600 > 27 44 Te 0.37467218443250 0.61107641531705 0.29835258357440 127.600 > 27 45 Te 0.87467218443250 0.13892358468295 0.79835258357440 127.600 > 29 46 Te 0.87467218443250 0.63892358468295 0.79835258357440 127.600 > 29 47 Te 0.62532781556750 0.38892358468295 0.70164741642560 127.600 > 31 48 Te 0.62532781556750 0.88892358468295 0.70164741642560 127.600 > 31 49 O 0.75188291722280 0.28146597752132 0.37019590396609 15.999 > 49 50 O 0.75188291722280 0.78146597752132 0.37019590396609 15.999 > 49 51 O 0.74811708277720 0.03146597752132 0.12980409603391 15.999 > 51 52 O 0.74811708277720 0.53146597752132 0.12980409603391 15.999 > 51 53 O 0.24811708277720 0.21853402247868 0.62980409603391 15.999 > 53 54 O 0.24811708277720 0.71853402247868 0.62980409603391 15.999 > 53 55 O 0.25188291722280 0.46853402247868 0.87019590396609 15.999 > 55 56 O 0.25188291722280 0.96853402247868 0.87019590396609 15.999 > 55 57 O 0.20830317645146 0.27268211175178 0.44685501280512 15.999 > 57 58 O 0.20830317645146 0.77268211175178 0.44685501280512 15.999 > 57 59 O 0.79169682354854 0.27268211175178 0.05314498719488 15.999 > 59 60 O 0.79169682354854 0.77268211175178 0.05314498719488 15.999 > 59 61 O 0.79169682354854 0.22731788824822 0.55314498719488 15.999 > 61 62 O 0.79169682354854 0.72731788824822 0.55314498719488 15.999 > 61 63 O 0.20830317645146 0.22731788824822 0.94685501280512 15.999 > 63 64 O 0.20830317645146 0.72731788824822 0.94685501280512 15.999 > 63 65 O 0.06760960155020 0.05396901744983 0.45447856327712 15.999 > 65 66 O 0.06760960155020 0.55396901744983 0.45447856327712 15.999 > 65 67 O 0.93239039844980 0.05396901744983 0.04552143672288 15.999 > 67 68 O 0.93239039844980 0.55396901744983 0.04552143672288 15.999 > 67 69 O 0.93239039844980 0.44603098255017 0.54552143672288 15.999 > 69 70 O 0.93239039844980 0.94603098255017 0.54552143672288 15.999 > 69 71 O 0.06760960155020 0.44603098255017 0.95447856327712 15.999 > 71 72 O 0.06760960155020 0.94603098255017 0.95447856327712 15.999 > 71 73 O 0.97642443041993 0.28937278727345 0.40336660131390 15.999 > 73 74 O 0.97642443041993 0.78937278727345 0.40336660131390 15.999 > 73 75 O 0.02357556958007 0.28937278727345 0.09663339868610 15.999 > 75 76 O 0.02357556958007 0.78937278727345 0.09663339868610 15.999 > 75 77 O 0.02357556958007 0.21062721272655 0.59663339868610 15.999 > 77 78 O 0.02357556958007 0.71062721272655 0.59663339868610 15.999 > 77 79 O 0.97642443041993 0.21062721272655 0.90336660131390 15.999 > 79 80 O 0.97642443041993 0.71062721272655 0.90336660131390 15.999 > 79 81 O 0.84738972592958 0.03149130568956 0.33003650372842 15.999 > 81 82 O 0.84738972592958 0.53149130568956 0.33003650372842 15.999 > 81 83 O 0.65261027407042 0.28149130568956 0.16996349627158 15.999 > 83 84 O 0.65261027407042 0.78149130568956 0.16996349627158 15.999 > 83 85 O 0.15261027407042 0.46850869431044 0.66996349627158 15.999 > 85 86 O 0.15261027407042 0.96850869431044 0.66996349627158 15.999 > 85 87 O 0.34738972592958 0.21850869431044 0.83003650372842 15.999 > 87 88 O 0.34738972592958 0.71850869431044 0.83003650372842 15.999 > 87 89 O 0.00000000000000 0.43228979652566 0.25000000000000 15.999 > 89 90 O 0.00000000000000 0.93228979652566 0.25000000000000 15.999 > 89 91 O 0.00000000000000 0.06771020347434 0.75000000000000 15.999 > 91 92 O 0.00000000000000 0.56771020347434 0.75000000000000 15.999 > 91 93 O 0.25188291722280 0.03146597752132 0.37019590396609 15.999 > 49 94 O 0.25188291722280 0.53146597752132 0.37019590396609 15.999 > 49 95 O 0.24811708277720 0.28146597752132 0.12980409603391 15.999 > 51 96 O 0.24811708277720 0.78146597752132 0.12980409603391 15.999 > 51 97 O 0.74811708277720 0.46853402247868 0.62980409603391 15.999 > 53 98 O 0.74811708277720 0.96853402247868 0.62980409603391 15.999 > 53 99 O 0.75188291722280 0.21853402247868 0.87019590396609 15.999 > 55 100 O 0.75188291722280 0.71853402247868 0.87019590396609 15.999 > 55 101 O 0.70830317645146 0.02268211175178 0.44685501280512 15.999 > 57 102 O 0.70830317645146 0.52268211175178 0.44685501280512 15.999 > 57 103 O 0.29169682354854 0.02268211175178 0.05314498719488 15.999 > 59 104 O 0.29169682354854 0.52268211175178 0.05314498719488 15.999 > 59 105 O 0.29169682354854 0.47731788824822 0.55314498719488 15.999 > 61 106 O 0.29169682354854 0.97731788824822 0.55314498719488 15.999 > 61 107 O 0.70830317645146 0.47731788824822 0.94685501280512 15.999 > 63 108 O 0.70830317645146 0.97731788824822 0.94685501280512 15.999 > 63 109 O 0.56760960155020 0.30396901744983 0.45447856327712 15.999 > 65 110 O 0.56760960155020 0.80396901744983 0.45447856327712 15.999 > 65 111 O 0.43239039844980 0.30396901744983 0.04552143672288 15.999 > 67 112 O 0.43239039844980 0.80396901744983 0.04552143672288 15.999 > 67 113 O 0.43239039844980 0.19603098255017 0.54552143672288 15.999 > 69 114 O 0.43239039844980 0.69603098255017 0.54552143672288 15.999 > 69 115 O 0.56760960155020 0.19603098255017 0.95447856327712 15.999 > 71 116 O 0.56760960155020 0.69603098255017 0.95447856327712 15.999 > 71 117 O 0.47642443041993 0.03937278727345 0.40336660131390 15.999 > 73 118 O 0.47642443041993 0.53937278727345 0.40336660131390 15.999 > 73 119 O 0.52357556958007 0.03937278727345 0.09663339868610 15.999 > 75 120 O 0.52357556958007 0.53937278727345 0.09663339868610 15.999 > 75 121 O 0.52357556958007 0.46062721272655 0.59663339868610 15.999 > 77 122 O 0.52357556958007 0.96062721272655 0.59663339868610 15.999 > 77 123 O 0.47642443041993 0.46062721272655 0.90336660131390 15.999 > 79 124 O 0.47642443041993 0.96062721272655 0.90336660131390 15.999 > 79 125 O 0.34738972592958 0.28149130568956 0.33003650372842 15.999 > 81 126 O 0.34738972592958 0.78149130568956 0.33003650372842 15.999 > 81 127 O 0.15261027407042 0.03149130568956 0.16996349627158 15.999 > 83 128 O 0.15261027407042 0.53149130568956 0.16996349627158 15.999 > 83 129 O 0.65261027407042 0.21850869431044 0.66996349627158 15.999 > 85 130 O 0.65261027407042 0.71850869431044 0.66996349627158 15.999 > 85 131 O 0.84738972592958 0.46850869431044 0.83003650372842 15.999 > 87 132 O 0.84738972592958 0.96850869431044 0.83003650372842 15.999 > 87 133 O 0.50000000000000 0.18228979652566 0.25000000000000 15.999 > 89 134 O 0.50000000000000 0.68228979652566 0.25000000000000 15.999 > 89 135 O 0.50000000000000 0.31771020347434 0.75000000000000 15.999 > 91 136 O 0.50000000000000 0.81771020347434 0.75000000000000 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.5370957 0.0000000 -0.5381906 0.0000000 4.9681742 0.0000000 -0.5381893 0.0000000 4.7049134 -------------------------- Born effective charges -------------------------- 1 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 2 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 3 Dy 4.0032684 -0.1316327 -0.4315826 0.0038927 4.4665133 -0.2219340 -0.2618527 0.1020871 4.6659890 4 Dy 4.0032684 0.1316327 -0.4315826 -0.0038927 4.4665133 0.2219340 -0.2618527 -0.1020871 4.6659890 5 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 6 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 7 Te 4.9113223 -1.0044757 -0.3434861 -0.5057178 4.1158464 0.6395997 -0.3902420 0.6405178 3.0374928 8 Te 4.9113223 1.0044757 -0.3434861 0.5057178 4.1158464 -0.6395997 -0.3902420 -0.6405178 3.0374928 9 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 10 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 11 Te 5.8276308 -0.7966958 -0.9664662 -0.1737254 3.5531458 0.6805733 -1.0203815 0.9473209 3.6857154 12 Te 5.8276308 0.7966958 -0.9664662 0.1737254 3.5531458 -0.6805733 -1.0203815 -0.9473209 3.6857154 13 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 14 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 15 O -3.8750738 0.7391581 0.4076206 0.9708504 -1.9948834 0.2890974 0.7584776 0.0060608 -1.6719447 16 O -3.8750738 -0.7391581 0.4076206 -0.9708504 -1.9948834 -0.2890974 0.7584776 -0.0060608 -1.6719447 17 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 18 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 19 O -2.1252524 -0.3539955 -0.0545046 -0.3243871 -2.3318839 -1.2441939 -0.1144507 -0.8836097 -2.0677027 20 O -2.1252524 0.3539955 -0.0545046 0.3243871 -2.3318839 1.2441939 -0.1144507 0.8836097 -2.0677027 21 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 22 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 23 O -2.3242547 -0.2762456 0.9073920 -0.3878541 -2.1915823 1.0690917 0.5003218 0.9289918 -2.2299054 24 O -2.3242547 0.2762456 0.9073920 0.3878541 -2.1915823 -1.0690917 0.5003218 -0.9289918 -2.2299054 25 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 26 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 27 O -2.4187995 0.4729626 -0.3700375 0.4685585 -2.0041727 0.6643315 -0.3642837 0.4738671 -2.6160381 28 O -2.4187995 -0.4729626 -0.3700375 -0.4685585 -2.0041727 -0.6643315 -0.3642837 -0.4738671 -2.6160381 29 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 30 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 31 O -1.7304456 0.7333249 0.3690224 0.3257536 -2.7125530 -0.8549340 0.0862144 -0.4606465 -1.9589066 32 O -1.7304456 -0.7333249 0.3690224 -0.3257536 -2.7125530 0.8549340 0.0862144 0.4606465 -1.9589066 33 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 34 O -4.5367909 0.0000000 0.9640838 0.0000000 -1.8008604 0.0000000 1.6123936 0.0000000 -1.6893999 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (xxx) 0.00000000 (xxx) 0.00000000 (xxx) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- 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 ... [ 11 11 3 ] 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: 0.53, Number of G-points: 311, Lambda: 0.12 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/102) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 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 1.096 ( 0.000 0.000 0.000) 0.000 1.255 ( 0.000 0.000 0.000) 0.000 1.691 ( 0.000 0.000 0.000) 0.000 1.794 ( 0.000 0.000 0.000) 0.000 2.201 ( 0.000 0.000 0.000) 0.000 2.253 ( 0.000 0.000 0.000) 0.000 2.451 ( 0.000 0.000 0.000) 0.000 2.622 ( 0.000 0.000 0.000) 0.000 2.808 ( 0.000 0.000 0.000) 0.000 2.975 ( 0.000 0.000 0.000) 0.000 3.085 ( 0.000 0.000 0.000) 0.000 3.143 ( 0.000 0.000 0.000) 0.000 3.365 ( 0.000 0.000 0.000) 0.000 3.459 ( 0.000 0.000 0.000) 0.000 3.467 ( 0.000 0.000 0.000) 0.000 3.494 ( 0.000 0.000 0.000) 0.000 3.630 ( 0.000 0.000 0.000) 0.000 3.723 ( 0.000 0.000 0.000) 0.000 3.904 ( 0.000 0.000 0.000) 0.000 3.926 ( 0.000 0.000 0.000) 0.000 4.002 ( 0.000 0.000 0.000) 0.000 4.234 ( 0.000 0.000 0.000) 0.000 4.448 ( 0.000 0.000 0.000) 0.000 4.608 ( 0.000 0.000 0.000) 0.000 4.679 ( 0.000 0.000 0.000) 0.000 4.690 ( 0.000 0.000 0.000) 0.000 4.829 ( 0.000 0.000 0.000) 0.000 4.872 ( 0.000 0.000 0.000) 0.000 4.930 ( 0.000 0.000 0.000) 0.000 5.000 ( 0.000 0.000 0.000) 0.000 5.133 ( 0.000 0.000 0.000) 0.000 5.139 ( 0.000 0.000 0.000) 0.000 5.372 ( 0.000 0.000 0.000) 0.000 5.482 ( 0.000 0.000 0.000) 0.000 5.572 ( 0.000 0.000 0.000) 0.000 5.661 ( 0.000 0.000 0.000) 0.000 5.663 ( 0.000 0.000 0.000) 0.000 5.904 ( 0.000 0.000 0.000) 0.000 5.948 ( 0.000 0.000 0.000) 0.000 6.123 ( 0.000 0.000 0.000) 0.000 6.233 ( 0.000 0.000 0.000) 0.000 6.649 ( 0.000 0.000 0.000) 0.000 6.731 ( 0.000 0.000 0.000) 0.000 6.983 ( 0.000 0.000 0.000) 0.000 6.994 ( 0.000 0.000 0.000) 0.000 7.025 ( 0.000 0.000 0.000) 0.000 7.407 ( 0.000 0.000 0.000) 0.000 7.652 ( 0.000 0.000 0.000) 0.000 7.995 ( 0.000 0.000 0.000) 0.000 8.144 ( 0.000 0.000 0.000) 0.000 8.401 ( 0.000 0.000 0.000) 0.000 8.534 ( 0.000 0.000 0.000) 0.000 8.850 ( 0.000 0.000 0.000) 0.000 8.985 ( 0.000 0.000 0.000) 0.000 9.077 ( 0.000 0.000 0.000) 0.000 9.177 ( 0.000 0.000 0.000) 0.000 9.409 ( 0.000 0.000 0.000) 0.000 9.666 ( 0.000 0.000 0.000) 0.000 9.776 ( 0.000 0.000 0.000) 0.000 10.453 ( 0.000 0.000 0.000) 0.000 10.708 ( 0.000 0.000 0.000) 0.000 10.732 ( 0.000 0.000 0.000) 0.000 10.787 ( 0.000 0.000 0.000) 0.000 10.925 ( 0.000 0.000 0.000) 0.000 10.939 ( 0.000 0.000 0.000) 0.000 10.946 ( 0.000 0.000 0.000) 0.000 11.199 ( 0.000 0.000 0.000) 0.000 11.354 ( 0.000 0.000 0.000) 0.000 11.445 ( 0.000 0.000 0.000) 0.000 12.344 ( 0.000 0.000 0.000) 0.000 12.377 ( 0.000 0.000 0.000) 0.000 12.417 ( 0.000 0.000 0.000) 0.000 12.531 ( 0.000 0.000 0.000) 0.000 13.066 ( 0.000 0.000 0.000) 0.000 13.068 ( 0.000 0.000 0.000) 0.000 13.954 ( 0.000 0.000 0.000) 0.000 13.973 ( 0.000 0.000 0.000) 0.000 15.801 ( 0.000 0.000 0.000) 0.000 16.202 ( 0.000 0.000 0.000) 0.000 17.301 ( 0.000 0.000 0.000) 0.000 17.365 ( 0.000 0.000 0.000) 0.000 17.492 ( 0.000 0.000 0.000) 0.000 17.889 ( 0.000 0.000 0.000) 0.000 19.165 ( 0.000 0.000 0.000) 0.000 19.548 ( 0.000 0.000 0.000) 0.000 19.617 ( 0.000 0.000 0.000) 0.000 19.690 ( 0.000 0.000 0.000) 0.000 19.965 ( 0.000 0.000 0.000) 0.000 20.127 ( 0.000 0.000 0.000) 0.000 20.625 ( 0.000 0.000 0.000) 0.000 20.656 ( 0.000 0.000 0.000) 0.000 21.608 ( 0.000 0.000 0.000) 0.000 21.873 ( 0.000 0.000 0.000) 0.000 21.887 ( 0.000 0.000 0.000) 0.000 22.363 ( 0.000 0.000 0.000) 0.000 22.432 ( 0.000 0.000 0.000) 0.000 22.900 ( 0.000 0.000 0.000) 0.000 23.058 ( 0.000 0.000 0.000) 0.000 23.102 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/102) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.376 ( 13.827 -16.042 -0.277) 21.181 0.566 ( 6.099 -27.214 7.957) 29.002 0.799 ( 23.257 -33.709 -3.620) 41.113 1.252 ( 4.780 -13.469 -3.723) 14.769 1.267 ( -2.378 -1.174 -3.120) 4.095 1.711 ( 3.534 6.212 -3.702) 8.048 1.773 ( 7.361 -3.582 11.953) 14.487 2.130 ( 11.898 7.784 -7.733) 16.185 2.441 ( 1.802 -11.624 -2.256) 11.978 2.580 ( 1.733 -10.417 -0.322) 10.565 2.676 ( 1.871 -4.766 2.069) 5.522 2.791 ( -0.814 4.484 -2.153) 5.040 2.889 ( 2.853 0.205 0.171) 2.865 3.082 ( -2.857 4.372 0.176) 5.226 3.261 ( 10.120 -1.174 -5.796) 11.721 3.325 ( 2.075 2.570 -1.528) 3.640 3.415 ( -2.025 2.858 0.745) 3.581 3.483 ( -4.235 -1.093 2.985) 5.295 3.543 ( 2.360 -2.190 -0.612) 3.277 3.666 ( 1.369 -2.202 -1.632) 3.064 3.856 ( -1.727 2.233 -4.765) 5.538 3.879 ( -2.527 0.584 4.331) 5.048 3.955 ( -4.457 -2.992 -0.095) 5.369 4.045 ( -6.754 -5.158 -0.595) 8.519 4.217 ( -2.342 1.600 3.060) 4.172 4.462 ( -3.348 5.668 5.234) 8.411 4.493 ( 9.581 9.884 -6.802) 15.355 4.649 ( 0.772 1.513 -2.131) 2.725 4.674 ( 4.442 7.164 -1.846) 8.629 4.794 ( 3.266 5.673 -0.285) 6.552 4.833 ( -6.208 -0.211 1.315) 6.349 5.025 ( -0.555 -0.861 -2.123) 2.357 5.101 ( 0.018 -1.539 0.147) 1.546 5.173 ( -2.010 -3.468 -2.840) 4.913 5.233 ( -4.534 -1.383 0.647) 4.784 5.384 ( 3.192 -2.600 -6.211) 7.451 5.457 ( -6.597 -0.651 -1.343) 6.763 5.604 ( -7.193 1.136 1.415) 7.418 5.676 ( -2.563 -2.285 2.476) 4.233 5.823 ( 15.590 9.567 -4.074) 18.740 5.958 ( 16.302 5.148 5.258) 17.886 6.005 ( 2.224 -4.955 -1.463) 5.625 6.119 ( -0.488 0.336 -0.175) 0.618 6.379 ( 9.962 2.456 1.414) 10.357 6.638 ( -1.076 2.075 2.509) 3.429 6.736 ( 0.914 -0.411 -3.723) 3.856 6.978 ( -1.036 -0.649 2.447) 2.735 7.038 ( 5.163 0.252 0.232) 5.174 7.316 ( -6.119 -7.718 0.914) 9.892 7.690 ( 10.650 1.019 -2.758) 11.048 7.734 ( 27.530 13.769 -7.781) 31.749 8.091 ( 3.699 0.155 -17.940) 18.318 8.198 ( 1.755 3.712 24.300) 24.644 8.351 ( -4.519 7.774 8.733) 12.535 8.545 ( 6.779 3.240 -7.253) 10.443 8.910 ( 0.322 -4.539 5.370) 7.039 8.951 ( -5.289 1.843 0.015) 5.601 9.104 ( 0.176 4.147 -2.600) 4.898 9.189 ( 7.888 -5.091 -5.064) 10.666 9.510 ( 24.017 8.918 -16.485) 30.465 9.696 ( -0.304 -0.862 6.574) 6.637 9.769 ( 8.972 3.033 -6.040) 11.233 10.398 ( 0.468 5.074 0.322) 5.106 10.658 ( -5.699 5.586 -0.574) 8.001 10.709 ( -1.426 4.143 1.506) 4.633 10.833 ( -8.337 -1.154 7.679) 11.393 10.901 ( 3.159 3.088 -5.498) 7.053 10.997 ( -4.690 -2.696 -4.650) 7.133 11.122 ( 6.841 -5.602 2.525) 9.196 11.358 ( 2.679 0.973 0.631) 2.919 11.499 ( 8.717 -1.196 1.503) 8.926 11.575 ( -6.088 -4.355 -12.122) 14.247 12.336 ( -4.094 0.484 3.215) 5.228 12.393 ( 1.300 1.214 -0.401) 1.823 12.452 ( 14.913 6.362 2.856) 16.463 12.560 ( 6.412 7.615 1.151) 10.021 13.052 ( -0.335 1.206 -0.205) 1.268 13.076 ( -0.524 -0.982 0.277) 1.147 13.927 ( -0.039 3.134 0.096) 3.136 14.085 ( -5.985 1.453 0.104) 6.159 15.879 ( 21.139 6.552 -14.951) 26.708 16.194 ( 2.375 2.557 4.298) 5.537 17.357 ( -0.405 -5.234 2.024) 5.626 17.531 ( 1.979 -3.467 -1.107) 4.143 17.814 ( -14.372 -0.265 -0.473) 14.382 18.364 ( 20.911 3.938 -6.515) 22.254 19.163 ( -1.877 3.730 7.818) 8.864 19.442 ( 12.136 13.892 1.498) 18.507 19.567 ( -1.626 11.528 -1.104) 11.694 19.742 ( 3.754 10.337 1.216) 11.065 20.092 ( -18.711 -16.108 3.651) 24.958 20.508 ( -4.424 9.401 1.574) 10.509 20.686 ( 16.761 0.400 -4.116) 17.263 20.807 ( 11.067 -8.288 -7.104) 15.545 21.677 ( 0.671 -6.242 4.246) 7.579 21.899 ( 0.634 -2.398 -0.487) 2.528 22.359 ( 0.170 0.678 -0.287) 0.756 22.443 ( 0.137 -1.400 0.374) 1.456 22.791 ( -3.912 -0.510 0.246) 3.952 23.069 ( -1.577 -1.952 -0.856) 2.651 23.133 ( -1.442 -3.648 0.855) 4.015 23.525 ( -31.970 -13.121 -8.566) 35.603 ======================= Grid point 2 (3/102) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.776 ( 12.617 -17.453 -0.150) 21.536 1.069 ( 3.800 -19.306 8.800) 21.554 1.198 ( 4.923 -0.150 0.467) 4.947 1.515 ( 9.084 -19.475 -3.724) 21.809 1.582 ( 13.073 -22.376 -5.899) 26.578 1.731 ( 7.311 -6.244 -9.097) 13.237 1.948 ( 10.911 -5.267 14.318) 18.756 2.113 ( 9.191 0.901 -4.331) 10.200 2.605 ( -1.599 -5.214 -4.138) 6.846 2.763 ( 3.336 -4.822 -0.171) 5.866 2.776 ( 1.259 -5.860 2.655) 6.555 2.812 ( 0.561 -7.685 3.381) 8.414 2.920 ( -0.806 4.725 0.373) 4.808 2.982 ( 4.851 -0.854 -1.706) 5.213 3.265 ( -1.581 0.660 -1.631) 2.365 3.323 ( -1.189 -0.411 -1.595) 2.032 3.367 ( 1.717 1.792 -1.122) 2.724 3.467 ( -4.965 0.869 4.333) 6.646 3.576 ( 4.008 1.461 -1.209) 4.434 3.697 ( -2.907 -1.903 -3.492) 4.927 3.790 ( -2.153 2.021 0.231) 2.962 3.857 ( -1.565 1.437 0.814) 2.275 3.960 ( -2.726 -1.553 -0.658) 3.206 4.057 ( -9.679 -2.274 0.302) 9.947 4.138 ( -3.996 5.893 4.805) 8.589 4.302 ( -2.815 6.912 0.326) 7.471 4.424 ( 4.499 6.532 0.647) 7.958 4.551 ( 4.680 4.819 -3.545) 7.596 4.658 ( 3.595 0.153 -1.759) 4.006 4.739 ( 3.854 2.898 0.316) 4.832 4.785 ( -8.166 -0.954 0.527) 8.238 5.010 ( 1.197 1.893 -0.374) 2.271 5.146 ( -0.242 -0.318 -3.602) 3.624 5.176 ( -4.840 -3.199 3.884) 6.982 5.253 ( -0.598 -1.639 -1.261) 2.153 5.400 ( -5.513 -1.614 -0.168) 5.747 5.463 ( -0.183 0.110 -3.430) 3.437 5.529 ( -5.450 -1.906 -1.866) 6.068 5.679 ( -5.647 -0.237 4.787) 7.407 5.776 ( 5.333 3.200 0.528) 6.242 6.028 ( 9.024 -0.739 0.752) 9.085 6.087 ( 5.019 -0.715 -0.146) 5.072 6.138 ( -0.510 -4.148 0.168) 4.182 6.407 ( 9.186 2.970 0.861) 9.693 6.561 ( -5.900 3.091 3.390) 7.474 6.768 ( 6.093 -1.167 -5.157) 8.067 7.014 ( 2.172 -1.560 3.341) 4.279 7.078 ( 10.858 2.889 0.241) 11.238 7.383 ( 5.802 0.158 -0.190) 5.807 7.604 ( 14.766 13.403 -5.037) 20.568 7.807 ( 7.390 -3.262 0.333) 8.085 8.071 ( -0.438 0.319 -5.382) 5.409 8.177 ( -2.533 5.669 2.784) 6.804 8.250 ( 3.348 0.814 7.290) 8.063 8.483 ( 1.850 4.980 -7.118) 8.882 8.816 ( -7.134 6.700 1.588) 9.915 8.995 ( -3.589 -4.133 3.639) 6.573 9.088 ( 4.324 1.099 -0.664) 4.510 9.309 ( 3.500 -4.221 -2.684) 6.105 9.464 ( 1.497 4.168 -2.658) 5.165 9.708 ( 1.842 1.950 4.028) 4.840 9.803 ( 8.455 -0.932 -5.768) 10.278 10.322 ( 0.453 4.010 -0.030) 4.035 10.473 ( -2.939 7.389 1.715) 8.135 10.668 ( -1.390 0.484 1.153) 1.870 10.823 ( -6.174 -1.591 5.396) 8.352 10.875 ( -0.470 -0.065 -4.418) 4.443 10.988 ( -1.209 -0.427 -3.896) 4.102 11.227 ( 5.396 -0.715 0.383) 5.457 11.364 ( 4.458 1.510 0.879) 4.788 11.553 ( 2.323 0.727 0.144) 2.439 11.610 ( 4.311 -1.170 0.047) 4.467 12.284 ( -2.592 2.651 1.562) 4.024 12.371 ( -1.429 2.497 -1.309) 3.161 12.462 ( 9.264 8.089 0.464) 12.307 12.467 ( 5.017 0.913 0.106) 5.100 13.030 ( -0.774 0.398 -0.302) 0.921 13.092 ( -1.351 -1.504 0.208) 2.032 13.841 ( -0.340 6.338 0.404) 6.360 13.987 ( -5.358 4.577 0.111) 7.047 15.889 ( 9.505 2.582 -6.152) 11.613 16.162 ( 1.733 3.845 4.426) 6.113 17.471 ( -4.983 -7.753 2.622) 9.581 17.629 ( 2.413 -5.671 -1.569) 6.360 17.754 ( -6.519 -3.240 -1.322) 7.399 18.392 ( 17.749 7.948 -3.659) 19.789 19.056 ( -7.283 6.261 2.490) 9.922 19.249 ( 4.147 17.021 -0.880) 17.541 19.343 ( 7.298 10.646 3.708) 13.430 19.570 ( 3.522 10.721 -2.693) 11.602 20.201 ( -9.797 -3.859 1.736) 10.671 20.275 ( -12.395 6.712 1.417) 14.167 20.824 ( 9.350 -4.438 -0.305) 10.354 21.078 ( 13.118 -12.367 -4.489) 18.579 21.834 ( 1.437 -8.601 4.448) 9.789 21.954 ( 0.906 -3.231 -1.658) 3.743 22.330 ( -0.212 2.472 -0.786) 2.602 22.493 ( 0.426 -3.805 0.949) 3.945 22.752 ( -3.705 1.773 0.438) 4.130 23.094 ( -2.624 -2.612 -2.101) 4.257 23.196 ( -3.022 -4.436 2.210) 5.805 23.497 ( -16.947 -5.541 -3.456) 18.161 ======================= Grid point 3 (4/102) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 10.139 -15.300 -0.152) 18.355 1.199 ( 6.900 -5.401 1.795) 8.944 1.512 ( 7.086 -13.306 4.588) 15.758 1.672 ( 2.026 -6.138 -6.274) 9.008 1.956 ( 8.027 -11.659 -3.050) 14.480 2.092 ( 6.820 -14.133 -1.495) 15.764 2.188 ( 10.259 -10.421 7.436) 16.405 2.266 ( 13.618 -12.384 -4.268) 18.895 2.632 ( -3.064 3.924 -0.896) 5.059 2.679 ( 1.475 4.329 1.271) 4.747 2.861 ( -1.131 -0.302 2.320) 2.599 2.930 ( -2.979 -4.659 3.619) 6.609 3.016 ( 10.009 -6.941 -5.495) 13.362 3.043 ( 2.385 -1.571 0.718) 2.945 3.256 ( -3.973 -2.118 -2.157) 4.993 3.319 ( -4.767 -2.391 0.262) 5.340 3.356 ( -1.123 0.071 -1.120) 1.587 3.387 ( -3.626 4.017 3.516) 6.454 3.547 ( 2.604 3.532 -1.708) 4.709 3.673 ( -3.586 1.396 -2.300) 4.483 3.750 ( -2.891 1.335 2.250) 3.899 3.821 ( -2.775 -0.054 -1.512) 3.161 3.956 ( -2.413 3.449 4.249) 5.981 3.991 ( -7.036 1.646 0.699) 7.260 4.036 ( 0.329 0.024 1.770) 1.800 4.201 ( 0.716 3.725 -1.993) 4.285 4.313 ( -2.113 4.207 -1.619) 4.979 4.557 ( 4.481 1.385 -0.215) 4.695 4.671 ( 5.393 2.546 0.641) 5.998 4.727 ( -2.314 -0.937 -2.335) 3.418 4.801 ( -0.650 -4.291 1.002) 4.454 4.980 ( 2.832 3.181 0.080) 4.260 5.108 ( -12.648 -1.610 4.279) 13.449 5.193 ( 1.028 -0.611 -1.575) 1.978 5.251 ( -4.072 0.501 -3.903) 5.663 5.386 ( -4.517 -0.265 -2.604) 5.220 5.462 ( 1.458 -4.474 0.996) 4.810 5.593 ( 1.726 -3.448 -2.216) 4.447 5.629 ( -6.132 1.131 3.215) 7.015 5.790 ( 2.804 -1.103 1.080) 3.201 6.044 ( -0.761 1.653 1.367) 2.276 6.198 ( 7.518 -3.330 2.267) 8.529 6.227 ( 5.993 -4.697 -0.963) 7.675 6.399 ( 3.306 3.128 -0.321) 4.563 6.506 ( 1.892 0.670 0.858) 2.183 6.832 ( 7.063 -1.189 -3.031) 7.778 7.041 ( 4.681 4.034 0.784) 6.229 7.111 ( 8.723 -0.093 2.895) 9.192 7.390 ( 11.927 7.053 -2.757) 14.128 7.469 ( 2.440 6.710 -1.292) 7.256 7.902 ( 9.727 0.368 -0.326) 9.739 8.048 ( -3.084 0.345 -2.800) 4.180 8.082 ( -0.363 2.173 3.286) 3.956 8.278 ( 4.716 2.739 2.174) 5.871 8.383 ( 0.580 5.761 -4.363) 7.250 8.667 ( -6.677 3.375 1.589) 7.649 9.000 ( -3.571 1.088 -0.471) 3.762 9.080 ( -3.950 -0.182 1.684) 4.298 9.369 ( -4.289 3.171 -2.150) 5.751 9.392 ( 3.519 -0.716 1.530) 3.904 9.658 ( -2.544 4.088 1.268) 4.979 9.865 ( 5.464 -0.219 -3.817) 6.669 10.240 ( -1.914 2.585 1.648) 3.614 10.457 ( 5.415 -2.924 -0.240) 6.159 10.677 ( -0.665 -2.138 1.446) 2.666 10.815 ( -4.433 -1.342 1.257) 4.799 10.870 ( -0.795 -0.616 -2.975) 3.140 10.997 ( 2.491 -0.790 -0.532) 2.667 11.257 ( 5.049 1.014 -0.274) 5.157 11.359 ( 5.123 3.461 0.425) 6.197 11.531 ( 2.873 4.205 0.857) 5.164 11.622 ( -0.221 1.946 0.771) 2.105 12.212 ( -1.764 3.671 0.526) 4.107 12.272 ( -0.406 6.482 -0.076) 6.495 12.426 ( 5.221 1.639 -0.672) 5.513 12.505 ( 4.148 -0.286 0.129) 4.160 13.036 ( -0.221 -1.805 -0.052) 1.819 13.115 ( -1.567 -2.433 -0.170) 2.899 13.702 ( -1.259 8.495 0.886) 8.633 13.855 ( -5.192 5.536 -0.367) 7.599 15.899 ( 5.349 1.375 -3.124) 6.346 16.106 ( -0.101 3.752 2.883) 4.733 17.527 ( -8.855 -4.118 1.279) 9.849 17.758 ( 2.600 -6.838 -2.247) 7.653 17.844 ( 1.483 -7.776 0.527) 7.934 18.342 ( 13.131 9.220 -0.441) 16.051 18.809 ( -6.381 14.186 -0.934) 15.583 19.046 ( 2.709 7.687 0.916) 8.202 19.252 ( 5.357 7.273 2.916) 9.492 19.420 ( 3.180 7.456 -3.184) 8.709 19.980 ( -6.161 12.120 0.223) 13.598 20.242 ( -8.560 -2.660 0.825) 9.001 20.961 ( 4.287 -4.982 0.444) 6.587 21.378 ( 10.437 -11.325 -1.830) 15.509 21.992 ( 1.294 -5.753 2.253) 6.313 22.021 ( 1.051 -4.306 -1.055) 4.556 22.267 ( -0.818 3.695 -0.645) 3.839 22.587 ( -0.074 -5.809 3.161) 6.614 22.680 ( -2.628 3.033 -1.715) 4.364 23.103 ( -3.093 -0.992 -1.956) 3.792 23.247 ( -3.376 -3.456 1.938) 5.205 23.458 ( -11.501 -2.540 -1.512) 11.875 ======================= Grid point 4 (5/102) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 8.245 -12.049 -2.296) 14.780 1.439 ( 5.994 -7.125 -1.942) 9.512 1.683 ( 6.146 -7.004 -1.352) 9.416 1.883 ( 4.389 -10.189 3.378) 11.597 2.195 ( 3.142 -10.630 0.728) 11.109 2.237 ( -0.667 -2.496 3.511) 4.359 2.404 ( 2.700 4.188 -1.821) 5.306 2.518 ( 2.723 -4.476 2.300) 5.722 2.570 ( 10.192 -8.136 -0.724) 13.061 2.718 ( 6.430 -1.648 -5.779) 8.801 2.822 ( -2.884 1.973 2.782) 4.466 2.938 ( -4.781 0.110 1.347) 4.968 3.051 ( -1.664 -1.397 0.802) 2.316 3.179 ( 1.557 -3.780 -4.551) 6.118 3.216 ( -1.747 1.464 1.468) 2.711 3.314 ( -2.464 3.036 -0.522) 3.944 3.345 ( 0.300 1.107 0.830) 1.416 3.370 ( -3.160 -4.019 1.245) 5.262 3.504 ( 2.549 1.877 0.381) 3.189 3.603 ( -2.379 0.802 -2.619) 3.628 3.701 ( -2.089 2.613 2.359) 4.094 3.811 ( -2.688 0.386 -0.023) 2.716 3.864 ( -0.050 2.690 2.186) 3.467 3.963 ( -4.620 -2.204 0.656) 5.161 4.089 ( 3.114 -1.264 -0.988) 3.503 4.174 ( 4.143 -0.151 -1.230) 4.324 4.272 ( -2.756 -1.757 -4.215) 5.333 4.511 ( -1.435 4.905 1.333) 5.282 4.638 ( -2.521 2.550 3.937) 5.325 4.761 ( 3.734 -2.400 -1.631) 4.729 4.872 ( 1.745 -2.121 -0.547) 2.801 4.930 ( -0.008 3.165 3.534) 4.744 5.077 ( -8.244 -2.852 -2.257) 9.011 5.175 ( -6.172 1.641 -2.274) 6.779 5.217 ( 1.485 -0.703 0.697) 1.785 5.388 ( -1.174 -2.718 -0.520) 3.006 5.531 ( -4.342 1.253 4.083) 6.091 5.577 ( 2.069 -2.472 -4.118) 5.229 5.673 ( 0.409 -3.601 -0.182) 3.628 5.841 ( 1.208 -1.816 -0.971) 2.387 5.981 ( -2.688 3.872 3.547) 5.899 6.267 ( 0.970 -1.971 0.924) 2.383 6.383 ( 10.915 -1.335 -1.446) 11.091 6.405 ( 4.060 -3.693 -0.338) 5.498 6.573 ( 7.328 -4.630 -0.542) 8.685 6.867 ( 2.476 3.547 0.248) 4.333 6.986 ( 6.089 3.426 -0.425) 7.000 7.197 ( 2.711 -1.466 5.293) 6.125 7.288 ( 6.642 8.095 -5.892) 12.015 7.415 ( 3.174 3.150 0.817) 4.546 7.925 ( 3.272 1.429 -1.255) 3.785 8.048 ( 4.956 -0.506 -2.293) 5.484 8.087 ( -0.334 -1.162 3.625) 3.821 8.230 ( 3.218 5.316 -0.095) 6.215 8.255 ( -0.432 6.916 -2.800) 7.473 8.609 ( -5.737 0.230 4.969) 7.593 8.922 ( -3.502 3.051 -4.184) 6.252 9.060 ( -5.771 -1.524 1.103) 6.070 9.234 ( -8.649 5.202 2.134) 10.316 9.425 ( 5.575 2.223 -1.876) 6.288 9.572 ( -5.546 0.695 0.547) 5.616 9.866 ( 2.821 2.412 -0.550) 3.752 10.236 ( -0.197 -1.719 0.254) 1.749 10.579 ( 5.980 -4.417 -1.023) 7.504 10.737 ( 0.621 -4.095 1.768) 4.504 10.819 ( -2.327 -2.006 -3.811) 4.895 10.878 ( -0.106 -1.264 1.707) 2.127 11.049 ( 3.175 -2.403 1.313) 4.192 11.271 ( 2.696 0.828 0.048) 2.821 11.322 ( 5.253 4.736 0.293) 7.079 11.438 ( 0.796 7.499 -0.312) 7.547 11.561 ( -2.065 3.228 0.008) 3.832 12.138 ( -1.356 3.058 0.021) 3.345 12.164 ( 0.924 5.460 0.999) 5.627 12.457 ( 3.048 -1.345 -1.045) 3.491 12.530 ( 1.806 0.092 0.184) 1.818 13.092 ( 1.386 -3.740 0.390) 4.008 13.160 ( -0.888 -3.805 -0.739) 3.977 13.533 ( -2.540 8.779 1.099) 9.204 13.720 ( -3.963 5.325 -0.564) 6.662 15.905 ( 3.063 0.870 -1.752) 3.634 16.045 ( -1.311 2.792 1.699) 3.522 17.525 ( -5.410 -1.837 0.302) 5.721 17.877 ( 0.229 -5.391 -2.591) 5.986 18.009 ( 1.307 -8.320 1.520) 8.558 18.281 ( 10.242 7.031 2.697) 12.712 18.534 ( -4.239 10.704 -2.997) 11.897 18.974 ( 3.118 3.910 3.117) 5.892 19.154 ( 1.707 6.402 -2.363) 7.035 19.349 ( 3.267 3.226 -0.199) 4.596 19.749 ( -5.409 8.408 0.153) 9.999 20.213 ( -4.052 0.415 0.007) 4.074 21.062 ( 2.231 -3.474 0.467) 4.155 21.619 ( 6.758 -8.732 -0.225) 11.044 22.062 ( 0.422 -2.327 -2.116) 3.174 22.085 ( 0.297 -0.003 0.193) 0.354 22.212 ( -0.522 0.564 0.962) 1.231 22.587 ( -4.024 3.291 4.509) 6.881 22.727 ( 2.796 -7.006 -3.306) 8.236 23.070 ( -3.332 1.722 -0.725) 3.821 23.281 ( -1.896 -2.320 0.981) 3.153 23.413 ( -7.736 -0.733 -0.692) 7.802 ======================= Grid point 5 (6/102) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 2.719 -0.129 -2.237) 3.524 1.689 ( 3.149 -8.422 -1.697) 9.150 1.896 ( 3.316 -11.647 0.008) 12.110 2.036 ( 3.679 -1.022 2.888) 4.788 2.207 ( -0.294 4.392 2.875) 5.257 2.247 ( -3.338 5.564 -1.194) 6.598 2.377 ( 2.332 -4.269 0.673) 4.911 2.576 ( -1.208 -0.800 0.360) 1.493 2.707 ( 1.383 2.827 -3.625) 4.801 2.756 ( -2.571 -0.954 0.069) 2.743 2.843 ( 8.070 -7.860 1.018) 11.311 2.967 ( -0.108 -4.264 0.093) 4.266 3.056 ( -3.657 -0.246 0.891) 3.772 3.164 ( -1.322 5.574 0.457) 5.747 3.195 ( -0.397 2.197 -0.090) 2.235 3.245 ( 1.784 -0.292 -2.833) 3.360 3.263 ( -2.961 4.065 2.314) 5.536 3.406 ( -0.991 -1.308 0.477) 1.709 3.564 ( 2.811 -3.767 -0.977) 4.801 3.625 ( -1.895 -2.184 0.411) 2.921 3.650 ( 3.161 1.646 -2.172) 4.174 3.728 ( -4.467 3.957 3.986) 7.176 3.912 ( 4.965 -1.985 -3.078) 6.170 3.971 ( -5.000 -2.376 1.561) 5.752 4.108 ( -0.396 -0.787 -0.531) 1.028 4.215 ( 4.706 1.405 -0.600) 4.948 4.302 ( 2.638 -2.939 -4.261) 5.810 4.395 ( -7.196 3.848 2.946) 8.676 4.592 ( -1.443 1.133 2.761) 3.315 4.822 ( 0.757 -1.306 1.639) 2.228 4.880 ( 5.570 1.703 -4.263) 7.217 4.932 ( -1.800 -1.611 4.449) 5.062 5.058 ( -4.000 -1.194 -2.748) 4.998 5.097 ( -4.112 1.820 -0.880) 4.582 5.256 ( 2.878 -1.272 -0.070) 3.147 5.403 ( -1.363 1.693 2.367) 3.213 5.512 ( -2.309 -3.193 0.056) 3.941 5.604 ( 0.995 0.829 -2.210) 2.562 5.740 ( 1.356 -3.078 1.025) 3.516 5.820 ( -2.102 2.796 -1.399) 3.767 5.940 ( -0.075 0.150 1.555) 1.564 6.297 ( 0.429 -0.632 0.260) 0.807 6.467 ( 6.283 -0.792 -1.422) 6.491 6.508 ( 1.773 -4.870 -0.593) 5.216 6.735 ( -0.113 2.790 4.678) 5.448 6.768 ( 5.343 -2.832 -3.283) 6.881 7.014 ( 2.502 -0.989 -0.806) 2.808 7.096 ( -2.433 7.908 1.228) 8.365 7.310 ( 0.990 -3.056 -0.931) 3.345 7.386 ( 3.061 2.929 0.634) 4.283 7.927 ( 0.107 -0.438 -0.585) 0.739 8.087 ( 0.960 -1.174 -1.157) 1.908 8.114 ( 1.573 1.455 2.700) 3.447 8.135 ( 3.091 3.264 -2.721) 5.255 8.198 ( 0.488 0.727 -0.350) 0.943 8.557 ( -4.334 1.783 4.591) 6.560 8.864 ( -0.840 0.193 -4.365) 4.449 9.052 ( -2.273 -0.450 0.192) 2.325 9.101 ( -5.017 2.848 1.871) 6.065 9.405 ( 1.670 1.599 -0.758) 2.433 9.556 ( -1.711 -0.709 0.101) 1.855 9.843 ( 0.885 1.179 0.418) 1.532 10.266 ( 0.095 -1.074 -0.384) 1.144 10.657 ( 2.391 -0.951 -0.437) 2.610 10.816 ( 1.808 -0.724 0.607) 2.040 10.831 ( -1.845 -3.160 -2.434) 4.395 10.923 ( 0.252 -2.186 2.275) 3.165 11.119 ( 1.962 -2.205 0.652) 3.022 11.261 ( -4.145 -0.493 0.874) 4.265 11.276 ( 7.587 5.771 -0.920) 9.577 11.319 ( -2.366 2.915 -0.320) 3.768 11.500 ( 0.025 2.069 -0.300) 2.091 12.092 ( -0.570 1.119 -0.035) 1.256 12.103 ( 0.454 2.024 0.513) 2.137 12.500 ( 1.555 -1.398 -0.614) 2.179 12.529 ( -0.030 0.654 0.270) 0.708 13.173 ( 1.541 -2.852 0.371) 3.263 13.235 ( 0.684 -4.959 -0.971) 5.099 13.369 ( -2.662 7.269 0.928) 7.797 13.619 ( -1.712 2.799 -0.263) 3.292 15.907 ( 1.150 0.325 -0.689) 1.380 16.003 ( -0.867 1.062 0.675) 1.529 17.520 ( -1.672 -0.559 0.049) 1.764 17.935 ( -0.785 -1.871 -1.381) 2.454 18.134 ( 0.123 -3.833 0.829) 3.923 18.266 ( 5.699 2.125 4.472) 7.549 18.366 ( -2.520 4.144 -4.402) 6.550 18.959 ( 1.814 0.751 3.277) 3.820 19.060 ( 0.232 3.423 -3.264) 4.735 19.332 ( 1.343 0.889 0.315) 1.641 19.616 ( -2.354 2.919 0.046) 3.750 20.182 ( -1.293 0.517 -0.092) 1.396 21.117 ( 0.764 -1.228 0.200) 1.460 21.785 ( 3.115 -5.085 0.423) 5.978 22.014 ( -1.309 3.596 -0.767) 3.903 22.108 ( 0.477 -1.231 -1.175) 1.767 22.227 ( -0.001 -0.805 0.811) 1.143 22.524 ( -1.528 1.619 1.601) 2.742 22.864 ( 2.774 -6.101 -1.589) 6.888 22.992 ( -3.064 4.048 0.540) 5.105 23.308 ( 0.073 -1.055 0.359) 1.116 23.373 ( -3.440 0.153 -0.315) 3.458 ======================= Grid point 12 (7/102) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.328 ( 22.801 0.000 -1.099) 22.828 0.403 ( 26.671 0.000 0.433) 26.674 0.771 ( 49.893 0.000 3.859) 50.042 1.160 ( 7.765 0.000 -0.779) 7.804 1.215 ( 2.360 0.000 -12.902) 13.116 1.810 ( 2.876 0.000 10.714) 11.093 1.860 ( 13.399 0.000 6.167) 14.750 2.325 ( 4.468 0.000 -13.125) 13.865 2.348 ( 11.478 0.000 -0.816) 11.507 2.485 ( 3.643 0.000 -0.524) 3.681 2.669 ( 4.569 0.000 4.484) 6.402 2.779 ( -3.474 -0.000 -2.862) 4.501 2.962 ( -0.027 -0.000 -0.284) 0.285 3.067 ( -8.014 -0.000 -2.175) 8.304 3.323 ( 3.654 0.000 -4.908) 6.119 3.381 ( 2.476 0.000 -5.830) 6.334 3.404 ( -7.313 -0.000 3.085) 7.937 3.452 ( -1.529 -0.000 4.285) 4.550 3.531 ( 2.929 0.000 0.563) 2.982 3.727 ( 3.551 0.000 -5.616) 6.645 3.734 ( 2.252 0.000 -3.784) 4.403 3.870 ( -3.327 -0.000 -0.341) 3.345 3.904 ( -2.948 -0.000 1.195) 3.181 4.011 ( 0.587 0.000 0.574) 0.821 4.212 ( -3.423 -0.000 4.267) 5.470 4.491 ( -9.297 -0.000 4.717) 10.426 4.587 ( -4.314 -0.000 -2.464) 4.968 4.706 ( 0.818 0.000 -3.802) 3.889 4.805 ( 0.179 0.000 -0.591) 0.618 4.816 ( 6.928 0.000 -0.962) 6.995 4.898 ( -1.652 -0.000 -0.874) 1.869 4.962 ( -0.683 -0.000 -2.805) 2.887 5.002 ( -0.871 -0.000 -6.804) 6.859 5.137 ( -0.970 -0.000 2.401) 2.590 5.217 ( 6.273 0.000 -6.619) 9.119 5.339 ( -8.191 -0.000 -1.330) 8.298 5.387 ( -4.944 -0.000 -3.127) 5.850 5.548 ( -11.813 -0.000 0.054) 11.813 5.612 ( -7.655 -0.000 7.399) 10.646 5.920 ( -2.731 -0.000 2.393) 3.631 5.939 ( 4.314 0.000 -1.182) 4.473 6.093 ( 0.706 0.000 -7.882) 7.913 6.395 ( 17.306 0.000 0.428) 17.311 6.488 ( -8.631 -0.000 -0.657) 8.656 6.673 ( -6.123 -0.000 -0.840) 6.180 6.706 ( 5.916 0.000 -0.236) 5.921 7.044 ( -0.166 -0.000 9.200) 9.202 7.056 ( 6.759 0.000 -2.096) 7.077 7.136 ( 19.242 0.000 -7.794) 20.760 7.694 ( 6.117 0.000 -1.409) 6.277 8.003 ( 0.617 0.000 1.527) 1.647 8.089 ( 8.378 0.000 -25.628) 26.963 8.333 ( -6.657 -0.000 0.584) 6.683 8.521 ( -21.294 -0.000 49.663) 54.036 8.621 ( 10.824 0.000 -6.623) 12.689 8.854 ( -8.611 -0.000 2.054) 8.852 8.955 ( 0.293 0.000 9.152) 9.157 9.110 ( -6.482 -0.000 -2.486) 6.943 9.207 ( 11.111 0.000 -8.562) 14.027 9.724 ( 3.879 0.000 7.788) 8.701 9.809 ( 6.066 0.000 -4.954) 7.832 10.427 ( 7.109 0.000 -32.849) 33.610 10.530 ( -1.302 -0.000 -16.219) 16.272 10.585 ( -16.914 -0.000 7.554) 18.524 10.693 ( 0.838 0.000 -9.831) 9.867 10.716 ( -7.474 -0.000 1.775) 7.682 10.979 ( 5.024 0.000 -3.959) 6.396 11.019 ( 6.003 0.000 -0.709) 6.045 11.109 ( 13.026 0.000 -43.505) 45.413 11.229 ( 2.428 0.000 6.076) 6.544 11.413 ( 7.561 0.000 -1.217) 7.658 11.588 ( 14.048 0.000 3.115) 14.389 12.293 ( -6.628 -0.000 2.471) 7.073 12.394 ( -4.471 -0.000 0.723) 4.529 12.589 ( 10.498 0.000 -3.390) 11.032 12.988 ( -2.739 -0.000 -0.937) 2.895 13.062 ( -0.129 -0.000 -1.056) 1.064 13.169 ( 8.751 0.000 0.337) 8.757 13.949 ( -2.942 -0.000 -0.124) 2.944 13.958 ( -1.825 -0.000 0.072) 1.826 16.243 ( 0.979 0.000 10.137) 10.184 16.276 ( 11.720 0.000 -62.093) 63.190 17.348 ( -0.261 -0.000 -1.736) 1.755 17.515 ( 3.542 0.000 -1.992) 4.064 17.947 ( 7.219 0.000 -0.867) 7.271 18.363 ( 6.641 0.000 -18.132) 19.310 19.284 ( -21.781 -0.000 20.893) 30.181 19.366 ( -14.273 -0.000 -0.805) 14.295 19.752 ( 8.870 0.000 -2.790) 9.298 19.822 ( 7.288 0.000 12.696) 14.639 20.183 ( 6.534 0.000 1.372) 6.677 20.638 ( 2.238 0.000 -0.457) 2.284 20.656 ( 0.704 0.000 -0.882) 1.128 21.389 ( 35.188 0.000 -105.423) 111.141 21.848 ( -16.643 -0.000 50.679) 53.342 21.891 ( -4.467 -0.000 20.638) 21.116 21.910 ( 3.104 0.000 -0.084) 3.105 22.373 ( 1.455 0.000 -2.903) 3.247 22.433 ( 0.065 0.000 0.203) 0.214 22.856 ( -6.154 -0.000 2.365) 6.593 23.043 ( -1.946 -0.000 -0.053) 1.947 23.082 ( -2.891 -0.000 0.375) 2.915 ======================= Grid point 13 (8/102) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.623 ( 18.136 -12.298 1.022) 21.936 0.783 ( 17.714 -17.571 3.878) 25.250 1.234 ( 6.800 -1.894 -4.030) 8.128 1.314 ( 36.593 -16.144 -1.665) 40.031 1.356 ( 11.556 -12.721 -3.741) 17.588 1.791 ( 7.728 5.096 1.072) 9.319 2.002 ( 14.221 -1.957 11.623) 18.471 2.265 ( 9.921 6.397 -8.962) 14.821 2.487 ( 5.403 -6.057 -2.311) 8.439 2.620 ( 1.989 -9.811 2.030) 10.215 2.728 ( -2.693 -0.819 4.482) 5.292 2.760 ( 6.323 -2.401 -4.435) 8.088 2.924 ( 0.374 0.437 0.180) 0.602 3.034 ( -2.795 0.334 -0.600) 2.878 3.283 ( -3.618 2.249 -1.289) 4.451 3.336 ( -1.632 4.337 -0.946) 4.730 3.385 ( -3.266 -2.073 1.622) 4.195 3.466 ( 2.160 1.555 -0.345) 2.684 3.561 ( -0.391 -3.115 2.274) 3.876 3.688 ( 2.465 1.879 -3.811) 4.912 3.811 ( -1.244 1.103 -3.280) 3.677 3.847 ( -2.483 -3.191 -1.784) 4.420 3.898 ( -2.265 -1.025 1.669) 2.994 3.991 ( -2.615 1.832 0.810) 3.294 4.185 ( -4.156 1.987 5.011) 6.806 4.372 ( -7.083 4.589 3.709) 9.218 4.554 ( -0.127 2.438 -1.858) 3.068 4.657 ( -3.715 1.947 -0.520) 4.227 4.691 ( 3.248 6.256 -4.310) 8.262 4.748 ( -5.353 5.376 -2.930) 8.133 4.858 ( 4.128 4.935 0.471) 6.452 5.011 ( 1.818 -1.361 -3.036) 3.791 5.066 ( -1.984 -5.792 3.900) 7.259 5.153 ( -3.835 -2.384 1.120) 4.652 5.241 ( 1.537 2.640 -2.444) 3.912 5.296 ( -8.186 -3.901 -1.957) 9.277 5.383 ( -2.422 -5.215 -5.319) 7.832 5.462 ( -9.342 0.870 -0.422) 9.392 5.598 ( -8.906 -2.834 6.451) 11.356 5.874 ( 0.127 3.415 1.634) 3.788 5.997 ( -0.841 -3.479 0.431) 3.605 6.097 ( 2.839 -1.228 -5.044) 5.917 6.273 ( 8.979 10.035 0.933) 13.498 6.536 ( 9.638 2.253 3.562) 10.519 6.581 ( -4.624 2.806 -1.277) 5.558 6.775 ( 7.095 -1.996 -3.198) 8.035 7.020 ( 2.205 0.501 3.287) 3.989 7.157 ( 5.905 -1.967 2.681) 6.777 7.351 ( 10.497 -6.226 -3.946) 12.826 7.788 ( 8.201 -4.007 -0.602) 9.148 7.967 ( 6.752 7.346 -0.202) 9.980 8.082 ( 4.544 1.887 -16.222) 16.952 8.243 ( -4.671 4.448 3.342) 7.264 8.342 ( -5.986 7.243 20.840) 22.861 8.611 ( 3.498 7.315 -5.968) 10.068 8.825 ( -10.150 -0.625 1.899) 10.345 8.948 ( -0.310 1.163 8.254) 8.341 9.112 ( 1.624 -2.811 0.284) 3.259 9.288 ( 8.929 -2.006 -6.986) 11.513 9.698 ( 4.630 12.800 -0.867) 13.639 9.797 ( 11.319 4.045 -6.445) 13.639 9.979 ( 17.574 18.481 -14.683) 29.427 10.418 ( 1.806 4.582 1.621) 5.185 10.504 ( -14.293 2.317 2.150) 14.638 10.665 ( -5.720 0.387 3.436) 6.684 10.723 ( -7.130 -3.347 -1.930) 8.110 10.903 ( 2.193 3.721 0.043) 4.320 11.010 ( 7.102 3.841 -7.912) 11.304 11.211 ( 4.856 -6.685 0.406) 8.272 11.435 ( 4.018 -2.077 1.820) 4.876 11.475 ( 3.781 -5.177 -7.550) 9.904 11.688 ( 10.331 0.758 4.502) 11.295 12.258 ( -6.967 -0.797 2.097) 7.319 12.350 ( -5.554 0.210 -0.387) 5.572 12.622 ( 13.956 6.103 -1.335) 15.290 12.813 ( 14.782 16.466 -0.526) 22.134 13.042 ( -0.585 1.360 -0.645) 1.615 13.086 ( 2.877 3.788 1.248) 4.918 13.917 ( -1.906 2.788 0.336) 3.394 13.975 ( -7.682 -1.026 -0.070) 7.750 16.053 ( 7.781 9.644 -16.654) 20.758 16.266 ( 1.164 3.609 6.307) 7.359 17.342 ( -0.498 -1.722 0.211) 1.805 17.579 ( 5.189 -3.496 -2.736) 6.829 17.751 ( 5.499 7.946 1.760) 9.822 18.549 ( 8.600 -3.218 -8.373) 12.427 19.081 ( -10.741 4.066 4.496) 12.333 19.455 ( -13.610 -4.717 -1.565) 14.489 19.689 ( 10.287 12.100 -2.210) 16.035 19.875 ( -8.417 -3.422 6.274) 11.042 19.899 ( 15.895 25.335 5.734) 30.453 20.465 ( -1.199 12.867 -0.312) 12.926 20.819 ( 6.551 -8.019 0.638) 10.374 21.069 ( 24.058 5.604 -16.955) 29.961 21.723 ( 0.901 -5.653 9.977) 11.503 21.914 ( 1.845 -1.826 -1.060) 2.804 22.362 ( 0.629 1.188 -0.913) 1.624 22.449 ( 0.149 -1.811 1.129) 2.139 22.679 ( -10.356 -11.233 -1.790) 15.383 22.970 ( -16.743 -16.456 -4.763) 23.955 23.064 ( -9.079 -8.540 -1.071) 12.511 23.103 ( -5.999 -6.541 2.116) 9.124 ======================= Grid point 14 (9/102) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.989 ( 14.797 -14.078 1.655) 20.491 1.215 ( 10.040 -9.302 6.438) 15.125 1.271 ( 4.757 -8.317 3.777) 10.299 1.623 ( 11.479 -6.795 -10.615) 17.048 1.844 ( 16.305 -9.376 -3.722) 19.173 1.911 ( 22.186 -13.958 -1.387) 26.248 2.174 ( 11.573 -3.861 8.872) 15.085 2.237 ( 9.724 0.408 -6.160) 11.518 2.585 ( 2.354 -2.871 -3.899) 5.384 2.747 ( -4.673 -3.195 4.980) 7.540 2.819 ( -0.016 -8.000 2.195) 8.296 2.858 ( 0.622 2.352 5.379) 5.904 2.930 ( 5.048 -5.169 -3.037) 7.837 3.057 ( 5.181 -2.988 -2.292) 6.405 3.214 ( -4.966 2.257 -0.637) 5.492 3.252 ( -5.151 0.191 -0.450) 5.174 3.385 ( -0.613 1.987 1.312) 2.459 3.418 ( -2.544 2.347 0.216) 3.468 3.626 ( 1.198 -1.909 -0.504) 2.309 3.640 ( -0.176 3.058 -3.693) 4.798 3.753 ( -2.694 2.035 0.193) 3.382 3.838 ( -1.077 3.393 -0.048) 3.560 3.906 ( -3.793 -3.103 -3.076) 5.785 3.948 ( -5.833 -0.845 3.153) 6.684 4.088 ( -5.019 4.789 5.063) 8.588 4.262 ( -2.783 4.584 1.589) 5.593 4.462 ( 0.507 10.184 -1.366) 10.288 4.578 ( 0.024 -1.556 -0.394) 1.605 4.648 ( -6.247 0.243 -2.339) 6.675 4.724 ( 4.978 -3.325 -4.449) 7.459 4.808 ( 2.627 3.467 2.048) 4.807 4.990 ( -6.195 0.406 0.228) 6.212 5.082 ( -3.879 3.836 7.411) 9.203 5.172 ( -1.640 -2.101 -0.387) 2.693 5.209 ( 0.192 -0.975 -8.685) 8.742 5.335 ( -5.592 -1.469 -1.735) 6.037 5.384 ( -4.386 -4.050 2.670) 6.540 5.486 ( -0.091 -6.262 -5.153) 8.110 5.586 ( -9.106 -1.721 5.104) 10.579 5.827 ( 2.034 2.510 1.135) 3.424 6.040 ( -1.092 -1.763 -0.335) 2.100 6.147 ( 1.038 -2.612 1.468) 3.171 6.272 ( 11.539 -0.732 -0.484) 11.572 6.458 ( -3.318 3.969 -0.046) 5.173 6.599 ( 11.188 2.600 0.972) 11.527 6.859 ( 7.932 -1.476 -3.695) 8.874 7.046 ( 0.465 -1.111 2.204) 2.511 7.215 ( 4.222 0.258 3.946) 5.785 7.471 ( 7.369 -0.711 -1.782) 7.614 7.768 ( 6.744 14.798 -0.630) 16.274 7.951 ( 9.608 -1.180 -1.270) 9.764 8.036 ( -1.539 1.484 -4.521) 5.001 8.153 ( -1.941 3.102 4.683) 5.943 8.328 ( 3.322 -1.646 3.603) 5.170 8.485 ( 3.030 6.853 -7.555) 10.641 8.687 ( -11.281 4.991 2.491) 12.584 8.961 ( -2.950 0.040 5.420) 6.170 9.135 ( 1.178 2.563 0.568) 2.878 9.374 ( 7.041 -1.494 -7.767) 10.590 9.480 ( 3.012 10.187 -1.522) 10.732 9.757 ( 2.135 7.215 2.147) 7.824 9.919 ( 9.336 1.725 -5.774) 11.112 10.314 ( -3.870 5.919 3.634) 7.951 10.434 ( -1.521 -2.089 0.779) 2.699 10.636 ( -3.766 -0.570 3.551) 5.207 10.729 ( -5.803 -3.368 -2.822) 7.279 10.870 ( 2.374 1.770 -0.189) 2.967 11.016 ( 5.730 0.298 -3.729) 6.843 11.324 ( 7.503 -1.084 -0.626) 7.606 11.459 ( 7.397 3.047 1.517) 8.142 11.565 ( 2.650 -2.628 -1.532) 4.034 11.709 ( 4.139 4.265 3.399) 6.847 12.217 ( -5.567 0.361 0.533) 5.604 12.309 ( -4.573 0.419 -0.271) 4.600 12.577 ( 11.759 8.589 -0.397) 14.567 12.690 ( 15.933 11.110 -0.104) 19.425 13.014 ( -1.061 0.335 -0.244) 1.139 13.066 ( -2.215 -0.880 0.321) 2.405 13.823 ( -2.606 6.080 0.634) 6.645 13.886 ( -7.839 3.398 -0.149) 8.545 15.963 ( 2.822 3.153 -6.211) 7.515 16.191 ( -1.957 5.157 4.906) 7.382 17.391 ( -3.344 -4.422 0.337) 5.554 17.687 ( 5.368 -4.438 -2.647) 7.451 17.770 ( 6.843 -2.667 1.775) 7.556 18.559 ( 7.024 5.695 -3.010) 9.530 18.939 ( -9.006 5.681 1.920) 10.820 19.298 ( 1.662 13.967 -0.572) 14.078 19.499 ( 8.466 14.150 -0.199) 16.491 19.606 ( 3.496 12.857 -1.713) 13.433 19.978 ( -15.726 -11.238 4.134) 19.765 20.202 ( -0.598 15.019 0.406) 15.036 20.990 ( 12.111 -2.840 0.744) 12.462 21.252 ( 12.986 -9.487 -6.327) 17.283 21.884 ( 1.384 -8.202 7.712) 11.343 21.964 ( 1.855 -2.637 -2.945) 4.367 22.322 ( -0.216 3.089 -1.511) 3.446 22.506 ( 0.544 -3.942 1.808) 4.371 22.684 ( -5.165 0.385 0.258) 5.185 23.029 ( -4.450 -3.729 -3.459) 6.758 23.131 ( -8.137 -6.377 0.616) 10.356 23.220 ( -15.283 -11.435 -0.425) 19.092 ======================= Grid point 15 (10/102) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 7.119 -5.241 1.208) 8.923 1.331 ( 11.363 -12.105 1.251) 16.650 1.645 ( 6.414 -15.338 8.169) 18.523 1.719 ( 9.207 -1.249 -10.081) 13.710 2.072 ( 7.879 -6.108 -2.670) 10.321 2.187 ( 6.676 -6.848 -0.911) 9.607 2.346 ( 7.383 -6.871 3.076) 10.545 2.486 ( 16.284 -11.120 -3.736) 20.069 2.591 ( -1.231 2.989 -0.223) 3.240 2.752 ( 7.044 1.198 1.974) 7.413 2.797 ( -8.797 0.172 4.131) 9.720 2.891 ( -3.707 -0.870 2.153) 4.374 3.063 ( -0.464 -1.979 0.448) 2.081 3.127 ( 4.738 -1.053 -1.732) 5.153 3.202 ( 0.402 -3.587 -3.385) 4.948 3.250 ( -3.892 -4.295 0.648) 5.833 3.323 ( -1.209 2.280 -2.248) 3.423 3.368 ( -1.332 1.340 1.751) 2.576 3.581 ( 3.035 3.344 -2.093) 4.977 3.622 ( -2.215 2.334 -0.202) 3.224 3.711 ( -3.470 0.641 1.232) 3.738 3.783 ( -1.915 0.256 -0.889) 2.127 3.879 ( -6.874 -0.094 3.880) 7.894 3.943 ( -2.410 2.324 0.921) 3.472 4.052 ( 1.161 -4.097 0.353) 4.273 4.179 ( -2.622 2.370 -1.213) 3.736 4.303 ( 0.339 6.302 -0.565) 6.337 4.579 ( -3.722 2.532 -1.518) 4.750 4.613 ( -2.533 -0.439 1.078) 2.788 4.786 ( 0.735 0.559 2.331) 2.508 4.829 ( 5.192 -4.143 -4.336) 7.932 4.936 ( -11.452 -0.634 4.901) 12.473 5.011 ( 2.181 1.642 -2.720) 3.853 5.141 ( -8.163 1.149 -1.028) 8.307 5.220 ( 0.875 -1.177 0.373) 1.514 5.314 ( -1.674 -2.221 -2.150) 3.515 5.503 ( 2.915 -6.127 -1.426) 6.933 5.548 ( -6.344 0.472 3.874) 7.448 5.582 ( -0.965 -5.698 -2.213) 6.188 5.824 ( 1.452 -0.145 0.780) 1.655 6.031 ( -1.553 2.023 1.356) 2.888 6.210 ( -0.018 -3.442 2.423) 4.209 6.388 ( 0.008 -0.687 -1.788) 1.916 6.432 ( 13.563 -3.473 -2.129) 14.161 6.634 ( 10.612 2.637 1.662) 11.060 6.917 ( 5.399 0.174 -3.145) 6.251 7.056 ( -0.673 0.574 0.541) 1.037 7.241 ( 3.454 1.227 6.618) 7.565 7.481 ( 1.833 3.232 0.088) 3.717 7.538 ( 5.987 14.237 -4.311) 16.035 7.952 ( -2.094 2.985 -2.939) 4.683 8.009 ( -2.842 -1.449 1.954) 3.741 8.171 ( 8.160 0.132 3.142) 8.745 8.349 ( 6.200 5.152 -2.898) 8.566 8.385 ( 0.619 6.134 -2.353) 6.598 8.564 ( -6.582 -0.610 2.246) 6.981 8.919 ( -5.777 1.258 1.997) 6.241 9.064 ( 0.393 4.781 -0.304) 4.807 9.274 ( -6.371 6.666 -1.845) 9.404 9.492 ( 8.300 -1.246 -1.171) 8.474 9.598 ( -5.159 8.015 0.722) 9.559 9.943 ( 6.698 2.363 -2.956) 7.693 10.241 ( 0.245 1.429 2.665) 3.034 10.522 ( 2.919 -6.325 0.008) 6.966 10.651 ( -2.811 -2.977 2.248) 4.671 10.745 ( -4.011 -3.065 -2.968) 5.856 10.866 ( 1.816 0.588 1.318) 2.320 11.056 ( 4.977 -0.920 -1.691) 5.337 11.368 ( 10.132 3.249 -1.142) 10.702 11.444 ( 5.511 4.609 1.664) 7.375 11.600 ( 1.497 1.354 -0.139) 2.024 11.615 ( 3.125 8.150 1.271) 8.820 12.166 ( -3.770 1.645 0.221) 4.120 12.255 ( -1.785 3.172 0.329) 3.654 12.520 ( 7.892 5.196 -0.639) 9.471 12.622 ( 10.116 7.409 -0.009) 12.539 13.035 ( -0.121 -3.302 0.547) 3.350 13.084 ( -2.162 -3.040 -0.636) 3.784 13.664 ( -4.509 8.416 0.440) 9.558 13.766 ( -6.343 4.003 0.090) 7.501 15.932 ( 0.381 0.944 -3.047) 3.212 16.093 ( -3.811 4.002 2.735) 6.166 17.441 ( -2.368 -3.528 0.080) 4.249 17.791 ( 1.927 -4.332 -2.088) 5.181 17.907 ( 6.705 -5.683 1.783) 8.968 18.479 ( 5.433 7.118 -0.236) 8.957 18.726 ( -4.299 12.051 0.133) 12.795 19.109 ( 4.582 8.904 1.601) 10.141 19.322 ( 2.989 10.104 -2.819) 10.907 19.460 ( 3.614 6.715 0.449) 7.639 19.910 ( -3.962 12.075 -1.286) 12.774 20.061 ( -13.580 -6.367 2.099) 15.144 21.109 ( 13.499 0.183 0.529) 13.511 21.497 ( 6.978 -9.893 -1.963) 12.265 22.017 ( 2.018 -2.719 -2.921) 4.472 22.040 ( 0.477 -5.695 4.475) 7.259 22.248 ( -1.302 3.812 -0.865) 4.120 22.595 ( -3.196 -2.602 8.704) 9.631 22.637 ( 0.283 -1.394 -6.639) 6.790 23.042 ( -3.540 -1.548 -2.798) 4.770 23.188 ( -5.917 -5.721 0.982) 8.289 23.274 ( -11.529 -6.333 -0.052) 13.154 ======================= Grid point 16 (11/102) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 4.817 -7.126 -2.717) 9.020 1.555 ( 10.129 -5.950 -3.409) 12.232 1.781 ( 7.619 -4.653 -1.806) 9.108 1.965 ( 2.365 -11.254 7.173) 13.554 2.167 ( -2.831 -3.227 0.205) 4.298 2.312 ( 3.462 -0.586 5.234) 6.303 2.443 ( 2.718 5.051 -2.721) 6.349 2.534 ( 2.235 -3.065 -1.758) 4.181 2.667 ( -2.245 -1.895 0.637) 3.006 2.759 ( -3.672 0.636 3.359) 5.017 2.803 ( 5.552 -2.451 -3.282) 6.900 2.906 ( 1.948 -2.665 0.135) 3.303 3.044 ( 2.570 0.179 -0.062) 2.577 3.162 ( -1.852 -1.085 -0.960) 2.351 3.235 ( 3.363 -0.345 -3.041) 4.547 3.286 ( -0.824 1.465 -0.057) 1.682 3.332 ( -3.678 3.525 1.660) 5.358 3.354 ( 1.225 -4.432 -0.500) 4.626 3.544 ( 1.261 1.477 2.888) 3.480 3.585 ( 1.442 -0.727 -2.772) 3.207 3.673 ( -1.580 1.110 0.050) 1.932 3.776 ( -2.430 0.801 1.266) 2.855 3.865 ( -8.228 -2.336 2.269) 8.849 3.892 ( 1.760 -0.859 0.134) 1.963 4.094 ( -2.153 0.791 -1.441) 2.709 4.205 ( -0.708 -6.108 -3.118) 6.895 4.257 ( 3.658 -0.442 -1.081) 3.840 4.448 ( -6.484 6.664 0.592) 9.317 4.597 ( -2.883 0.476 2.769) 4.025 4.803 ( -0.703 -1.185 2.938) 3.245 4.867 ( -10.425 -1.128 2.436) 10.765 4.927 ( 5.547 -2.048 -0.576) 5.941 5.022 ( 4.227 -0.462 -6.659) 7.901 5.075 ( -5.151 0.135 -0.385) 5.168 5.257 ( 0.228 -2.279 1.515) 2.746 5.368 ( 0.295 -4.236 -0.827) 4.326 5.495 ( -1.623 2.593 2.741) 4.107 5.585 ( -0.963 -2.340 -2.349) 3.452 5.683 ( 2.851 -4.965 0.089) 5.726 5.833 ( -1.375 0.195 -0.597) 1.511 5.969 ( -0.627 2.883 2.172) 3.664 6.267 ( -0.707 -2.245 2.261) 3.264 6.431 ( 3.023 -4.088 -4.049) 6.499 6.569 ( 11.196 1.827 -1.510) 11.444 6.705 ( 8.548 -3.826 2.461) 9.683 6.877 ( -1.285 6.413 -0.456) 6.557 7.038 ( 2.060 1.148 -0.971) 2.550 7.226 ( -1.998 4.355 6.291) 7.907 7.324 ( 1.171 8.655 -4.947) 10.037 7.441 ( -0.867 2.281 0.728) 2.546 7.897 ( -2.447 0.238 -3.303) 4.117 8.011 ( -6.770 -1.808 4.049) 8.093 8.190 ( -2.103 3.072 -0.874) 3.824 8.276 ( 5.426 4.065 -1.718) 6.994 8.288 ( 10.196 7.288 -1.803) 12.662 8.568 ( -2.333 0.243 5.487) 5.968 8.862 ( -0.354 1.008 -4.288) 4.419 9.014 ( -1.198 0.003 1.532) 1.945 9.115 ( -7.711 4.095 1.282) 8.824 9.448 ( -4.916 3.942 -0.231) 6.306 9.564 ( 7.584 -0.243 -1.514) 7.738 9.916 ( 4.239 4.227 -0.344) 5.996 10.255 ( 1.970 -0.873 0.475) 2.207 10.662 ( 5.207 -3.462 -0.884) 6.315 10.696 ( -5.349 -5.719 -1.417) 7.958 10.767 ( -2.808 -3.024 0.019) 4.127 10.886 ( 0.546 -1.556 3.121) 3.530 11.110 ( 2.868 -1.681 -0.557) 3.371 11.333 ( 4.027 7.621 -1.135) 8.694 11.386 ( 4.365 5.117 1.390) 6.868 11.474 ( 3.845 7.634 0.856) 8.591 11.584 ( 5.953 4.765 -0.981) 7.688 12.111 ( -2.019 1.771 -0.361) 2.710 12.171 ( -0.777 4.783 0.925) 4.934 12.512 ( 4.918 1.127 -0.737) 5.099 12.574 ( 3.715 3.803 0.144) 5.318 13.119 ( 0.906 -4.771 0.670) 4.902 13.143 ( 0.079 -4.749 -1.032) 4.861 13.479 ( -4.752 7.951 0.131) 9.263 13.653 ( -5.049 3.625 0.541) 6.239 15.915 ( -0.668 0.387 -2.209) 2.339 16.014 ( -3.984 1.867 1.985) 4.827 17.484 ( -0.085 -2.377 -0.008) 2.378 17.855 ( -2.567 -3.633 -1.221) 4.613 18.053 ( 4.032 -5.233 1.533) 6.781 18.402 ( 3.192 4.950 -0.315) 5.899 18.498 ( 2.163 11.610 -0.376) 11.816 19.030 ( 2.695 4.272 4.053) 6.476 19.178 ( 3.117 7.914 -4.489) 9.618 19.398 ( 3.505 3.864 0.738) 5.268 19.685 ( -3.490 8.504 -0.480) 9.205 20.070 ( -13.624 -5.675 0.229) 14.760 21.186 ( 12.503 2.224 0.528) 12.711 21.691 ( 3.208 -7.696 0.060) 8.338 22.058 ( 0.258 0.304 -2.623) 2.653 22.087 ( 0.254 0.055 -1.219) 1.246 22.205 ( -1.466 -0.940 2.423) 2.984 22.547 ( -3.723 2.243 4.261) 6.087 22.757 ( 3.003 -7.445 -2.682) 8.464 23.017 ( -3.081 1.150 -1.133) 3.478 23.251 ( -2.715 -4.538 1.006) 5.383 23.292 ( -7.866 -4.216 -0.466) 8.937 ======================= Grid point 17 (12/102) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( 2.967 2.913 -3.494) 5.431 1.741 ( 4.785 -3.719 -1.280) 6.194 1.934 ( 2.514 -7.036 -3.268) 8.155 2.082 ( -0.156 4.285 4.798) 6.435 2.133 ( -9.392 0.759 7.713) 12.177 2.268 ( 4.483 4.675 -1.889) 6.747 2.399 ( -0.757 -0.647 2.297) 2.503 2.573 ( 1.541 -0.442 -3.591) 3.933 2.691 ( -4.919 -2.335 4.045) 6.783 2.702 ( 0.085 -0.512 -4.548) 4.578 2.918 ( 0.151 -0.204 0.437) 0.505 2.995 ( 5.022 -6.028 0.509) 7.862 3.064 ( 3.509 0.757 -2.727) 4.508 3.134 ( -3.184 6.384 1.181) 7.231 3.173 ( -2.008 -0.372 -1.319) 2.431 3.251 ( 1.151 3.137 1.918) 3.853 3.280 ( 3.602 -0.336 -2.710) 4.520 3.411 ( 1.311 -1.395 -1.044) 2.180 3.562 ( -3.505 -1.741 1.676) 4.257 3.607 ( -0.726 -0.269 2.282) 2.410 3.680 ( 1.492 1.810 0.175) 2.352 3.724 ( 3.556 0.053 -2.805) 4.529 3.851 ( -7.901 -3.235 3.591) 9.263 3.987 ( 2.024 -3.513 -0.128) 4.056 4.083 ( -1.571 -2.864 -3.181) 4.560 4.197 ( -5.039 2.748 0.439) 5.757 4.300 ( -6.700 1.645 2.725) 7.417 4.379 ( 8.174 -4.001 -5.483) 10.625 4.578 ( -1.739 -0.227 1.545) 2.337 4.803 ( -7.789 -0.940 5.429) 9.541 4.825 ( -4.229 -0.408 1.014) 4.368 4.972 ( 4.045 1.530 -4.484) 6.229 5.067 ( 1.510 -3.422 -0.320) 3.754 5.086 ( 5.897 -1.842 -0.981) 6.255 5.277 ( -0.386 0.916 -0.578) 1.150 5.429 ( 2.648 0.167 0.147) 2.657 5.483 ( -1.294 -3.071 1.311) 3.582 5.587 ( -1.906 -0.291 0.737) 2.064 5.766 ( 0.264 0.024 -1.510) 1.533 5.800 ( 1.318 -0.613 1.173) 1.868 5.950 ( 1.010 0.737 0.056) 1.252 6.288 ( -1.412 -0.630 1.313) 2.029 6.520 ( 0.644 0.170 -2.179) 2.279 6.536 ( 2.829 3.577 -0.795) 4.630 6.712 ( -3.194 5.459 1.738) 6.559 6.834 ( 2.329 1.034 0.506) 2.598 7.030 ( 0.650 0.151 -1.936) 2.048 7.070 ( -1.240 6.811 0.813) 6.970 7.269 ( -5.251 -2.494 -0.865) 5.878 7.385 ( -2.979 3.568 1.363) 4.844 7.888 ( -2.530 -1.538 -2.823) 4.091 7.994 ( -9.125 -2.369 4.793) 10.576 8.120 ( -2.955 0.407 -1.179) 3.207 8.199 ( 2.777 7.121 2.807) 8.142 8.266 ( 6.927 4.448 -4.238) 9.259 8.558 ( 3.164 -0.525 -1.978) 3.768 8.878 ( 2.543 -0.511 2.216) 3.411 9.036 ( -0.353 -2.464 2.238) 3.347 9.072 ( 1.319 -2.597 -0.389) 2.938 9.381 ( -3.415 0.436 -0.451) 3.472 9.605 ( 7.081 1.293 -1.371) 7.327 9.870 ( 2.659 3.397 -0.560) 4.351 10.283 ( 1.947 -0.228 0.685) 2.076 10.674 ( -0.171 1.484 -1.840) 2.370 10.746 ( -5.516 -3.212 -2.069) 6.710 10.831 ( -0.793 -3.566 3.064) 4.768 10.931 ( -0.522 -1.533 1.715) 2.359 11.133 ( -1.924 0.041 -0.485) 1.985 11.203 ( -3.048 4.110 0.301) 5.125 11.356 ( 6.209 2.765 0.614) 6.824 11.394 ( 8.984 7.324 -0.688) 11.611 11.532 ( 4.284 4.060 -0.504) 5.924 12.082 ( -0.201 0.085 -1.647) 1.661 12.100 ( -1.582 2.129 1.581) 3.088 12.529 ( 2.458 1.035 -0.285) 2.683 12.538 ( 0.998 1.798 0.262) 2.073 13.188 ( 0.046 -1.453 0.253) 1.476 13.246 ( 1.622 -5.620 -1.340) 6.001 13.326 ( -3.095 5.169 0.261) 6.031 13.588 ( -2.655 -0.267 0.982) 2.843 15.894 ( -2.147 0.299 -1.104) 2.433 15.984 ( -2.013 -0.665 0.936) 2.317 17.526 ( 2.442 -1.417 -0.035) 2.823 17.889 ( -4.955 -3.795 0.157) 6.244 18.140 ( 0.936 -1.500 1.016) 2.039 18.316 ( -1.025 5.701 -4.862) 7.562 18.387 ( 6.680 3.917 3.323) 8.427 18.986 ( -0.361 4.378 3.678) 5.729 19.076 ( 3.675 3.424 -3.236) 5.975 19.356 ( 1.749 3.591 0.002) 3.994 19.591 ( -0.946 -0.409 -0.213) 1.052 20.077 ( -11.438 -5.816 0.024) 12.832 21.215 ( 10.957 4.396 0.286) 11.809 21.801 ( -1.302 -1.950 0.392) 2.378 21.993 ( -1.094 1.715 -0.299) 2.056 22.113 ( 1.272 -0.946 -2.780) 3.200 22.223 ( -1.247 -0.848 1.846) 2.384 22.511 ( -1.261 0.081 1.793) 2.193 22.899 ( 2.699 -5.028 -2.042) 6.061 22.955 ( -2.079 2.316 0.716) 3.193 23.288 ( -3.058 -1.964 0.480) 3.666 23.339 ( -0.628 -4.628 -0.263) 4.678 ======================= Grid point 18 (13/102) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -1.157 3.536 0.368) 3.739 1.656 ( -2.715 13.628 2.100) 14.053 1.838 ( -3.570 12.095 -2.379) 12.834 1.979 ( -2.564 5.149 0.979) 5.835 2.192 ( -0.360 -8.756 -1.187) 8.844 2.261 ( -3.275 0.438 2.880) 4.383 2.380 ( 3.699 4.929 -1.322) 6.303 2.582 ( -1.083 -1.437 -1.941) 2.646 2.682 ( -3.432 0.866 4.036) 5.368 2.723 ( -5.293 13.349 -2.011) 14.500 2.772 ( -0.017 -3.228 -0.508) 3.268 2.964 ( -0.831 3.473 0.492) 3.605 3.145 ( 5.284 1.521 -2.335) 5.974 3.161 ( -0.312 -6.270 1.959) 6.577 3.206 ( 1.202 -0.417 -2.165) 2.511 3.240 ( 0.101 -3.091 0.497) 3.133 3.304 ( 3.169 -2.452 -0.749) 4.076 3.430 ( 1.767 0.482 -1.980) 2.697 3.528 ( -1.208 3.991 0.468) 4.196 3.596 ( -3.179 -2.224 5.374) 6.628 3.680 ( 4.491 0.062 -2.317) 5.054 3.785 ( 4.875 -2.308 -3.948) 6.684 3.857 ( -3.273 -0.372 4.298) 5.414 4.001 ( -1.187 0.139 -0.163) 1.207 4.089 ( -4.710 2.355 0.732) 5.317 4.140 ( -1.417 -1.714 -1.093) 2.478 4.294 ( -2.571 -2.181 4.878) 5.930 4.463 ( 3.698 -2.046 -4.967) 6.522 4.583 ( -2.699 -1.030 -1.276) 3.158 4.795 ( -4.567 -3.312 3.878) 6.845 4.807 ( 0.516 0.960 -0.895) 1.411 4.948 ( 2.650 2.104 -3.730) 5.036 5.143 ( 0.760 -2.041 4.435) 4.941 5.171 ( 6.038 -2.090 -1.807) 6.640 5.253 ( 4.678 1.204 -2.083) 5.261 5.412 ( -0.412 2.299 -0.846) 2.484 5.531 ( -1.496 -3.008 1.310) 3.606 5.597 ( -0.406 -0.001 3.648) 3.670 5.717 ( -1.047 2.499 -1.967) 3.348 5.854 ( 0.850 -0.408 3.394) 3.522 5.942 ( 1.892 -0.380 -4.737) 5.115 6.274 ( -1.879 1.118 0.161) 2.192 6.378 ( -6.117 5.982 3.466) 9.231 6.478 ( -2.052 6.132 -2.130) 6.807 6.669 ( -4.864 9.535 1.809) 10.856 6.736 ( -1.561 -6.334 -2.505) 6.988 6.959 ( -5.144 4.034 -0.006) 6.537 7.116 ( 0.612 -5.242 -1.191) 5.410 7.267 ( -4.271 4.624 2.361) 6.723 7.305 ( -5.615 -4.407 -0.884) 7.192 7.864 ( -6.014 0.283 -1.106) 6.121 8.012 ( -4.814 -5.065 1.732) 7.200 8.106 ( -0.229 4.264 2.873) 5.147 8.150 ( 0.324 -4.544 0.218) 4.561 8.221 ( 2.866 3.113 -1.793) 4.596 8.619 ( 5.784 -1.953 -6.278) 8.757 8.915 ( 2.318 -1.524 4.557) 5.335 9.095 ( 2.644 -2.205 2.005) 3.984 9.194 ( 7.792 -5.676 -1.163) 9.710 9.368 ( -2.370 -1.196 0.252) 2.667 9.621 ( 5.721 1.644 -1.250) 6.082 9.839 ( 0.566 1.030 -0.948) 1.510 10.288 ( 2.763 1.870 1.060) 3.501 10.619 ( -2.462 3.437 -0.193) 4.232 10.727 ( -8.429 -0.528 -0.287) 8.450 10.848 ( -0.638 0.931 3.872) 4.033 10.915 ( 0.556 2.293 -3.300) 4.057 11.087 ( -2.963 1.904 -0.989) 3.658 11.180 ( -4.750 -3.330 1.359) 5.957 11.321 ( 3.078 5.472 -0.397) 6.291 11.393 ( 6.346 -1.168 -0.113) 6.453 11.541 ( 5.179 -0.920 0.172) 5.263 12.082 ( -2.602 -1.445 1.515) 3.340 12.101 ( 1.394 -2.271 -2.259) 3.493 12.488 ( -0.438 2.888 0.650) 2.992 12.537 ( 1.008 0.736 -0.139) 1.256 13.150 ( -1.401 3.848 0.227) 4.101 13.230 ( -0.161 3.511 -0.236) 3.522 13.389 ( 0.547 -8.167 -1.062) 8.254 13.642 ( 1.022 -5.520 1.101) 5.721 15.872 ( -3.235 -0.251 0.202) 3.251 16.003 ( -0.425 -2.135 -0.303) 2.198 17.574 ( 5.583 -0.748 -0.260) 5.639 17.917 ( -4.775 -2.575 2.272) 5.881 18.111 ( -1.921 4.169 0.091) 4.591 18.196 ( -1.055 5.542 -4.934) 7.495 18.441 ( 4.938 -4.258 3.476) 7.389 18.902 ( -4.288 1.133 -1.970) 4.853 19.099 ( 3.778 -1.497 1.753) 4.426 19.306 ( -2.435 1.148 -0.126) 2.695 19.667 ( 5.051 -5.736 -0.385) 7.653 20.113 ( -9.395 -6.764 0.171) 11.578 21.194 ( 9.996 6.580 -0.115) 11.968 21.707 ( -7.090 6.890 -0.146) 9.887 22.036 ( 1.001 -4.121 0.900) 4.336 22.110 ( 0.519 1.625 -0.433) 1.760 22.217 ( -1.123 0.720 0.125) 1.340 22.540 ( 1.245 -3.116 -0.992) 3.500 22.835 ( -1.815 6.215 1.056) 6.560 23.034 ( 2.650 -4.722 -0.526) 5.441 23.298 ( -0.791 -0.751 -0.095) 1.095 23.425 ( 3.010 -3.718 0.205) 4.788 ======================= Grid point 19 (14/102) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( -5.015 14.277 1.558) 15.212 1.362 ( -4.472 11.198 -0.172) 12.059 1.618 ( -3.192 8.481 0.953) 9.111 1.830 ( -1.635 9.001 -0.131) 9.149 2.115 ( -4.488 9.362 0.316) 10.387 2.266 ( 1.994 9.610 -2.222) 10.063 2.373 ( -2.130 9.443 -3.074) 10.156 2.420 ( -5.112 -2.981 -0.580) 5.946 2.460 ( -5.926 11.161 2.879) 12.960 2.692 ( -0.758 -2.286 2.844) 3.727 2.827 ( 0.139 -3.105 -1.584) 3.488 2.958 ( -0.799 0.309 -2.276) 2.432 3.068 ( -0.502 5.690 2.297) 6.157 3.132 ( -3.899 5.416 2.682) 7.192 3.280 ( 4.893 -4.602 -2.479) 7.160 3.341 ( -0.185 -2.934 0.664) 3.014 3.350 ( 2.013 -0.002 -1.838) 2.726 3.405 ( 0.937 1.056 -0.246) 1.433 3.509 ( 3.698 0.573 0.016) 3.742 3.660 ( 3.331 -3.489 3.438) 5.923 3.713 ( 1.534 -2.835 -2.315) 3.968 3.847 ( 1.243 -0.262 1.823) 2.222 3.880 ( 3.136 -4.258 -3.732) 6.472 3.979 ( -2.761 0.076 -2.719) 3.876 4.049 ( -0.941 0.062 3.196) 3.333 4.135 ( -1.494 -0.676 -0.312) 1.669 4.332 ( 1.473 -1.172 5.935) 6.226 4.504 ( -0.071 -1.318 -2.563) 2.883 4.560 ( -7.511 -2.205 -1.539) 7.978 4.781 ( 1.859 2.639 -0.658) 3.294 4.857 ( -0.228 -2.483 1.706) 3.021 4.921 ( 1.923 1.416 -3.817) 4.503 5.172 ( 1.340 -1.232 1.291) 2.231 5.233 ( 7.624 0.617 -0.919) 7.704 5.290 ( 4.942 0.741 1.201) 5.140 5.383 ( -1.899 -1.420 0.717) 2.477 5.528 ( -4.442 3.839 2.902) 6.549 5.601 ( 1.604 -2.229 -1.891) 3.334 5.657 ( -0.592 3.227 -0.244) 3.290 5.813 ( -2.141 3.255 2.767) 4.778 5.988 ( -0.775 -3.448 -5.551) 6.581 6.214 ( -1.896 4.366 -1.613) 5.025 6.277 ( -3.149 3.220 1.548) 4.762 6.338 ( -7.169 2.658 3.124) 8.259 6.547 ( 4.064 3.054 -1.829) 5.403 6.824 ( -3.221 1.594 0.155) 3.597 6.844 ( -11.619 -5.439 0.665) 12.846 7.137 ( -2.587 4.875 -0.751) 5.570 7.197 ( -6.364 -5.249 1.713) 8.425 7.374 ( -1.717 -5.256 -0.304) 5.537 7.819 ( -6.616 -0.891 -0.172) 6.678 8.051 ( 1.604 0.312 0.828) 1.832 8.097 ( 0.052 -2.119 0.821) 2.273 8.190 ( -1.325 -0.635 -1.481) 2.086 8.270 ( 0.295 -6.928 1.163) 7.031 8.663 ( 3.227 -0.995 -2.617) 4.272 8.980 ( 2.442 -2.285 1.792) 3.794 9.152 ( 5.826 0.328 -0.237) 5.840 9.336 ( 5.555 -4.422 -1.531) 7.264 9.377 ( -2.003 -0.857 1.697) 2.762 9.637 ( 3.192 -0.198 -1.589) 3.571 9.838 ( -1.327 -0.910 1.081) 1.939 10.267 ( 4.046 2.853 -0.311) 4.960 10.498 ( -5.682 6.384 1.024) 8.607 10.677 ( -5.324 -0.791 -0.207) 5.387 10.846 ( -1.232 -0.340 4.844) 5.009 10.872 ( 1.200 1.586 -3.728) 4.225 11.033 ( 1.506 2.813 -2.829) 4.264 11.209 ( -5.734 -2.599 1.550) 6.483 11.273 ( -1.307 -0.576 0.164) 1.437 11.470 ( 4.126 -2.351 -0.121) 4.750 11.600 ( 2.457 -1.500 -0.214) 2.887 12.115 ( -3.430 -4.400 0.400) 5.593 12.176 ( 2.359 -4.857 -1.274) 5.548 12.430 ( -1.149 2.907 0.736) 3.211 12.521 ( 0.416 1.537 -0.031) 1.592 13.078 ( -0.516 2.995 0.091) 3.041 13.172 ( 0.444 2.998 0.080) 3.032 13.546 ( 0.114 -9.123 -0.931) 9.171 13.772 ( 2.474 -6.805 0.689) 7.273 15.854 ( -3.734 -0.387 0.963) 3.876 16.045 ( -0.229 -2.753 -0.983) 2.932 17.633 ( 9.023 0.425 -1.150) 9.106 17.882 ( -0.964 5.544 3.210) 6.478 17.986 ( -1.938 7.758 0.485) 8.011 18.112 ( -9.557 -2.862 -3.353) 10.524 18.626 ( 6.157 -10.981 2.400) 12.816 18.901 ( -5.083 -5.374 -2.065) 7.679 19.156 ( 1.495 -1.683 -0.950) 2.443 19.300 ( -3.804 -3.614 1.939) 5.594 19.850 ( 8.266 -8.831 -0.426) 12.104 20.177 ( -7.489 -7.350 0.122) 10.494 21.129 ( 10.163 9.043 -0.470) 13.612 21.491 ( -10.656 9.833 0.467) 14.507 22.066 ( 0.132 3.475 0.633) 3.534 22.079 ( -0.369 1.518 -0.037) 1.562 22.212 ( -0.038 -2.240 -0.191) 2.248 22.622 ( 2.895 -4.325 -3.694) 6.382 22.705 ( -1.982 6.877 3.107) 7.802 23.114 ( 2.148 -2.192 0.311) 3.085 23.299 ( 0.927 0.801 -0.620) 1.373 23.513 ( 4.949 -2.693 0.522) 5.659 ======================= Grid point 20 (15/102) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.047 ( -4.744 18.913 -0.021) 19.499 1.119 ( -2.558 4.060 -0.856) 4.875 1.419 ( -2.988 15.134 -1.543) 15.503 1.695 ( 1.183 5.253 3.090) 6.208 1.890 ( -2.506 12.199 4.003) 13.082 2.011 ( -4.555 26.378 0.756) 26.779 2.020 ( -5.561 14.092 -6.340) 16.423 2.147 ( -4.179 8.830 1.417) 9.871 2.658 ( 1.238 -13.920 -1.845) 14.096 2.695 ( 1.773 3.039 1.056) 3.673 2.846 ( -1.290 2.080 -0.637) 2.529 2.895 ( -4.914 3.858 0.020) 6.248 2.927 ( -2.186 6.620 1.567) 7.145 3.043 ( 1.204 5.406 -0.392) 5.552 3.305 ( 1.168 2.493 1.930) 3.362 3.344 ( -0.466 1.809 -0.794) 2.029 3.371 ( 1.018 0.053 0.088) 1.024 3.444 ( 4.162 -3.660 -2.605) 6.124 3.518 ( -2.171 -1.133 1.503) 2.873 3.724 ( 1.417 -1.155 1.162) 2.166 3.787 ( 2.676 -1.402 -0.481) 3.059 3.864 ( 1.428 0.023 1.171) 1.847 3.960 ( 0.166 -2.399 -1.419) 2.793 4.012 ( 0.014 -7.474 -2.755) 7.966 4.102 ( 6.021 -3.989 -0.995) 7.291 4.180 ( -2.937 -5.916 2.355) 7.012 4.382 ( 4.774 0.413 1.225) 4.946 4.470 ( -5.458 0.176 0.942) 5.541 4.583 ( -3.561 -4.249 -1.566) 5.761 4.720 ( -2.613 3.091 0.190) 4.052 4.869 ( 5.006 1.693 0.272) 5.291 4.939 ( -1.574 -3.104 -1.405) 3.753 5.208 ( 1.903 2.436 1.747) 3.550 5.256 ( 1.466 1.611 0.777) 2.312 5.276 ( 6.023 1.473 -1.352) 6.346 5.431 ( -3.237 -3.272 2.710) 5.341 5.438 ( -1.837 1.577 -1.183) 2.694 5.571 ( 0.990 2.995 0.389) 3.178 5.682 ( 0.100 -3.685 -1.236) 3.888 5.752 ( 0.329 3.045 0.279) 3.075 5.983 ( -6.011 0.625 -2.506) 6.542 6.113 ( 0.702 3.937 0.083) 4.000 6.211 ( -0.413 3.187 -0.022) 3.214 6.304 ( -6.160 -2.243 2.163) 6.903 6.579 ( 9.898 0.050 -5.858) 11.502 6.729 ( -9.771 -0.340 5.309) 11.125 6.915 ( -6.016 -5.989 0.489) 8.503 7.039 ( -2.021 3.473 -1.131) 4.174 7.250 ( -5.893 -5.319 1.332) 8.050 7.451 ( -0.591 -4.105 0.028) 4.147 7.789 ( -4.215 0.057 -0.058) 4.215 8.087 ( 0.667 -2.656 -0.760) 2.843 8.108 ( 2.663 0.767 2.653) 3.836 8.202 ( -3.310 -1.943 -3.004) 4.874 8.394 ( 0.025 -6.071 1.638) 6.288 8.730 ( 2.282 -5.280 -0.523) 5.776 9.025 ( 0.475 -1.178 0.474) 1.356 9.137 ( 2.727 5.190 -0.877) 5.928 9.365 ( 0.004 1.891 0.701) 2.016 9.425 ( 1.955 -2.709 -0.592) 3.393 9.657 ( -0.883 -1.323 -1.276) 2.039 9.827 ( -1.509 2.441 2.064) 3.535 10.288 ( 4.985 -1.889 -0.598) 5.364 10.371 ( -6.100 0.541 0.418) 6.138 10.666 ( -0.736 -0.198 -0.355) 0.841 10.855 ( 2.659 0.375 -5.053) 5.722 10.874 ( -2.475 -1.824 6.090) 6.822 11.010 ( 3.069 0.741 -1.072) 3.334 11.202 ( -3.039 -0.605 0.473) 3.134 11.301 ( -2.088 -2.656 0.136) 3.381 11.517 ( 0.749 -0.532 -0.932) 1.309 11.615 ( -0.618 0.211 0.353) 0.743 12.184 ( -2.963 -5.656 -0.757) 6.430 12.294 ( 1.564 -6.244 0.533) 6.459 12.381 ( -1.251 1.379 0.069) 1.863 12.490 ( 0.553 2.211 -0.006) 2.279 13.040 ( 0.147 1.137 0.116) 1.152 13.131 ( 0.557 2.039 -0.005) 2.114 13.704 ( -0.141 -8.588 -0.375) 8.597 13.912 ( 2.058 -6.567 0.140) 6.883 15.833 ( -3.449 0.009 1.306) 3.688 16.090 ( -0.530 -2.817 -1.187) 3.102 17.635 ( 4.393 6.703 -2.020) 8.265 17.752 ( 0.166 8.155 0.809) 8.196 17.878 ( 7.155 3.880 1.987) 8.378 18.120 ( -14.981 -7.607 -0.198) 16.803 18.914 ( 6.832 -14.090 0.837) 15.681 19.003 ( -4.063 -10.376 -0.115) 11.144 19.175 ( -2.202 -2.014 -2.942) 4.190 19.390 ( -2.062 -7.777 2.101) 8.315 20.082 ( 6.298 -10.127 -0.176) 11.928 20.269 ( -2.805 -7.706 -0.255) 8.204 21.008 ( 9.526 13.335 -0.810) 16.408 21.208 ( -12.552 11.503 1.370) 17.080 21.970 ( -0.457 7.547 -1.179) 7.652 22.014 ( -0.443 3.631 0.718) 3.728 22.277 ( 0.286 -3.731 0.234) 3.749 22.578 ( -0.105 6.044 -0.837) 6.103 22.715 ( 1.173 -4.067 0.337) 4.246 23.143 ( 1.243 0.563 0.758) 1.561 23.274 ( 1.155 2.758 -0.908) 3.125 23.593 ( 4.966 -1.912 0.783) 5.379 ======================= Grid point 21 (16/102) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.666 ( 0.000 20.409 0.000) 20.409 1.028 ( 0.000 25.374 0.000) 25.374 1.144 ( -0.000 -3.468 -0.000) 3.468 1.435 ( 0.000 31.829 0.000) 31.829 1.524 ( 0.000 15.689 0.000) 15.689 1.745 ( 0.000 9.905 0.000) 9.905 1.780 ( 0.000 2.082 0.000) 2.082 2.044 ( 0.000 1.350 0.000) 1.350 2.634 ( 0.000 6.025 0.000) 6.025 2.733 ( 0.000 7.398 0.000) 7.398 2.755 ( 0.000 5.656 0.000) 5.656 2.798 ( 0.000 7.132 0.000) 7.132 2.924 ( -0.000 -12.004 -0.000) 12.004 2.951 ( 0.000 4.968 0.000) 4.968 3.285 ( 0.000 2.873 0.000) 2.873 3.294 ( -0.000 -0.245 -0.000) 0.245 3.381 ( -0.000 -1.116 -0.000) 1.116 3.514 ( 0.000 0.231 0.000) 0.231 3.527 ( -0.000 -2.370 -0.000) 2.370 3.731 ( 0.000 2.710 0.000) 2.710 3.806 ( -0.000 -2.381 -0.000) 2.381 3.869 ( -0.000 -0.137 -0.000) 0.137 3.985 ( -0.000 -0.378 -0.000) 0.378 4.153 ( -0.000 -6.430 -0.000) 6.430 4.196 ( 0.000 2.382 0.000) 2.382 4.299 ( -0.000 -7.947 -0.000) 7.947 4.355 ( -0.000 -3.461 -0.000) 3.461 4.532 ( -0.000 -6.778 -0.000) 6.778 4.624 ( -0.000 -1.441 -0.000) 1.441 4.697 ( -0.000 -2.825 -0.000) 2.825 4.871 ( 0.000 0.905 0.000) 0.905 4.996 ( -0.000 -4.008 -0.000) 4.008 5.110 ( 0.000 4.716 0.000) 4.716 5.243 ( 0.000 2.030 0.000) 2.030 5.327 ( -0.000 -0.349 -0.000) 0.349 5.353 ( 0.000 2.663 0.000) 2.663 5.479 ( -0.000 -1.113 -0.000) 1.113 5.591 ( -0.000 -3.629 -0.000) 3.629 5.707 ( 0.000 1.475 0.000) 1.475 5.716 ( 0.000 1.048 0.000) 1.048 5.914 ( 0.000 2.060 0.000) 2.060 6.076 ( 0.000 2.112 0.000) 2.112 6.151 ( 0.000 3.022 0.000) 3.022 6.317 ( -0.000 -1.345 -0.000) 1.345 6.612 ( -0.000 -0.865 -0.000) 0.865 6.730 ( -0.000 -1.384 -0.000) 1.384 6.967 ( -0.000 -2.695 -0.000) 2.695 6.996 ( 0.000 0.049 0.000) 0.049 7.313 ( -0.000 -4.385 -0.000) 4.385 7.503 ( -0.000 -2.138 -0.000) 2.138 7.749 ( 0.000 2.630 0.000) 2.630 8.091 ( 0.000 0.007 0.000) 0.007 8.185 ( 0.000 1.348 0.000) 1.348 8.205 ( -0.000 -7.812 -0.000) 7.812 8.485 ( -0.000 -3.709 -0.000) 3.709 8.872 ( -0.000 -8.311 -0.000) 8.311 9.021 ( 0.000 7.524 0.000) 7.524 9.043 ( -0.000 -1.253 -0.000) 1.253 9.295 ( 0.000 6.254 0.000) 6.254 9.454 ( 0.000 0.126 0.000) 0.126 9.685 ( -0.000 -2.759 -0.000) 2.759 9.749 ( 0.000 4.376 0.000) 4.376 10.319 ( -0.000 -2.466 -0.000) 2.466 10.491 ( -0.000 -11.729 -0.000) 11.729 10.673 ( -0.000 -0.998 -0.000) 0.998 10.853 ( 0.000 0.116 0.000) 0.116 10.888 ( 0.000 0.383 0.000) 0.383 11.045 ( -0.000 -2.020 -0.000) 2.020 11.170 ( 0.000 3.483 0.000) 3.483 11.329 ( -0.000 -1.478 -0.000) 1.478 11.495 ( 0.000 1.877 0.000) 1.877 11.613 ( -0.000 -0.262 -0.000) 0.262 12.265 ( -0.000 -4.890 -0.000) 4.890 12.371 ( -0.000 -1.059 -0.000) 1.059 12.389 ( -0.000 -1.573 -0.000) 1.573 12.473 ( -0.000 -1.827 -0.000) 1.827 13.037 ( -0.000 -0.505 -0.000) 0.505 13.102 ( 0.000 1.534 0.000) 1.534 13.840 ( -0.000 -6.473 -0.000) 6.473 14.030 ( -0.000 -5.490 -0.000) 5.490 15.813 ( 0.000 0.520 0.000) 0.520 16.135 ( -0.000 -2.733 -0.000) 2.733 17.491 ( 0.000 8.848 0.000) 8.848 17.617 ( 0.000 6.566 0.000) 6.566 17.904 ( 0.000 0.639 0.000) 0.639 18.173 ( -0.000 -6.485 -0.000) 6.485 19.107 ( -0.000 -5.066 -0.000) 5.066 19.222 ( -0.000 -6.973 -0.000) 6.973 19.280 ( -0.000 -18.451 -0.000) 18.451 19.543 ( -0.000 -9.927 -0.000) 9.927 20.256 ( -0.000 -5.562 -0.000) 5.562 20.417 ( -0.000 -8.206 -0.000) 8.206 20.746 ( 0.000 17.228 0.000) 17.228 20.964 ( 0.000 10.573 0.000) 10.573 21.812 ( 0.000 8.948 0.000) 8.948 21.951 ( 0.000 3.368 0.000) 3.368 22.334 ( -0.000 -2.268 -0.000) 2.268 22.487 ( 0.000 3.785 0.000) 3.785 22.780 ( -0.000 -2.447 -0.000) 2.447 23.119 ( 0.000 2.430 0.000) 2.430 23.213 ( 0.000 4.347 0.000) 4.347 23.650 ( -0.000 -1.603 -0.000) 1.603 ======================= Grid point 24 (17/102) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.667 ( 23.419 0.000 -0.959) 23.439 0.788 ( 25.289 0.000 -0.994) 25.308 1.272 ( 11.473 0.000 -9.013) 14.590 1.318 ( 13.473 0.000 0.151) 13.474 1.496 ( 45.085 0.000 2.416) 45.149 1.906 ( 5.844 0.000 7.318) 9.365 2.125 ( 14.879 0.000 8.270) 17.023 2.359 ( 5.694 0.000 -6.445) 8.600 2.490 ( 3.597 0.000 -0.480) 3.629 2.537 ( 4.504 0.000 -3.502) 5.705 2.740 ( 5.703 0.000 -7.469) 9.397 2.759 ( 2.314 0.000 5.274) 5.760 2.927 ( -8.161 -0.000 -0.006) 8.161 2.987 ( 2.416 0.000 1.286) 2.737 3.275 ( -11.748 -0.000 5.015) 12.774 3.304 ( -3.423 -0.000 -3.764) 5.088 3.399 ( 1.173 0.000 3.324) 3.525 3.478 ( 2.635 0.000 -1.188) 2.891 3.556 ( -0.749 -0.000 1.453) 1.635 3.728 ( -1.572 -0.000 -2.893) 3.293 3.749 ( 2.564 0.000 -6.122) 6.637 3.843 ( 1.572 0.000 -2.709) 3.132 3.873 ( -1.664 -0.000 3.296) 3.693 4.018 ( -0.066 -0.000 0.870) 0.872 4.188 ( -1.948 -0.000 3.325) 3.854 4.374 ( -9.038 -0.000 3.418) 9.663 4.515 ( -4.552 -0.000 -1.961) 4.957 4.627 ( -6.305 -0.000 -0.354) 6.315 4.781 ( -7.347 -0.000 -3.205) 8.016 4.810 ( -2.987 -0.000 0.968) 3.140 4.928 ( 2.894 0.000 -3.353) 4.429 4.933 ( 1.316 0.000 -1.029) 1.671 5.062 ( 8.545 0.000 -2.230) 8.831 5.088 ( -9.705 -0.000 6.977) 11.952 5.185 ( -4.920 -0.000 -2.610) 5.569 5.233 ( -2.301 -0.000 -1.249) 2.618 5.345 ( -1.931 -0.000 -3.745) 4.213 5.379 ( -9.720 -0.000 -1.541) 9.842 5.524 ( -7.415 -0.000 4.944) 8.912 5.910 ( -0.150 -0.000 4.566) 4.569 5.956 ( -1.175 -0.000 0.404) 1.242 6.096 ( 3.790 0.000 -5.439) 6.630 6.358 ( -7.670 -0.000 -1.086) 7.746 6.570 ( -6.660 -0.000 -1.408) 6.807 6.661 ( 16.530 0.000 1.348) 16.585 6.801 ( 7.230 0.000 -2.602) 7.684 7.074 ( -0.875 -0.000 8.701) 8.745 7.131 ( 3.857 0.000 -0.974) 3.978 7.401 ( 18.415 0.000 -7.441) 19.861 7.813 ( 10.245 0.000 -2.621) 10.575 8.029 ( 1.550 0.000 3.156) 3.516 8.100 ( 3.749 0.000 -12.148) 12.714 8.235 ( -5.425 -0.000 -4.492) 7.044 8.409 ( -15.306 -0.000 26.225) 30.365 8.680 ( -14.543 -0.000 6.331) 15.861 8.745 ( 8.156 0.000 -8.268) 11.614 9.020 ( -2.750 -0.000 -1.289) 3.037 9.042 ( 2.051 0.000 9.116) 9.344 9.333 ( 11.124 0.000 -7.907) 13.648 9.814 ( 2.863 0.000 9.846) 10.254 9.911 ( 10.924 0.000 -7.544) 13.276 10.290 ( -8.598 -0.000 -19.346) 21.170 10.362 ( -18.155 -0.000 10.076) 20.764 10.513 ( 1.420 0.000 5.200) 5.390 10.609 ( -7.184 -0.000 2.975) 7.775 10.654 ( 1.792 0.000 -15.792) 15.893 11.043 ( 5.703 0.000 -4.947) 7.550 11.093 ( 4.817 0.000 -0.619) 4.856 11.142 ( 8.928 0.000 -14.562) 17.081 11.316 ( 4.929 0.000 7.439) 8.924 11.545 ( 9.848 0.000 0.615) 9.867 11.772 ( 7.174 0.000 2.906) 7.740 12.201 ( -6.317 -0.000 1.890) 6.594 12.307 ( -6.384 -0.000 0.025) 6.384 12.790 ( 14.070 0.000 0.634) 14.084 12.947 ( -2.371 -0.000 -1.309) 2.708 13.072 ( 3.932 0.000 -1.716) 4.291 13.301 ( 9.278 0.000 -2.486) 9.605 13.892 ( -4.448 -0.000 0.003) 4.448 13.918 ( -3.752 -0.000 0.329) 3.766 16.144 ( -4.149 -0.000 -23.376) 23.741 16.257 ( -7.289 -0.000 12.616) 14.570 17.391 ( 7.646 0.000 -0.951) 7.705 17.575 ( 5.831 0.000 -2.728) 6.438 18.069 ( 8.893 0.000 -0.158) 8.894 18.391 ( 4.906 0.000 -8.503) 9.817 19.054 ( -16.797 -0.000 7.056) 18.219 19.154 ( -13.527 -0.000 -1.210) 13.581 19.825 ( 3.510 0.000 -4.739) 5.898 19.941 ( 2.302 0.000 7.570) 7.912 20.289 ( 4.690 0.000 3.680) 5.962 20.685 ( 3.578 0.000 1.186) 3.769 20.701 ( 7.131 0.000 -1.905) 7.381 21.469 ( 20.478 0.000 -50.402) 54.403 21.816 ( -10.490 -0.000 27.586) 29.514 21.920 ( 0.364 0.000 6.627) 6.637 21.976 ( 5.793 0.000 -0.106) 5.794 22.388 ( 1.818 0.000 -1.229) 2.194 22.433 ( -0.403 -0.000 0.535) 0.670 22.761 ( -7.648 -0.000 3.764) 8.524 22.999 ( -3.846 -0.000 -0.323) 3.860 23.020 ( -5.467 -0.000 0.210) 5.471 ======================= Grid point 25 (18/102) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.907 ( 18.550 -7.980 2.366) 20.332 1.083 ( 21.069 -11.272 -0.730) 23.906 1.324 ( 8.606 1.621 -0.460) 8.769 1.535 ( 14.900 -9.760 -4.113) 18.280 1.884 ( 32.033 -5.479 -1.014) 32.514 1.945 ( 14.245 -0.371 4.036) 14.810 2.242 ( 10.804 -0.549 5.654) 12.206 2.329 ( 4.483 4.448 -7.578) 9.864 2.555 ( 3.924 -4.072 -0.802) 5.712 2.641 ( 0.678 -7.505 2.172) 7.842 2.710 ( -2.229 0.249 0.300) 2.263 2.871 ( 8.567 -5.208 -4.087) 10.827 2.893 ( -1.310 -0.178 2.350) 2.696 3.027 ( -0.569 -1.464 1.808) 2.395 3.182 ( -7.782 0.879 3.255) 8.481 3.260 ( -5.467 1.383 -2.136) 6.030 3.408 ( 3.534 1.687 2.026) 4.409 3.480 ( -0.283 3.296 -2.071) 3.903 3.542 ( -3.951 -3.178 2.775) 5.780 3.693 ( 0.096 1.074 -2.496) 2.719 3.784 ( -1.883 -0.202 -2.959) 3.513 3.821 ( 2.406 0.936 -3.479) 4.333 3.892 ( -0.217 -0.977 1.930) 2.174 3.960 ( -1.871 5.858 -0.646) 6.183 4.140 ( -4.495 3.989 5.258) 7.985 4.304 ( -3.404 1.777 0.950) 3.956 4.506 ( -5.559 -3.070 -0.310) 6.358 4.582 ( -4.756 1.782 1.076) 5.192 4.641 ( -4.842 5.518 -4.746) 8.741 4.722 ( 0.998 2.644 -2.275) 3.628 4.878 ( -2.805 2.687 1.321) 4.103 4.981 ( -8.006 3.482 4.855) 9.989 5.069 ( 1.526 -6.385 -0.072) 6.566 5.140 ( 3.212 -1.360 -1.973) 4.007 5.206 ( -5.677 0.386 -0.363) 5.702 5.239 ( 0.673 -1.163 -2.348) 2.705 5.261 ( -7.923 -3.972 1.009) 8.920 5.372 ( -4.571 -3.809 -4.742) 7.608 5.495 ( -7.154 -1.645 3.646) 8.197 5.897 ( 2.389 2.832 2.251) 4.335 5.982 ( -1.082 -3.121 0.520) 3.343 6.131 ( 2.926 -1.417 -1.285) 3.496 6.305 ( -0.677 -0.484 -1.370) 1.603 6.492 ( -4.738 2.634 -0.985) 5.509 6.744 ( 13.000 2.844 1.507) 13.392 6.873 ( 7.093 -2.090 -3.493) 8.178 7.062 ( 2.158 1.306 3.237) 4.103 7.198 ( -0.162 -3.206 3.538) 4.777 7.517 ( 11.501 -0.842 -5.847) 12.930 7.902 ( 5.834 -0.970 -0.376) 5.926 8.037 ( 1.776 0.877 -0.149) 1.987 8.076 ( 2.647 4.387 -4.657) 6.924 8.164 ( -5.616 1.510 -1.739) 6.069 8.328 ( -4.606 1.070 11.892) 12.798 8.566 ( -8.586 2.315 2.789) 9.320 8.705 ( -4.885 5.866 -2.782) 8.125 8.991 ( 2.717 1.394 3.821) 4.891 9.118 ( -2.527 -3.111 2.756) 4.864 9.405 ( 11.011 -0.642 -8.117) 13.695 9.755 ( 2.029 12.247 2.672) 12.698 9.930 ( 9.712 5.840 -6.872) 13.253 10.043 ( -0.083 8.357 -5.198) 9.842 10.291 ( -14.497 -1.690 4.898) 15.395 10.457 ( 1.089 4.789 3.661) 6.126 10.606 ( -4.135 -1.066 5.204) 6.731 10.643 ( 1.247 -1.587 -10.910) 11.095 10.969 ( 5.651 5.405 0.428) 7.832 11.095 ( 7.939 3.986 -6.128) 10.792 11.283 ( 5.466 -7.667 -0.506) 9.430 11.484 ( 4.547 -7.745 2.341) 9.282 11.595 ( 9.540 2.657 0.402) 9.911 11.796 ( 2.441 1.923 1.112) 3.300 12.170 ( -5.181 -0.643 0.694) 5.267 12.267 ( -4.786 -0.568 0.248) 4.826 12.847 ( 12.407 4.656 1.806) 13.375 12.907 ( 0.942 2.834 -2.215) 3.718 13.048 ( 3.669 5.032 -0.628) 6.259 13.198 ( 10.445 13.654 -0.416) 17.196 13.854 ( -7.170 0.894 0.221) 7.229 13.882 ( -4.358 1.894 0.021) 4.752 16.006 ( -4.958 3.782 -8.872) 10.844 16.225 ( -10.046 0.669 6.103) 11.774 17.403 ( 8.425 3.999 -0.084) 9.326 17.651 ( 5.849 -3.261 -2.106) 7.020 17.906 ( 12.618 9.909 0.851) 16.066 18.601 ( 3.225 -5.732 -4.474) 7.955 18.930 ( -10.988 1.781 2.797) 11.478 19.206 ( -17.280 -13.714 -0.710) 22.072 19.733 ( 0.434 9.945 -4.384) 10.877 19.836 ( -1.692 10.648 2.690) 11.112 20.129 ( 7.932 20.391 4.816) 22.403 20.505 ( 6.755 15.893 1.359) 17.322 20.922 ( 7.069 -10.962 -0.243) 13.046 21.316 ( 18.900 6.783 -15.695) 25.486 21.774 ( -0.493 -5.654 10.973) 12.354 21.945 ( 2.670 -1.050 -0.185) 2.875 22.370 ( 1.163 2.020 -1.706) 2.889 22.456 ( -0.172 -2.749 2.069) 3.445 22.513 ( -7.894 -22.862 -5.475) 24.798 22.752 ( -10.476 -7.178 2.646) 12.972 22.978 ( -5.107 -1.606 -1.091) 5.463 23.027 ( -6.191 -4.969 1.706) 8.120 ======================= Grid point 26 (19/102) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.201 ( 10.400 -11.020 5.422) 16.094 1.343 ( 6.550 1.261 2.846) 7.252 1.446 ( 15.139 -13.405 2.137) 20.334 1.768 ( 13.587 -4.103 -9.975) 17.348 2.048 ( 13.187 -5.184 -1.576) 14.256 2.155 ( 5.989 0.430 -4.351) 7.415 2.326 ( 7.361 -2.915 3.480) 8.648 2.420 ( 17.895 -8.457 -3.813) 20.156 2.636 ( 3.538 0.126 -0.028) 3.541 2.691 ( -4.510 -2.426 5.953) 7.853 2.782 ( -6.638 -6.200 3.190) 9.627 2.883 ( 0.970 2.393 3.309) 4.198 3.001 ( 2.184 -3.311 1.659) 4.300 3.079 ( 3.270 -7.343 -6.300) 10.213 3.168 ( -1.175 0.652 1.852) 2.288 3.188 ( -2.664 0.119 -0.471) 2.708 3.377 ( -2.001 3.661 -2.020) 4.635 3.411 ( 3.711 3.439 1.602) 5.307 3.570 ( -5.010 -2.427 -2.135) 5.962 3.680 ( 1.824 0.875 -0.334) 2.051 3.708 ( -3.481 3.572 1.203) 5.131 3.821 ( -2.466 5.877 -1.048) 6.459 3.848 ( 0.580 -0.014 -2.830) 2.888 3.912 ( -0.233 -3.131 1.462) 3.464 4.045 ( -3.553 3.626 4.009) 6.469 4.226 ( -2.937 4.354 0.054) 5.252 4.421 ( -3.955 6.569 -0.731) 7.703 4.558 ( -3.382 0.907 -2.336) 4.209 4.597 ( 1.345 -3.233 -0.267) 3.512 4.721 ( -4.785 -2.314 -0.008) 5.316 4.821 ( -5.469 1.442 3.025) 6.414 4.904 ( 0.666 0.556 0.594) 1.052 5.064 ( -4.556 4.111 -1.882) 6.418 5.095 ( -5.689 0.787 1.191) 5.866 5.180 ( -4.984 -1.035 -0.391) 5.105 5.274 ( 0.571 -3.516 -3.380) 4.910 5.377 ( 1.759 -7.688 0.344) 7.895 5.443 ( -2.973 -6.742 -2.298) 7.718 5.495 ( -4.156 -2.995 3.056) 5.965 5.869 ( 3.361 2.755 0.506) 4.376 6.020 ( -2.404 -1.624 1.037) 3.081 6.184 ( 3.612 -2.105 1.251) 4.363 6.352 ( -0.938 -2.493 -1.513) 3.063 6.458 ( 5.500 -1.548 -1.847) 6.005 6.779 ( 11.084 3.423 1.550) 11.704 6.937 ( 3.793 -0.886 -3.361) 5.145 7.068 ( 2.461 0.906 0.943) 2.787 7.252 ( -0.403 -2.153 5.057) 5.511 7.553 ( 3.772 2.422 -3.313) 5.574 7.809 ( -1.509 12.095 1.431) 12.273 7.989 ( -2.764 3.422 -1.981) 4.825 8.002 ( -1.256 2.388 0.368) 2.723 8.188 ( 4.345 -2.974 1.474) 5.468 8.372 ( 2.011 -3.431 -1.771) 4.354 8.500 ( -1.057 1.047 0.660) 1.627 8.522 ( -9.809 6.773 1.539) 12.020 8.962 ( 0.356 4.165 4.077) 5.839 9.113 ( -4.132 0.854 0.290) 4.229 9.421 ( 4.135 9.474 -9.108) 13.777 9.552 ( 6.075 5.002 -0.242) 7.873 9.760 ( -3.517 11.682 1.504) 12.292 10.029 ( 9.242 1.469 -4.701) 10.472 10.253 ( -4.838 -0.781 5.053) 7.039 10.440 ( 0.474 -2.049 0.616) 2.191 10.608 ( -2.233 -1.338 4.700) 5.373 10.672 ( 1.529 -1.982 -5.511) 6.053 10.936 ( 5.468 3.403 0.776) 6.487 11.092 ( 5.447 1.439 -2.258) 6.070 11.433 ( 7.495 -3.840 -0.586) 8.442 11.589 ( 8.622 4.787 1.301) 9.947 11.626 ( 5.267 -1.970 0.592) 5.655 11.744 ( 0.556 4.497 -0.177) 4.534 12.144 ( -4.183 -0.210 0.041) 4.188 12.254 ( -2.960 -0.547 0.382) 3.035 12.771 ( 13.244 12.956 -0.473) 18.533 12.894 ( 9.613 5.182 0.269) 10.924 13.005 ( 0.157 1.558 0.042) 1.567 13.039 ( 0.208 5.479 0.186) 5.486 13.757 ( -7.756 5.446 -0.611) 9.496 13.775 ( -5.570 3.470 0.886) 6.622 15.921 ( -4.915 0.483 -3.315) 5.948 16.123 ( -8.997 3.017 2.711) 9.869 17.413 ( 5.641 0.542 0.025) 5.667 17.740 ( 2.922 -2.896 -1.231) 4.295 17.935 ( 13.396 0.138 0.886) 13.426 18.606 ( 1.623 4.124 -1.413) 4.652 18.821 ( -7.532 3.793 1.421) 8.552 19.264 ( -7.297 -0.750 1.348) 7.458 19.510 ( -1.880 11.484 -4.119) 12.345 19.647 ( -0.964 8.105 -0.016) 8.163 19.870 ( -0.067 9.856 0.785) 9.887 20.246 ( 5.347 17.983 2.321) 18.904 21.161 ( 9.408 -7.528 1.278) 12.116 21.412 ( 12.756 -4.183 -6.598) 14.958 21.925 ( -0.387 -8.056 6.590) 10.415 21.989 ( 2.678 -1.805 -0.654) 3.295 22.311 ( -0.291 4.083 -2.001) 4.557 22.523 ( 0.484 -4.256 2.475) 4.947 22.617 ( -3.319 -0.340 -1.087) 3.508 22.907 ( -10.841 -14.619 -2.906) 18.430 22.976 ( -6.800 -3.682 -2.217) 8.045 23.091 ( -6.992 -6.365 3.360) 10.034 ======================= Grid point 27 (20/102) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 3.664 -6.546 0.187) 7.504 1.497 ( 8.406 -9.055 4.322) 13.089 1.776 ( 8.111 -12.280 5.454) 15.695 1.842 ( 12.272 2.520 -10.928) 16.624 2.129 ( 0.797 -0.780 -2.226) 2.489 2.270 ( 4.529 -7.024 -1.809) 8.551 2.434 ( 3.141 -4.423 0.457) 5.444 2.582 ( 2.305 5.430 2.455) 6.389 2.669 ( -4.264 -5.684 5.694) 9.105 2.690 ( 1.855 1.275 0.574) 2.323 2.798 ( -4.211 -1.389 0.880) 4.520 2.908 ( 7.388 -2.131 -1.086) 7.765 3.067 ( 2.986 -1.606 2.041) 3.957 3.131 ( -2.026 -0.010 -1.054) 2.283 3.216 ( -0.278 -2.987 0.465) 3.035 3.253 ( 5.504 -7.479 -4.851) 10.477 3.304 ( 0.667 3.200 -3.632) 4.886 3.369 ( 0.926 3.194 1.701) 3.735 3.564 ( -3.750 -1.355 -1.427) 4.235 3.642 ( 2.386 3.954 1.846) 4.974 3.669 ( -1.459 0.375 -0.575) 1.612 3.739 ( -3.366 0.548 -2.119) 4.015 3.824 ( -3.955 0.310 5.072) 6.439 3.909 ( -2.249 3.603 1.658) 4.560 4.083 ( 3.455 -7.344 -2.041) 8.369 4.115 ( -4.661 4.396 -0.546) 6.431 4.296 ( -1.228 4.605 -0.417) 4.784 4.503 ( -3.436 3.440 -1.678) 5.143 4.597 ( -3.273 1.294 2.536) 4.338 4.737 ( -9.754 -3.797 -1.522) 10.577 4.780 ( -2.219 -0.785 4.488) 5.068 4.932 ( 1.503 -1.039 0.306) 1.853 5.015 ( -1.328 -1.582 -5.212) 5.606 5.052 ( 0.193 0.239 1.231) 1.268 5.167 ( -5.838 -3.368 0.734) 6.780 5.342 ( 3.130 -2.317 -3.953) 5.549 5.474 ( -3.613 -3.414 2.960) 5.786 5.500 ( -2.988 -4.595 -0.425) 5.497 5.614 ( 6.009 -6.440 0.182) 8.810 5.850 ( 1.857 2.004 0.557) 2.788 6.003 ( -2.773 1.087 0.483) 3.018 6.251 ( 3.255 -1.147 3.741) 5.090 6.374 ( 0.217 -3.016 -4.755) 5.635 6.598 ( 9.303 -5.530 -1.705) 10.956 6.794 ( 9.068 3.694 2.496) 10.105 6.936 ( -0.663 1.866 -2.163) 2.932 7.065 ( 1.861 1.355 -0.650) 2.392 7.286 ( 0.333 0.508 5.726) 5.758 7.466 ( -4.080 6.103 -0.629) 7.368 7.560 ( -0.643 13.135 -2.091) 13.316 7.897 ( -3.130 2.483 -2.464) 4.694 7.971 ( -3.302 0.870 3.667) 5.011 8.220 ( -2.270 2.896 -1.971) 4.175 8.348 ( -0.961 2.976 -2.537) 4.027 8.430 ( 2.784 0.737 0.105) 2.882 8.537 ( -1.257 -3.211 4.904) 5.995 8.895 ( 1.769 3.737 1.811) 4.514 9.057 ( -0.979 2.323 -1.900) 3.157 9.193 ( -2.391 11.005 -2.637) 11.567 9.500 ( -5.856 7.630 0.948) 9.664 9.630 ( 7.971 0.568 -1.918) 8.218 10.034 ( 6.525 4.121 -1.293) 7.825 10.259 ( 0.915 -0.566 1.635) 1.957 10.523 ( -1.803 -6.712 -0.868) 7.004 10.649 ( -0.195 -2.912 3.605) 4.638 10.709 ( 2.024 -1.872 -2.824) 3.947 10.921 ( 3.954 2.529 1.641) 4.972 11.104 ( 1.567 -0.088 -0.874) 1.797 11.501 ( 4.435 5.901 -0.202) 7.384 11.546 ( 9.122 3.872 -0.472) 9.921 11.591 ( 2.460 6.141 -0.486) 6.633 11.724 ( 7.730 2.930 1.318) 8.371 12.113 ( -3.106 0.629 -0.281) 3.182 12.226 ( -2.500 1.949 0.447) 3.201 12.648 ( 9.018 9.096 -0.184) 12.810 12.767 ( 8.664 13.148 -0.136) 15.746 13.020 ( -2.519 -4.718 -0.531) 5.375 13.067 ( 0.660 -4.612 0.715) 4.714 13.578 ( -6.486 7.582 -0.623) 9.998 13.674 ( -6.227 3.297 0.952) 7.110 15.889 ( -4.029 -0.939 -2.003) 4.596 16.017 ( -7.211 2.312 1.598) 7.740 17.458 ( 4.164 -1.306 -0.005) 4.364 17.785 ( -1.854 -1.968 -0.575) 2.764 18.047 ( 10.558 -1.567 0.802) 10.704 18.513 ( 0.361 6.401 -1.787) 6.656 18.690 ( -1.148 7.087 1.618) 7.359 19.170 ( 1.204 6.910 4.222) 8.187 19.324 ( 0.455 7.512 -4.112) 8.576 19.526 ( 4.113 7.255 -0.003) 8.340 19.770 ( -12.073 -1.559 -3.712) 12.726 19.976 ( -0.357 13.595 3.317) 13.999 21.319 ( 13.155 -0.692 1.022) 13.213 21.577 ( 5.377 -7.050 -2.235) 9.143 22.030 ( 2.411 -2.623 -5.569) 6.611 22.062 ( -1.268 -4.059 7.287) 8.437 22.220 ( -2.017 4.095 -0.815) 4.637 22.564 ( -3.798 1.616 5.250) 6.678 22.643 ( 2.470 -6.524 -3.271) 7.705 22.980 ( -3.125 -2.189 -3.083) 4.905 23.068 ( -8.299 -11.263 -1.744) 14.099 23.151 ( -6.765 -5.305 3.060) 9.125 ======================= Grid point 28 (21/102) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.550 ( 2.723 -5.308 -3.613) 6.974 1.684 ( 8.094 -5.304 -1.424) 9.781 1.879 ( 6.834 -1.697 -4.053) 8.125 1.998 ( -2.458 -7.439 10.477) 13.082 2.137 ( -1.241 0.084 -1.643) 2.061 2.354 ( 0.223 -0.082 1.675) 1.692 2.444 ( 0.507 3.548 0.477) 3.616 2.581 ( -3.358 -2.260 1.149) 4.208 2.612 ( 4.361 2.924 -0.698) 5.297 2.696 ( -6.111 -1.381 1.578) 6.461 2.872 ( 2.906 -4.680 -1.006) 5.600 2.961 ( 6.326 -0.371 -2.857) 6.951 3.106 ( -0.584 -0.930 1.770) 2.083 3.132 ( 1.969 1.411 -0.930) 2.594 3.257 ( -3.798 0.354 0.516) 3.849 3.285 ( 4.803 1.781 -2.395) 5.655 3.300 ( 1.347 2.206 -1.378) 2.929 3.370 ( -0.899 -3.148 -0.435) 3.303 3.574 ( 0.723 3.522 3.184) 4.803 3.590 ( 1.026 -1.372 -0.390) 1.757 3.684 ( 4.166 -1.965 -4.864) 6.699 3.724 ( -6.758 -3.905 2.274) 8.130 3.771 ( -3.776 2.967 3.446) 5.910 3.913 ( -0.479 -4.353 1.251) 4.554 4.027 ( -3.556 0.286 -2.344) 4.268 4.184 ( -0.682 -0.255 -1.205) 1.408 4.273 ( -3.628 -1.811 0.923) 4.159 4.385 ( 0.173 2.780 -3.179) 4.227 4.569 ( -2.122 0.525 1.416) 2.605 4.701 ( -11.920 -2.207 2.485) 12.374 4.803 ( 0.218 -1.366 2.294) 2.679 5.000 ( -0.533 -4.692 1.804) 5.055 5.014 ( 2.366 0.545 -2.299) 3.344 5.097 ( 6.287 -1.717 -2.951) 7.155 5.217 ( -4.698 -4.788 1.481) 6.870 5.378 ( 0.677 -2.136 -4.719) 5.224 5.511 ( 1.055 -0.482 3.543) 3.728 5.545 ( -2.154 -2.743 0.057) 3.488 5.746 ( 4.074 -2.818 -1.976) 5.334 5.820 ( 0.475 1.754 2.882) 3.407 5.975 ( 0.686 0.572 -0.386) 0.973 6.282 ( 1.047 0.082 3.999) 4.135 6.441 ( 0.963 -4.503 -6.161) 7.692 6.688 ( 5.615 3.435 -2.181) 6.934 6.809 ( -1.065 5.446 7.376) 9.230 6.861 ( 4.896 0.722 -3.497) 6.060 7.039 ( -1.666 1.454 0.091) 2.213 7.200 ( -4.465 7.204 1.988) 8.705 7.299 ( -0.717 10.259 -3.566) 10.885 7.411 ( -2.860 1.442 1.967) 3.759 7.852 ( -1.743 -0.030 -2.720) 3.231 7.931 ( -5.392 0.671 4.474) 7.038 8.104 ( -6.759 2.769 -1.512) 7.458 8.332 ( 4.568 2.902 -3.102) 6.238 8.397 ( 3.227 5.668 -1.462) 6.684 8.559 ( -2.711 -0.668 4.502) 5.298 8.892 ( 1.944 -0.329 1.400) 2.418 9.024 ( 1.270 2.174 0.704) 2.614 9.055 ( 2.255 0.458 -1.786) 2.913 9.364 ( -5.683 2.122 0.218) 6.070 9.683 ( 7.989 0.711 -1.991) 8.264 9.982 ( 4.459 5.601 -0.332) 7.166 10.287 ( 1.854 -0.984 0.919) 2.292 10.609 ( -3.493 -4.986 -3.488) 7.017 10.694 ( -2.218 -1.751 2.528) 3.792 10.771 ( 3.854 -2.856 -0.449) 4.818 10.917 ( 1.677 0.445 2.595) 3.122 11.104 ( -3.398 -0.372 -0.559) 3.464 11.335 ( -0.396 10.211 -0.360) 10.225 11.499 ( 6.679 6.998 -0.406) 9.682 11.573 ( 9.151 4.002 1.160) 10.055 11.690 ( 7.613 7.447 -0.616) 10.667 12.081 ( -1.507 0.618 -0.591) 1.732 12.147 ( -2.930 4.096 0.562) 5.067 12.587 ( 4.923 3.759 -0.193) 6.197 12.628 ( 3.215 6.977 0.056) 7.682 13.099 ( -1.635 -5.973 -1.782) 6.443 13.179 ( 2.877 -5.129 1.767) 6.140 13.405 ( -4.624 6.630 -0.885) 8.131 13.579 ( -5.242 2.290 1.165) 5.838 15.874 ( -3.005 -0.388 -2.127) 3.702 15.954 ( -4.709 -0.183 1.819) 5.052 17.517 ( 4.247 -1.820 -0.038) 4.620 17.791 ( -5.459 -2.255 0.017) 5.906 18.135 ( 5.645 -1.193 1.280) 5.910 18.388 ( -1.538 5.896 -3.714) 7.136 18.572 ( 4.857 8.049 1.887) 9.588 19.093 ( 2.379 5.120 7.530) 9.411 19.200 ( 3.074 7.298 -6.691) 10.367 19.465 ( 5.450 3.546 -0.217) 6.506 19.628 ( -4.195 8.209 -1.145) 9.290 19.859 ( -13.839 -5.172 0.875) 14.800 21.392 ( 13.910 3.764 0.661) 14.426 21.717 ( 0.238 -6.067 -0.033) 6.072 22.039 ( -1.828 3.715 -1.127) 4.291 22.088 ( 1.461 -1.776 -3.593) 4.265 22.188 ( -2.402 -1.877 3.448) 4.602 22.517 ( -2.392 1.525 3.195) 4.273 22.790 ( 2.703 -7.789 -1.905) 8.462 22.974 ( -1.935 0.500 -1.095) 2.278 23.187 ( -5.647 -6.657 -0.318) 8.736 23.213 ( -2.925 -6.814 0.953) 7.476 ======================= Grid point 29 (22/102) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( 1.977 4.095 -3.014) 5.455 1.810 ( 4.318 0.909 -0.086) 4.413 1.935 ( 0.617 0.506 -6.496) 6.545 2.048 ( -6.163 -2.026 8.594) 10.768 2.078 ( -2.595 4.125 3.943) 6.268 2.322 ( 2.166 4.461 0.798) 5.023 2.398 ( 0.996 -1.060 0.457) 1.524 2.566 ( -0.332 3.761 -4.032) 5.524 2.651 ( -0.925 -6.422 0.684) 6.524 2.700 ( -0.514 -0.834 -0.343) 1.039 2.918 ( 0.882 4.454 1.220) 4.702 3.021 ( -4.335 -0.492 1.509) 4.616 3.084 ( 1.185 5.995 0.443) 6.127 3.129 ( -0.023 -4.688 -2.817) 5.469 3.155 ( 3.770 -0.538 -1.924) 4.266 3.282 ( 1.787 -0.654 -0.864) 2.090 3.315 ( 1.871 2.928 -1.078) 3.638 3.397 ( -3.434 -3.126 -0.385) 4.659 3.522 ( -1.893 1.182 1.866) 2.909 3.617 ( 1.279 0.267 1.436) 1.941 3.717 ( 3.154 1.157 0.910) 3.481 3.781 ( 5.499 -3.347 -3.779) 7.465 3.792 ( -2.203 -4.614 3.804) 6.373 3.952 ( -6.340 -2.003 0.191) 6.652 4.075 ( 2.832 -4.821 -2.966) 6.329 4.121 ( -4.432 4.596 0.805) 6.435 4.217 ( -6.498 -2.107 2.753) 7.365 4.447 ( 4.353 -2.474 -6.012) 7.824 4.547 ( -3.593 0.004 0.975) 3.723 4.681 ( -7.805 -4.086 3.946) 9.653 4.847 ( 5.135 -0.801 0.077) 5.198 4.988 ( -0.027 1.253 -2.063) 2.414 5.103 ( 1.598 -3.458 4.421) 5.836 5.165 ( 3.849 -1.486 -1.697) 4.462 5.246 ( -2.752 -3.166 -2.889) 5.093 5.440 ( -0.179 -3.932 -0.154) 3.939 5.482 ( 1.254 3.629 -1.327) 4.062 5.593 ( -0.091 -1.942 4.605) 4.999 5.729 ( -2.132 1.712 -2.963) 4.032 5.858 ( 3.389 -1.217 2.660) 4.476 5.977 ( 2.679 1.300 -1.551) 3.358 6.282 ( -0.067 1.236 2.341) 2.649 6.489 ( -2.613 -0.329 -4.201) 4.958 6.551 ( -0.651 11.183 1.679) 11.327 6.680 ( -1.360 2.048 -0.041) 2.459 6.832 ( -2.370 10.407 2.177) 10.893 7.013 ( -1.482 3.602 -3.231) 5.060 7.078 ( 1.714 -0.576 1.358) 2.262 7.185 ( -4.343 -0.762 -1.695) 4.724 7.348 ( -2.056 4.809 1.799) 5.531 7.849 ( -1.011 0.473 -2.730) 2.950 7.898 ( -5.820 -2.011 3.633) 7.149 8.059 ( -3.725 -3.214 0.208) 4.924 8.237 ( 1.039 8.254 0.733) 8.352 8.316 ( 2.344 4.773 -1.742) 5.595 8.598 ( 2.991 -3.040 -3.677) 5.631 8.907 ( -0.305 -1.244 3.482) 3.710 9.046 ( -0.173 -3.424 2.651) 4.334 9.155 ( 8.247 -4.742 -0.061) 9.513 9.327 ( -3.207 -1.301 -1.499) 3.771 9.704 ( 6.060 2.406 -1.272) 6.643 9.908 ( 2.410 5.145 -0.825) 5.741 10.322 ( 2.244 -0.799 1.487) 2.809 10.630 ( -2.087 -0.707 -3.539) 4.169 10.682 ( -3.870 1.179 0.958) 4.158 10.841 ( 0.735 -2.515 2.275) 3.470 10.931 ( 0.224 0.290 0.661) 0.756 11.054 ( -6.479 1.045 -0.325) 6.570 11.192 ( 0.300 4.878 -0.170) 4.890 11.441 ( 3.658 3.245 1.875) 5.237 11.514 ( 6.259 10.197 -2.401) 12.204 11.621 ( 7.449 4.059 0.287) 8.488 12.066 ( -3.221 0.733 2.049) 3.888 12.080 ( 0.410 0.134 -2.243) 2.284 12.550 ( 0.749 3.804 0.287) 3.888 12.569 ( 2.280 1.863 -0.142) 2.948 13.182 ( -0.493 -2.158 -0.588) 2.290 13.263 ( 0.930 -2.324 -0.412) 2.537 13.287 ( -2.010 2.214 0.024) 2.990 13.556 ( -2.020 -3.406 1.101) 4.110 15.849 ( -2.672 0.116 -0.829) 2.800 15.958 ( -1.758 -2.156 0.650) 2.857 17.587 ( 5.617 -2.038 -0.114) 5.976 17.797 ( -7.246 -3.780 0.559) 8.192 18.171 ( 2.239 1.258 1.169) 2.821 18.278 ( -1.525 4.452 -3.524) 5.879 18.490 ( 5.128 4.840 1.597) 7.230 18.977 ( -2.040 9.081 1.643) 9.451 19.139 ( 5.349 1.572 -0.981) 5.661 19.373 ( 0.102 8.099 -0.209) 8.102 19.602 ( 3.480 -5.142 -0.450) 6.225 19.886 ( -13.256 -8.287 0.227) 15.635 21.400 ( 12.575 6.295 0.303) 14.066 21.747 ( -5.915 2.220 -0.009) 6.318 21.983 ( -0.296 -1.203 0.190) 1.253 22.122 ( 1.589 -0.863 -2.967) 3.475 22.208 ( -1.844 -0.880 2.110) 2.938 22.503 ( -0.668 -0.981 1.209) 1.694 22.915 ( 0.327 2.068 -1.389) 2.512 22.947 ( 0.605 -5.140 0.405) 5.191 23.244 ( -2.513 -3.881 0.315) 4.634 23.336 ( -0.079 -7.153 -0.076) 7.154 ======================= Grid point 30 (23/102) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 0.070 5.601 -0.446) 5.619 1.625 ( -1.897 17.305 1.194) 17.450 1.791 ( -1.311 10.706 -1.028) 10.835 1.966 ( -0.263 7.222 0.809) 7.272 2.182 ( -0.541 -11.003 -0.017) 11.016 2.229 ( -1.357 6.429 0.695) 6.607 2.435 ( 3.153 4.868 0.455) 5.818 2.525 ( -3.744 -1.727 -1.316) 4.328 2.640 ( -2.508 4.395 1.028) 5.164 2.700 ( 0.882 12.454 -0.694) 12.505 2.771 ( 0.429 -0.985 -0.811) 1.346 2.943 ( -1.712 -0.876 0.305) 1.948 3.130 ( -1.934 -0.930 2.126) 3.021 3.200 ( 1.699 -4.164 -2.326) 5.063 3.211 ( 0.143 4.252 0.062) 4.255 3.239 ( -0.701 -3.716 0.328) 3.796 3.352 ( 3.287 -3.012 -0.855) 4.540 3.439 ( 2.365 -0.468 -3.151) 3.968 3.487 ( -5.034 -1.763 2.543) 5.909 3.649 ( 4.908 -1.266 0.997) 5.165 3.738 ( 3.518 2.116 0.461) 4.131 3.834 ( 3.076 -1.586 -3.185) 4.703 3.846 ( -0.022 -1.777 2.963) 3.455 3.930 ( -6.783 -1.281 -0.503) 6.921 4.044 ( -1.130 0.729 1.432) 1.965 4.140 ( 0.995 -0.126 -1.663) 1.942 4.264 ( -3.106 -5.579 3.046) 7.075 4.467 ( 0.229 -0.415 -3.971) 3.999 4.522 ( -3.194 -0.044 1.252) 3.430 4.747 ( -2.018 -5.126 0.809) 5.569 4.885 ( 6.939 2.117 -1.229) 7.358 4.966 ( -0.142 1.253 -0.384) 1.318 5.148 ( -0.593 -1.381 1.747) 2.304 5.216 ( 0.722 -3.917 -0.225) 3.989 5.314 ( 2.471 -3.092 -1.960) 4.417 5.402 ( -0.549 1.975 -1.535) 2.560 5.503 ( 0.764 -0.325 2.083) 2.242 5.586 ( -5.104 1.823 3.335) 6.364 5.700 ( 0.646 0.451 -2.205) 2.341 5.892 ( 1.209 1.127 6.179) 6.396 5.939 ( 0.805 2.656 -7.015) 7.544 6.253 ( -0.865 1.145 0.040) 1.435 6.341 ( -0.864 6.994 2.173) 7.374 6.441 ( -1.311 8.316 -0.669) 8.446 6.629 ( -1.230 5.692 1.247) 5.955 6.691 ( -2.509 -3.447 -2.303) 4.845 6.889 ( -2.929 6.594 -0.045) 7.215 7.109 ( -0.541 -1.404 -0.300) 1.535 7.232 ( -1.228 6.486 0.802) 6.650 7.249 ( -1.679 -6.978 -0.062) 7.178 7.790 ( -2.829 1.745 -0.341) 3.341 7.970 ( -1.391 -7.055 0.035) 7.191 8.115 ( -0.754 4.725 4.213) 6.375 8.148 ( 0.469 -6.407 -3.189) 7.172 8.249 ( 1.184 4.200 -0.011) 4.364 8.655 ( 1.747 -1.654 -2.485) 3.458 8.956 ( 1.250 -2.621 1.255) 3.164 9.133 ( 1.086 -4.858 1.255) 5.134 9.291 ( 4.184 -4.332 1.449) 6.195 9.342 ( -1.114 -2.177 -1.548) 2.894 9.685 ( 2.848 2.855 -0.863) 4.124 9.844 ( 0.326 2.495 -0.383) 2.545 10.350 ( 3.972 1.112 0.731) 4.189 10.584 ( -3.226 5.751 0.771) 6.639 10.610 ( -4.264 -0.096 -1.189) 4.428 10.865 ( 0.521 1.075 4.256) 4.420 10.901 ( -0.255 1.927 -4.581) 4.977 11.027 ( -3.320 -2.342 0.884) 4.158 11.150 ( -0.549 0.198 -0.148) 0.602 11.349 ( 0.945 8.572 0.144) 8.625 11.462 ( 2.431 -1.690 -0.305) 2.976 11.626 ( 4.359 1.469 0.070) 4.601 12.047 ( -2.146 -1.145 0.709) 2.534 12.114 ( 0.958 -3.121 -1.022) 3.421 12.488 ( 0.006 3.624 0.288) 3.635 12.551 ( 0.670 1.388 -0.031) 1.542 13.136 ( -0.515 3.825 0.189) 3.864 13.228 ( 0.074 3.105 -0.352) 3.126 13.383 ( -0.463 -8.544 -0.366) 8.564 13.658 ( 0.470 -7.178 0.557) 7.215 15.831 ( -1.726 -0.060 0.016) 1.727 15.995 ( -0.412 -2.586 -0.079) 2.619 17.675 ( 7.654 -2.149 -0.547) 7.969 17.819 ( -8.223 -4.828 1.236) 9.615 18.103 ( 0.308 7.529 0.323) 7.542 18.171 ( -0.535 6.501 -1.908) 6.796 18.523 ( 3.531 -4.855 1.425) 6.170 18.832 ( -3.185 3.206 -0.890) 4.606 19.174 ( 5.053 -0.501 0.428) 5.095 19.255 ( -4.194 2.804 0.126) 5.046 19.766 ( 7.968 -7.554 -0.437) 10.988 19.953 ( -10.552 -9.101 0.269) 13.937 21.363 ( 10.950 7.463 -0.075) 13.252 21.581 ( -9.027 8.628 0.026) 12.487 22.049 ( 0.343 -4.068 0.465) 4.109 22.119 ( 0.785 1.728 -0.633) 2.001 22.200 ( -1.018 0.600 0.326) 1.226 22.550 ( 0.479 -4.014 -0.321) 4.055 22.821 ( -0.585 6.293 0.376) 6.331 23.060 ( 1.051 -5.031 -0.246) 5.145 23.288 ( -0.400 -2.032 0.007) 2.071 23.457 ( 1.151 -5.796 0.077) 5.910 ======================= Grid point 31 (24/102) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( 0.000 16.122 0.000) 16.122 1.324 ( 0.000 12.113 0.000) 12.113 1.597 ( 0.000 9.025 0.000) 9.025 1.822 ( 0.000 8.225 0.000) 8.225 2.082 ( 0.000 9.423 0.000) 9.423 2.266 ( 0.000 14.106 0.000) 14.106 2.340 ( 0.000 13.659 0.000) 13.659 2.393 ( -0.000 -1.671 -0.000) 1.671 2.423 ( 0.000 6.666 0.000) 6.666 2.694 ( -0.000 -4.480 -0.000) 4.480 2.824 ( -0.000 -2.887 -0.000) 2.887 2.940 ( 0.000 2.773 0.000) 2.773 3.051 ( 0.000 7.009 0.000) 7.009 3.122 ( 0.000 3.341 0.000) 3.341 3.315 ( -0.000 -5.434 -0.000) 5.434 3.328 ( -0.000 -3.981 -0.000) 3.981 3.365 ( 0.000 2.732 0.000) 2.732 3.410 ( -0.000 -0.904 -0.000) 0.904 3.543 ( 0.000 0.858 0.000) 0.858 3.710 ( -0.000 -1.573 -0.000) 1.573 3.728 ( -0.000 -3.719 -0.000) 3.719 3.859 ( -0.000 -1.154 -0.000) 1.154 3.909 ( -0.000 -3.308 -0.000) 3.308 3.917 ( -0.000 -1.558 -0.000) 1.558 4.062 ( -0.000 -2.318 -0.000) 2.318 4.122 ( 0.000 0.581 0.000) 0.581 4.351 ( -0.000 -4.473 -0.000) 4.473 4.492 ( -0.000 -3.410 -0.000) 3.410 4.501 ( 0.000 2.003 0.000) 2.003 4.774 ( 0.000 2.292 0.000) 2.292 4.887 ( -0.000 -1.048 -0.000) 1.048 4.925 ( 0.000 2.576 0.000) 2.576 5.189 ( -0.000 -2.910 -0.000) 2.910 5.310 ( 0.000 2.155 0.000) 2.155 5.315 ( -0.000 -5.800 -0.000) 5.800 5.393 ( 0.000 4.270 0.000) 4.270 5.460 ( 0.000 2.575 0.000) 2.575 5.581 ( -0.000 -4.974 -0.000) 4.974 5.662 ( 0.000 4.647 0.000) 4.647 5.823 ( 0.000 4.620 0.000) 4.620 5.944 ( -0.000 -1.999 -0.000) 1.999 6.242 ( 0.000 8.704 0.000) 8.704 6.251 ( -0.000 -0.938 -0.000) 0.938 6.263 ( 0.000 4.123 0.000) 4.123 6.627 ( -0.000 -2.021 -0.000) 2.021 6.690 ( 0.000 2.726 0.000) 2.726 6.811 ( -0.000 -1.919 -0.000) 1.919 7.116 ( 0.000 5.767 0.000) 5.767 7.151 ( -0.000 -3.804 -0.000) 3.804 7.361 ( -0.000 -5.874 -0.000) 5.874 7.768 ( -0.000 -0.268 -0.000) 0.268 8.065 ( 0.000 0.697 0.000) 0.697 8.098 ( -0.000 -6.869 -0.000) 6.869 8.179 ( 0.000 3.968 0.000) 3.968 8.274 ( -0.000 -7.219 -0.000) 7.219 8.681 ( -0.000 -1.423 -0.000) 1.423 9.004 ( -0.000 -1.797 -0.000) 1.797 9.199 ( -0.000 -0.438 -0.000) 0.438 9.368 ( -0.000 -1.076 -0.000) 1.076 9.375 ( -0.000 -3.621 -0.000) 3.621 9.655 ( 0.000 1.226 0.000) 1.226 9.832 ( -0.000 -0.674 -0.000) 0.674 10.320 ( 0.000 3.231 0.000) 3.231 10.437 ( 0.000 7.593 0.000) 7.593 10.630 ( -0.000 -3.087 -0.000) 3.087 10.849 ( 0.000 0.777 0.000) 0.777 10.869 ( 0.000 0.591 0.000) 0.591 11.045 ( 0.000 0.612 0.000) 0.612 11.162 ( -0.000 -1.622 -0.000) 1.622 11.265 ( 0.000 0.518 0.000) 0.518 11.509 ( -0.000 -1.718 -0.000) 1.718 11.620 ( 0.000 0.735 0.000) 0.735 12.084 ( -0.000 -3.903 -0.000) 3.903 12.194 ( -0.000 -5.336 -0.000) 5.336 12.424 ( 0.000 3.359 0.000) 3.359 12.527 ( 0.000 1.645 0.000) 1.645 13.075 ( 0.000 2.715 0.000) 2.715 13.175 ( 0.000 2.706 0.000) 2.706 13.542 ( -0.000 -9.237 -0.000) 9.237 13.793 ( -0.000 -7.359 -0.000) 7.359 15.825 ( 0.000 0.068 0.000) 0.068 16.040 ( -0.000 -2.600 -0.000) 2.600 17.730 ( 0.000 1.149 0.000) 1.149 17.867 ( -0.000 -1.647 -0.000) 1.647 17.962 ( 0.000 4.216 0.000) 4.216 18.027 ( 0.000 8.071 0.000) 8.071 18.699 ( -0.000 -12.164 -0.000) 12.164 18.838 ( -0.000 -5.148 -0.000) 5.148 19.172 ( 0.000 1.763 0.000) 1.763 19.269 ( -0.000 -5.099 -0.000) 5.099 19.949 ( -0.000 -8.453 -0.000) 8.453 20.077 ( -0.000 -9.933 -0.000) 9.933 21.290 ( 0.000 7.497 0.000) 7.497 21.333 ( 0.000 13.108 0.000) 13.108 22.070 ( 0.000 2.983 0.000) 2.983 22.075 ( 0.000 3.208 0.000) 3.208 22.211 ( -0.000 -3.076 -0.000) 3.076 22.636 ( -0.000 -4.960 -0.000) 4.960 22.697 ( 0.000 7.096 0.000) 7.096 23.132 ( -0.000 -2.384 -0.000) 2.384 23.304 ( 0.000 0.255 0.000) 0.255 23.553 ( -0.000 -4.168 -0.000) 4.168 ======================= Grid point 36 (25/102) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.006 ( 22.529 0.000 -1.434) 22.574 1.136 ( 22.545 0.000 -3.260) 22.780 1.439 ( 13.302 0.000 -3.432) 13.738 1.537 ( 14.671 0.000 2.131) 14.825 2.034 ( 6.523 0.000 6.659) 9.322 2.093 ( 32.101 0.000 1.246) 32.125 2.293 ( 2.130 0.000 0.881) 2.304 2.415 ( 2.823 0.000 0.193) 2.830 2.500 ( 2.882 0.000 1.345) 3.180 2.574 ( 1.565 0.000 -7.964) 8.116 2.733 ( -0.323 -0.000 -1.055) 1.103 2.844 ( 7.360 0.000 -7.989) 10.862 2.905 ( 0.943 0.000 5.147) 5.233 3.017 ( -0.992 -0.000 6.099) 6.179 3.155 ( -4.829 -0.000 5.755) 7.512 3.226 ( -4.137 -0.000 -4.261) 5.939 3.432 ( -0.144 -0.000 6.339) 6.341 3.486 ( -0.273 -0.000 -1.565) 1.589 3.535 ( -0.925 -0.000 -1.409) 1.686 3.673 ( -3.508 -0.000 -1.149) 3.691 3.755 ( 2.194 0.000 -7.812) 8.114 3.868 ( -3.095 -0.000 6.062) 6.807 3.900 ( 7.669 0.000 -4.287) 8.786 4.002 ( -2.651 -0.000 -2.664) 3.759 4.190 ( 0.181 0.000 5.860) 5.863 4.267 ( -5.193 -0.000 -0.616) 5.229 4.436 ( -5.297 -0.000 0.665) 5.338 4.546 ( -4.137 -0.000 -0.103) 4.138 4.637 ( -8.678 -0.000 -4.426) 9.742 4.784 ( -1.230 -0.000 0.586) 1.362 4.868 ( -8.134 -0.000 3.642) 8.912 4.944 ( 0.444 0.000 -0.198) 0.486 4.988 ( -5.387 -0.000 0.290) 5.395 5.142 ( -2.076 -0.000 -0.826) 2.234 5.150 ( -9.260 -0.000 1.567) 9.391 5.197 ( 0.870 0.000 0.522) 1.014 5.259 ( 4.252 0.000 -6.410) 7.692 5.283 ( -6.300 -0.000 2.973) 6.967 5.443 ( -4.855 -0.000 0.399) 4.871 5.938 ( -2.032 -0.000 1.411) 2.474 5.959 ( 4.343 0.000 2.516) 5.019 6.133 ( 2.128 0.000 -2.089) 2.982 6.273 ( -1.063 -0.000 -3.331) 3.496 6.466 ( -7.094 -0.000 0.261) 7.099 6.874 ( 10.502 0.000 3.622) 11.109 6.889 ( 6.866 0.000 -5.220) 8.625 7.109 ( 2.382 0.000 3.983) 4.641 7.169 ( 1.572 0.000 1.132) 1.937 7.580 ( 9.619 0.000 -6.480) 11.598 7.920 ( 2.842 0.000 -4.520) 5.339 8.067 ( -0.158 -0.000 4.618) 4.621 8.106 ( 2.791 0.000 0.524) 2.840 8.135 ( -2.949 -0.000 -9.469) 9.917 8.320 ( -7.827 -0.000 14.434) 16.420 8.499 ( -13.245 -0.000 6.661) 14.826 8.750 ( -1.916 -0.000 -5.937) 6.238 9.042 ( 5.084 0.000 -2.523) 5.676 9.063 ( -3.663 -0.000 6.907) 7.818 9.466 ( 10.802 0.000 -8.471) 13.727 9.867 ( -3.868 -0.000 7.753) 8.664 10.052 ( 11.654 0.000 -6.517) 13.352 10.071 ( -11.727 -0.000 -7.614) 13.982 10.172 ( -9.356 -0.000 9.516) 13.345 10.550 ( -2.946 -0.000 3.900) 4.888 10.557 ( -0.348 -0.000 3.343) 3.361 10.640 ( 6.640 0.000 -12.967) 14.568 11.096 ( 3.961 0.000 -3.852) 5.525 11.163 ( 4.857 0.000 -0.102) 4.858 11.255 ( 11.916 0.000 -5.116) 12.968 11.431 ( 6.214 0.000 6.800) 9.212 11.688 ( 7.678 0.000 2.687) 8.134 11.819 ( -0.473 -0.000 -1.978) 2.033 12.136 ( -2.727 -0.000 -0.135) 2.731 12.229 ( -3.978 -0.000 0.818) 4.061 12.899 ( 0.699 0.000 1.006) 1.225 12.900 ( -3.506 -0.000 -0.907) 3.622 13.220 ( 14.237 0.000 1.219) 14.289 13.415 ( 7.760 0.000 -3.327) 8.443 13.827 ( -4.212 -0.000 0.449) 4.236 13.851 ( -5.314 -0.000 0.177) 5.317 15.967 ( -9.536 -0.000 -9.861) 13.718 16.136 ( -13.891 -0.000 8.149) 16.105 17.548 ( 11.977 0.000 1.338) 12.051 17.658 ( 6.518 0.000 -2.290) 6.909 18.201 ( 8.523 0.000 1.052) 8.588 18.431 ( 4.385 0.000 -5.180) 6.787 18.858 ( -12.630 -0.000 3.705) 13.162 18.957 ( -12.388 -0.000 -1.359) 12.462 19.827 ( -0.287 -0.000 -3.874) 3.884 19.958 ( -2.590 -0.000 3.379) 4.257 20.339 ( 0.404 0.000 3.041) 3.068 20.769 ( 5.606 0.000 3.970) 6.869 20.816 ( 8.613 0.000 -2.362) 8.931 21.545 ( 13.697 0.000 -32.570) 35.333 21.780 ( -7.841 -0.000 19.294) 20.826 21.959 ( 2.102 0.000 2.706) 3.427 22.074 ( 7.140 0.000 -0.349) 7.149 22.418 ( 2.730 0.000 -0.657) 2.808 22.427 ( -0.855 -0.000 1.649) 1.857 22.679 ( -5.116 -0.000 3.186) 6.027 22.928 ( -5.409 -0.000 -0.733) 5.458 22.929 ( -6.605 -0.000 0.183) 6.607 ======================= Grid point 37 (26/102) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.171 ( 14.985 -2.651 1.933) 15.340 1.387 ( 20.877 -8.976 -4.113) 23.094 1.459 ( 7.957 4.864 2.933) 9.777 1.739 ( 13.458 -7.297 -1.967) 15.435 2.087 ( 9.023 -0.540 0.760) 9.071 2.228 ( 1.438 3.795 -3.417) 5.305 2.335 ( 6.789 -3.156 3.513) 8.270 2.447 ( 10.432 -1.227 -1.407) 10.597 2.576 ( -3.497 -5.971 2.433) 7.335 2.612 ( 0.936 -4.467 -3.073) 5.502 2.724 ( 5.237 1.982 -0.738) 5.647 2.892 ( -1.911 -1.338 3.008) 3.807 2.977 ( 5.597 -5.792 -3.400) 8.742 3.019 ( 0.917 0.855 5.824) 5.958 3.152 ( -0.651 -0.447 3.717) 3.800 3.182 ( -1.710 0.566 -3.161) 3.638 3.445 ( -3.384 1.085 -1.062) 3.709 3.470 ( -4.491 1.543 0.369) 4.763 3.495 ( 6.027 1.068 1.969) 6.429 3.676 ( -1.095 -1.211 -1.612) 2.294 3.732 ( -3.413 2.218 -1.745) 4.429 3.857 ( 3.024 -1.747 -1.112) 3.665 3.905 ( -3.948 4.484 -3.242) 6.798 3.932 ( 4.456 4.018 -0.742) 6.046 4.115 ( -1.503 5.411 4.599) 7.259 4.269 ( -1.846 2.008 -0.408) 2.758 4.423 ( -4.068 -2.182 1.006) 4.725 4.540 ( -3.144 -1.584 -1.294) 3.750 4.551 ( -3.034 1.068 -2.877) 4.315 4.713 ( -1.406 4.062 0.434) 4.321 4.799 ( -7.103 0.642 4.868) 8.635 4.927 ( -1.435 1.471 -0.948) 2.263 5.030 ( -11.366 1.013 -2.157) 11.614 5.102 ( -2.603 -8.627 1.414) 9.121 5.104 ( -3.955 1.085 0.188) 4.105 5.167 ( -6.804 1.484 2.107) 7.276 5.270 ( -5.503 -5.318 -1.067) 7.727 5.368 ( 12.157 -3.013 -2.908) 12.858 5.420 ( -3.925 -1.797 1.142) 4.465 5.952 ( -3.530 -1.787 4.073) 5.678 5.963 ( 3.890 2.418 -0.869) 4.662 6.166 ( 2.790 -3.088 -2.197) 4.706 6.299 ( 0.578 -1.608 -1.754) 2.449 6.435 ( -1.653 -2.394 -0.153) 2.914 6.906 ( 8.101 2.057 -1.934) 8.579 6.952 ( 5.303 -0.054 1.177) 5.432 7.121 ( 4.398 1.483 0.314) 4.652 7.212 ( 0.137 -2.559 3.177) 4.082 7.609 ( 4.238 1.625 -4.873) 6.659 7.892 ( -6.859 1.848 0.077) 7.104 8.029 ( -4.777 1.979 -1.776) 5.468 8.059 ( 0.167 5.100 -0.973) 5.195 8.177 ( 6.497 -2.414 2.427) 7.343 8.324 ( -0.637 -2.405 3.802) 4.544 8.429 ( -10.356 -0.876 3.819) 11.072 8.638 ( -3.515 7.792 -1.607) 8.698 9.047 ( 3.188 2.734 0.238) 4.206 9.065 ( -5.182 -1.461 1.533) 5.598 9.521 ( 8.580 0.390 -8.475) 12.066 9.731 ( -7.747 9.498 3.726) 12.811 9.904 ( -7.923 7.657 -1.410) 11.108 10.116 ( 11.430 1.027 -5.333) 12.655 10.188 ( -1.464 -2.687 5.911) 6.657 10.472 ( 0.198 4.018 0.433) 4.046 10.580 ( -2.518 -1.085 4.187) 5.005 10.677 ( 7.068 -0.257 -6.035) 9.298 11.052 ( 4.773 4.524 -0.048) 6.576 11.178 ( 5.249 3.347 -1.860) 6.497 11.389 ( 9.504 -5.772 -0.679) 11.141 11.583 ( 6.460 -7.137 3.394) 10.207 11.719 ( 5.547 2.697 1.644) 6.384 11.788 ( -1.838 1.431 -2.691) 3.559 12.120 ( -1.472 0.197 -0.581) 1.595 12.217 ( -2.550 -1.001 0.780) 2.848 12.878 ( -2.885 -1.110 -1.078) 3.274 12.921 ( -0.583 -2.301 0.702) 2.476 13.188 ( 11.717 13.466 0.812) 17.868 13.354 ( 10.667 12.374 -0.890) 16.361 13.745 ( -7.348 2.494 0.029) 7.759 13.813 ( -5.085 2.596 0.273) 5.716 15.868 ( -8.747 0.423 -4.061) 9.653 16.061 ( -13.323 -0.825 3.580) 13.820 17.553 ( 10.413 6.731 0.428) 12.406 17.728 ( 4.971 -1.606 -0.829) 5.289 18.105 ( 13.583 7.260 0.285) 15.404 18.617 ( 1.058 -4.930 -2.409) 5.588 18.795 ( -8.318 -0.092 2.113) 8.582 18.962 ( -15.164 -13.306 -0.378) 20.178 19.700 ( -2.382 11.173 -2.443) 11.683 19.817 ( -1.955 11.173 1.595) 11.455 20.194 ( 1.272 15.525 -0.074) 15.577 20.639 ( 8.160 16.714 3.288) 18.888 21.015 ( 5.450 -11.752 -0.654) 12.970 21.495 ( 13.508 3.213 -12.812) 18.892 21.800 ( -1.833 -5.906 9.043) 10.955 21.988 ( 2.606 -0.803 1.344) 3.040 22.376 ( 0.764 -0.656 -3.616) 3.753 22.421 ( -1.923 -15.870 -3.115) 16.286 22.467 ( 0.548 -3.640 2.227) 4.302 22.654 ( -5.092 -0.720 3.597) 6.276 22.891 ( -5.743 -1.278 -1.341) 6.035 22.939 ( -6.284 -5.429 1.247) 8.397 ======================= Grid point 38 (27/102) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 2.245 -4.606 4.967) 7.136 1.465 ( 7.248 -0.869 2.918) 7.861 1.695 ( 17.814 -9.238 -1.967) 20.164 1.917 ( 10.387 -2.909 -6.602) 12.646 2.134 ( -2.379 3.543 -4.958) 6.542 2.205 ( 8.169 -4.328 -2.422) 9.557 2.401 ( 1.001 -2.097 3.514) 4.213 2.538 ( -5.284 -4.726 3.212) 7.783 2.641 ( -6.492 -4.020 3.171) 8.268 2.719 ( 4.190 -1.232 -0.850) 4.449 2.747 ( 8.221 0.641 1.899) 8.462 2.891 ( -1.442 -2.239 1.684) 3.151 3.052 ( 4.758 -2.243 2.525) 5.835 3.116 ( -4.216 -0.592 0.465) 4.283 3.143 ( 5.538 -5.915 -4.722) 9.378 3.210 ( 3.428 -0.613 0.888) 3.594 3.371 ( 3.806 3.777 -3.730) 6.532 3.435 ( -8.875 -0.593 0.437) 8.906 3.514 ( 5.400 1.288 0.398) 5.566 3.631 ( -5.553 1.837 0.684) 5.889 3.695 ( -1.293 0.299 -1.143) 1.752 3.792 ( -0.823 3.832 -1.748) 4.291 3.851 ( 0.067 5.789 0.684) 5.829 3.981 ( 8.980 -5.257 -0.901) 10.444 4.009 ( -3.208 5.032 2.793) 6.589 4.173 ( -4.096 5.513 0.217) 6.872 4.379 ( -0.972 4.729 -1.240) 4.985 4.507 ( -3.352 -0.747 -0.582) 3.483 4.605 ( 0.282 -2.371 -4.159) 4.796 4.618 ( -7.611 2.885 3.758) 8.965 4.769 ( -1.869 -0.374 5.501) 5.822 4.888 ( -10.236 0.221 -0.427) 10.247 4.966 ( 1.460 -2.872 -2.084) 3.837 5.052 ( -3.975 0.446 1.629) 4.318 5.092 ( -5.449 -0.222 -2.200) 5.880 5.257 ( 0.284 -6.883 -3.745) 7.841 5.355 ( -2.895 -7.038 -0.850) 7.658 5.413 ( -4.382 -2.838 5.360) 7.482 5.556 ( 10.912 -6.063 -1.600) 12.585 5.922 ( 2.299 3.385 1.605) 4.395 5.968 ( -4.198 -1.584 0.314) 4.497 6.266 ( 6.048 -2.607 0.913) 6.649 6.298 ( -3.676 -2.589 -3.074) 5.446 6.543 ( 5.477 -6.230 -0.645) 8.320 6.910 ( 4.803 2.588 -2.978) 6.215 6.973 ( 4.251 1.921 3.795) 6.013 7.119 ( 3.799 2.199 -1.870) 4.772 7.267 ( -0.130 -2.866 3.718) 4.696 7.547 ( -2.264 5.693 -2.995) 6.819 7.745 ( -6.569 8.719 1.376) 11.003 7.920 ( -4.322 3.479 -2.670) 6.157 8.004 ( 0.591 2.975 3.691) 4.778 8.252 ( 1.868 0.679 -0.933) 2.196 8.357 ( -2.129 0.035 -3.458) 4.062 8.407 ( -2.239 -2.307 1.027) 3.375 8.495 ( -3.471 1.904 4.709) 6.152 8.992 ( -0.426 4.609 2.857) 5.439 9.051 ( -0.782 -0.529 -2.827) 2.981 9.413 ( -1.735 13.125 -2.583) 13.489 9.617 ( 2.373 3.907 -3.433) 5.716 9.691 ( -4.439 6.494 1.882) 8.088 10.143 ( 6.583 2.993 -0.900) 7.287 10.248 ( 2.746 -2.003 0.251) 3.408 10.448 ( 1.084 -0.955 -0.278) 1.471 10.600 ( -2.264 -2.260 5.499) 6.361 10.719 ( 6.495 -0.212 -3.884) 7.571 11.014 ( 3.946 3.611 0.501) 5.373 11.141 ( 1.728 3.323 -0.102) 3.747 11.549 ( 8.345 -4.039 0.166) 9.273 11.658 ( 0.580 5.163 -0.974) 5.286 11.734 ( 7.466 2.454 0.104) 7.860 11.766 ( 3.134 -2.588 0.381) 4.083 12.102 ( -1.186 0.610 -0.079) 1.336 12.216 ( -2.600 -0.491 0.136) 2.649 12.892 ( 1.056 -0.608 -2.098) 2.426 12.979 ( 2.664 -1.007 1.932) 3.441 12.994 ( 3.238 10.256 0.333) 10.760 13.143 ( 9.489 18.429 0.191) 20.729 13.634 ( -7.789 4.291 -0.646) 8.917 13.699 ( -5.247 4.429 0.689) 6.901 15.819 ( -6.568 -1.750 -1.320) 6.924 15.982 ( -9.751 0.365 0.987) 9.808 17.525 ( 8.431 3.717 0.053) 9.214 17.758 ( -0.190 0.015 -0.197) 0.274 18.147 ( 14.172 1.859 0.290) 14.296 18.608 ( -0.390 3.813 -1.739) 4.208 18.735 ( -4.782 1.028 1.459) 5.104 19.114 ( -11.909 -11.424 1.291) 16.553 19.467 ( -2.156 10.069 -1.104) 10.356 19.620 ( -1.738 8.302 1.412) 8.599 19.891 ( 2.016 17.548 -3.967) 18.103 20.350 ( 6.140 21.145 2.599) 22.172 21.268 ( 4.562 -11.353 0.809) 12.262 21.570 ( 11.361 -1.351 -5.356) 12.633 21.934 ( -1.221 -7.534 3.961) 8.599 22.029 ( 2.038 -1.356 2.076) 3.210 22.294 ( -0.837 5.478 -1.869) 5.848 22.544 ( 0.919 -4.737 2.408) 5.393 22.583 ( -0.186 0.282 -2.739) 2.760 22.749 ( -8.919 -15.488 0.328) 17.876 22.892 ( -3.499 -3.733 -3.052) 5.957 23.008 ( -5.957 -6.120 2.738) 8.969 ======================= Grid point 39 (28/102) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 0.204 -7.493 0.144) 7.497 1.602 ( 3.541 -7.393 3.760) 9.018 1.932 ( 8.468 -4.461 4.635) 10.634 1.963 ( 9.971 3.612 -10.782) 15.124 2.090 ( -3.522 -2.647 -1.647) 4.704 2.309 ( 2.943 -3.791 -2.081) 5.231 2.456 ( -0.511 -1.746 3.098) 3.593 2.568 ( -8.861 -4.318 2.972) 10.295 2.623 ( -1.927 3.319 4.743) 6.101 2.691 ( 1.127 3.266 -0.112) 3.457 2.803 ( 1.776 -4.564 -0.664) 4.943 3.001 ( 8.673 -3.038 -3.117) 9.703 3.079 ( -3.221 0.716 1.810) 3.763 3.142 ( -0.070 -3.233 1.493) 3.562 3.236 ( 3.278 -0.541 -0.197) 3.328 3.264 ( -2.444 -3.472 -1.015) 4.365 3.351 ( 6.585 1.670 -5.549) 8.772 3.391 ( 2.020 2.497 0.742) 3.297 3.539 ( 3.139 -1.663 -1.817) 3.990 3.586 ( -7.523 -3.282 0.788) 8.245 3.682 ( -2.604 -0.470 1.124) 2.875 3.716 ( 3.354 6.473 -1.792) 7.507 3.784 ( -3.926 0.634 3.548) 5.330 3.896 ( -0.607 3.852 0.877) 3.997 4.036 ( -3.929 4.288 0.975) 5.897 4.167 ( 7.305 -5.796 -1.618) 9.464 4.263 ( -2.617 5.317 -1.153) 6.037 4.441 ( -4.402 5.535 -0.060) 7.073 4.546 ( -5.620 -1.543 1.061) 5.924 4.602 ( -5.449 -0.069 -0.529) 5.475 4.789 ( 0.928 -1.037 2.663) 3.005 4.887 ( -5.084 -5.541 1.648) 7.699 5.015 ( 0.897 -1.504 -0.452) 1.808 5.079 ( 0.945 -3.800 -1.331) 4.136 5.114 ( 1.295 -4.696 -2.074) 5.294 5.312 ( -3.760 -2.422 -3.927) 5.952 5.455 ( -1.257 -5.428 2.093) 5.952 5.478 ( -0.759 -4.539 2.684) 5.327 5.725 ( 8.658 -4.228 -2.049) 9.850 5.878 ( -0.203 3.025 4.287) 5.251 5.963 ( -1.432 -0.901 -2.395) 2.932 6.294 ( -1.366 -1.629 3.695) 4.263 6.373 ( 3.611 -2.621 -4.938) 6.655 6.688 ( 3.694 -5.027 -0.885) 6.300 6.879 ( 1.139 1.324 -1.928) 2.602 6.959 ( 4.610 5.519 5.168) 8.856 7.083 ( 1.561 3.312 -2.669) 4.531 7.311 ( -0.088 3.582 2.229) 4.220 7.372 ( -6.513 4.193 -0.603) 7.769 7.523 ( -2.596 11.614 -0.633) 11.918 7.849 ( -2.022 1.626 -1.028) 2.791 7.959 ( 0.013 3.258 2.976) 4.412 8.129 ( -6.600 6.218 -1.744) 9.234 8.373 ( 5.058 -0.661 -5.629) 7.597 8.440 ( -0.744 -1.541 1.710) 2.419 8.510 ( -5.124 -2.306 5.479) 7.848 8.916 ( -1.958 2.745 2.277) 4.069 9.076 ( 6.385 -0.698 -4.318) 7.740 9.170 ( -0.750 10.966 -0.198) 10.993 9.417 ( -5.595 9.259 1.429) 10.912 9.716 ( 4.455 -1.888 -2.190) 5.311 10.109 ( 3.351 4.701 0.169) 5.775 10.288 ( 2.405 -0.511 0.146) 2.463 10.504 ( 0.734 -4.148 -2.067) 4.693 10.639 ( -3.185 -2.509 4.665) 6.181 10.774 ( 6.664 -1.293 -2.533) 7.246 10.978 ( 2.320 3.120 1.129) 4.049 11.087 ( -3.103 2.067 0.049) 3.728 11.517 ( 0.280 9.308 -0.679) 9.337 11.639 ( 4.154 2.434 1.668) 5.095 11.706 ( 9.422 3.846 -3.044) 10.622 11.831 ( 4.990 1.527 1.658) 5.475 12.081 ( -1.029 0.806 0.418) 1.373 12.182 ( -3.213 2.093 -0.501) 3.867 12.767 ( 6.524 11.970 -0.028) 13.633 12.859 ( 3.494 15.640 -0.001) 16.025 12.977 ( -2.211 -5.399 -1.024) 5.923 13.098 ( 2.363 -5.795 1.342) 6.400 13.482 ( -5.444 6.124 -0.792) 8.232 13.597 ( -4.284 3.464 0.780) 5.564 15.818 ( -3.795 -2.451 -1.090) 4.647 15.919 ( -5.723 0.199 0.791) 5.781 17.544 ( 6.740 0.659 -0.089) 6.773 17.734 ( -4.659 0.159 0.151) 4.664 18.202 ( 8.908 2.163 0.839) 9.206 18.492 ( -1.532 7.257 -2.535) 7.838 18.694 ( 0.476 2.688 0.844) 2.857 19.181 ( -1.807 -2.215 5.223) 5.954 19.319 ( 0.532 6.840 -1.665) 7.060 19.544 ( -3.734 -1.614 -0.070) 4.069 19.623 ( -2.103 9.923 -4.834) 11.237 20.005 ( 1.711 20.709 2.012) 20.876 21.473 ( 6.107 -6.605 1.286) 9.087 21.651 ( 6.034 -1.095 -2.276) 6.541 22.038 ( 0.805 -3.426 -2.994) 4.620 22.068 ( -0.839 -1.353 4.384) 4.664 22.182 ( -2.608 4.188 -0.379) 4.948 22.541 ( -1.602 2.049 2.332) 3.493 22.670 ( 2.299 -7.000 -1.162) 7.459 22.906 ( -5.286 -7.185 -1.351) 9.022 22.991 ( -0.401 -9.463 -2.755) 9.864 23.073 ( -5.609 -5.680 2.986) 8.523 ======================= Grid point 40 (29/102) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( 0.501 -5.249 -1.652) 5.525 1.764 ( 2.668 -7.379 0.340) 7.854 1.940 ( 4.608 1.553 -7.095) 8.602 2.002 ( -3.106 -0.659 10.142) 10.627 2.106 ( -1.405 0.035 -1.247) 1.879 2.359 ( 0.629 1.636 -0.793) 1.923 2.487 ( 4.993 0.157 -1.299) 5.162 2.557 ( -0.902 0.174 2.710) 2.862 2.599 ( -6.657 -5.357 1.050) 8.609 2.652 ( 0.067 3.336 0.173) 3.341 2.919 ( 4.774 -5.291 -2.089) 7.427 3.003 ( -1.486 1.694 -0.294) 2.273 3.102 ( 0.487 1.719 0.318) 1.815 3.162 ( 4.041 -0.761 0.513) 4.144 3.227 ( -0.598 2.944 -0.007) 3.004 3.269 ( -5.910 -1.642 -0.854) 6.193 3.329 ( -1.166 3.740 1.015) 4.047 3.380 ( 6.185 1.169 -3.090) 7.012 3.561 ( -3.649 2.388 1.673) 4.671 3.615 ( 1.230 -0.746 0.072) 1.441 3.674 ( -0.678 -4.180 1.963) 4.667 3.728 ( 3.434 -6.101 -3.769) 7.951 3.757 ( -0.244 0.897 2.079) 2.278 3.873 ( -3.505 -1.476 0.444) 3.829 4.024 ( 2.845 -3.195 -0.716) 4.338 4.162 ( -2.353 2.774 -2.120) 4.210 4.196 ( -4.452 4.828 3.632) 7.504 4.406 ( 3.613 -3.395 -4.068) 6.413 4.550 ( -0.988 1.387 0.195) 1.714 4.555 ( -7.760 -3.625 2.588) 8.948 4.848 ( 4.409 -2.712 -0.333) 5.186 4.946 ( -4.803 -3.715 1.538) 6.264 5.068 ( 2.050 -3.773 1.396) 4.515 5.137 ( -1.019 -2.588 -1.954) 3.399 5.200 ( 2.986 0.200 1.059) 3.174 5.345 ( -1.507 -6.918 -4.382) 8.326 5.520 ( 0.759 0.113 -1.666) 1.834 5.540 ( -1.657 -3.866 5.044) 6.567 5.769 ( 1.439 3.028 -2.752) 4.337 5.873 ( 2.222 -0.717 4.271) 4.867 5.978 ( 0.326 -1.593 -2.275) 2.797 6.333 ( 2.699 0.182 6.237) 6.798 6.403 ( -2.081 -2.537 -7.152) 7.869 6.710 ( -0.466 2.441 -0.812) 2.614 6.806 ( -0.189 13.845 1.988) 13.989 6.945 ( 3.936 -5.245 -1.204) 6.667 7.024 ( 0.915 5.729 4.304) 7.224 7.112 ( -6.157 7.134 -3.306) 9.987 7.284 ( -0.046 10.578 -1.338) 10.663 7.394 ( -0.593 0.631 1.441) 1.681 7.825 ( -0.695 -0.431 -0.920) 1.231 7.908 ( -0.179 3.180 2.704) 4.178 8.005 ( -4.604 1.442 -1.674) 5.107 8.375 ( 2.193 4.087 -1.574) 4.898 8.411 ( 0.248 5.293 -0.343) 5.310 8.533 ( -1.889 -4.310 1.360) 4.898 8.886 ( -1.516 -0.402 1.508) 2.175 9.038 ( 0.417 2.911 0.377) 2.965 9.157 ( 8.385 -2.127 -1.323) 8.751 9.280 ( -5.858 1.290 0.376) 6.010 9.762 ( 3.176 -0.065 -1.045) 3.345 10.030 ( 1.686 6.124 -0.151) 6.353 10.313 ( 0.838 -1.063 0.805) 1.575 10.580 ( 1.450 -3.768 -3.395) 5.275 10.654 ( -3.914 -1.144 3.271) 5.228 10.833 ( 3.611 -0.608 -0.748) 3.737 10.954 ( 2.276 1.288 1.289) 2.915 11.026 ( -5.495 1.047 -0.391) 5.608 11.337 ( 0.369 10.088 -0.132) 10.096 11.560 ( 1.944 6.870 0.230) 7.143 11.702 ( 5.627 4.959 -0.260) 7.505 11.781 ( 4.150 7.514 -0.035) 8.584 12.060 ( -1.528 0.757 0.911) 1.933 12.103 ( -1.814 3.043 -0.935) 3.664 12.640 ( 1.863 6.119 0.080) 6.397 12.664 ( 1.436 7.703 -0.035) 7.835 13.073 ( -0.769 -6.648 -0.917) 6.755 13.224 ( 1.737 -5.170 1.374) 5.624 13.347 ( -2.267 5.455 -0.964) 5.985 13.521 ( -2.473 1.604 0.601) 3.008 15.828 ( -1.671 -0.771 -0.913) 2.054 15.906 ( -2.051 -1.923 0.765) 2.914 17.597 ( 6.036 -1.325 -0.169) 6.182 17.701 ( -6.301 -1.314 0.316) 6.445 18.213 ( 3.304 1.536 1.305) 3.870 18.347 ( -1.547 6.129 -2.507) 6.800 18.631 ( 2.010 5.817 0.559) 6.180 19.149 ( -0.030 9.078 7.104) 11.527 19.220 ( 3.534 3.682 -6.078) 7.937 19.541 ( 0.489 -2.638 -0.911) 2.834 19.561 ( 0.915 3.056 -1.168) 3.397 19.698 ( -7.804 6.501 1.476) 10.264 21.579 ( 10.172 2.629 0.757) 10.534 21.690 ( -4.088 -2.964 -0.517) 5.076 22.006 ( -1.610 3.924 -0.258) 4.250 22.097 ( 1.322 -1.965 -2.439) 3.400 22.168 ( -1.697 -2.426 2.221) 3.702 22.504 ( -0.792 1.251 1.201) 1.906 22.817 ( 1.348 -7.772 -0.775) 7.926 22.950 ( -0.833 -0.429 -0.403) 1.020 23.130 ( -1.879 -6.632 -0.090) 6.893 23.181 ( -1.456 -9.189 0.387) 9.312 ======================= Grid point 41 (30/102) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 0.000 4.057 0.000) 4.057 1.847 ( 0.000 4.462 0.000) 4.462 1.921 ( 0.000 3.600 0.000) 3.600 2.019 ( -0.000 -5.144 -0.000) 5.144 2.064 ( 0.000 3.456 0.000) 3.456 2.335 ( 0.000 2.642 0.000) 2.642 2.420 ( 0.000 1.149 0.000) 1.149 2.548 ( 0.000 5.798 0.000) 5.798 2.658 ( -0.000 -4.166 -0.000) 4.166 2.682 ( -0.000 -5.393 -0.000) 5.393 2.944 ( 0.000 6.053 0.000) 6.053 2.972 ( 0.000 5.019 0.000) 5.019 3.093 ( 0.000 4.147 0.000) 4.147 3.113 ( -0.000 -6.778 -0.000) 6.778 3.195 ( 0.000 0.854 0.000) 0.854 3.308 ( -0.000 -1.924 -0.000) 1.924 3.318 ( -0.000 -2.339 -0.000) 2.339 3.348 ( 0.000 1.190 0.000) 1.190 3.515 ( 0.000 1.917 0.000) 1.917 3.637 ( -0.000 -1.649 -0.000) 1.649 3.766 ( -0.000 -0.825 -0.000) 0.825 3.779 ( -0.000 -5.496 -0.000) 5.496 3.843 ( -0.000 -4.216 -0.000) 4.216 3.864 ( 0.000 0.971 0.000) 0.971 4.088 ( 0.000 4.488 0.000) 4.488 4.125 ( -0.000 -1.118 -0.000) 1.118 4.138 ( -0.000 -6.383 -0.000) 6.383 4.479 ( -0.000 -2.887 -0.000) 2.887 4.495 ( 0.000 2.603 0.000) 2.603 4.633 ( -0.000 -6.229 -0.000) 6.229 4.931 ( -0.000 -3.208 -0.000) 3.208 4.950 ( 0.000 0.573 0.000) 0.573 5.139 ( -0.000 -0.096 -0.000) 0.096 5.185 ( 0.000 0.530 0.000) 0.530 5.196 ( -0.000 -7.668 -0.000) 7.668 5.432 ( 0.000 0.371 0.000) 0.371 5.525 ( -0.000 -2.812 -0.000) 2.812 5.572 ( 0.000 0.602 0.000) 0.602 5.712 ( 0.000 2.091 0.000) 2.091 5.895 ( -0.000 -0.151 -0.000) 0.151 5.993 ( 0.000 0.656 0.000) 0.656 6.299 ( 0.000 4.122 0.000) 4.122 6.443 ( -0.000 -1.572 -0.000) 1.572 6.549 ( 0.000 11.944 0.000) 11.944 6.669 ( 0.000 1.096 0.000) 1.096 6.815 ( 0.000 14.092 0.000) 14.092 6.988 ( 0.000 4.682 0.000) 4.682 7.108 ( -0.000 -7.512 -0.000) 7.512 7.139 ( 0.000 4.816 0.000) 4.816 7.339 ( 0.000 5.250 0.000) 5.250 7.836 ( 0.000 4.162 0.000) 4.162 7.861 ( -0.000 -4.130 -0.000) 4.130 8.031 ( -0.000 -5.265 -0.000) 5.265 8.243 ( 0.000 8.611 0.000) 8.611 8.330 ( 0.000 4.309 0.000) 4.309 8.611 ( -0.000 -3.862 -0.000) 3.862 8.912 ( -0.000 -2.546 -0.000) 2.546 9.051 ( -0.000 -3.520 -0.000) 3.520 9.254 ( -0.000 -3.095 -0.000) 3.095 9.270 ( -0.000 -3.398 -0.000) 3.398 9.750 ( 0.000 2.584 0.000) 2.584 9.925 ( 0.000 5.794 0.000) 5.794 10.346 ( -0.000 -1.986 -0.000) 1.986 10.621 ( 0.000 0.452 0.000) 0.452 10.634 ( 0.000 1.680 0.000) 1.680 10.857 ( -0.000 -1.700 -0.000) 1.700 10.945 ( 0.000 2.659 0.000) 2.659 10.986 ( -0.000 -0.243 -0.000) 0.243 11.195 ( 0.000 5.238 0.000) 5.238 11.473 ( 0.000 2.826 0.000) 2.826 11.552 ( 0.000 12.230 0.000) 12.230 11.694 ( 0.000 3.967 0.000) 3.967 12.037 ( 0.000 0.642 0.000) 0.642 12.080 ( -0.000 -0.699 -0.000) 0.699 12.557 ( 0.000 4.076 0.000) 4.076 12.587 ( 0.000 2.631 0.000) 2.631 13.176 ( -0.000 -2.537 -0.000) 2.537 13.269 ( -0.000 -0.480 -0.000) 0.480 13.272 ( 0.000 0.961 0.000) 0.961 13.543 ( -0.000 -4.979 -0.000) 4.979 15.825 ( -0.000 -0.001 -0.000) 0.001 15.945 ( -0.000 -2.713 -0.000) 2.713 17.671 ( -0.000 -2.659 -0.000) 2.659 17.703 ( -0.000 -3.065 -0.000) 3.065 18.199 ( 0.000 2.368 0.000) 2.368 18.251 ( 0.000 3.954 0.000) 3.954 18.535 ( 0.000 4.461 0.000) 4.461 18.961 ( 0.000 10.800 0.000) 10.800 19.187 ( 0.000 0.837 0.000) 0.837 19.365 ( 0.000 10.350 0.000) 10.350 19.682 ( -0.000 -6.437 -0.000) 6.437 19.730 ( -0.000 -9.444 -0.000) 9.444 21.532 ( 0.000 6.407 0.000) 6.407 21.666 ( 0.000 4.107 0.000) 4.107 21.982 ( -0.000 -2.375 -0.000) 2.375 22.129 ( -0.000 -0.885 -0.000) 0.885 22.196 ( -0.000 -0.869 -0.000) 0.869 22.501 ( -0.000 -1.351 -0.000) 1.351 22.912 ( 0.000 3.880 0.000) 3.880 22.955 ( -0.000 -7.006 -0.000) 7.006 23.225 ( -0.000 -4.687 -0.000) 4.687 23.335 ( -0.000 -8.075 -0.000) 8.075 ======================= Grid point 48 (31/102) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.306 ( 18.564 0.000 -2.788) 18.772 1.417 ( 17.460 0.000 -5.826) 18.407 1.604 ( 8.419 0.000 2.388) 8.751 1.737 ( 8.755 0.000 5.248) 10.207 2.129 ( 3.204 0.000 1.142) 3.402 2.263 ( -2.306 -0.000 -1.354) 2.674 2.324 ( -1.986 -0.000 4.662) 5.067 2.440 ( 0.271 0.000 -3.092) 3.104 2.523 ( -3.591 -0.000 2.077) 4.149 2.636 ( 18.167 0.000 -7.165) 19.529 2.778 ( 0.815 0.000 -4.115) 4.195 2.885 ( 3.346 0.000 -0.255) 3.356 2.948 ( 2.498 0.000 5.314) 5.872 3.019 ( -2.368 -0.000 6.668) 7.076 3.162 ( -1.247 -0.000 -4.688) 4.851 3.187 ( 4.547 0.000 3.199) 5.560 3.366 ( -10.618 -0.000 3.767) 11.267 3.541 ( 3.712 0.000 -5.233) 6.416 3.558 ( 7.633 0.000 4.056) 8.643 3.632 ( -1.116 -0.000 -1.066) 1.543 3.744 ( 0.429 0.000 -6.110) 6.125 3.831 ( -2.549 -0.000 4.806) 5.441 3.893 ( -8.086 -0.000 -4.806) 9.407 4.021 ( 8.314 0.000 -2.270) 8.619 4.217 ( -1.941 -0.000 -1.812) 2.655 4.250 ( 3.799 0.000 6.371) 7.418 4.376 ( -2.919 -0.000 1.121) 3.127 4.483 ( -6.950 -0.000 -0.370) 6.960 4.536 ( 0.587 0.000 -3.286) 3.338 4.750 ( -4.462 -0.000 2.295) 5.018 4.817 ( 1.047 0.000 -0.001) 1.047 4.917 ( -3.389 -0.000 -1.970) 3.920 4.930 ( -10.913 -0.000 -2.208) 11.134 4.960 ( -6.059 -0.000 2.462) 6.541 5.094 ( -3.551 -0.000 -1.824) 3.992 5.132 ( -4.192 -0.000 1.090) 4.332 5.176 ( -11.104 -0.000 7.349) 13.315 5.393 ( -2.005 -0.000 0.374) 2.040 5.430 ( 14.466 0.000 -5.234) 15.384 5.887 ( -6.811 -0.000 4.435) 8.128 6.049 ( 7.087 0.000 -1.030) 7.162 6.117 ( -1.655 -0.000 -2.551) 3.041 6.325 ( 8.033 0.000 -3.388) 8.719 6.364 ( -7.325 -0.000 2.118) 7.625 6.959 ( 5.569 0.000 -5.308) 7.694 7.015 ( 6.580 0.000 5.495) 8.572 7.172 ( 4.215 0.000 -0.546) 4.250 7.192 ( 0.620 0.000 2.007) 2.101 7.644 ( 2.908 0.000 -4.394) 5.269 7.845 ( -8.563 -0.000 0.973) 8.618 7.988 ( -6.732 -0.000 -4.857) 8.302 8.133 ( 2.301 0.000 -0.877) 2.462 8.199 ( 5.186 0.000 4.260) 6.711 8.297 ( -2.231 -0.000 6.490) 6.863 8.361 ( -6.739 -0.000 2.199) 7.089 8.692 ( -2.234 -0.000 -3.669) 4.296 9.009 ( -6.226 -0.000 4.234) 7.529 9.101 ( 4.117 0.000 -2.983) 5.084 9.558 ( 6.158 0.000 -7.684) 9.846 9.731 ( -14.407 -0.000 5.748) 15.511 9.904 ( -7.449 -0.000 -2.576) 7.882 10.179 ( 7.868 0.000 -1.068) 7.941 10.219 ( 7.033 0.000 3.692) 7.943 10.538 ( -1.274 -0.000 2.979) 3.240 10.539 ( -1.028 -0.000 -2.089) 2.328 10.720 ( 7.143 0.000 -3.552) 7.977 11.127 ( 1.739 0.000 -1.294) 2.168 11.234 ( 4.425 0.000 0.432) 4.446 11.436 ( 13.914 0.000 -2.098) 14.071 11.550 ( 6.141 0.000 4.636) 7.695 11.765 ( -4.004 -0.000 -4.217) 5.815 11.774 ( 1.616 0.000 3.196) 3.582 12.121 ( 1.070 0.000 -1.291) 1.676 12.194 ( -1.605 -0.000 1.017) 1.900 12.837 ( -4.252 -0.000 -0.666) 4.303 12.887 ( -1.646 -0.000 0.327) 1.679 13.415 ( 9.891 0.000 1.892) 10.070 13.505 ( 6.410 0.000 -2.889) 7.031 13.766 ( -6.138 -0.000 0.146) 6.139 13.778 ( -2.614 -0.000 0.914) 2.769 15.796 ( -8.818 -0.000 -3.826) 9.612 15.957 ( -12.423 -0.000 3.718) 12.968 17.720 ( 9.430 0.000 1.422) 9.537 17.741 ( 5.410 0.000 -1.363) 5.579 18.331 ( 8.278 0.000 1.739) 8.458 18.471 ( 3.208 0.000 -3.361) 4.646 18.716 ( -8.099 -0.000 2.460) 8.465 18.776 ( -11.188 -0.000 -1.414) 11.277 19.798 ( -1.465 -0.000 -1.727) 2.265 19.916 ( -3.706 -0.000 1.134) 3.876 20.340 ( -1.054 -0.000 0.946) 1.416 20.867 ( 4.704 0.000 4.421) 6.455 20.914 ( 5.571 0.000 -1.712) 5.828 21.588 ( 7.600 0.000 -20.814) 22.158 21.755 ( -4.840 -0.000 12.816) 13.699 22.001 ( 2.272 0.000 1.192) 2.566 22.169 ( 5.489 0.000 -0.946) 5.570 22.430 ( 0.129 0.000 3.155) 3.158 22.463 ( 3.528 0.000 -0.371) 3.547 22.639 ( -1.383 -0.000 0.910) 1.656 22.832 ( -6.528 -0.000 0.558) 6.552 22.838 ( -5.868 -0.000 -0.912) 5.939 ======================= Grid point 49 (32/102) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( 7.159 3.684 0.624) 8.076 1.567 ( 4.711 5.690 3.381) 8.124 1.652 ( 16.658 -9.627 -6.643) 20.355 1.887 ( 5.660 -5.917 3.238) 8.805 2.157 ( -1.522 -0.284 -2.403) 2.858 2.216 ( 3.766 1.383 -2.435) 4.693 2.346 ( -5.550 -3.486 4.693) 8.061 2.454 ( -1.210 -1.022 0.567) 1.682 2.526 ( -1.707 -3.515 -1.212) 4.091 2.738 ( -0.246 0.245 -3.077) 3.096 2.808 ( 13.631 -3.691 -3.455) 14.539 2.869 ( -1.404 2.384 7.348) 7.851 3.032 ( -1.835 -3.776 1.333) 4.404 3.048 ( 4.009 -2.981 0.591) 5.030 3.140 ( 1.250 1.091 -2.945) 3.381 3.235 ( 4.952 -0.498 1.717) 5.265 3.300 ( -13.211 -2.331 3.727) 13.923 3.481 ( 4.589 5.406 -4.337) 8.312 3.603 ( 2.944 1.846 4.284) 5.516 3.648 ( -0.738 1.257 -2.300) 2.723 3.692 ( 0.317 1.496 -2.650) 3.059 3.796 ( -7.812 1.826 -2.096) 8.292 3.920 ( 6.618 -5.506 0.719) 8.639 4.006 ( 5.025 6.673 -1.933) 8.574 4.121 ( -0.729 5.813 2.468) 6.357 4.255 ( 0.874 4.876 0.529) 4.982 4.407 ( 0.196 -2.702 1.451) 3.073 4.438 ( -6.999 -0.597 -1.782) 7.247 4.558 ( 1.867 -1.110 -0.781) 2.308 4.696 ( -2.055 4.959 -0.035) 5.368 4.755 ( -0.020 1.114 -0.414) 1.188 4.814 ( -12.068 0.105 2.646) 12.355 4.915 ( -0.635 -2.504 -1.771) 3.132 5.036 ( -5.191 2.130 -2.022) 5.964 5.040 ( -8.198 -0.063 3.386) 8.870 5.118 ( 0.999 -8.550 -0.536) 8.624 5.202 ( -3.759 -6.752 0.987) 7.790 5.366 ( -2.682 0.732 1.830) 3.328 5.558 ( 13.239 -3.516 -3.706) 14.191 5.870 ( -8.574 -2.844 4.818) 10.238 6.028 ( 4.060 4.146 -1.216) 5.929 6.189 ( 2.000 -5.649 -4.651) 7.586 6.282 ( -2.590 1.000 2.571) 3.784 6.460 ( 4.143 -6.368 -1.038) 7.668 6.967 ( 3.389 1.901 -3.871) 5.485 7.059 ( 6.011 1.371 5.008) 7.943 7.177 ( 2.992 1.600 -1.585) 3.745 7.224 ( -0.311 -2.063 1.847) 2.787 7.617 ( -0.292 3.636 -2.845) 4.626 7.776 ( -7.606 1.621 2.001) 8.030 7.922 ( -5.020 1.265 -3.950) 6.512 8.093 ( 1.829 4.306 2.576) 5.341 8.249 ( -1.289 -1.252 2.069) 2.741 8.328 ( -2.579 -2.873 0.827) 3.948 8.349 ( 3.182 -1.213 0.433) 3.432 8.586 ( -2.785 7.975 -0.247) 8.451 8.989 ( -5.002 -1.155 1.368) 5.313 9.096 ( 3.533 2.731 -2.040) 4.909 9.557 ( -2.745 5.147 -1.489) 6.020 9.625 ( -2.990 -0.407 -0.976) 3.172 9.794 ( -5.229 6.680 0.085) 8.484 10.238 ( 3.235 1.827 3.451) 5.071 10.253 ( 8.220 -0.269 -3.266) 8.849 10.482 ( 1.453 2.703 -0.962) 3.216 10.560 ( -2.489 -1.416 3.427) 4.467 10.760 ( 5.625 0.125 -2.385) 6.111 11.098 ( 1.450 3.330 0.034) 3.632 11.233 ( 2.647 3.825 0.279) 4.660 11.546 ( 10.831 -2.961 -0.088) 11.229 11.679 ( 3.494 -5.202 1.902) 6.549 11.720 ( -2.073 0.182 -2.943) 3.604 11.787 ( 0.618 -0.482 1.342) 1.554 12.122 ( 1.815 0.961 -0.486) 2.110 12.188 ( -1.957 -0.334 0.292) 2.006 12.826 ( -3.096 -2.257 -0.683) 3.892 12.904 ( -1.323 -3.058 0.374) 3.353 13.337 ( 7.879 13.502 -0.080) 15.633 13.496 ( 8.215 10.312 0.142) 13.185 13.641 ( -6.307 4.089 -0.194) 7.519 13.738 ( -4.950 3.545 0.457) 6.106 15.739 ( -6.255 -1.053 -1.381) 6.492 15.900 ( -8.831 -1.471 1.317) 9.049 17.689 ( 7.432 6.542 -0.004) 9.901 17.779 ( 1.855 1.424 0.026) 2.339 18.306 ( 13.071 4.047 0.472) 13.691 18.610 ( -0.792 -3.103 -1.821) 3.684 18.695 ( -7.931 -0.418 0.712) 7.974 18.770 ( -8.773 -13.365 0.730) 16.004 19.655 ( -2.204 12.064 -0.890) 12.296 19.798 ( -1.288 9.409 1.031) 9.553 20.195 ( -0.183 14.104 -1.310) 14.166 20.748 ( 4.509 15.912 2.351) 16.704 21.074 ( 2.755 -11.601 -0.491) 11.934 21.603 ( 7.052 -1.442 -7.991) 10.755 21.803 ( -1.736 -6.007 5.648) 8.426 22.028 ( 1.838 -0.992 1.259) 2.438 22.357 ( -0.262 -9.544 -3.694) 10.237 22.419 ( 1.033 0.609 0.860) 1.475 22.488 ( 1.027 -4.090 0.804) 4.293 22.624 ( -0.751 1.589 1.806) 2.520 22.806 ( -4.534 -1.761 -0.915) 4.949 22.859 ( -4.799 -6.259 0.702) 7.919 ======================= Grid point 50 (33/102) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.338 ( -0.200 -1.257 1.765) 2.176 1.553 ( 2.886 -0.918 1.320) 3.304 1.917 ( 10.778 -8.564 -4.420) 14.459 1.996 ( 2.902 -1.884 2.389) 4.205 2.087 ( -0.651 3.773 -4.899) 6.218 2.274 ( 2.754 -3.217 -0.706) 4.293 2.364 ( -8.225 -3.248 3.970) 9.693 2.492 ( 0.741 -2.714 1.709) 3.292 2.599 ( 2.869 -3.831 -2.725) 5.507 2.706 ( -8.823 -0.822 2.234) 9.139 2.815 ( 3.205 3.944 2.145) 5.516 2.989 ( 11.883 -4.691 -2.234) 12.969 3.055 ( -3.262 -1.682 1.628) 4.015 3.110 ( 1.535 -0.645 -0.081) 1.667 3.163 ( -3.756 -3.379 -0.892) 5.131 3.233 ( -3.849 -1.994 1.251) 4.512 3.352 ( 2.647 -5.517 -0.584) 6.147 3.446 ( 7.603 2.871 -3.649) 8.908 3.538 ( -6.643 3.328 3.557) 8.237 3.603 ( 4.343 3.514 -2.816) 6.256 3.653 ( -4.108 1.135 0.583) 4.301 3.759 ( -1.555 -0.769 -0.319) 1.764 3.869 ( 0.922 8.231 0.302) 8.288 3.988 ( 0.009 5.558 -0.170) 5.560 4.094 ( -0.276 -0.590 0.151) 0.669 4.167 ( 8.347 3.516 2.315) 9.349 4.333 ( -5.479 4.202 -3.311) 7.658 4.460 ( -1.466 -1.201 0.875) 2.088 4.545 ( -4.101 5.515 2.193) 7.214 4.592 ( -0.166 1.280 -1.756) 2.180 4.747 ( -5.775 -3.566 0.165) 6.789 4.812 ( 3.507 0.329 3.075) 4.676 4.982 ( 0.943 -4.509 -2.648) 5.314 4.999 ( -3.348 -3.916 -1.696) 5.424 5.006 ( -3.647 -2.944 1.368) 4.882 5.257 ( 0.934 -2.846 -2.057) 3.634 5.333 ( 0.384 -8.808 -0.828) 8.855 5.367 ( -3.805 -4.373 3.932) 7.005 5.717 ( 10.668 -4.348 -2.487) 11.786 5.866 ( -8.262 -2.338 4.044) 9.491 5.982 ( 2.713 3.423 -1.426) 4.594 6.232 ( -2.916 -2.320 -0.707) 3.793 6.345 ( 3.269 -4.357 -0.460) 5.466 6.600 ( 2.150 -6.507 -0.173) 6.855 6.925 ( 0.577 3.390 -1.603) 3.793 7.081 ( 5.253 2.391 5.251) 7.803 7.142 ( 0.394 3.113 -4.013) 5.094 7.272 ( -0.692 -3.564 1.428) 3.902 7.491 ( -2.536 8.784 -1.439) 9.255 7.668 ( -3.390 6.475 0.840) 7.357 7.864 ( -1.718 1.596 -1.090) 2.586 8.041 ( 1.951 3.990 2.120) 4.921 8.199 ( -4.399 4.718 -0.856) 6.507 8.377 ( 3.447 -1.926 -3.536) 5.300 8.405 ( 1.561 -1.398 0.038) 2.096 8.452 ( -4.753 1.090 4.341) 6.529 8.957 ( -2.441 2.338 0.693) 3.450 9.085 ( 3.322 -0.274 -1.817) 3.796 9.366 ( -2.971 11.105 0.863) 11.528 9.591 ( -1.759 11.512 -1.229) 11.711 9.679 ( 0.448 -3.388 -0.282) 3.429 10.198 ( 1.326 3.766 0.682) 4.051 10.307 ( 3.441 -0.247 -1.166) 3.641 10.472 ( 1.987 -0.419 -1.062) 2.292 10.584 ( -2.169 -2.273 3.345) 4.589 10.795 ( 4.124 -0.723 -1.641) 4.497 11.041 ( -0.209 3.377 0.383) 3.405 11.153 ( 0.317 5.710 0.257) 5.725 11.638 ( 0.820 3.583 -1.162) 3.855 11.682 ( 5.466 -1.232 1.992) 5.947 11.764 ( -1.269 -1.569 -2.279) 3.044 11.842 ( 3.516 -2.499 1.033) 4.436 12.109 ( 1.374 1.934 0.747) 2.488 12.175 ( -2.395 -0.106 -0.650) 2.484 12.870 ( -1.343 -4.442 -0.595) 4.678 12.971 ( -0.510 -4.402 0.268) 4.439 13.094 ( 4.468 17.678 0.177) 18.235 13.252 ( 4.090 18.986 0.415) 19.426 13.538 ( -3.869 4.370 -0.447) 5.853 13.638 ( -2.631 3.608 0.319) 4.477 15.740 ( -2.900 -2.860 -0.307) 4.085 15.876 ( -4.063 -0.974 0.191) 4.182 17.642 ( 6.767 4.269 -0.140) 8.002 17.729 ( -3.640 2.695 0.173) 4.532 18.331 ( 8.747 4.308 0.502) 9.764 18.578 ( -2.324 3.165 -1.770) 4.307 18.694 ( -1.511 -1.944 0.896) 2.620 18.973 ( -6.034 -14.048 0.771) 15.309 19.440 ( -1.008 8.405 -0.160) 8.467 19.611 ( -0.386 9.988 1.074) 10.053 19.893 ( 0.479 17.801 -2.313) 17.957 20.426 ( 2.459 22.261 1.021) 22.420 21.312 ( 1.291 -12.355 0.234) 12.425 21.679 ( 4.814 -1.974 -2.440) 5.747 21.930 ( -0.902 -7.330 1.960) 7.641 22.062 ( 1.086 -0.897 1.129) 1.805 22.274 ( -0.764 7.147 -0.863) 7.239 22.572 ( 1.079 -4.069 2.775) 5.042 22.580 ( 1.645 0.510 -4.113) 4.459 22.648 ( -5.102 -13.956 1.398) 14.925 22.850 ( -0.817 -6.253 -1.531) 6.489 22.947 ( -2.859 -5.794 1.278) 6.586 ======================= Grid point 51 (34/102) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( -0.000 -7.721 -0.000) 7.721 1.637 ( -0.000 -6.625 -0.000) 6.625 2.005 ( 0.000 0.949 0.000) 0.949 2.017 ( 0.000 3.928 0.000) 3.928 2.066 ( -0.000 -4.061 -0.000) 4.061 2.363 ( -0.000 -2.453 -0.000) 2.453 2.408 ( -0.000 -7.805 -0.000) 7.805 2.508 ( 0.000 0.971 0.000) 0.971 2.635 ( 0.000 3.996 0.000) 3.996 2.670 ( -0.000 -1.392 -0.000) 1.392 2.836 ( -0.000 -4.257 -0.000) 4.257 3.043 ( 0.000 1.711 0.000) 1.711 3.128 ( -0.000 -4.766 -0.000) 4.766 3.139 ( -0.000 -0.027 -0.000) 0.027 3.162 ( -0.000 -2.865 -0.000) 2.865 3.262 ( -0.000 -0.019 -0.000) 0.019 3.421 ( 0.000 3.634 0.000) 3.634 3.440 ( 0.000 2.962 0.000) 2.962 3.484 ( -0.000 -5.376 -0.000) 5.376 3.611 ( -0.000 -0.816 -0.000) 0.816 3.626 ( -0.000 -3.021 -0.000) 3.021 3.742 ( 0.000 6.693 0.000) 6.693 3.757 ( 0.000 0.061 0.000) 0.061 3.892 ( 0.000 4.230 0.000) 4.230 4.013 ( 0.000 2.634 0.000) 2.634 4.224 ( 0.000 4.612 0.000) 4.612 4.249 ( -0.000 -0.914 -0.000) 0.914 4.406 ( 0.000 4.540 0.000) 4.540 4.468 ( -0.000 -1.931 -0.000) 1.931 4.577 ( 0.000 1.408 0.000) 1.408 4.826 ( -0.000 -6.399 -0.000) 6.399 4.828 ( -0.000 -1.349 -0.000) 1.349 5.014 ( -0.000 -2.331 -0.000) 2.331 5.079 ( -0.000 -4.089 -0.000) 4.089 5.152 ( -0.000 -10.435 -0.000) 10.435 5.251 ( 0.000 1.568 0.000) 1.568 5.453 ( -0.000 -5.634 -0.000) 5.634 5.478 ( -0.000 -5.394 -0.000) 5.394 5.811 ( 0.000 0.014 0.000) 0.014 5.865 ( -0.000 -1.628 -0.000) 1.628 5.952 ( 0.000 0.136 0.000) 0.136 6.279 ( -0.000 -4.237 -0.000) 4.237 6.399 ( -0.000 -0.123 -0.000) 0.123 6.710 ( -0.000 -3.704 -0.000) 3.704 6.880 ( 0.000 0.004 0.000) 0.004 7.018 ( 0.000 8.531 0.000) 8.531 7.096 ( 0.000 1.338 0.000) 1.338 7.277 ( 0.000 12.699 0.000) 12.699 7.342 ( -0.000 -3.658 -0.000) 3.658 7.500 ( 0.000 10.723 0.000) 10.723 7.832 ( 0.000 1.265 0.000) 1.265 7.981 ( 0.000 3.814 0.000) 3.814 8.057 ( 0.000 6.844 0.000) 6.844 8.412 ( -0.000 -0.131 -0.000) 0.131 8.441 ( -0.000 -3.838 -0.000) 3.838 8.465 ( -0.000 -0.482 -0.000) 0.482 8.898 ( 0.000 2.337 0.000) 2.337 9.136 ( -0.000 -3.252 -0.000) 3.252 9.159 ( 0.000 9.931 0.000) 9.931 9.370 ( 0.000 10.638 0.000) 10.638 9.743 ( -0.000 -2.829 -0.000) 2.829 10.132 ( 0.000 4.513 0.000) 4.513 10.311 ( 0.000 0.315 0.000) 0.315 10.515 ( -0.000 -3.326 -0.000) 3.326 10.616 ( -0.000 -1.863 -0.000) 1.863 10.834 ( -0.000 -1.378 -0.000) 1.378 10.990 ( 0.000 1.862 0.000) 1.862 11.056 ( 0.000 4.720 0.000) 4.720 11.518 ( 0.000 9.095 0.000) 9.095 11.678 ( 0.000 4.495 0.000) 4.495 11.777 ( 0.000 0.798 0.000) 0.798 11.872 ( 0.000 1.014 0.000) 1.014 12.080 ( 0.000 1.689 0.000) 1.689 12.148 ( 0.000 2.293 0.000) 2.293 12.820 ( 0.000 13.221 0.000) 13.221 12.880 ( 0.000 15.186 0.000) 15.186 12.957 ( -0.000 -5.763 -0.000) 5.763 13.125 ( -0.000 -5.138 -0.000) 5.138 13.434 ( 0.000 5.379 0.000) 5.379 13.565 ( 0.000 3.607 0.000) 3.607 15.785 ( -0.000 -2.954 -0.000) 2.954 15.875 ( -0.000 -0.694 -0.000) 0.694 17.628 ( 0.000 1.253 0.000) 1.253 17.667 ( 0.000 1.048 0.000) 1.048 18.281 ( 0.000 4.056 0.000) 4.056 18.466 ( 0.000 7.503 0.000) 7.503 18.701 ( 0.000 1.267 0.000) 1.267 19.177 ( -0.000 -9.538 -0.000) 9.538 19.320 ( 0.000 7.383 0.000) 7.383 19.493 ( 0.000 1.144 0.000) 1.144 19.615 ( 0.000 11.130 0.000) 11.130 20.025 ( 0.000 22.745 0.000) 22.745 21.517 ( -0.000 -9.708 -0.000) 9.708 21.702 ( 0.000 1.580 0.000) 1.580 22.032 ( -0.000 -2.978 -0.000) 2.978 22.077 ( -0.000 -0.584 -0.000) 0.584 22.156 ( 0.000 4.066 0.000) 4.066 22.535 ( 0.000 2.229 0.000) 2.229 22.689 ( -0.000 -6.703 -0.000) 6.703 22.855 ( -0.000 -9.815 -0.000) 9.815 22.999 ( -0.000 -9.762 -0.000) 9.762 23.023 ( -0.000 -4.427 -0.000) 4.427 ======================= Grid point 61 (35/102) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( 7.983 0.000 -2.501) 8.366 1.581 ( 7.093 0.000 -4.630) 8.470 1.697 ( 2.118 0.000 4.048) 4.569 1.825 ( 1.073 0.000 4.518) 4.643 2.138 ( -0.689 -0.000 -0.997) 1.212 2.258 ( 1.968 0.000 -1.788) 2.659 2.267 ( -4.127 -0.000 0.971) 4.239 2.457 ( -4.291 -0.000 1.704) 4.617 2.499 ( 9.355 0.000 -2.010) 9.568 2.677 ( -10.313 -0.000 -0.408) 10.321 2.895 ( 16.994 0.000 -4.167) 17.497 2.902 ( -2.004 -0.000 3.976) 4.453 2.996 ( 2.224 0.000 -0.852) 2.382 3.042 ( 2.467 0.000 0.132) 2.471 3.139 ( -2.953 -0.000 -1.928) 3.526 3.193 ( -11.933 -0.000 5.627) 13.193 3.268 ( 3.500 0.000 1.781) 3.927 3.596 ( 7.258 0.000 -5.738) 9.252 3.606 ( -0.084 -0.000 -0.161) 0.182 3.644 ( -0.593 -0.000 2.118) 2.200 3.703 ( -6.990 -0.000 2.388) 7.387 3.756 ( -4.008 -0.000 -3.837) 5.548 3.941 ( 13.085 0.000 0.083) 13.085 4.099 ( 2.336 0.000 -0.037) 2.336 4.174 ( -3.477 -0.000 0.315) 3.491 4.334 ( 3.669 0.000 2.412) 4.390 4.360 ( -0.092 -0.000 -0.119) 0.151 4.373 ( -6.360 -0.000 -0.914) 6.425 4.578 ( 5.028 0.000 -0.637) 5.068 4.699 ( -12.704 -0.000 -0.301) 12.708 4.708 ( -1.675 -0.000 0.640) 1.793 4.865 ( 5.317 0.000 -6.810) 8.639 4.880 ( -0.683 -0.000 2.864) 2.944 4.958 ( 0.343 0.000 -0.011) 0.343 5.033 ( -7.511 -0.000 8.545) 11.377 5.041 ( -4.925 -0.000 -3.706) 6.164 5.087 ( -2.012 -0.000 0.554) 2.086 5.380 ( -0.421 -0.000 0.641) 0.767 5.606 ( 11.229 0.000 -4.557) 12.119 5.785 ( -8.793 -0.000 4.837) 10.036 6.090 ( -0.600 -0.000 -1.354) 1.481 6.149 ( 6.825 0.000 -2.695) 7.338 6.269 ( -6.573 -0.000 2.886) 7.179 6.417 ( 4.312 0.000 -1.439) 4.546 7.003 ( 2.396 0.000 -2.306) 3.326 7.119 ( 3.950 0.000 3.591) 5.338 7.204 ( 0.132 0.000 0.969) 0.978 7.207 ( 0.976 0.000 -1.628) 1.898 7.646 ( -0.129 -0.000 -1.636) 1.641 7.742 ( -4.667 -0.000 1.473) 4.894 7.891 ( -3.055 -0.000 -2.634) 4.034 8.154 ( 0.678 0.000 0.025) 0.678 8.223 ( -2.542 -0.000 3.243) 4.121 8.287 ( -0.324 -0.000 0.884) 0.941 8.365 ( 2.951 0.000 0.072) 2.952 8.660 ( -0.553 -0.000 -1.439) 1.542 8.941 ( -3.544 -0.000 1.395) 3.809 9.139 ( 2.125 0.000 -1.543) 2.626 9.579 ( -6.933 -0.000 2.525) 7.378 9.589 ( 1.587 0.000 -3.106) 3.488 9.828 ( -2.150 -0.000 -0.594) 2.231 10.268 ( 3.606 0.000 -0.144) 3.609 10.316 ( 3.505 0.000 1.449) 3.793 10.522 ( -0.329 -0.000 -0.874) 0.934 10.529 ( -0.848 -0.000 0.899) 1.236 10.791 ( 3.012 0.000 -0.962) 3.162 11.138 ( 0.294 0.000 -0.107) 0.313 11.287 ( 1.984 0.000 0.412) 2.026 11.619 ( 10.162 0.000 -0.926) 10.204 11.636 ( 2.922 0.000 1.491) 3.280 11.696 ( -2.416 -0.000 -2.033) 3.157 11.762 ( -4.134 -0.000 1.627) 4.443 12.140 ( 1.274 0.000 -0.529) 1.380 12.182 ( -0.511 -0.000 0.351) 0.620 12.782 ( -2.237 -0.000 -0.304) 2.257 12.868 ( -0.772 -0.000 0.123) 0.782 13.516 ( 3.072 0.000 0.593) 3.129 13.585 ( 5.713 0.000 -1.718) 5.966 13.676 ( -5.895 -0.000 0.628) 5.928 13.758 ( -0.655 -0.000 0.602) 0.889 15.690 ( -3.543 -0.000 -0.961) 3.671 15.833 ( -4.921 -0.000 0.991) 5.020 17.796 ( 2.197 0.000 -0.432) 2.239 17.822 ( 3.490 0.000 0.481) 3.523 18.463 ( 8.548 0.000 1.697) 8.715 18.492 ( 1.016 0.000 -1.365) 1.701 18.614 ( -9.675 -0.000 -1.479) 9.787 18.643 ( -2.696 -0.000 1.078) 2.904 19.777 ( -0.665 -0.000 -0.333) 0.743 19.876 ( -1.656 -0.000 0.225) 1.671 20.327 ( -0.635 -0.000 0.014) 0.636 20.932 ( 1.807 0.000 1.955) 2.662 20.964 ( 1.819 0.000 -0.615) 1.920 21.597 ( 2.223 0.000 -7.189) 7.525 21.746 ( -1.476 -0.000 4.354) 4.597 22.030 ( 0.965 0.000 0.370) 1.033 22.219 ( 1.733 0.000 -0.595) 1.833 22.450 ( 0.499 0.000 1.897) 1.962 22.510 ( 2.326 0.000 -0.094) 2.328 22.646 ( 1.834 0.000 -0.579) 1.923 22.748 ( -4.563 -0.000 0.687) 4.615 22.761 ( -3.270 -0.000 -0.473) 3.304 ======================= Grid point 62 (36/102) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 0.000 6.739 0.000) 6.739 1.613 ( 0.000 5.634 0.000) 5.634 1.771 ( -0.000 -10.876 -0.000) 10.876 1.948 ( -0.000 -7.314 -0.000) 7.314 2.111 ( 0.000 1.917 0.000) 1.917 2.254 ( 0.000 0.523 0.000) 0.523 2.294 ( -0.000 -3.324 -0.000) 3.324 2.446 ( -0.000 -1.232 -0.000) 1.232 2.576 ( -0.000 -2.224 -0.000) 2.224 2.633 ( -0.000 -1.441 -0.000) 1.441 2.884 ( 0.000 1.809 0.000) 1.809 2.989 ( -0.000 -2.308 -0.000) 2.308 3.020 ( -0.000 -1.103 -0.000) 1.103 3.068 ( -0.000 -1.705 -0.000) 1.705 3.136 ( -0.000 -4.470 -0.000) 4.470 3.148 ( 0.000 1.619 0.000) 1.619 3.299 ( -0.000 -1.864 -0.000) 1.864 3.537 ( 0.000 3.462 0.000) 3.462 3.583 ( 0.000 4.764 0.000) 4.764 3.651 ( 0.000 0.811 0.000) 0.811 3.697 ( 0.000 2.858 0.000) 2.858 3.716 ( -0.000 -2.338 -0.000) 2.338 3.998 ( 0.000 3.288 0.000) 3.288 4.074 ( 0.000 0.668 0.000) 0.668 4.096 ( 0.000 5.464 0.000) 5.464 4.308 ( 0.000 4.805 0.000) 4.805 4.330 ( 0.000 1.467 0.000) 1.467 4.414 ( -0.000 -4.296 -0.000) 4.296 4.605 ( 0.000 1.456 0.000) 1.456 4.607 ( 0.000 1.847 0.000) 1.847 4.712 ( 0.000 1.357 0.000) 1.357 4.846 ( -0.000 -3.405 -0.000) 3.405 4.905 ( -0.000 -2.769 -0.000) 2.769 4.916 ( 0.000 5.104 0.000) 5.104 5.009 ( 0.000 1.205 0.000) 1.205 5.134 ( -0.000 -11.717 -0.000) 11.717 5.168 ( -0.000 -6.501 -0.000) 6.501 5.351 ( 0.000 1.934 0.000) 1.934 5.694 ( -0.000 -3.880 -0.000) 3.880 5.773 ( -0.000 -2.575 -0.000) 2.575 6.060 ( 0.000 3.288 0.000) 3.288 6.188 ( -0.000 -1.149 -0.000) 1.149 6.268 ( -0.000 -4.013 -0.000) 4.013 6.497 ( -0.000 -5.795 -0.000) 5.795 6.985 ( 0.000 2.637 0.000) 2.637 7.133 ( 0.000 0.664 0.000) 0.664 7.188 ( 0.000 2.190 0.000) 2.190 7.222 ( -0.000 -1.792 -0.000) 1.792 7.602 ( 0.000 4.583 0.000) 4.583 7.719 ( 0.000 1.311 0.000) 1.311 7.874 ( 0.000 0.491 0.000) 0.491 8.121 ( 0.000 3.391 0.000) 3.391 8.214 ( 0.000 0.304 0.000) 0.304 8.321 ( -0.000 -3.270 -0.000) 3.270 8.391 ( -0.000 -1.419 -0.000) 1.419 8.561 ( 0.000 8.886 0.000) 8.886 8.950 ( -0.000 -1.424 -0.000) 1.424 9.122 ( 0.000 2.278 0.000) 2.278 9.505 ( 0.000 5.676 0.000) 5.676 9.618 ( -0.000 -2.824 -0.000) 2.824 9.757 ( 0.000 6.962 0.000) 6.962 10.272 ( 0.000 2.813 0.000) 2.813 10.311 ( 0.000 0.085 0.000) 0.085 10.497 ( 0.000 1.893 0.000) 1.893 10.543 ( -0.000 -1.644 -0.000) 1.644 10.800 ( -0.000 -0.098 -0.000) 0.098 11.106 ( 0.000 3.311 0.000) 3.311 11.254 ( 0.000 4.430 0.000) 4.430 11.670 ( -0.000 -0.100 -0.000) 0.100 11.673 ( -0.000 -3.442 -0.000) 3.442 11.697 ( -0.000 -1.170 -0.000) 1.170 11.794 ( -0.000 -4.291 -0.000) 4.291 12.152 ( -0.000 -0.716 -0.000) 0.716 12.160 ( 0.000 2.102 0.000) 2.102 12.798 ( -0.000 -2.678 -0.000) 2.678 12.894 ( -0.000 -3.176 -0.000) 3.176 13.406 ( 0.000 13.107 0.000) 13.107 13.565 ( 0.000 11.319 0.000) 11.319 13.588 ( 0.000 2.691 0.000) 2.691 13.690 ( 0.000 4.264 0.000) 4.264 15.688 ( -0.000 -1.449 -0.000) 1.449 15.834 ( -0.000 -1.686 -0.000) 1.686 17.758 ( 0.000 4.392 0.000) 4.392 17.782 ( 0.000 4.695 0.000) 4.695 18.463 ( 0.000 4.919 0.000) 4.919 18.551 ( -0.000 -2.699 -0.000) 2.699 18.610 ( -0.000 -6.504 -0.000) 6.504 18.724 ( -0.000 -9.293 -0.000) 9.293 19.636 ( 0.000 12.379 0.000) 12.379 19.790 ( 0.000 8.474 0.000) 8.474 20.189 ( 0.000 13.821 0.000) 13.821 20.787 ( 0.000 15.589 0.000) 15.589 21.093 ( -0.000 -11.462 -0.000) 11.462 21.637 ( -0.000 -3.573 -0.000) 3.573 21.802 ( -0.000 -5.942 -0.000) 5.942 22.046 ( -0.000 -1.196 -0.000) 1.196 22.347 ( -0.000 -9.242 -0.000) 9.242 22.433 ( 0.000 4.237 0.000) 4.237 22.497 ( -0.000 -4.279 -0.000) 4.279 22.629 ( 0.000 2.520 0.000) 2.520 22.767 ( -0.000 -2.295 -0.000) 2.295 22.820 ( -0.000 -7.160 -0.000) 7.160 ======================= Grid point 125 (37/102) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.466 ( -4.649 -0.000 21.140) 21.645 0.506 ( 13.790 0.000 22.771) 26.621 0.745 ( -17.557 -0.000 30.497) 35.190 0.903 ( 2.438 0.000 -13.592) 13.809 0.975 ( -12.324 -0.000 -19.629) 23.177 1.417 ( 16.189 0.000 -25.496) 30.202 1.955 ( 8.369 0.000 13.614) 15.981 2.243 ( -12.992 -0.000 -11.954) 17.654 2.321 ( -1.159 -0.000 5.101) 5.231 2.424 ( -0.021 -0.000 -3.359) 3.359 2.775 ( -1.173 -0.000 8.713) 8.791 2.882 ( -1.222 -0.000 0.646) 1.382 3.010 ( -2.884 -0.000 5.369) 6.095 3.135 ( -0.766 -0.000 -3.074) 3.168 3.307 ( -11.385 -0.000 3.153) 11.813 3.358 ( -7.013 -0.000 2.803) 7.553 3.401 ( 5.000 0.000 -4.382) 6.648 3.461 ( 4.013 0.000 -3.785) 5.517 3.479 ( 2.855 0.000 2.429) 3.748 3.596 ( -2.825 -0.000 -8.189) 8.663 3.759 ( -13.953 -0.000 7.643) 15.909 3.907 ( 7.216 0.000 -4.395) 8.449 3.940 ( 1.376 0.000 1.271) 1.873 3.964 ( -2.942 -0.000 -0.698) 3.023 4.225 ( 2.840 0.000 1.810) 3.367 4.348 ( 2.190 0.000 -7.992) 8.287 4.719 ( -7.934 -0.000 5.936) 9.909 4.731 ( 0.507 0.000 4.222) 4.252 4.761 ( -7.685 -0.000 3.627) 8.498 4.820 ( -1.885 -0.000 -2.701) 3.294 4.851 ( 5.747 0.000 -0.919) 5.820 4.875 ( 1.620 0.000 -3.930) 4.250 5.138 ( -2.483 -0.000 0.104) 2.486 5.142 ( 2.334 0.000 0.133) 2.338 5.379 ( -36.001 -0.000 4.700) 36.306 5.391 ( -6.770 -0.000 2.397) 7.182 5.510 ( 4.829 0.000 0.123) 4.830 5.521 ( 8.193 0.000 -4.178) 9.197 5.605 ( 11.016 0.000 -2.304) 11.254 5.636 ( 0.279 0.000 -2.423) 2.439 5.958 ( 0.579 0.000 0.826) 1.009 5.977 ( 0.843 0.000 -0.745) 1.125 6.244 ( 1.002 0.000 0.866) 1.324 6.262 ( 0.922 0.000 -0.634) 1.119 6.697 ( 0.950 0.000 4.302) 4.405 6.806 ( -5.874 -0.000 4.397) 7.338 6.829 ( 5.996 0.000 -5.621) 8.219 6.938 ( -0.730 -0.000 -4.876) 4.931 7.192 ( -1.569 -0.000 8.158) 8.307 7.345 ( -0.658 -0.000 -5.474) 5.513 7.735 ( -5.893 -0.000 6.655) 8.889 7.900 ( 4.805 0.000 -7.394) 8.819 8.410 ( -1.419 -0.000 2.783) 3.124 8.518 ( 12.059 0.000 -6.267) 13.590 8.675 ( -11.164 -0.000 9.682) 14.778 8.875 ( 8.753 0.000 -5.719) 10.456 8.999 ( 8.975 0.000 2.626) 9.351 9.116 ( -3.894 -0.000 -5.143) 6.451 9.351 ( -3.702 -0.000 7.564) 8.421 9.519 ( 6.222 0.000 -7.913) 10.066 9.948 ( 0.846 0.000 9.747) 9.784 10.138 ( -22.387 -0.000 -6.918) 23.432 10.724 ( -9.436 -0.000 1.060) 9.495 10.735 ( 11.594 0.000 0.078) 11.595 10.755 ( -17.639 -0.000 0.777) 17.656 10.776 ( 5.510 0.000 -0.928) 5.588 10.942 ( -2.197 -0.000 0.256) 2.212 10.946 ( 1.460 0.000 -0.070) 1.462 11.167 ( -51.211 -0.000 0.453) 51.213 11.185 ( 15.298 0.000 -1.000) 15.331 11.378 ( -2.479 -0.000 1.942) 3.149 11.423 ( 1.839 0.000 -1.830) 2.594 12.357 ( -1.010 -0.000 1.158) 1.536 12.391 ( 1.744 0.000 -1.790) 2.499 12.555 ( -8.624 -0.000 1.609) 8.773 12.585 ( 22.504 0.000 -0.971) 22.525 13.067 ( -1.294 -0.000 0.036) 1.295 13.068 ( 1.256 0.000 -0.029) 1.256 13.959 ( 0.017 0.000 0.379) 0.379 13.968 ( -0.087 -0.000 -0.377) 0.387 16.205 ( 18.891 0.000 0.208) 18.892 16.210 ( -58.995 -0.000 -0.215) 58.995 17.390 ( -3.407 -0.000 2.218) 4.065 17.451 ( 5.338 0.000 -2.992) 6.119 17.789 ( 15.030 0.000 3.340) 15.397 17.859 ( -2.362 -0.000 -2.592) 3.507 19.576 ( -3.825 -0.000 2.195) 4.410 19.612 ( 33.289 0.000 -0.667) 33.296 19.624 ( -3.358 -0.000 0.685) 3.427 19.658 ( -6.816 -0.000 -2.378) 7.218 20.121 ( -16.377 -0.000 0.276) 16.379 20.125 ( 2.281 0.000 -0.113) 2.284 20.633 ( -0.382 -0.000 0.676) 0.777 20.648 ( 0.429 0.000 -0.622) 0.755 21.875 ( -0.092 -0.000 0.237) 0.254 21.882 ( 0.023 0.000 -0.366) 0.366 22.357 ( -0.355 -0.000 2.082) 2.112 22.407 ( 0.820 0.000 -2.074) 2.230 22.919 ( 3.459 0.000 1.623) 3.821 22.961 ( -11.199 -0.000 -1.927) 11.364 23.075 ( -2.127 -0.000 1.094) 2.392 23.094 ( 1.067 0.000 -0.654) 1.252 ======================= Grid point 126 (38/102) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.527 ( 4.639 -6.301 15.133) 17.036 0.862 ( 11.580 -11.154 5.028) 16.846 0.900 ( 13.911 -8.387 -3.350) 16.585 1.046 ( -3.205 -25.037 12.206) 28.038 1.078 ( 3.941 -14.440 -13.238) 19.982 1.532 ( 14.165 -5.817 -13.264) 20.259 2.029 ( -4.539 0.916 2.035) 5.058 2.092 ( 4.701 -1.909 6.171) 7.989 2.411 ( 0.692 -6.988 1.065) 7.102 2.511 ( 5.959 -7.101 -3.645) 9.961 2.730 ( -2.622 7.143 6.147) 9.782 2.890 ( 4.326 1.152 -1.337) 4.672 2.937 ( -4.275 -0.729 5.664) 7.134 3.018 ( -0.529 6.928 -3.676) 7.861 3.253 ( -5.393 -3.067 4.247) 7.518 3.318 ( -2.928 -0.117 1.739) 3.407 3.417 ( 1.401 2.154 -0.452) 2.609 3.477 ( 4.566 -0.217 -3.159) 5.556 3.566 ( -1.302 -3.982 2.720) 4.995 3.660 ( -3.111 -3.889 -5.703) 7.571 3.732 ( -0.668 -2.527 3.394) 4.284 3.898 ( 0.476 2.277 -3.880) 4.524 3.969 ( -3.066 -1.910 3.318) 4.904 4.001 ( -4.592 -4.969 -2.331) 7.157 4.235 ( 4.977 2.943 -0.013) 5.782 4.339 ( 9.858 4.485 -7.011) 12.902 4.615 ( -6.437 4.115 7.560) 10.748 4.657 ( -6.609 6.632 3.107) 9.865 4.698 ( 1.357 4.014 2.464) 4.902 4.792 ( 0.676 2.077 0.408) 2.222 4.831 ( 2.984 2.276 -1.703) 4.122 4.916 ( -1.814 -2.076 -4.908) 5.629 5.094 ( -2.669 2.550 -0.379) 3.711 5.180 ( 2.221 -2.988 -0.859) 3.821 5.272 ( -12.855 -7.892 6.221) 16.316 5.362 ( -7.396 -1.997 3.114) 8.269 5.498 ( -8.866 -0.027 4.058) 9.750 5.578 ( -3.384 3.069 -3.816) 5.952 5.654 ( 12.511 -2.011 -4.979) 13.614 5.712 ( 11.027 -0.342 -2.260) 11.262 5.981 ( 0.200 -0.266 -1.328) 1.369 5.994 ( 1.886 -2.776 0.410) 3.380 6.201 ( 3.882 3.637 4.162) 6.754 6.335 ( 13.007 0.244 -3.671) 13.518 6.686 ( -4.650 2.043 -0.490) 5.102 6.733 ( -4.094 1.210 3.239) 5.359 6.966 ( 6.616 -4.133 -0.555) 7.820 6.981 ( 8.523 -2.640 -5.610) 10.539 7.286 ( 2.064 -6.848 2.246) 7.496 7.363 ( 12.803 3.001 -5.919) 14.421 7.741 ( -0.174 -2.231 5.460) 5.901 7.928 ( 4.612 -0.676 -6.496) 7.995 8.333 ( -0.468 6.930 1.251) 7.058 8.450 ( 6.412 10.392 -3.987) 12.845 8.657 ( -9.337 0.235 7.454) 11.950 8.960 ( 8.273 3.458 -7.967) 11.994 8.993 ( -1.981 -0.894 3.965) 4.522 9.104 ( 2.702 -0.058 -3.858) 4.711 9.336 ( -4.840 -0.110 9.281) 10.468 9.544 ( 2.333 0.388 -3.311) 4.069 9.688 ( -18.128 8.432 17.165) 26.351 9.900 ( 0.688 7.497 7.750) 10.804 10.410 ( -3.204 7.514 1.138) 8.248 10.629 ( -4.495 7.468 -1.806) 8.902 10.717 ( 4.627 5.808 -2.044) 7.702 10.766 ( 3.442 1.857 -3.213) 5.061 10.955 ( -9.076 -2.613 0.511) 9.458 10.993 ( -2.728 -2.441 4.575) 5.859 11.184 ( -3.087 -6.878 1.830) 7.758 11.352 ( 4.848 -1.629 -1.685) 5.384 11.419 ( -0.282 -5.286 -0.561) 5.323 11.542 ( 18.994 -2.522 3.133) 19.415 12.363 ( -3.336 2.411 -0.732) 4.180 12.372 ( -0.733 -0.508 -0.483) 1.014 12.475 ( 1.250 2.512 -0.923) 2.954 12.565 ( 13.035 12.095 -0.706) 17.796 13.061 ( -1.310 0.221 0.464) 1.407 13.080 ( 0.495 -0.359 -0.019) 0.612 13.943 ( -0.894 1.994 1.359) 2.573 13.998 ( -1.059 -0.796 -4.193) 4.397 15.897 ( -12.178 1.788 8.778) 15.117 16.270 ( 17.009 8.564 2.352) 19.188 17.433 ( -4.977 -7.318 3.434) 9.493 17.514 ( 0.404 -5.150 -0.962) 5.254 17.755 ( -12.580 1.335 -3.038) 13.010 18.122 ( 26.305 -7.295 -6.586) 28.081 19.299 ( -11.619 9.226 1.427) 14.905 19.493 ( 12.884 15.810 0.570) 20.403 19.559 ( -0.692 7.883 2.075) 8.181 19.669 ( 6.653 12.128 -5.361) 14.835 20.169 ( -17.328 -11.427 -0.401) 20.760 20.438 ( 17.366 -5.958 -3.747) 18.738 20.590 ( -4.009 -5.629 2.311) 7.287 20.728 ( 6.752 -6.120 -0.747) 9.144 21.846 ( 2.143 0.030 5.108) 5.540 21.882 ( 0.137 -0.923 -1.342) 1.634 22.359 ( -0.905 0.537 0.841) 1.347 22.413 ( 1.624 -0.827 -2.240) 2.888 22.872 ( -5.337 -0.869 5.834) 7.955 22.990 ( -2.847 -1.894 -5.752) 6.692 23.178 ( -2.405 -7.949 3.382) 8.967 23.237 ( -10.411 -15.735 -7.442) 20.282 ======================= Grid point 127 (39/102) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( 9.632 -14.805 3.222) 17.954 1.000 ( 11.868 -4.084 -11.265) 16.865 1.265 ( 8.550 -11.800 -6.252) 15.856 1.349 ( 9.838 -17.166 3.878) 20.162 1.612 ( 9.142 -26.777 8.073) 29.423 1.776 ( 7.416 -11.345 3.809) 14.079 2.051 ( 0.972 -4.901 -1.021) 5.100 2.231 ( 8.636 -2.768 9.048) 12.810 2.550 ( -1.314 -6.188 -0.454) 6.342 2.581 ( -0.532 -0.976 -7.216) 7.301 2.718 ( 12.090 -3.593 -4.717) 13.466 2.817 ( 3.174 5.970 -6.480) 9.365 2.964 ( 1.558 -3.712 4.361) 5.935 3.039 ( 0.432 -4.095 2.521) 4.828 3.246 ( -3.730 0.733 0.339) 3.817 3.328 ( -4.524 -2.156 1.340) 5.188 3.389 ( -0.026 0.891 2.087) 2.270 3.506 ( 4.005 0.353 -3.363) 5.241 3.563 ( -2.160 4.170 3.932) 6.125 3.636 ( -4.520 0.128 -1.858) 4.889 3.769 ( -1.705 -1.481 -1.074) 2.501 3.855 ( -1.173 1.156 -1.366) 2.140 3.942 ( -5.194 1.266 -0.162) 5.348 4.049 ( -6.879 -4.357 -0.839) 8.186 4.182 ( 3.915 5.034 -1.805) 6.628 4.310 ( 2.649 3.950 0.582) 4.791 4.464 ( -1.937 9.145 -0.439) 9.359 4.557 ( -0.451 1.647 6.373) 6.598 4.673 ( -0.135 1.276 1.416) 1.911 4.743 ( -1.658 4.377 1.337) 4.868 4.782 ( 0.747 0.033 -0.929) 1.193 4.948 ( 2.543 -0.622 -5.406) 6.007 5.060 ( -0.983 -1.983 -0.507) 2.270 5.223 ( -3.025 -1.567 0.267) 3.417 5.324 ( -8.758 -0.137 4.559) 9.874 5.395 ( 1.502 -2.837 -0.820) 3.313 5.428 ( -8.251 -2.330 2.071) 8.820 5.480 ( -2.802 2.103 -2.181) 4.127 5.739 ( 5.162 0.798 -2.267) 5.694 5.753 ( 1.823 -1.130 0.434) 2.188 6.012 ( 1.653 -3.208 -2.369) 4.317 6.077 ( 6.944 -2.588 0.465) 7.425 6.209 ( 2.168 -0.779 3.677) 4.339 6.397 ( 12.785 3.402 -1.303) 13.294 6.560 ( -10.530 2.747 -4.845) 11.912 6.755 ( 4.400 -1.261 5.151) 6.891 7.022 ( 3.633 -1.058 -3.341) 5.048 7.074 ( 18.592 5.840 -0.371) 19.492 7.365 ( 8.099 2.151 -0.919) 8.430 7.412 ( 3.546 -1.591 -3.456) 5.201 7.833 ( 5.753 -3.599 3.416) 7.597 7.966 ( 3.742 -1.694 -4.819) 6.332 8.200 ( 1.390 8.322 0.692) 8.466 8.310 ( 3.258 6.715 -2.997) 8.043 8.550 ( -10.800 3.705 8.938) 14.500 8.810 ( -3.705 7.450 -2.585) 8.713 9.076 ( 0.778 0.660 1.329) 1.675 9.112 ( 3.586 -2.405 -1.701) 4.641 9.365 ( -5.911 -3.408 8.230) 10.691 9.544 ( -2.465 -0.214 8.494) 8.847 9.660 ( 7.186 -0.194 -3.208) 7.872 9.769 ( -0.176 7.218 -0.492) 7.237 10.296 ( -0.126 4.311 -2.107) 4.800 10.462 ( 1.702 6.781 -1.724) 7.201 10.680 ( 0.615 0.753 -1.148) 1.504 10.760 ( 0.443 -0.017 -2.703) 2.740 10.903 ( -7.865 0.462 1.013) 7.943 11.033 ( -2.476 -2.943 5.543) 6.746 11.250 ( 3.253 -0.672 1.125) 3.507 11.365 ( 5.153 2.552 -0.829) 5.810 11.507 ( 2.262 -2.799 -2.129) 4.181 11.662 ( 10.188 2.720 2.311) 10.795 12.268 ( -2.884 2.512 -2.496) 4.567 12.362 ( -4.405 2.548 0.698) 5.136 12.465 ( 4.539 3.415 -0.172) 5.683 12.467 ( 11.427 5.213 -0.099) 12.560 13.046 ( -1.687 -0.039 1.458) 2.230 13.086 ( -0.729 -0.593 -0.846) 1.265 13.873 ( -1.698 5.304 2.314) 6.031 13.938 ( -2.843 4.191 -3.780) 6.320 15.876 ( -0.179 -0.532 4.379) 4.415 16.202 ( 9.101 8.667 -1.258) 12.631 17.524 ( -10.873 -7.530 -0.348) 13.231 17.637 ( -3.111 -6.719 2.891) 7.949 17.698 ( 2.231 -3.362 -1.931) 4.473 18.323 ( 21.938 3.390 -0.719) 22.210 19.085 ( -8.817 9.903 -0.457) 13.267 19.228 ( 3.311 14.889 -0.430) 15.259 19.421 ( 3.231 11.803 -0.952) 12.274 19.490 ( 7.005 9.538 -0.064) 11.834 20.216 ( -9.137 -2.944 -0.568) 9.617 20.278 ( -10.346 8.427 -1.408) 13.417 20.828 ( 7.501 -6.033 0.616) 9.646 21.026 ( 12.133 -16.709 1.245) 20.687 21.908 ( -0.387 -2.670 -2.577) 3.730 21.944 ( 3.922 -5.762 3.591) 7.840 22.331 ( -1.891 1.600 1.276) 2.787 22.442 ( 2.518 -1.002 -3.836) 4.697 22.858 ( -5.423 -0.452 7.288) 9.096 22.994 ( -2.100 -2.127 -6.032) 6.732 23.284 ( -6.636 -6.112 4.953) 10.292 23.360 ( -9.250 -8.281 -6.012) 13.795 ======================= Grid point 128 (40/102) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 7.955 -11.950 -2.866) 14.639 1.203 ( 10.129 -12.714 0.121) 16.256 1.493 ( 5.584 -9.940 -4.366) 12.209 1.715 ( 11.045 -11.046 6.038) 16.747 1.958 ( 3.145 -5.030 4.703) 7.571 2.112 ( 5.897 -17.619 1.045) 18.609 2.203 ( 5.632 -11.273 -1.478) 12.688 2.362 ( 5.214 -6.598 6.553) 10.661 2.570 ( 2.221 6.067 -4.010) 7.604 2.619 ( 3.152 -1.831 -2.785) 4.587 2.787 ( 5.521 -7.126 -8.000) 12.053 2.927 ( 8.686 -4.445 -2.068) 9.974 3.021 ( -3.699 -1.451 2.852) 4.891 3.091 ( 1.288 0.467 3.871) 4.106 3.208 ( -4.545 -2.093 -1.359) 5.185 3.328 ( -3.432 -1.786 0.669) 3.926 3.386 ( -1.735 0.250 1.222) 2.137 3.434 ( -6.250 4.394 1.305) 7.751 3.486 ( 3.779 4.684 -2.332) 6.454 3.640 ( -0.848 -1.960 -0.860) 2.303 3.768 ( -1.873 0.093 -1.650) 2.497 3.803 ( -2.250 2.844 1.788) 4.043 3.897 ( -4.764 -1.099 -4.056) 6.353 4.024 ( -4.844 0.745 -0.830) 4.970 4.149 ( 1.567 1.220 2.666) 3.325 4.235 ( -2.624 3.819 4.973) 6.797 4.303 ( -0.538 7.780 0.557) 7.819 4.560 ( 3.384 1.920 1.648) 4.226 4.638 ( -4.039 -0.639 -4.565) 6.128 4.704 ( 3.529 1.300 2.080) 4.298 4.828 ( 3.449 -2.799 -0.770) 4.508 4.939 ( -1.870 0.006 -1.124) 2.182 5.123 ( -3.152 -4.718 -2.260) 6.108 5.193 ( -3.903 1.980 0.115) 4.378 5.253 ( -5.217 1.311 3.202) 6.260 5.329 ( -6.421 -0.354 -0.060) 6.431 5.462 ( 0.289 -0.491 -1.006) 1.156 5.558 ( 2.734 -6.832 -0.447) 7.373 5.699 ( -2.323 3.136 1.731) 4.269 5.804 ( 2.252 -2.029 0.126) 3.033 6.067 ( -0.605 -1.968 -0.821) 2.217 6.217 ( 10.208 -5.497 -0.725) 11.616 6.259 ( 1.628 -2.244 2.728) 3.889 6.377 ( 4.702 6.151 0.305) 7.748 6.474 ( 0.859 0.078 -4.070) 4.160 6.843 ( 4.448 -3.144 4.260) 6.915 7.038 ( 7.187 5.777 -0.608) 9.241 7.079 ( 16.650 4.045 -5.810) 18.093 7.353 ( 4.879 4.652 1.882) 6.999 7.432 ( 1.883 0.476 -1.424) 2.408 7.918 ( 5.248 0.152 1.934) 5.595 8.024 ( 2.217 -2.896 -1.757) 4.048 8.071 ( 5.110 7.877 -0.093) 9.389 8.250 ( 2.348 3.007 -4.269) 5.726 8.432 ( -8.706 3.331 6.838) 11.561 8.659 ( -3.339 4.793 -2.555) 6.376 9.038 ( -2.989 3.091 3.243) 5.386 9.145 ( -0.904 0.014 -1.377) 1.647 9.360 ( -7.579 0.566 5.563) 9.418 9.530 ( -0.476 2.531 8.613) 8.990 9.626 ( -3.403 4.551 -3.802) 6.837 9.725 ( 6.529 -0.454 -7.488) 9.945 10.255 ( 0.462 0.254 -0.488) 0.718 10.450 ( 5.764 -2.062 -0.134) 6.123 10.686 ( -1.357 -1.859 -1.854) 2.955 10.745 ( -1.160 0.534 -1.281) 1.808 10.875 ( -1.580 -1.637 0.696) 2.379 11.082 ( -0.716 -2.332 5.089) 5.643 11.275 ( 4.486 1.125 1.435) 4.842 11.343 ( 7.116 4.700 -1.599) 8.676 11.521 ( 3.141 3.652 -1.439) 5.028 11.632 ( -0.065 3.724 -0.305) 3.737 12.213 ( -1.666 2.899 -0.628) 3.402 12.253 ( 0.885 5.793 -0.719) 5.904 12.444 ( 3.208 1.735 1.929) 4.126 12.494 ( 4.974 0.109 -1.079) 5.090 13.057 ( -0.601 -1.960 1.754) 2.698 13.094 ( -1.171 -1.715 -1.547) 2.589 13.735 ( -3.638 8.125 1.114) 8.972 13.822 ( -2.560 5.303 -1.645) 6.114 15.896 ( 0.949 -0.238 2.823) 2.988 16.115 ( 3.862 5.855 -2.260) 7.369 17.528 ( -10.497 -3.587 -1.199) 11.158 17.746 ( 0.634 -6.911 1.300) 7.061 17.851 ( 3.915 -8.077 0.202) 8.978 18.356 ( 16.353 7.887 1.233) 18.197 18.779 ( -7.073 14.742 -0.880) 16.375 19.093 ( 2.598 5.076 2.827) 6.364 19.214 ( 1.570 10.875 -5.987) 12.513 19.413 ( 5.751 5.849 2.631) 8.614 19.984 ( -7.162 12.103 0.042) 14.064 20.235 ( -7.389 -2.254 -1.209) 7.819 20.969 ( 4.278 -5.030 0.002) 6.604 21.375 ( 10.075 -12.348 1.640) 16.021 21.960 ( -1.328 -4.303 -1.899) 4.887 22.073 ( 3.043 -3.603 1.883) 5.078 22.288 ( -1.919 1.553 2.757) 3.701 22.462 ( 3.228 -0.206 -7.242) 7.931 22.846 ( -5.370 -0.804 9.380) 10.839 23.006 ( -1.786 -2.118 -6.098) 6.698 23.324 ( -7.060 -3.315 3.886) 8.714 23.389 ( -7.239 -3.351 -3.620) 8.760 ======================= Grid point 129 (41/102) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( 3.947 -11.516 0.993) 12.214 1.481 ( 3.537 -10.064 3.394) 11.194 1.703 ( 3.950 -10.573 2.208) 11.501 1.885 ( 8.866 -1.946 -2.656) 9.457 2.129 ( 9.527 -7.174 -3.090) 12.320 2.284 ( -0.487 -3.375 -1.628) 3.779 2.415 ( 3.636 3.581 -3.212) 6.030 2.542 ( 5.906 -6.695 3.403) 9.554 2.566 ( 3.885 -12.099 1.197) 12.764 2.654 ( 0.037 0.575 1.337) 1.456 2.862 ( 0.542 0.471 0.352) 0.800 2.977 ( -5.415 1.496 1.737) 5.880 3.015 ( -1.882 -2.396 -5.131) 5.967 3.105 ( 5.949 -0.656 1.303) 6.125 3.258 ( -1.973 -1.972 0.467) 2.828 3.307 ( -3.081 3.856 -0.209) 4.940 3.347 ( -2.746 -1.953 0.610) 3.425 3.391 ( -0.339 -2.574 -1.313) 2.910 3.467 ( 2.748 -0.896 -0.761) 2.989 3.606 ( -3.182 4.669 1.785) 5.926 3.726 ( -0.345 1.676 -1.942) 2.588 3.768 ( -0.658 0.749 -0.555) 1.141 3.902 ( -3.401 -3.897 -3.044) 6.002 3.957 ( -3.118 4.059 2.840) 5.853 4.153 ( 2.034 0.909 -0.135) 2.232 4.185 ( -0.282 3.153 5.314) 6.185 4.219 ( -0.337 -0.809 0.834) 1.210 4.520 ( 0.173 3.734 -0.308) 3.751 4.645 ( -3.307 -4.068 -5.391) 7.520 4.729 ( 5.826 0.892 1.708) 6.136 4.876 ( 1.843 0.346 -2.001) 2.742 4.940 ( -4.377 -2.782 0.631) 5.225 5.108 ( -6.813 1.454 3.394) 7.749 5.140 ( -4.509 -0.248 -1.251) 4.686 5.227 ( -0.389 -0.122 0.854) 0.947 5.362 ( -0.389 -5.290 -0.904) 5.380 5.484 ( 1.707 -1.294 -3.521) 4.121 5.614 ( -3.249 4.007 2.794) 5.867 5.681 ( 1.921 -4.565 0.601) 4.989 5.848 ( 1.007 -0.781 1.085) 1.673 6.040 ( -5.550 2.461 -0.149) 6.073 6.284 ( 2.479 -0.009 -0.220) 2.488 6.352 ( 6.401 -1.378 -0.136) 6.549 6.419 ( 6.144 -5.727 2.604) 8.794 6.523 ( 9.020 -2.780 -3.498) 10.065 6.922 ( 1.369 0.515 4.377) 4.615 6.968 ( 7.903 5.033 -1.250) 9.452 7.116 ( 5.955 1.293 -7.382) 9.572 7.307 ( 4.331 3.860 3.668) 6.864 7.421 ( 3.133 2.549 -0.425) 4.061 7.921 ( -2.481 -0.524 0.970) 2.715 8.016 ( 11.387 5.596 -0.206) 12.689 8.089 ( 4.323 -1.462 -0.573) 4.599 8.179 ( 0.504 4.725 -4.079) 6.263 8.324 ( -7.993 2.901 6.322) 10.596 8.608 ( -0.082 -0.946 -5.353) 5.436 8.928 ( -8.035 5.835 4.924) 11.084 9.106 ( -3.189 1.626 -0.853) 3.679 9.250 ( -7.597 4.833 0.710) 9.032 9.501 ( 0.544 2.352 8.590) 8.923 9.559 ( -4.401 -0.962 -1.343) 4.701 9.752 ( 5.977 0.756 -8.400) 10.337 10.262 ( -0.955 -0.614 1.209) 1.658 10.574 ( 4.853 -5.673 0.841) 7.513 10.711 ( -2.300 -3.334 -3.388) 5.281 10.757 ( 3.746 -1.220 -0.076) 3.940 10.920 ( -0.951 -3.378 1.083) 3.672 11.125 ( 0.928 -1.541 3.469) 3.908 11.285 ( 4.333 2.076 0.569) 4.838 11.296 ( 6.884 5.742 -2.065) 9.199 11.424 ( -0.920 6.446 -0.430) 6.526 11.557 ( -2.228 3.428 -0.249) 4.096 12.117 ( -1.154 4.826 -0.986) 5.059 12.195 ( 1.616 2.952 0.421) 3.392 12.461 ( 1.665 -0.875 1.575) 2.453 12.519 ( 2.452 -0.030 -1.031) 2.660 13.115 ( 1.640 -3.469 1.574) 4.147 13.130 ( -0.885 -3.600 -1.658) 4.061 13.552 ( -4.763 8.461 -0.106) 9.710 13.708 ( -1.804 5.255 -0.041) 5.557 15.908 ( 0.183 -0.121 2.037) 2.048 16.043 ( 1.350 3.824 -1.941) 4.496 17.517 ( -5.312 -2.009 -0.711) 5.724 17.871 ( -0.284 -5.915 2.015) 6.255 18.014 ( 1.132 -7.705 -1.127) 7.869 18.313 ( 13.402 9.272 -1.316) 16.350 18.511 ( -6.849 8.127 2.168) 10.847 19.038 ( 6.331 8.811 -2.479) 11.130 19.070 ( -1.232 1.146 0.736) 1.837 19.366 ( 3.251 3.685 1.104) 5.037 19.747 ( -5.948 8.396 -0.241) 10.292 20.207 ( -3.811 0.192 -0.322) 3.829 21.070 ( 2.589 -3.314 -0.046) 4.206 21.626 ( 7.304 -8.464 0.648) 11.198 22.030 ( -1.983 -4.907 -0.466) 5.313 22.081 ( -1.129 3.198 0.257) 3.401 22.281 ( -0.003 -0.016 4.550) 4.550 22.469 ( 3.627 0.250 -9.039) 9.743 22.856 ( -3.877 -2.158 8.596) 9.673 23.013 ( -1.523 -1.246 -4.296) 4.726 23.327 ( -4.420 -1.178 2.839) 5.383 23.370 ( -5.421 -1.006 -2.832) 6.198 ======================= Grid point 130 (42/102) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( -2.179 -6.127 6.949) 9.517 1.664 ( 1.081 -7.658 0.253) 7.738 1.842 ( 2.968 -0.012 -6.722) 7.348 2.034 ( 10.198 -8.137 -0.638) 13.062 2.186 ( 0.349 7.064 -0.089) 7.073 2.307 ( 0.562 -1.819 -1.903) 2.692 2.359 ( 2.320 3.752 0.736) 4.472 2.602 ( -1.341 1.063 -1.907) 2.562 2.645 ( -2.765 -2.462 2.908) 4.708 2.815 ( -2.567 -6.003 3.820) 7.564 2.865 ( 7.702 -3.579 0.073) 8.494 2.949 ( 0.681 -0.806 -0.429) 1.139 3.029 ( -5.887 -2.372 -3.510) 7.253 3.129 ( 3.896 2.850 -0.994) 4.929 3.182 ( -2.158 3.704 -1.520) 4.549 3.278 ( -2.010 0.410 3.259) 3.851 3.310 ( -1.540 3.784 1.363) 4.307 3.459 ( -3.166 -1.537 3.589) 5.027 3.504 ( 2.672 -2.505 -2.703) 4.552 3.563 ( 2.373 -2.402 -1.635) 3.752 3.704 ( -0.818 3.069 1.787) 3.644 3.737 ( -0.226 0.688 -4.451) 4.509 3.868 ( 0.337 2.208 1.556) 2.722 3.973 ( -0.350 -4.239 -0.514) 4.284 4.127 ( -4.844 0.073 1.899) 5.203 4.178 ( 4.964 1.443 -2.042) 5.558 4.259 ( 1.987 -1.951 0.452) 2.821 4.453 ( -4.480 1.391 1.950) 5.080 4.667 ( -2.297 -0.027 -1.770) 2.900 4.754 ( 5.978 1.310 0.125) 6.121 4.854 ( 0.382 1.559 0.306) 1.634 4.962 ( -3.450 -2.863 -3.573) 5.733 5.052 ( -2.464 1.108 2.853) 3.929 5.131 ( -2.761 -2.183 3.142) 4.718 5.232 ( 0.942 0.251 -1.635) 1.904 5.457 ( -1.556 -1.729 2.108) 3.139 5.493 ( 1.421 -1.370 -3.796) 4.278 5.541 ( 0.161 2.152 0.124) 2.161 5.766 ( 3.412 -3.136 0.484) 4.659 5.831 ( -3.633 2.073 1.713) 4.520 5.958 ( -1.859 2.097 -0.372) 2.827 6.302 ( 1.269 0.010 0.023) 1.269 6.447 ( 6.996 -2.409 0.549) 7.420 6.503 ( -1.631 -2.629 0.010) 3.094 6.696 ( 8.601 -6.872 -3.021) 11.416 6.825 ( -0.840 7.346 2.985) 7.974 7.002 ( 0.092 -1.938 -0.088) 1.942 7.068 ( -0.256 3.951 -2.589) 4.731 7.316 ( 1.969 -1.183 1.137) 2.563 7.386 ( 2.449 3.432 -0.659) 4.268 7.937 ( -5.449 -3.601 1.536) 6.709 8.008 ( 11.386 4.466 -2.448) 12.473 8.091 ( 1.502 3.197 -2.986) 4.625 8.149 ( 4.169 -1.407 1.855) 4.775 8.257 ( -7.928 0.004 3.173) 8.539 8.642 ( 1.294 -1.130 -2.271) 2.847 8.752 ( -6.439 4.540 0.628) 7.903 9.071 ( 0.540 0.673 -0.116) 0.870 9.132 ( -4.609 2.931 0.537) 5.488 9.493 ( 1.733 1.488 7.524) 7.863 9.561 ( -5.049 -2.636 1.067) 5.794 9.751 ( 3.430 1.197 -8.111) 8.888 10.268 ( -0.153 -0.411 0.523) 0.682 10.673 ( -0.581 -2.707 1.838) 3.323 10.760 ( 0.996 -2.646 -2.508) 3.779 10.830 ( 3.652 -3.105 -0.010) 4.794 10.947 ( -1.241 0.816 -0.123) 1.491 11.169 ( 1.158 -1.449 2.407) 3.039 11.228 ( 6.403 5.520 -2.272) 8.754 11.271 ( -2.426 0.225 -0.074) 2.437 11.324 ( -2.150 2.653 0.446) 3.444 11.499 ( -0.003 1.438 0.258) 1.461 12.045 ( -0.346 1.985 -1.484) 2.502 12.165 ( 0.097 1.322 1.797) 2.233 12.493 ( 1.074 -1.068 0.254) 1.536 12.527 ( 0.491 0.183 -0.394) 0.655 13.187 ( 0.815 -2.062 0.328) 2.241 13.207 ( 1.571 -5.052 -0.597) 5.324 13.378 ( -3.900 6.669 -0.313) 7.732 13.622 ( -0.505 2.802 0.400) 2.875 15.918 ( -0.593 -0.888 1.625) 1.945 15.992 ( 0.732 2.237 -1.627) 2.862 17.516 ( -1.538 -0.722 -0.259) 1.718 17.957 ( -0.347 -3.589 3.270) 4.868 18.122 ( -3.757 -5.825 -2.626) 7.412 18.202 ( 7.608 10.218 -4.111) 13.386 18.435 ( -1.686 -0.879 4.894) 5.250 18.928 ( 2.770 5.311 -3.894) 7.145 19.081 ( 0.315 -1.143 3.197) 3.410 19.334 ( 0.856 1.614 -0.220) 1.840 19.612 ( -2.445 2.932 -0.288) 3.829 20.182 ( -1.256 0.272 0.092) 1.289 21.122 ( 0.938 -0.983 0.090) 1.362 21.791 ( 3.942 -4.586 -0.121) 6.049 21.996 ( -1.798 3.487 -0.313) 3.936 22.095 ( -1.844 -3.585 0.419) 4.053 22.278 ( 0.212 1.171 2.936) 3.168 22.463 ( 2.169 1.297 -5.492) 6.045 22.902 ( -0.899 -3.261 3.638) 4.968 23.002 ( -1.516 0.914 -0.320) 1.799 23.317 ( -0.981 0.304 0.401) 1.102 23.349 ( -2.271 -0.611 -1.273) 2.674 ======================= Grid point 132 (43/102) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -4.925 -1.460 7.184) 8.831 1.692 ( -0.865 6.552 -1.089) 6.698 1.800 ( 1.802 1.550 -10.033) 10.311 1.987 ( -6.843 10.066 2.931) 12.519 2.212 ( 4.314 -2.868 2.052) 5.572 2.240 ( -1.831 6.944 -1.533) 7.343 2.361 ( -3.529 -3.985 0.300) 5.331 2.610 ( 3.037 -1.696 0.160) 3.482 2.674 ( 0.506 -0.722 -1.127) 1.431 2.837 ( 1.130 2.104 2.804) 3.683 2.860 ( -8.414 6.796 0.967) 10.859 2.948 ( 3.316 4.583 0.343) 5.667 3.011 ( -1.432 -1.956 -3.382) 4.161 3.146 ( -0.066 -2.017 -1.933) 2.794 3.158 ( 0.765 -5.424 -0.033) 5.478 3.263 ( 1.384 -0.740 1.831) 2.411 3.319 ( -0.797 -2.303 2.005) 3.156 3.430 ( -1.840 1.966 2.366) 3.585 3.557 ( 0.178 5.531 -1.574) 5.753 3.587 ( 2.638 -0.993 -2.876) 4.027 3.658 ( 2.116 -0.809 0.540) 2.329 3.713 ( -2.011 -1.960 0.350) 2.830 3.918 ( 6.552 -1.362 -1.747) 6.916 3.958 ( -2.918 3.831 0.926) 4.905 4.133 ( -3.353 -1.468 1.666) 4.022 4.177 ( 0.888 -1.696 -2.895) 3.471 4.314 ( 3.013 -1.448 -3.577) 4.896 4.429 ( -3.408 -1.754 4.852) 6.183 4.607 ( 0.391 4.516 1.805) 4.879 4.765 ( 2.696 1.028 -0.887) 3.018 4.846 ( 0.332 0.140 -0.114) 0.378 4.958 ( -2.652 -0.203 -1.104) 2.880 5.067 ( 3.017 -1.618 0.438) 3.452 5.181 ( 1.358 -2.448 3.634) 4.587 5.214 ( -0.128 1.595 -3.651) 3.986 5.399 ( -3.111 2.011 2.750) 4.614 5.497 ( 3.531 4.547 -1.363) 5.916 5.586 ( 3.444 -3.945 -2.603) 5.848 5.757 ( -4.479 2.456 1.381) 5.292 5.855 ( 3.655 -3.435 0.156) 5.019 5.927 ( -0.761 0.999 1.338) 1.835 6.296 ( 0.157 1.298 0.272) 1.335 6.485 ( -5.518 0.981 -0.506) 5.627 6.506 ( -1.397 0.406 -1.005) 1.769 6.661 ( -5.002 5.775 -0.768) 7.678 6.832 ( -2.218 -3.165 2.183) 4.439 7.031 ( -0.612 0.218 0.120) 0.661 7.035 ( 0.993 -3.471 -2.395) 4.332 7.330 ( -1.095 0.980 0.257) 1.492 7.374 ( -2.218 -3.197 -0.040) 3.892 7.956 ( -6.846 -3.474 1.554) 7.833 8.007 ( 7.422 3.275 -3.438) 8.811 8.077 ( -0.901 -2.149 -1.944) 3.035 8.180 ( -8.816 0.587 -0.261) 8.839 8.261 ( 7.854 -3.857 3.135) 9.295 8.534 ( -7.371 3.391 2.999) 8.651 8.853 ( 11.642 -6.723 -4.306) 14.116 9.061 ( 0.848 1.132 -0.358) 1.459 9.107 ( 2.563 -0.757 2.750) 3.835 9.507 ( 2.056 0.109 5.584) 5.951 9.572 ( -5.399 -2.043 3.531) 6.767 9.733 ( 0.929 0.061 -8.922) 8.971 10.274 ( 1.078 0.450 0.139) 1.177 10.689 ( -2.657 -0.247 2.037) 3.357 10.751 ( 0.036 4.059 -3.317) 5.242 10.860 ( -0.859 4.187 -2.657) 5.033 10.910 ( 2.123 -0.642 3.134) 3.839 11.146 ( -5.171 1.551 2.382) 5.901 11.241 ( 0.909 -2.379 -1.209) 2.819 11.270 ( -1.516 -1.861 -0.507) 2.454 11.329 ( 2.056 -3.445 0.141) 4.015 11.505 ( -0.457 -1.909 -0.042) 1.964 12.041 ( 0.633 -1.883 -1.299) 2.373 12.159 ( -1.353 -0.773 2.087) 2.604 12.509 ( -0.504 -0.402 -0.513) 0.824 12.517 ( -0.515 0.732 0.032) 0.896 13.175 ( -0.390 3.712 0.496) 3.765 13.229 ( -2.567 3.108 -1.363) 4.255 13.363 ( 3.238 -6.378 0.613) 7.179 13.626 ( 1.972 -2.605 0.138) 3.271 15.942 ( -1.692 -2.236 2.050) 3.473 15.968 ( 1.357 0.774 -2.065) 2.589 17.515 ( 1.514 0.760 -0.210) 1.707 18.003 ( 1.282 0.497 3.598) 3.852 18.076 ( 4.801 8.121 -3.754) 10.153 18.179 ( -10.132 -7.872 -1.317) 12.898 18.469 ( 1.907 -1.492 2.436) 3.434 18.893 ( -1.346 -1.637 -1.317) 2.496 19.115 ( -1.219 -2.290 0.616) 2.666 19.328 ( -0.895 -1.220 0.093) 1.516 19.611 ( 2.206 -3.002 -0.242) 3.733 20.183 ( 1.327 -0.364 0.000) 1.376 21.118 ( -0.925 1.418 0.290) 1.717 21.783 ( -3.686 4.839 0.304) 6.090 22.009 ( 2.562 -4.056 -1.090) 4.920 22.111 ( -0.055 1.379 -0.647) 1.524 22.275 ( -1.075 -0.633 4.009) 4.199 22.432 ( 1.151 1.935 -4.327) 4.878 22.939 ( -1.581 1.878 2.973) 3.856 22.979 ( 1.753 -1.186 -0.637) 2.210 23.309 ( 0.966 0.723 0.623) 1.358 23.357 ( 3.017 -0.261 -1.444) 3.355 ======================= Grid point 133 (44/102) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -4.635 15.074 -1.734) 15.866 1.499 ( -6.573 12.047 1.784) 13.839 1.729 ( -9.386 11.636 0.621) 14.962 1.840 ( -0.502 -4.388 1.202) 4.578 2.106 ( -5.602 6.255 -2.280) 8.701 2.222 ( 0.313 2.539 1.395) 2.914 2.389 ( -4.620 -2.740 -2.846) 6.079 2.537 ( -10.601 13.916 2.134) 17.624 2.622 ( -1.576 3.916 3.485) 5.474 2.701 ( 2.198 -0.296 -4.163) 4.716 2.854 ( -3.866 2.086 0.875) 4.479 2.922 ( 3.806 2.341 1.561) 4.733 3.012 ( 3.119 0.202 -1.335) 3.398 3.168 ( -0.587 -2.596 -3.160) 4.131 3.244 ( -1.295 0.545 1.418) 1.996 3.308 ( 1.740 -1.888 -0.363) 2.593 3.360 ( 1.917 0.960 -0.486) 2.198 3.388 ( 0.208 -1.617 2.010) 2.588 3.445 ( 0.893 2.784 -1.846) 3.458 3.609 ( -0.149 -1.214 0.688) 1.404 3.718 ( 3.315 -2.082 -1.127) 4.074 3.768 ( 0.913 -3.525 0.336) 3.656 3.867 ( 2.709 4.605 0.093) 5.344 3.955 ( 2.673 0.965 1.586) 3.255 4.144 ( -2.532 -2.444 1.638) 3.881 4.201 ( -4.688 -1.425 0.603) 4.936 4.323 ( 4.666 1.419 -2.327) 5.404 4.499 ( 0.078 -5.051 1.751) 5.347 4.569 ( 2.287 -0.167 -1.047) 2.521 4.755 ( -1.349 0.288 -0.895) 1.644 4.840 ( 0.488 0.991 -0.753) 1.337 4.939 ( -1.878 0.750 1.876) 2.758 5.116 ( 5.308 1.209 1.110) 5.556 5.178 ( 0.923 0.346 -2.916) 3.078 5.238 ( 4.204 -0.575 1.678) 4.563 5.362 ( 1.671 1.572 -1.519) 2.751 5.457 ( 3.756 1.741 -1.592) 4.436 5.646 ( 0.191 0.301 0.762) 0.841 5.680 ( -3.198 1.799 0.438) 3.695 5.865 ( -1.635 3.202 -0.067) 3.596 5.973 ( 3.611 -3.658 3.607) 6.280 6.259 ( -1.298 2.444 0.608) 2.833 6.385 ( -9.316 1.800 -1.485) 9.604 6.441 ( -9.350 2.635 3.343) 10.273 6.519 ( -2.000 4.799 -5.114) 7.292 6.909 ( -7.945 -8.511 3.294) 12.101 7.001 ( -4.947 0.164 1.308) 5.120 7.064 ( 0.754 1.831 -5.889) 6.213 7.354 ( -4.553 -6.188 -0.174) 7.685 7.407 ( -3.984 -2.669 0.473) 4.819 7.970 ( -6.606 -3.450 -0.668) 7.482 7.992 ( -0.619 0.265 -0.323) 0.746 8.085 ( -2.688 0.822 0.907) 2.953 8.160 ( -1.693 -3.973 -3.651) 5.655 8.396 ( 5.341 -4.230 4.591) 8.215 8.507 ( 1.463 -2.446 -1.674) 3.306 9.012 ( 4.610 -2.946 2.442) 5.991 9.076 ( 4.301 -0.778 -2.160) 4.875 9.194 ( 6.882 -4.674 3.481) 9.018 9.548 ( 3.045 -1.741 1.878) 3.979 9.557 ( -5.775 0.230 5.781) 8.174 9.747 ( 0.940 -3.474 -10.556) 11.152 10.258 ( 0.238 2.212 1.442) 2.652 10.600 ( -5.285 6.737 -0.021) 8.563 10.683 ( 1.720 2.529 -1.645) 3.473 10.780 ( -0.132 2.341 -2.554) 3.467 10.921 ( 2.113 2.513 1.322) 3.540 11.104 ( -8.107 -2.034 4.718) 9.598 11.278 ( -2.883 -2.423 -0.137) 3.768 11.299 ( -2.407 -3.050 -0.942) 3.998 11.430 ( -0.265 -5.665 -0.746) 5.720 11.556 ( 1.683 -3.147 -0.241) 3.577 12.112 ( 2.112 -4.774 -0.743) 5.273 12.182 ( -2.723 -3.083 1.205) 4.286 12.489 ( -2.638 0.823 1.514) 3.151 12.507 ( -1.497 -0.074 -1.837) 2.371 13.099 ( -0.301 3.606 0.970) 3.746 13.152 ( -0.487 3.544 -1.402) 3.842 13.531 ( 3.574 -8.648 0.994) 9.410 13.720 ( 3.285 -4.968 -0.606) 5.986 15.963 ( -0.901 -0.886 1.002) 1.612 15.988 ( -0.839 -2.947 -0.958) 3.211 17.512 ( 4.960 2.169 -0.411) 5.429 17.941 ( -0.834 6.791 -2.584) 7.314 17.960 ( 1.984 7.365 2.410) 7.999 18.266 ( -13.412 -11.205 1.520) 17.542 18.567 ( 6.010 -7.045 -0.983) 9.313 18.952 ( -3.399 -6.470 1.847) 7.538 19.140 ( -3.493 -2.871 -2.808) 5.322 19.371 ( -1.936 -4.586 0.886) 5.057 19.745 ( 5.382 -8.538 -0.088) 10.093 20.207 ( 4.185 0.283 -0.315) 4.206 21.061 ( -2.668 3.454 0.420) 4.385 21.631 ( -7.211 7.406 0.424) 10.346 22.047 ( 1.518 5.516 -1.996) 6.059 22.092 ( 0.700 -2.331 -0.009) 2.434 22.285 ( -2.602 -0.474 6.991) 7.474 22.414 ( 2.530 -0.200 -7.810) 8.212 22.876 ( -1.098 3.889 7.147) 8.210 23.022 ( 3.598 -1.085 -5.187) 6.406 23.303 ( 2.814 2.076 2.725) 4.433 23.392 ( 7.250 0.310 -2.448) 7.659 ======================= Grid point 134 (45/102) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( -6.746 15.081 -2.071) 16.651 1.203 ( -8.784 12.981 0.756) 15.692 1.414 ( -7.370 15.926 -0.240) 17.551 1.886 ( -9.880 7.962 -8.647) 15.355 1.920 ( -7.048 -0.207 11.376) 13.384 2.120 ( -2.481 9.529 0.538) 9.861 2.158 ( -9.332 14.978 1.930) 17.753 2.419 ( -13.619 8.875 6.632) 17.556 2.510 ( 1.513 -3.563 -4.101) 5.639 2.628 ( 0.642 3.374 -5.240) 6.265 2.789 ( 0.216 4.362 -6.741) 8.032 2.865 ( -1.707 4.909 2.668) 5.843 3.039 ( 0.031 -0.305 0.007) 0.306 3.118 ( -6.106 6.320 3.088) 9.315 3.251 ( 7.592 -2.974 -4.881) 9.503 3.321 ( 2.780 3.414 1.605) 4.686 3.359 ( 1.051 -3.069 1.874) 3.746 3.417 ( -1.720 -0.791 3.200) 3.718 3.535 ( 3.287 -5.606 -4.052) 7.658 3.632 ( 0.034 -2.614 -2.090) 3.347 3.758 ( 1.700 -0.355 0.670) 1.862 3.825 ( 4.049 2.152 -0.121) 4.587 3.860 ( 6.526 -2.804 -2.022) 7.385 3.984 ( 3.392 -2.118 1.830) 4.398 4.115 ( -2.972 2.767 4.566) 6.111 4.256 ( 0.894 -5.130 1.941) 5.557 4.344 ( 1.707 -1.760 -0.281) 2.468 4.563 ( -0.457 -2.711 1.202) 3.001 4.630 ( -3.097 -4.870 -3.144) 6.572 4.759 ( -0.278 -2.324 -0.201) 2.349 4.804 ( -0.773 2.656 -0.668) 2.846 4.909 ( -1.625 0.788 -0.399) 1.849 5.100 ( 5.318 4.415 0.908) 6.971 5.203 ( 3.756 -0.994 -0.327) 3.899 5.290 ( 7.488 -1.543 -1.457) 7.783 5.387 ( 5.900 -0.851 -2.319) 6.396 5.447 ( -1.095 2.693 -0.074) 2.909 5.555 ( -1.530 3.350 -0.569) 3.727 5.701 ( -0.726 -1.545 3.031) 3.479 5.770 ( -2.435 4.846 1.117) 5.537 6.047 ( 0.145 -1.369 0.546) 1.481 6.177 ( -6.339 4.247 1.238) 7.730 6.270 ( -7.625 2.485 2.201) 8.317 6.389 ( 0.801 -0.408 0.252) 0.934 6.454 ( -5.681 -1.286 -3.615) 6.855 6.937 ( -7.239 -0.593 5.611) 9.178 6.975 ( -2.587 2.719 -5.598) 6.740 7.044 ( -10.041 -7.678 -1.388) 12.716 7.410 ( -3.490 -0.785 -0.252) 3.587 7.439 ( -5.808 -7.091 -3.495) 9.810 7.945 ( -11.384 -0.007 3.442) 11.893 7.990 ( 0.344 -0.963 -4.220) 4.342 8.106 ( 2.273 -3.081 1.563) 4.135 8.189 ( -3.652 -2.314 -2.686) 5.090 8.532 ( 2.799 -7.074 4.746) 8.966 8.599 ( 6.001 -4.285 -3.179) 8.030 9.058 ( 2.326 0.959 3.465) 4.282 9.111 ( 1.858 -0.333 0.105) 1.891 9.356 ( 3.129 -6.959 4.421) 8.818 9.516 ( -4.600 0.431 5.766) 7.388 9.610 ( 0.897 -2.510 -1.249) 2.944 9.808 ( 1.420 -3.832 -9.801) 10.619 10.225 ( 0.480 0.623 1.242) 1.470 10.454 ( -5.179 3.758 -0.369) 6.410 10.654 ( 2.368 2.067 -0.053) 3.143 10.761 ( 0.943 0.336 -1.782) 2.044 10.889 ( 2.539 1.707 -0.566) 3.112 11.105 ( -4.878 -1.620 4.362) 6.741 11.280 ( -5.845 -1.556 1.117) 6.151 11.333 ( -3.527 -3.047 -1.203) 4.814 11.502 ( -3.287 -3.795 -0.625) 5.059 11.617 ( 1.088 -2.122 0.464) 2.429 12.203 ( 0.870 -2.767 -0.078) 2.901 12.257 ( 0.641 -7.045 -0.837) 7.123 12.460 ( -5.269 -0.675 1.846) 5.624 12.486 ( -3.660 -0.334 -1.522) 3.977 13.057 ( 0.494 1.454 1.617) 2.230 13.098 ( 1.218 2.312 -1.633) 3.082 13.714 ( 2.618 -8.407 1.786) 8.984 13.834 ( 3.910 -4.928 -1.798) 6.542 15.979 ( -0.095 -1.319 -1.026) 1.674 16.036 ( -5.038 -4.776 1.348) 7.072 17.507 ( 8.327 4.186 0.079) 9.320 17.793 ( -0.928 7.480 -1.649) 7.716 17.833 ( -1.245 7.287 1.434) 7.530 18.366 ( -16.707 -11.348 0.796) 20.212 18.793 ( 8.169 -11.550 -1.805) 14.262 19.082 ( -1.151 -9.382 4.262) 10.369 19.170 ( -6.338 -6.178 -3.694) 9.591 19.458 ( -3.664 -7.171 -0.464) 8.066 19.980 ( 6.713 -12.232 0.265) 13.955 20.220 ( 8.541 3.792 -0.383) 9.353 20.961 ( -4.615 4.753 0.446) 6.640 21.409 ( -10.967 10.137 -0.196) 14.935 21.937 ( 1.815 7.357 -0.600) 7.601 22.074 ( -3.246 3.089 1.791) 4.826 22.310 ( -0.021 -2.264 3.081) 3.823 22.426 ( 1.806 -0.338 -6.509) 6.763 22.833 ( 0.869 2.427 7.947) 8.355 23.042 ( 3.755 0.451 -6.643) 7.644 23.283 ( 4.450 4.188 4.027) 7.318 23.433 ( 10.139 1.921 -3.573) 10.920 ======================= Grid point 135 (46/102) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.793 ( -10.264 14.102 2.649) 17.641 0.987 ( -5.452 4.397 -6.155) 9.324 1.059 ( -6.864 17.130 1.931) 18.554 1.601 ( -7.753 12.174 -9.850) 17.474 1.673 ( -16.803 17.356 1.960) 24.237 1.744 ( -12.922 23.740 5.022) 27.492 1.980 ( 0.390 6.833 7.998) 10.527 2.232 ( -11.294 -0.145 5.683) 12.644 2.581 ( 2.855 -2.093 -5.821) 6.813 2.652 ( 0.589 7.313 -6.477) 9.786 2.705 ( 0.762 -7.597 -6.479) 10.013 2.716 ( -4.790 6.638 3.092) 8.751 2.981 ( -1.896 3.617 2.894) 5.005 3.035 ( -4.589 0.923 1.734) 4.992 3.284 ( 4.343 0.992 -1.168) 4.605 3.351 ( 7.001 -0.368 -1.348) 7.139 3.404 ( 0.784 -0.181 1.471) 1.677 3.423 ( -6.089 -2.104 2.649) 6.966 3.591 ( -0.820 -0.269 1.339) 1.593 3.706 ( 4.564 -3.254 -7.116) 9.058 3.765 ( -0.251 -0.135 1.772) 1.794 3.827 ( 4.242 0.592 -1.235) 4.457 3.953 ( 5.168 -1.121 -0.793) 5.347 4.049 ( 7.960 3.064 -0.719) 8.559 4.103 ( -1.729 -5.055 3.327) 6.294 4.308 ( 1.225 0.330 0.618) 1.412 4.446 ( -4.259 -10.242 1.357) 11.175 4.629 ( 2.714 -3.925 2.711) 5.488 4.685 ( -5.430 -5.944 -2.138) 8.330 4.759 ( -2.526 0.516 1.895) 3.199 4.792 ( -0.311 -0.774 2.805) 2.926 4.908 ( 1.448 -1.552 -8.091) 8.365 5.065 ( 5.992 3.089 -0.824) 6.792 5.255 ( 4.935 2.059 -0.613) 5.383 5.330 ( -5.424 1.704 5.492) 7.905 5.394 ( 7.897 -2.213 -1.492) 8.336 5.446 ( 5.637 -0.822 -2.396) 6.180 5.551 ( 5.450 -0.112 -5.328) 7.622 5.641 ( -2.486 5.950 5.597) 8.539 5.756 ( -4.133 -3.718 -0.172) 5.562 5.985 ( -6.645 3.851 -1.112) 7.760 6.090 ( -3.068 1.820 -0.273) 3.578 6.215 ( -4.469 -0.257 4.265) 6.183 6.374 ( -6.600 0.114 -0.747) 6.643 6.503 ( 4.144 -4.782 -1.087) 6.420 6.893 ( -3.573 1.853 -2.497) 4.737 6.904 ( -3.881 1.030 2.244) 4.600 7.077 ( -11.979 -4.409 -0.084) 12.765 7.374 ( -4.135 1.770 -0.792) 4.567 7.486 ( -6.723 -4.027 -8.690) 11.702 7.854 ( -9.343 1.803 4.480) 10.517 7.966 ( -1.017 2.167 -8.247) 8.588 8.201 ( 0.537 -5.901 3.531) 6.897 8.238 ( -1.204 -6.180 0.501) 6.316 8.688 ( -1.430 -6.215 7.946) 10.189 8.729 ( 10.224 -5.490 -6.252) 13.182 9.027 ( 1.137 4.581 4.111) 6.259 9.107 ( -1.656 0.744 -0.473) 1.876 9.415 ( -3.156 1.013 5.231) 6.193 9.554 ( -1.162 -1.939 -0.434) 2.302 9.675 ( -6.897 -11.544 5.613) 14.572 9.837 ( -1.945 -2.184 -5.539) 6.264 10.290 ( 5.960 -5.047 -2.503) 8.201 10.426 ( -3.411 -4.630 0.336) 5.761 10.650 ( 2.425 0.130 0.083) 2.430 10.756 ( -0.721 -0.013 -1.010) 1.241 10.912 ( 6.356 -0.033 0.154) 6.358 11.097 ( -0.704 0.817 1.583) 1.916 11.243 ( -4.943 2.150 1.616) 5.627 11.347 ( -5.003 -2.307 0.034) 5.509 11.503 ( -5.331 -0.416 -1.983) 5.703 11.664 ( -3.817 -4.048 2.361) 6.044 12.243 ( 1.716 -1.292 -0.966) 2.355 12.379 ( 5.369 -1.512 -0.585) 5.608 12.459 ( -11.412 -7.072 0.339) 13.430 12.464 ( -5.056 -1.616 -0.043) 5.308 13.056 ( 0.328 -0.334 1.662) 1.727 13.077 ( 1.775 1.141 -1.145) 2.400 13.861 ( 1.123 -5.710 2.327) 6.268 13.940 ( 4.392 -3.798 -3.281) 6.669 16.006 ( 2.333 -1.698 -4.763) 5.569 16.101 ( -13.320 -9.907 6.160) 17.707 17.466 ( 7.032 7.320 2.337) 10.416 17.674 ( -4.043 5.025 1.618) 6.650 17.725 ( 8.437 5.158 -3.611) 10.528 18.382 ( -23.764 -6.083 -4.409) 24.923 19.044 ( 9.392 -7.809 2.087) 12.392 19.238 ( -4.367 -11.224 -1.171) 12.101 19.337 ( -3.258 -15.766 2.876) 16.354 19.562 ( -5.198 -8.325 -3.032) 10.272 20.182 ( 15.360 10.021 1.078) 18.371 20.261 ( 5.751 -12.482 0.095) 13.743 20.831 ( -7.169 4.666 0.281) 8.558 21.100 ( -14.484 13.440 -3.209) 20.018 21.826 ( 1.095 5.903 3.591) 6.996 21.980 ( -3.150 4.122 0.206) 5.192 22.356 ( -0.054 -1.961 1.304) 2.355 22.416 ( 0.832 1.105 -3.738) 3.986 22.833 ( 2.813 1.197 6.205) 6.917 23.036 ( 2.976 1.303 -6.183) 6.985 23.232 ( 4.845 6.403 4.177) 9.051 23.444 ( 12.098 5.490 -6.857) 14.950 ======================= Grid point 136 (47/102) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.512 ( -12.587 8.164 13.605) 20.253 0.682 ( -6.573 17.547 15.379) 24.240 0.934 ( -1.558 1.205 -17.753) 17.862 1.133 ( -19.075 24.766 19.096) 36.631 1.264 ( -16.833 12.714 -14.532) 25.616 1.417 ( 8.301 7.696 -13.350) 17.503 1.910 ( 4.914 3.950 8.280) 10.407 2.221 ( -8.106 -5.683 -1.593) 10.027 2.447 ( -5.809 8.900 0.560) 10.643 2.508 ( -1.252 6.143 -5.634) 8.429 2.729 ( -1.998 -4.075 8.487) 9.624 2.858 ( 1.384 -8.063 -2.341) 8.510 2.942 ( -0.111 1.412 3.729) 3.988 3.046 ( -0.218 -5.914 -2.860) 6.572 3.318 ( 1.569 -1.072 0.126) 1.904 3.372 ( -1.816 0.291 -0.403) 1.883 3.404 ( 0.178 -0.807 0.270) 0.869 3.418 ( -0.781 -0.570 -0.795) 1.251 3.546 ( 3.232 5.538 0.799) 6.461 3.705 ( -0.752 4.313 -5.935) 7.376 3.783 ( -5.652 -3.194 4.383) 7.833 3.862 ( 5.878 -0.678 -5.484) 8.067 3.951 ( 3.295 3.018 1.928) 4.867 4.033 ( 4.069 4.209 -1.641) 6.080 4.187 ( -1.219 -3.381 2.881) 4.606 4.331 ( -1.528 -3.588 -6.282) 7.394 4.616 ( -0.765 -8.885 4.803) 10.129 4.728 ( -0.927 -3.722 1.916) 4.288 4.744 ( -1.499 -2.557 2.471) 3.859 4.760 ( -2.928 -5.899 -1.733) 6.810 4.824 ( -1.513 -1.323 1.428) 2.465 4.913 ( 2.372 1.010 -8.133) 8.532 5.088 ( 6.223 -0.290 -0.089) 6.231 5.180 ( -3.029 2.231 -0.872) 3.861 5.365 ( 3.228 -0.978 5.525) 6.473 5.437 ( 10.143 3.332 -3.057) 11.105 5.505 ( 3.083 1.232 -1.602) 3.687 5.553 ( 1.659 0.795 2.400) 3.024 5.598 ( 8.714 0.424 -3.819) 9.523 5.727 ( -26.236 -3.331 -5.175) 26.948 5.926 ( 2.444 -0.492 2.434) 3.484 6.020 ( -3.437 2.757 -0.810) 4.480 6.221 ( -6.237 -3.052 4.780) 8.430 6.303 ( -7.716 0.596 -3.245) 8.391 6.633 ( 5.810 -4.076 2.079) 7.396 6.843 ( 2.721 3.439 -0.542) 4.419 6.857 ( -5.675 0.075 -0.614) 5.708 7.019 ( -6.446 2.611 -2.579) 7.418 7.277 ( -4.662 5.201 0.876) 7.039 7.425 ( -11.892 0.214 -10.008) 15.545 7.780 ( -8.493 0.366 6.016) 10.415 7.904 ( 2.389 2.035 -8.564) 9.121 8.336 ( -1.019 -7.358 3.802) 8.344 8.370 ( 4.029 -7.000 0.642) 8.103 8.749 ( -5.099 -0.494 8.092) 9.577 8.847 ( 7.340 0.157 -6.256) 9.646 8.965 ( 3.186 3.463 4.867) 6.770 9.104 ( 0.372 -2.500 -2.488) 3.547 9.377 ( -5.520 0.748 7.846) 9.622 9.520 ( 1.979 2.126 -7.617) 8.152 9.870 ( -1.190 -5.436 2.854) 6.254 9.970 ( -16.619 -25.231 5.005) 30.624 10.455 ( 3.333 -10.027 3.313) 11.074 10.571 ( 3.252 -12.082 -3.628) 13.028 10.694 ( 3.618 -2.521 -0.472) 4.435 10.750 ( -2.072 -0.560 -0.256) 2.162 10.953 ( 5.872 1.315 0.734) 6.062 11.065 ( -2.785 2.847 -1.918) 4.421 11.143 ( 1.150 5.908 4.756) 7.671 11.347 ( -3.275 -1.283 -0.422) 3.542 11.454 ( -4.421 0.778 -2.462) 5.120 11.664 ( -25.107 -3.882 -6.079) 26.122 12.305 ( 8.238 -2.732 2.937) 9.163 12.389 ( 0.800 0.391 -0.962) 1.311 12.434 ( -5.015 -0.720 1.703) 5.345 12.553 ( -6.891 -7.007 0.307) 9.832 13.067 ( 0.692 0.309 0.106) 0.765 13.073 ( 0.061 -0.044 0.404) 0.411 13.940 ( 0.515 -2.060 1.378) 2.531 13.997 ( 3.384 0.562 -4.012) 5.279 16.070 ( 9.538 -2.440 -6.336) 11.708 16.246 ( -34.135 -24.056 7.362) 42.403 17.390 ( 5.275 5.793 4.504) 9.038 17.552 ( -3.650 5.168 -1.004) 6.406 17.760 ( 18.346 2.719 -3.773) 18.926 18.148 ( -28.862 9.869 -10.395) 32.225 19.238 ( 12.671 -6.902 7.054) 16.060 19.456 ( -7.995 -15.731 2.384) 17.807 19.587 ( -1.588 -11.614 1.159) 11.779 19.650 ( -1.147 -4.177 -4.636) 6.344 20.104 ( 17.174 10.677 3.277) 20.486 20.460 ( -7.949 -4.891 -2.670) 9.708 20.688 ( -2.179 10.430 -5.134) 11.827 20.728 ( -14.034 8.014 -2.591) 16.367 21.797 ( 0.452 -1.985 6.912) 7.206 21.902 ( -1.876 2.122 -0.572) 2.890 22.372 ( -1.360 0.254 1.259) 1.870 22.401 ( 1.477 0.226 -2.591) 2.991 22.852 ( 3.929 0.499 4.770) 6.200 23.021 ( 1.767 0.743 -5.105) 5.453 23.148 ( 3.387 6.655 2.084) 7.753 23.335 ( 8.560 15.267 -12.332) 21.411 ======================= Grid point 138 (48/102) ======================= q-point: ( 0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.621 ( 11.872 0.000 16.075) 19.984 0.721 ( -2.217 -0.000 24.871) 24.969 0.876 ( 9.914 0.000 -16.185) 18.980 0.972 ( 15.165 0.000 -11.090) 18.787 1.018 ( 35.829 0.000 14.156) 38.525 1.584 ( 20.716 0.000 -22.230) 30.387 2.003 ( 0.036 0.000 -8.933) 8.933 2.141 ( 8.522 0.000 11.713) 14.485 2.379 ( 5.214 0.000 3.742) 6.417 2.506 ( 9.731 0.000 -2.924) 10.160 2.827 ( 2.862 0.000 7.452) 7.982 2.862 ( -6.921 -0.000 6.069) 9.205 2.948 ( -2.408 -0.000 0.004) 2.408 3.038 ( -10.794 -0.000 -0.929) 10.834 3.228 ( 6.565 0.000 4.929) 8.210 3.310 ( -4.453 -0.000 -0.931) 4.549 3.434 ( -2.244 -0.000 -1.579) 2.744 3.487 ( 3.147 0.000 -3.633) 4.806 3.543 ( 3.602 0.000 4.007) 5.388 3.561 ( 3.992 0.000 -8.395) 9.296 3.715 ( 0.212 0.000 4.272) 4.277 3.882 ( -6.524 -0.000 0.738) 6.565 3.942 ( -1.283 -0.000 1.756) 2.175 3.969 ( 2.269 0.000 -3.823) 4.446 4.286 ( 1.981 0.000 2.263) 3.008 4.478 ( 15.542 0.000 -12.341) 19.846 4.616 ( -9.320 -0.000 7.820) 12.166 4.618 ( -9.820 -0.000 4.369) 10.748 4.767 ( -4.880 -0.000 -2.635) 5.546 4.827 ( 7.259 0.000 2.176) 7.578 4.863 ( -1.558 -0.000 -1.979) 2.519 4.879 ( -5.768 -0.000 3.913) 6.970 5.061 ( -1.012 -0.000 2.411) 2.615 5.144 ( -0.892 -0.000 0.991) 1.333 5.166 ( 0.078 0.000 -0.010) 0.079 5.306 ( -3.612 -0.000 -0.768) 3.693 5.413 ( -13.165 -0.000 4.566) 13.934 5.531 ( -10.627 -0.000 -1.725) 10.766 5.745 ( -0.356 -0.000 5.168) 5.181 5.759 ( 16.941 0.000 -11.617) 20.542 5.959 ( -2.942 -0.000 -3.328) 4.442 5.992 ( 3.971 0.000 4.118) 5.720 6.382 ( 12.385 0.000 -1.625) 12.491 6.386 ( 7.633 0.000 -2.546) 8.046 6.683 ( -5.226 -0.000 0.717) 5.275 6.726 ( 1.176 0.000 2.238) 2.528 6.924 ( 5.782 0.000 -6.484) 8.688 7.016 ( 16.805 0.000 -2.389) 16.973 7.268 ( 3.295 0.000 10.983) 11.467 7.532 ( 20.796 0.000 -11.821) 23.921 7.743 ( 5.175 0.000 3.213) 6.091 7.948 ( 4.954 0.000 -4.719) 6.842 8.382 ( -5.082 -0.000 1.126) 5.205 8.588 ( -3.412 -0.000 4.555) 5.691 8.639 ( 7.709 0.000 -11.756) 14.058 8.972 ( 1.384 0.000 0.849) 1.623 9.021 ( -4.351 -0.000 -5.306) 6.862 9.120 ( 6.668 0.000 -3.380) 7.476 9.409 ( 13.040 0.000 -6.714) 14.667 9.596 ( 9.010 0.000 -8.614) 12.465 9.611 ( -32.577 -0.000 27.320) 42.516 10.006 ( 0.087 0.000 12.449) 12.450 10.478 ( -3.992 -0.000 -4.692) 6.161 10.638 ( -7.942 -0.000 1.176) 8.028 10.714 ( -11.531 -0.000 3.345) 12.006 10.750 ( -4.290 -0.000 1.324) 4.489 10.958 ( -0.502 -0.000 3.976) 4.008 10.996 ( 5.659 0.000 -1.075) 5.760 11.028 ( 3.822 0.000 1.778) 4.215 11.346 ( 4.563 0.000 3.769) 5.918 11.450 ( 7.792 0.000 2.856) 8.299 11.698 ( 20.074 0.000 8.799) 21.918 12.332 ( -4.461 -0.000 1.508) 4.709 12.381 ( -6.851 -0.000 -2.356) 7.245 12.541 ( 15.446 0.000 -0.539) 15.456 12.821 ( 11.528 0.000 -8.423) 14.277 13.046 ( -1.181 -0.000 -0.246) 1.206 13.103 ( 4.770 0.000 -1.053) 4.885 13.945 ( -2.637 -0.000 -0.191) 2.644 13.950 ( -1.500 -0.000 -0.123) 1.506 15.865 ( -2.414 -0.000 5.896) 6.371 16.531 ( 12.581 0.000 17.917) 21.893 17.320 ( -2.503 -0.000 -1.068) 2.721 17.462 ( 1.543 0.000 -2.736) 3.141 17.909 ( 10.167 0.000 -2.680) 10.514 18.037 ( 15.736 0.000 -7.224) 17.315 19.331 ( -16.113 -0.000 -3.035) 16.397 19.413 ( -19.156 -0.000 -0.721) 19.169 19.720 ( 4.494 0.000 -0.535) 4.525 20.022 ( 8.385 0.000 -1.605) 8.537 20.160 ( 26.892 0.000 -12.190) 29.526 20.251 ( 11.587 0.000 5.959) 13.030 20.643 ( 1.448 0.000 0.923) 1.717 20.690 ( 6.913 0.000 -1.223) 7.021 21.882 ( 0.681 0.000 0.776) 1.032 21.900 ( 2.732 0.000 -0.705) 2.822 22.365 ( 0.486 0.000 1.478) 1.556 22.413 ( 1.146 0.000 -1.928) 2.243 22.670 ( -24.345 -0.000 12.747) 27.480 22.912 ( -5.260 -0.000 2.489) 5.820 23.047 ( -2.603 -0.000 0.563) 2.664 23.079 ( -3.085 -0.000 -0.761) 3.177 ======================= Grid point 139 (49/102) ======================= q-point: ( 0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.729 ( 14.283 -4.688 9.724) 17.903 0.996 ( 15.652 -5.754 -9.533) 19.209 1.063 ( 4.885 -19.377 11.602) 23.108 1.160 ( 15.341 -8.535 -9.992) 20.200 1.429 ( 33.003 -11.865 9.251) 36.270 1.723 ( 18.185 -3.554 -8.765) 20.497 2.033 ( 8.932 -1.093 -8.527) 12.397 2.254 ( 8.872 -3.212 6.336) 11.366 2.470 ( 6.372 -3.986 1.282) 7.625 2.584 ( -0.711 0.775 1.835) 2.115 2.727 ( 2.381 1.010 0.276) 2.602 2.897 ( -2.447 0.610 3.112) 4.006 2.948 ( 3.008 -2.626 -0.339) 4.007 2.975 ( -3.539 0.136 -0.795) 3.630 3.247 ( -5.024 1.067 -0.964) 5.225 3.288 ( 4.896 0.482 -0.766) 4.979 3.429 ( -2.289 0.094 1.982) 3.030 3.479 ( -1.342 -0.255 -0.563) 1.478 3.571 ( 2.968 -1.898 -4.879) 6.018 3.629 ( -0.220 0.097 2.911) 2.920 3.740 ( -0.270 -0.978 0.229) 1.040 3.833 ( -6.452 0.232 0.043) 6.456 3.933 ( -0.529 -1.944 -0.321) 2.040 3.962 ( -1.872 1.747 -1.559) 2.998 4.275 ( -0.323 3.258 1.020) 3.429 4.426 ( 1.450 6.898 -3.486) 7.864 4.552 ( -3.768 1.121 4.187) 5.743 4.588 ( -2.071 2.325 -0.138) 3.117 4.689 ( -5.685 1.670 -0.164) 5.927 4.740 ( -10.213 4.631 4.323) 12.018 4.872 ( 6.423 3.069 0.487) 7.135 4.918 ( 5.587 -2.797 -3.545) 7.184 5.065 ( -3.925 -0.259 -1.704) 4.287 5.179 ( 2.878 -1.965 -1.837) 3.939 5.240 ( -0.066 -5.645 2.513) 6.180 5.290 ( -6.352 -3.123 0.414) 7.090 5.341 ( -10.537 -0.884 3.786) 11.232 5.451 ( -9.434 -0.230 -0.794) 9.470 5.724 ( -5.751 -0.433 4.160) 7.111 5.826 ( 9.273 3.276 -6.198) 11.625 5.948 ( -1.712 -3.187 -3.513) 5.042 6.058 ( 4.299 -2.983 2.695) 5.886 6.320 ( 5.553 5.578 2.765) 8.343 6.484 ( -0.122 -1.101 -5.671) 5.779 6.597 ( 5.826 5.933 0.668) 8.342 6.775 ( 3.564 -1.578 3.228) 5.060 6.997 ( 5.700 -2.345 -4.129) 7.419 7.203 ( 15.731 -4.996 -5.345) 17.349 7.336 ( 0.415 -2.686 9.252) 9.642 7.596 ( 17.129 4.968 -11.150) 21.033 7.829 ( 10.000 -2.290 1.435) 10.359 7.973 ( 3.945 0.012 -3.132) 5.037 8.312 ( -4.531 2.952 1.618) 5.645 8.503 ( 3.595 9.021 -3.760) 10.413 8.577 ( -3.697 6.738 1.474) 7.825 8.871 ( -10.201 5.592 0.623) 11.650 9.060 ( 0.008 -4.079 0.382) 4.097 9.141 ( 7.343 1.074 -9.112) 11.751 9.346 ( -0.345 4.878 13.225) 14.100 9.544 ( 1.064 0.012 8.304) 8.372 9.691 ( 9.607 -1.735 -7.498) 12.309 9.952 ( 1.411 8.584 8.163) 11.930 10.395 ( 0.730 5.313 -5.637) 7.780 10.518 ( -7.410 3.145 2.005) 8.296 10.689 ( -12.705 -2.554 -2.312) 13.164 10.737 ( -2.418 0.869 2.290) 3.441 10.898 ( 3.382 4.747 -0.105) 5.830 10.991 ( 1.577 -1.428 4.488) 4.967 11.207 ( 3.927 -7.332 -0.238) 8.321 11.427 ( 6.235 -2.062 -0.377) 6.578 11.502 ( 8.082 0.774 3.752) 8.944 11.799 ( 6.245 1.930 5.233) 8.373 12.280 ( -5.724 2.303 -1.757) 6.415 12.317 ( -5.468 -0.770 -0.850) 5.587 12.621 ( 18.477 7.009 1.521) 19.820 12.759 ( 12.470 10.356 -2.954) 16.476 13.040 ( -1.220 0.283 0.265) 1.280 13.096 ( 2.276 2.940 -0.362) 3.735 13.919 ( -3.250 1.241 -0.437) 3.507 13.941 ( -3.985 0.366 -1.307) 4.210 15.883 ( 2.239 -0.317 2.106) 3.090 16.476 ( 2.001 12.626 9.279) 15.797 17.335 ( -2.235 -3.230 -0.740) 3.997 17.537 ( 3.556 -5.238 -0.345) 6.341 17.747 ( 8.103 7.180 -1.577) 10.941 18.423 ( 15.129 -10.406 -0.704) 18.376 19.119 ( -11.982 4.897 -1.132) 12.994 19.427 ( -12.300 -5.083 -0.478) 13.318 19.652 ( 3.251 9.745 -1.400) 10.368 19.835 ( 12.332 24.221 -2.772) 27.321 20.010 ( 1.635 3.134 -2.860) 4.547 20.462 ( -3.708 11.642 0.302) 12.222 20.779 ( 18.166 -18.381 -1.033) 25.864 20.850 ( 9.757 -5.923 0.968) 11.455 21.870 ( 0.703 -0.713 -0.383) 1.072 21.927 ( 4.467 -0.579 2.458) 5.131 22.352 ( -0.510 1.874 0.414) 1.986 22.427 ( 1.293 -1.438 -1.838) 2.668 22.728 ( -14.713 -11.666 3.759) 19.149 22.903 ( -6.525 -3.550 -0.291) 7.434 23.069 ( -7.736 -6.333 0.926) 10.040 23.135 ( -6.213 -8.316 0.733) 10.407 ======================= Grid point 140 (50/102) ======================= q-point: ( 0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( 16.130 -10.802 0.730) 19.426 1.156 ( 13.896 -3.122 -8.259) 16.464 1.380 ( 12.719 -8.589 -9.327) 17.959 1.513 ( 5.988 -19.610 14.073) 24.869 1.880 ( 15.032 -12.342 4.560) 19.977 1.958 ( 17.418 -7.702 3.912) 19.442 2.101 ( 7.752 -3.023 -4.667) 9.541 2.352 ( 1.089 0.045 7.161) 7.243 2.556 ( 5.114 -3.834 -0.743) 6.435 2.607 ( 7.680 -5.967 -8.186) 12.712 2.820 ( 2.926 4.874 -5.638) 8.007 2.880 ( 7.300 -6.450 -2.715) 10.112 2.968 ( -4.215 -1.200 3.904) 5.870 3.053 ( 0.885 -5.865 1.918) 6.234 3.208 ( -0.976 2.468 -0.188) 2.661 3.264 ( -4.362 -0.351 0.930) 4.474 3.391 ( -0.504 2.513 0.824) 2.692 3.486 ( -4.926 2.065 2.907) 6.081 3.566 ( -3.575 -0.399 -0.218) 3.604 3.591 ( 4.044 2.523 -2.211) 5.255 3.737 ( -1.821 -0.779 -1.043) 2.239 3.812 ( -3.098 -1.383 -1.778) 3.831 3.874 ( -3.861 4.460 -0.326) 5.908 3.979 ( -2.792 -2.656 -0.287) 3.864 4.165 ( -4.393 4.463 0.126) 6.264 4.321 ( -1.350 5.019 1.246) 5.344 4.455 ( -1.845 8.975 1.172) 9.237 4.555 ( -2.028 -1.438 -0.309) 2.506 4.641 ( -2.220 0.560 0.849) 2.442 4.693 ( -2.321 -3.434 3.069) 5.158 4.860 ( 5.064 2.627 1.219) 5.834 4.934 ( -1.784 2.668 -3.682) 4.885 5.042 ( -2.059 -1.517 -4.921) 5.545 5.196 ( -3.602 1.015 2.147) 4.315 5.239 ( -5.486 0.650 3.402) 6.488 5.277 ( -4.052 -1.339 -0.448) 4.291 5.407 ( -3.212 -4.955 -0.559) 5.932 5.446 ( -1.120 -6.410 1.095) 6.599 5.688 ( -8.496 -0.546 3.503) 9.206 5.812 ( 4.789 1.754 -2.568) 5.710 6.007 ( -0.700 -3.878 -2.320) 4.573 6.173 ( 5.723 -5.027 0.742) 7.653 6.307 ( 6.686 1.628 2.944) 7.484 6.408 ( -7.133 2.323 -3.537) 8.294 6.603 ( 14.081 3.999 -0.817) 14.660 6.846 ( 5.328 -1.839 2.669) 6.236 7.048 ( 2.213 -0.895 -1.566) 2.855 7.336 ( 13.547 1.883 -0.108) 13.678 7.401 ( -1.211 -3.583 0.114) 3.784 7.549 ( 13.893 10.890 -8.313) 19.512 7.948 ( 5.902 -1.640 1.125) 6.228 7.997 ( 2.517 -1.216 -0.401) 2.824 8.242 ( 1.277 3.098 0.198) 3.357 8.350 ( 6.295 8.994 -3.118) 11.413 8.435 ( -7.569 4.468 5.297) 10.262 8.703 ( -9.162 5.061 -0.982) 10.513 9.066 ( -2.405 1.012 0.078) 2.610 9.182 ( 6.635 1.386 -5.279) 8.591 9.314 ( -6.659 0.644 11.568) 13.363 9.562 ( -0.444 0.394 9.528) 9.546 9.757 ( 8.315 1.952 -7.396) 11.299 9.780 ( 2.312 10.316 -0.871) 10.608 10.309 ( 2.903 3.806 -3.141) 5.725 10.458 ( -1.006 -0.259 0.873) 1.357 10.628 ( -8.283 -1.213 -4.011) 9.283 10.721 ( -1.736 -0.533 2.767) 3.310 10.870 ( 2.511 1.380 -0.249) 2.876 11.050 ( 2.144 -2.091 5.035) 5.858 11.322 ( 5.730 -1.788 0.488) 6.023 11.466 ( 8.588 2.883 -1.165) 9.134 11.571 ( 5.452 -0.883 1.799) 5.809 11.750 ( 0.896 6.383 -0.696) 6.483 12.217 ( -3.864 0.739 -0.724) 4.000 12.286 ( -3.986 0.199 -0.838) 4.078 12.582 ( 11.435 8.432 0.671) 14.223 12.683 ( 15.980 10.335 -0.315) 19.034 13.027 ( -1.573 -0.473 1.156) 2.009 13.063 ( -1.798 0.275 -0.705) 1.951 13.838 ( -4.144 6.184 0.366) 7.453 13.858 ( -5.640 2.555 -1.550) 6.383 15.903 ( 0.525 -0.243 1.399) 1.514 16.272 ( -1.263 9.923 0.985) 10.052 17.384 ( -3.660 -4.445 -0.705) 5.802 17.659 ( 4.176 -5.073 0.550) 6.593 17.787 ( 8.042 -3.032 -0.218) 8.597 18.564 ( 8.746 2.863 3.316) 9.782 18.941 ( -9.104 7.420 -1.830) 11.886 19.307 ( 5.144 13.335 1.477) 14.369 19.447 ( 2.702 13.664 -3.241) 14.301 19.594 ( 5.189 10.140 0.743) 11.415 19.995 ( -15.051 -6.922 -2.841) 16.808 20.202 ( -0.827 13.939 -0.360) 13.968 21.000 ( 13.990 -1.941 -0.300) 14.127 21.200 ( 9.512 -15.740 2.880) 18.615 21.896 ( 0.780 -1.850 -3.505) 4.040 22.027 ( 4.896 -4.901 3.456) 7.741 22.307 ( -1.985 2.062 0.699) 2.946 22.459 ( 1.747 -1.073 -3.709) 4.238 22.783 ( -7.985 -3.868 5.433) 10.404 22.926 ( -3.967 -3.319 -3.750) 6.388 23.137 ( -12.023 -8.737 0.522) 14.872 23.233 ( -7.668 -7.317 0.749) 10.625 ======================= Grid point 141 (51/102) ======================= q-point: ( 0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( 11.806 -6.901 -4.300) 14.335 1.363 ( 10.803 -9.862 1.000) 14.662 1.581 ( 7.019 -7.176 -1.788) 10.196 1.884 ( 6.561 -10.411 9.787) 15.723 2.031 ( 3.906 -4.424 0.119) 5.903 2.141 ( 2.984 -8.757 -1.504) 9.373 2.397 ( 9.365 -8.762 -2.726) 13.111 2.429 ( 9.217 -8.339 2.058) 12.599 2.597 ( 2.705 3.077 0.642) 4.148 2.710 ( 7.743 3.497 -3.137) 9.056 2.837 ( 3.795 -4.449 -3.938) 7.050 2.931 ( -6.331 -1.148 2.972) 7.087 2.998 ( 2.149 -0.570 -4.750) 5.245 3.140 ( -1.301 -0.484 -0.503) 1.476 3.157 ( 1.504 -3.430 2.824) 4.691 3.284 ( -3.229 -2.363 1.947) 4.449 3.350 ( -2.988 3.154 4.417) 6.196 3.379 ( -1.674 1.243 -2.116) 2.970 3.526 ( 2.604 4.105 -1.243) 5.017 3.618 ( -1.582 -1.779 0.089) 2.383 3.742 ( -1.555 -1.088 0.102) 1.901 3.766 ( -3.653 3.129 0.391) 4.826 3.814 ( -2.010 -1.401 -5.485) 6.007 3.966 ( -3.267 0.519 -0.604) 3.363 4.139 ( -2.881 -3.560 3.283) 5.634 4.218 ( -4.136 4.957 3.784) 7.483 4.299 ( -0.529 6.437 0.346) 6.468 4.550 ( -3.426 0.067 -0.760) 3.510 4.616 ( 1.630 1.945 -0.681) 2.628 4.761 ( 2.017 -1.661 -0.866) 2.753 4.858 ( -3.890 0.027 -3.822) 5.453 4.874 ( 1.569 -0.785 2.346) 2.929 5.032 ( -8.137 -2.153 0.254) 8.421 5.136 ( -4.459 1.732 0.618) 4.823 5.219 ( -1.811 -1.685 -0.503) 2.524 5.294 ( 1.371 -1.246 1.077) 2.143 5.458 ( 0.106 -2.899 -1.766) 3.396 5.575 ( -1.265 -6.200 0.891) 6.390 5.646 ( -4.034 -0.212 3.406) 5.284 5.829 ( 1.692 -1.045 -0.298) 2.011 6.030 ( -2.761 0.075 -1.709) 3.248 6.292 ( 0.141 -4.329 0.097) 4.333 6.322 ( 2.378 1.723 0.790) 3.041 6.406 ( 8.313 -4.437 0.023) 9.423 6.634 ( 13.563 3.612 -1.449) 14.111 6.917 ( 3.067 -1.551 2.809) 4.439 7.060 ( 0.517 0.564 0.071) 0.768 7.325 ( 14.014 12.329 -9.843) 21.102 7.405 ( -0.096 2.199 4.983) 5.448 7.458 ( 2.651 2.119 -1.544) 3.729 7.925 ( -3.487 2.999 0.713) 4.654 8.059 ( 2.611 -1.804 2.356) 3.953 8.220 ( 1.788 1.815 -4.066) 4.799 8.286 ( 14.765 7.338 -0.818) 16.508 8.321 ( -8.434 2.961 1.810) 9.120 8.578 ( -5.451 0.910 -1.109) 5.636 8.997 ( -4.367 4.588 1.988) 6.639 9.136 ( 0.345 4.649 0.045) 4.662 9.254 ( -10.084 1.768 6.168) 11.952 9.543 ( -4.252 3.807 -0.613) 5.740 9.597 ( 3.792 5.212 5.289) 8.338 9.807 ( 8.922 0.926 -8.043) 12.048 10.280 ( 2.314 1.826 0.271) 2.961 10.522 ( 3.359 -5.197 0.030) 6.188 10.608 ( -4.390 -2.672 -3.625) 6.290 10.743 ( -0.665 -2.334 1.811) 3.028 10.877 ( 2.066 -0.374 -0.557) 2.172 11.107 ( 1.219 -1.676 4.411) 4.874 11.365 ( 7.280 2.734 0.656) 7.804 11.461 ( 7.960 4.414 -0.281) 9.107 11.591 ( 4.947 3.316 -0.732) 6.001 11.613 ( 0.555 8.408 -1.240) 8.517 12.160 ( -4.462 2.252 -0.521) 5.025 12.256 ( -0.100 1.744 -0.339) 1.780 12.525 ( 6.795 5.184 0.943) 8.599 12.616 ( 10.546 7.683 -0.354) 13.053 13.053 ( -1.856 -3.136 0.156) 3.647 13.070 ( -0.265 -2.770 0.111) 2.785 13.663 ( -5.809 8.328 -0.465) 10.164 13.763 ( -4.999 3.642 -0.248) 6.189 15.905 ( -1.405 -0.181 1.043) 1.760 16.122 ( -2.489 5.479 -0.587) 6.046 17.432 ( -1.896 -3.466 -0.551) 3.989 17.778 ( 2.079 -5.028 1.121) 5.555 17.918 ( 6.111 -5.073 -0.923) 7.995 18.526 ( 3.754 6.097 3.366) 7.912 18.698 ( -2.065 13.439 -2.176) 13.770 19.151 ( 4.209 7.909 0.193) 8.961 19.247 ( 5.264 10.563 -0.908) 11.837 19.481 ( 2.239 6.413 0.841) 6.844 19.888 ( -7.295 9.524 -0.284) 12.000 20.067 ( -10.888 -4.109 -1.472) 11.731 21.119 ( 14.012 0.215 0.015) 14.014 21.504 ( 6.079 -11.306 2.359) 13.052 21.938 ( -0.128 -3.405 -2.938) 4.499 22.120 ( 1.984 0.219 1.498) 2.496 22.274 ( -1.517 -0.647 3.027) 3.447 22.471 ( 2.103 -0.314 -7.279) 7.583 22.803 ( -5.376 -2.537 8.831) 10.645 22.946 ( -2.667 -2.980 -5.104) 6.484 23.200 ( -9.801 -7.318 0.580) 12.246 23.279 ( -6.794 -3.926 -0.040) 7.847 ======================= Grid point 143 (52/102) ======================= q-point: ( 0.45 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( 7.158 -7.003 -1.262) 10.093 1.535 ( 0.989 -5.237 4.745) 7.136 1.777 ( 5.853 -8.670 -0.755) 10.488 2.013 ( 9.069 -2.570 -1.694) 9.577 2.236 ( -3.782 -8.160 2.858) 9.437 2.273 ( 9.243 -3.246 -5.993) 11.484 2.458 ( 1.469 5.366 1.844) 5.861 2.524 ( -1.496 -4.058 0.430) 4.346 2.644 ( -2.069 4.554 -2.068) 5.413 2.722 ( 8.940 -6.010 0.510) 10.785 2.863 ( -1.843 -1.443 1.394) 2.725 2.907 ( -2.903 0.169 -0.265) 2.920 3.002 ( 3.447 -0.132 -0.879) 3.560 3.165 ( 1.104 0.801 1.157) 1.788 3.240 ( -1.535 -2.446 1.435) 3.224 3.275 ( -0.553 2.018 0.480) 2.146 3.319 ( -0.584 -2.172 -0.756) 2.373 3.396 ( 1.046 -3.229 -0.811) 3.490 3.506 ( 1.414 0.403 0.287) 1.498 3.563 ( -1.858 4.075 -0.011) 4.479 3.709 ( -1.383 0.387 -1.589) 2.142 3.759 ( -0.004 0.753 -0.730) 1.049 3.833 ( -4.130 -4.455 -2.228) 6.470 3.936 ( -0.830 0.615 1.343) 1.695 4.109 ( -6.173 2.574 2.274) 7.064 4.208 ( -1.691 -3.938 3.041) 5.255 4.233 ( 1.990 1.808 -0.935) 2.847 4.490 ( -5.476 3.814 3.317) 7.452 4.607 ( 0.749 -1.657 -3.779) 4.194 4.788 ( -0.643 -1.759 -4.356) 4.742 4.857 ( -0.165 -0.458 -5.092) 5.115 4.884 ( -1.722 -0.868 3.797) 4.258 5.043 ( -3.553 -2.214 6.491) 7.724 5.093 ( -1.039 -0.621 -0.137) 1.218 5.252 ( 1.461 -0.956 -1.484) 2.291 5.346 ( -1.627 -5.146 -0.258) 5.404 5.494 ( 2.233 -0.591 -3.369) 4.085 5.568 ( -3.902 1.722 1.971) 4.699 5.723 ( 2.667 -4.792 1.973) 5.828 5.849 ( -0.118 0.728 1.772) 1.919 5.974 ( -2.665 1.673 -2.176) 3.825 6.312 ( 1.670 -0.342 -2.306) 2.868 6.389 ( 0.051 -3.934 4.925) 6.303 6.543 ( 8.649 -1.170 -0.952) 8.779 6.688 ( 11.737 -0.742 -2.535) 12.031 6.938 ( -1.695 1.922 4.353) 5.051 7.027 ( 1.623 4.108 0.243) 4.423 7.159 ( 3.993 8.335 -8.109) 12.295 7.349 ( -2.132 4.543 3.706) 6.238 7.440 ( -0.083 1.597 -0.967) 1.869 7.865 ( -4.452 -0.165 0.759) 4.519 8.094 ( -2.716 -0.470 3.852) 4.737 8.157 ( 0.701 3.910 -7.030) 8.075 8.203 ( -4.918 1.993 1.300) 5.463 8.280 ( 11.740 6.739 0.988) 13.573 8.606 ( 3.913 -3.989 -3.119) 6.400 8.840 ( -5.138 8.585 2.901) 10.417 9.076 ( -0.842 0.974 0.792) 1.512 9.143 ( -7.202 2.893 1.222) 7.857 9.470 ( -5.850 -1.047 1.315) 6.087 9.590 ( 5.228 2.831 5.640) 8.195 9.816 ( 7.393 3.024 -7.495) 10.954 10.275 ( 1.806 0.473 0.768) 2.018 10.628 ( -2.053 -2.562 -1.814) 3.751 10.657 ( 1.296 -6.505 0.209) 6.636 10.797 ( 0.509 -3.439 0.823) 3.573 10.907 ( 0.223 -1.747 -1.162) 2.110 11.150 ( -0.402 -1.774 2.664) 3.225 11.318 ( 2.684 6.296 -0.067) 6.844 11.418 ( 2.827 5.864 1.373) 6.653 11.463 ( 10.490 10.946 -2.457) 15.358 11.561 ( 3.481 2.982 -0.048) 4.584 12.083 ( -2.293 2.954 -1.018) 3.875 12.208 ( -0.629 3.052 0.931) 3.252 12.512 ( 4.269 1.366 0.799) 4.553 12.569 ( 4.409 3.778 -0.528) 5.830 13.105 ( -1.535 -4.588 -0.809) 4.905 13.156 ( 2.916 -4.600 1.129) 5.562 13.472 ( -5.462 7.845 -0.536) 9.574 13.660 ( -4.668 3.420 -0.164) 5.789 15.898 ( -2.393 -0.504 0.881) 2.599 16.030 ( -2.404 2.788 -0.707) 3.749 17.478 ( 0.302 -2.490 -0.299) 2.526 17.866 ( -2.596 -4.672 2.049) 5.724 18.034 ( 3.980 -3.514 -2.763) 5.985 18.435 ( -5.116 6.217 2.558) 8.448 18.485 ( 10.092 9.886 -0.802) 14.151 19.052 ( 1.948 6.193 -4.743) 8.040 19.148 ( 5.690 5.818 4.747) 9.421 19.402 ( 1.777 4.096 -0.523) 4.496 19.678 ( -3.816 7.977 0.055) 8.843 20.067 ( -13.168 -5.716 -0.374) 14.360 21.197 ( 12.881 2.389 0.065) 13.101 21.711 ( 3.714 -7.570 1.120) 8.506 22.001 ( -1.337 -4.452 -1.221) 4.806 22.059 ( -1.978 4.768 -0.306) 5.171 22.298 ( -0.561 -0.315 4.756) 4.799 22.476 ( 2.338 -0.092 -8.212) 8.539 22.841 ( -2.688 -3.309 7.473) 8.603 22.972 ( -1.625 -2.391 -3.217) 4.325 23.258 ( -5.730 -5.551 0.173) 7.980 23.286 ( -4.676 -2.051 -0.452) 5.126 ======================= Grid point 144 (53/102) ======================= q-point: ( 0.55 0.09 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( -1.537 -2.374 6.089) 6.714 1.685 ( 2.243 -6.916 -1.922) 7.520 1.866 ( 3.641 2.854 -5.287) 7.026 2.116 ( -3.377 3.700 1.885) 5.353 2.208 ( 7.657 0.017 -2.515) 8.060 2.314 ( 0.096 1.797 1.091) 2.105 2.387 ( 1.641 7.766 -2.117) 8.215 2.583 ( -5.993 -4.861 4.770) 9.071 2.606 ( 1.828 -3.073 -3.260) 4.839 2.773 ( -4.772 -0.772 3.439) 5.932 2.912 ( -1.311 -4.739 -2.286) 5.422 2.992 ( 6.686 -4.669 -0.377) 8.164 3.010 ( 2.840 3.290 -0.558) 4.382 3.150 ( -0.278 1.278 -0.395) 1.366 3.169 ( -0.231 6.755 0.626) 6.787 3.269 ( -2.079 2.343 3.693) 4.843 3.284 ( -0.808 -1.164 -0.233) 1.436 3.421 ( -3.435 -0.553 2.526) 4.300 3.548 ( 3.800 -3.113 -3.538) 6.054 3.591 ( 3.078 -4.308 -3.298) 6.238 3.685 ( -2.977 2.861 3.324) 5.300 3.714 ( -0.182 2.080 -2.467) 3.232 3.867 ( -0.062 -2.988 -1.443) 3.319 3.981 ( 1.323 -3.679 0.126) 3.912 4.048 ( -6.167 -0.386 1.110) 6.278 4.203 ( -2.478 2.250 0.700) 3.420 4.279 ( 2.970 -3.127 -3.966) 5.859 4.403 ( -5.612 0.837 6.579) 8.688 4.634 ( -1.993 -1.488 0.139) 2.491 4.789 ( -1.258 -0.117 -4.619) 4.788 4.832 ( -2.155 0.375 -0.993) 2.402 4.919 ( 0.924 -1.547 1.450) 2.312 5.065 ( 2.993 -1.067 0.833) 3.285 5.158 ( 3.024 -3.517 4.624) 6.549 5.241 ( -0.235 1.769 -2.058) 2.724 5.434 ( -1.071 -2.038 0.578) 2.374 5.496 ( -0.274 -1.565 -0.131) 1.594 5.534 ( 0.158 -0.690 -3.953) 4.016 5.782 ( -2.920 1.493 1.917) 3.798 5.840 ( 4.923 -1.053 0.843) 5.104 5.947 ( 0.559 0.848 -0.012) 1.016 6.317 ( 1.149 1.015 0.038) 1.534 6.438 ( -4.002 -2.135 -1.352) 4.733 6.558 ( 4.306 3.791 1.036) 5.830 6.753 ( -1.670 5.710 0.924) 6.020 6.829 ( 1.832 3.075 -0.878) 3.686 6.996 ( -0.344 0.088 -0.820) 0.893 7.067 ( 1.063 3.519 0.014) 3.677 7.283 ( -6.731 -1.578 1.599) 7.096 7.377 ( -2.133 4.222 -1.923) 5.106 7.854 ( -5.155 -1.904 -0.014) 5.495 8.051 ( -3.261 0.437 -1.742) 3.723 8.106 ( -5.426 -0.016 2.099) 5.818 8.148 ( 1.714 4.826 -4.760) 6.992 8.280 ( 8.150 -0.224 3.774) 8.984 8.575 ( -6.598 6.309 3.193) 9.671 8.835 ( 14.166 -4.943 -4.673) 15.714 9.074 ( -2.437 0.792 -0.155) 2.567 9.097 ( 1.728 -2.398 1.398) 3.269 9.473 ( -7.113 -3.189 6.360) 10.060 9.586 ( 5.745 3.036 1.529) 6.675 9.779 ( 4.545 4.149 -6.486) 8.941 10.294 ( 3.438 -0.152 -0.046) 3.441 10.649 ( -3.614 -2.324 0.307) 4.308 10.741 ( -2.429 -2.534 1.229) 3.719 10.871 ( 1.477 -3.024 0.494) 3.402 10.908 ( -1.870 1.301 -3.416) 4.106 11.158 ( -5.038 -0.328 1.391) 5.237 11.233 ( -0.778 3.828 2.665) 4.729 11.305 ( 5.674 5.904 -3.909) 9.073 11.403 ( 9.553 5.198 0.578) 10.891 11.536 ( 4.478 3.203 0.656) 5.544 12.033 ( -0.181 0.900 -1.219) 1.526 12.157 ( -2.348 1.515 1.731) 3.287 12.522 ( 2.608 0.866 -0.184) 2.755 12.540 ( 1.311 1.859 -0.046) 2.275 13.178 ( -0.664 -3.602 -0.610) 3.713 13.252 ( 2.872 -1.008 1.480) 3.385 13.322 ( -3.148 2.695 -0.553) 4.181 13.594 ( -3.084 -0.243 -0.600) 3.152 15.897 ( -2.755 -1.345 1.363) 3.355 15.981 ( -1.385 0.960 -1.225) 2.083 17.523 ( 2.522 -1.384 -0.120) 2.879 17.928 ( -6.666 -5.903 2.688) 9.300 18.075 ( 2.341 0.478 -4.726) 5.296 18.281 ( 1.952 8.725 0.816) 8.978 18.468 ( 4.272 0.304 2.800) 5.117 18.930 ( -0.180 6.395 -4.503) 7.824 19.126 ( 3.490 2.094 3.663) 5.476 19.348 ( 1.385 3.407 -0.506) 3.713 19.585 ( -1.033 -0.295 -0.100) 1.079 20.079 ( -11.322 -5.950 0.069) 12.791 21.222 ( 11.193 4.749 0.135) 12.159 21.812 ( -1.466 -0.263 0.202) 1.503 21.977 ( -0.120 0.251 -0.737) 0.787 22.069 ( -1.639 -3.993 0.070) 4.317 22.291 ( -0.284 1.237 3.247) 3.486 22.462 ( 0.843 1.439 -5.206) 5.466 22.910 ( 0.116 -3.664 2.428) 4.397 22.982 ( -1.219 -0.146 0.816) 1.474 23.293 ( -2.278 -2.032 0.025) 3.052 23.319 ( -0.888 -4.248 -1.058) 4.467 ======================= Grid point 145 (54/102) ======================= q-point: (-0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -5.122 0.312 7.984) 9.490 1.693 ( 0.901 13.302 -0.672) 13.349 1.767 ( -1.143 1.926 -5.110) 5.579 1.917 ( -2.743 9.416 -2.723) 10.179 2.186 ( -3.360 6.929 2.057) 7.971 2.276 ( 0.417 4.455 -6.014) 7.496 2.335 ( 2.739 -2.163 2.375) 4.222 2.604 ( -6.760 0.875 1.048) 6.897 2.664 ( 2.101 -2.196 -2.729) 4.085 2.754 ( -7.503 1.955 3.551) 8.529 2.852 ( -0.400 6.935 4.755) 8.418 2.981 ( -0.370 4.277 1.821) 4.663 3.032 ( 6.416 -4.149 -4.836) 9.042 3.141 ( 2.784 0.239 -3.382) 4.387 3.186 ( -0.037 -4.309 0.228) 4.315 3.285 ( 1.487 -2.827 -0.352) 3.213 3.312 ( -1.581 -2.351 3.028) 4.147 3.415 ( -2.646 0.634 1.453) 3.085 3.549 ( 0.514 5.437 0.393) 5.475 3.609 ( 2.445 -0.033 -3.023) 3.889 3.693 ( -0.376 -3.164 1.601) 3.566 3.710 ( 4.302 -1.666 -1.739) 4.931 3.914 ( -1.579 -0.410 1.028) 1.928 3.996 ( 3.235 0.397 -0.854) 3.369 4.079 ( -3.524 -3.861 -1.240) 5.373 4.132 ( -5.217 0.616 0.969) 5.342 4.333 ( 2.735 -1.358 -5.084) 5.930 4.413 ( -3.525 -3.663 4.068) 6.511 4.625 ( -1.227 1.643 4.515) 4.959 4.764 ( 0.786 1.238 -3.764) 4.040 4.819 ( -2.744 -1.107 -0.222) 2.968 4.944 ( 0.256 0.160 2.805) 2.821 5.130 ( 4.721 -2.542 -1.744) 5.639 5.199 ( -0.138 1.023 -1.669) 1.962 5.254 ( 5.221 -1.779 3.648) 6.613 5.394 ( 0.641 2.905 0.089) 2.976 5.522 ( 0.357 -0.298 -1.951) 2.006 5.601 ( 0.751 -4.653 -2.945) 5.558 5.712 ( -2.468 3.674 1.500) 4.673 5.858 ( -2.834 0.960 -2.493) 3.894 5.975 ( 5.048 -1.146 5.933) 7.873 6.284 ( -2.036 2.589 0.569) 3.343 6.392 ( -3.100 3.261 -4.306) 6.228 6.476 ( -4.053 5.871 4.249) 8.304 6.603 ( -1.068 5.310 -4.858) 7.276 6.765 ( -8.248 1.270 2.430) 8.692 6.988 ( -3.706 1.136 3.177) 5.012 7.076 ( 3.693 -1.646 -3.081) 5.083 7.267 ( -6.443 1.743 -0.909) 6.736 7.309 ( -4.851 -3.989 0.289) 6.287 7.851 ( -5.448 -2.144 0.182) 5.857 8.015 ( -3.649 1.430 -3.626) 5.339 8.074 ( -4.730 -1.800 3.321) 6.053 8.111 ( 4.940 0.725 -5.370) 7.333 8.370 ( 0.929 -2.526 9.349) 9.728 8.490 ( 2.468 -0.040 -3.995) 4.696 8.999 ( 5.424 -3.059 2.273) 6.629 9.087 ( 5.864 -1.645 -5.368) 8.118 9.190 ( 6.679 -4.054 3.262) 8.467 9.494 ( -6.621 -2.751 9.040) 11.538 9.581 ( 4.187 1.444 -1.506) 4.678 9.725 ( 2.673 2.323 -7.784) 8.552 10.316 ( 4.410 1.540 0.519) 4.700 10.652 ( -3.044 0.851 3.182) 4.485 10.703 ( -5.965 2.039 -2.000) 6.613 10.826 ( -1.505 3.889 -4.438) 6.090 10.921 ( -0.749 -2.053 2.781) 3.537 11.080 ( -3.898 4.256 0.183) 5.774 11.215 ( -3.205 -2.962 1.225) 4.533 11.280 ( 2.020 1.645 -1.898) 3.223 11.416 ( 7.423 0.754 1.163) 7.551 11.539 ( 4.716 -0.219 -0.255) 4.728 12.050 ( 1.365 -2.584 -1.205) 3.161 12.131 ( -3.453 -0.621 1.796) 3.941 12.507 ( -0.001 1.927 0.633) 2.028 12.522 ( 1.175 1.286 -0.969) 1.993 13.167 ( -1.123 4.167 1.350) 4.522 13.195 ( -0.806 2.246 -2.154) 3.215 13.411 ( 2.333 -7.399 2.274) 8.084 13.634 ( -0.378 -5.319 -1.669) 5.587 15.909 ( -3.589 -1.968 2.794) 4.956 15.967 ( 0.041 -0.442 -2.635) 2.672 17.567 ( 5.460 -0.346 -0.156) 5.473 17.993 ( -10.704 -7.936 2.228) 13.510 18.046 ( 2.952 4.065 -3.630) 6.198 18.140 ( 1.515 9.098 0.914) 9.268 18.525 ( 4.608 -2.633 1.853) 5.621 18.844 ( -4.392 -0.500 -1.486) 4.664 19.124 ( 2.413 1.182 -0.169) 2.693 19.310 ( -2.146 -0.054 0.393) 2.182 19.662 ( 5.170 -5.865 0.077) 7.819 20.114 ( -9.395 -6.552 -0.096) 11.455 21.196 ( 10.008 6.955 0.229) 12.189 21.701 ( -7.383 6.494 -0.228) 9.836 22.043 ( 2.533 -3.978 -0.703) 4.768 22.104 ( -0.852 -0.295 0.484) 1.024 22.275 ( -1.440 0.625 4.393) 4.665 22.427 ( 1.367 1.411 -6.373) 6.669 22.931 ( -1.879 1.834 5.102) 5.738 23.003 ( 2.287 -2.380 -2.400) 4.081 23.322 ( -0.000 -1.572 2.193) 2.699 23.393 ( 2.940 -3.546 -2.712) 5.345 ======================= Grid point 146 (55/102) ======================= q-point: (-0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -4.101 18.070 2.373) 18.681 1.422 ( -4.769 14.206 2.484) 15.190 1.630 ( -2.877 11.098 -0.963) 11.505 1.815 ( -3.904 0.221 -1.473) 4.178 2.037 ( -2.554 8.182 0.525) 8.587 2.219 ( 1.142 2.692 -6.582) 7.202 2.330 ( -2.017 3.233 0.306) 3.823 2.398 ( -7.701 9.538 1.157) 12.313 2.622 ( -3.334 8.777 9.229) 13.165 2.698 ( 1.817 2.093 -4.233) 5.060 2.810 ( -2.616 0.315 1.008) 2.821 2.930 ( -1.924 2.578 -1.809) 3.691 3.075 ( 4.108 3.846 -0.457) 5.646 3.141 ( -1.565 -0.904 -2.528) 3.108 3.249 ( 1.012 -1.706 0.944) 2.196 3.312 ( 0.064 -0.552 -0.381) 0.674 3.375 ( -0.455 -4.003 -0.253) 4.037 3.383 ( -0.536 0.176 0.295) 0.636 3.505 ( 6.212 0.882 -0.100) 6.275 3.622 ( 1.990 0.339 -2.164) 2.959 3.754 ( 1.500 -1.571 0.906) 2.354 3.788 ( 2.133 -4.826 -1.470) 5.477 3.908 ( 2.310 0.567 2.129) 3.192 3.996 ( 1.006 1.145 2.659) 3.065 4.099 ( -2.553 -2.521 0.456) 3.617 4.145 ( -3.383 -4.082 1.120) 5.419 4.366 ( 3.119 -1.531 -4.924) 6.027 4.466 ( -5.891 -4.971 -0.117) 7.709 4.587 ( -0.474 2.407 5.754) 6.255 4.753 ( 3.905 0.851 -3.625) 5.396 4.823 ( -2.407 -1.273 -1.030) 2.911 4.908 ( -2.501 3.355 1.869) 4.583 5.196 ( 2.134 -1.809 0.534) 2.848 5.207 ( 6.967 0.575 -1.117) 7.079 5.319 ( 4.902 -0.770 0.745) 5.018 5.380 ( -0.023 -1.301 -0.925) 1.596 5.517 ( 4.458 2.587 -3.651) 6.317 5.607 ( -6.515 5.347 2.541) 8.803 5.645 ( -0.438 -1.533 -0.580) 1.697 5.802 ( -6.610 0.073 -2.247) 6.982 6.032 ( 1.536 0.431 6.804) 6.988 6.197 ( -3.554 3.913 0.001) 5.286 6.304 ( -1.113 3.551 -0.068) 3.722 6.400 ( -0.818 0.860 3.880) 4.057 6.469 ( -0.744 6.053 -5.623) 8.295 6.766 ( -10.343 -7.817 -2.685) 13.240 6.925 ( -6.592 1.768 5.704) 8.894 7.046 ( 0.493 4.864 -6.521) 8.150 7.270 ( -5.365 -5.758 2.552) 8.273 7.351 ( -2.958 -3.782 -1.239) 4.959 7.851 ( -6.266 -2.173 2.905) 7.240 7.972 ( -1.224 -0.008 -5.369) 5.507 8.093 ( 1.663 -1.641 -0.700) 2.439 8.141 ( -0.030 -1.308 -1.188) 1.767 8.435 ( -2.816 -4.682 9.817) 11.235 8.558 ( 6.061 -3.550 -6.378) 9.488 9.059 ( 0.284 -1.483 5.006) 5.229 9.147 ( 5.749 -0.312 -4.699) 7.432 9.332 ( 8.551 -3.674 4.622) 10.391 9.500 ( -5.468 -0.561 7.281) 9.123 9.586 ( 1.245 -0.139 -1.153) 1.703 9.733 ( 2.647 -3.080 -9.971) 10.766 10.293 ( 3.660 4.394 1.766) 5.985 10.516 ( -6.242 7.493 -0.200) 9.755 10.676 ( -2.006 -0.469 0.718) 2.182 10.769 ( 0.060 0.753 -4.353) 4.418 10.938 ( 0.193 0.659 1.581) 1.723 11.010 ( -4.506 -0.943 1.874) 4.970 11.250 ( -3.606 -1.019 1.656) 4.097 11.260 ( -0.975 -1.597 -1.608) 2.467 11.472 ( 5.626 -0.794 0.236) 5.687 11.590 ( 1.719 -1.788 -0.340) 2.504 12.129 ( -1.735 -4.694 0.012) 5.005 12.144 ( 0.079 -3.741 -0.178) 3.746 12.466 ( -1.306 2.243 1.955) 3.250 12.501 ( 1.061 1.641 -1.800) 2.656 13.098 ( -0.601 2.819 1.631) 3.312 13.143 ( 0.384 2.549 -2.224) 3.405 13.580 ( 1.709 -8.678 3.407) 9.478 13.743 ( 1.029 -6.608 -2.947) 7.308 15.921 ( -5.017 -1.965 4.533) 7.042 15.981 ( 1.147 -1.289 -4.336) 4.667 17.619 ( 9.245 0.711 0.287) 9.277 17.942 ( 1.681 8.474 -1.979) 8.863 17.981 ( 0.206 9.068 0.743) 9.101 18.058 ( -14.751 -8.926 1.020) 17.271 18.666 ( 7.679 -8.225 -0.425) 11.261 18.884 ( -7.032 -8.264 1.524) 10.957 19.123 ( 2.697 0.458 -1.211) 2.992 19.323 ( -4.702 -3.994 -0.420) 6.184 19.852 ( 8.881 -9.089 0.568) 12.721 20.170 ( -7.672 -6.779 -0.527) 10.251 21.125 ( 9.856 9.225 0.293) 13.503 21.497 ( -10.824 8.793 -0.132) 13.946 22.063 ( 1.361 4.590 -0.274) 4.796 22.095 ( -0.335 0.385 0.457) 0.685 22.273 ( -2.704 -1.487 5.949) 6.701 22.420 ( 3.294 -0.382 -9.300) 9.874 22.889 ( -1.870 2.290 8.515) 9.014 23.048 ( 3.013 -1.073 -5.833) 6.652 23.350 ( 1.289 -0.009 4.427) 4.610 23.471 ( 4.892 -2.414 -4.058) 6.799 ======================= Grid point 147 (56/102) ======================= q-point: (-0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.048 ( -1.612 16.952 -0.631) 17.040 1.097 ( -4.996 14.751 0.259) 15.576 1.376 ( 2.750 16.802 0.381) 17.030 1.677 ( -10.855 8.739 -10.495) 17.446 1.889 ( -3.393 9.501 9.822) 14.080 2.051 ( -2.591 14.312 -1.432) 14.615 2.143 ( -0.327 9.256 8.412) 12.512 2.280 ( -8.224 11.640 5.984) 15.457 2.526 ( 2.606 -6.392 -3.394) 7.692 2.635 ( 3.670 4.022 -6.555) 8.521 2.770 ( 1.257 4.277 -5.580) 7.142 2.807 ( -4.346 7.444 -3.439) 9.281 3.033 ( -4.318 2.962 4.843) 7.133 3.061 ( 0.314 4.098 0.604) 4.154 3.338 ( 2.927 -3.302 -2.149) 4.908 3.353 ( -0.418 -2.968 1.714) 3.453 3.370 ( 2.320 2.028 0.264) 3.093 3.403 ( -0.890 -0.568 0.951) 1.421 3.548 ( -0.944 -1.692 2.038) 2.812 3.646 ( 3.212 -2.679 -6.266) 7.534 3.789 ( 1.946 -0.385 0.225) 1.996 3.843 ( -0.354 -1.044 -1.861) 2.163 3.960 ( 6.694 -2.228 0.861) 7.108 4.020 ( -1.891 -2.975 2.578) 4.367 4.123 ( 4.207 -0.344 1.948) 4.649 4.241 ( -5.638 -8.004 2.070) 10.007 4.384 ( 5.465 2.500 -1.733) 6.254 4.501 ( -9.539 -6.307 0.403) 11.443 4.596 ( 1.714 -1.992 4.239) 4.987 4.748 ( -1.470 1.554 0.006) 2.139 4.816 ( 0.064 0.343 -2.266) 2.293 4.856 ( 0.382 -0.846 -4.214) 4.315 5.210 ( 8.908 4.351 -0.738) 9.941 5.272 ( 3.374 -2.381 2.261) 4.708 5.351 ( -9.229 5.035 3.105) 10.962 5.381 ( 5.119 -2.464 -2.852) 6.356 5.467 ( 0.747 -0.305 -0.649) 1.036 5.525 ( -1.911 -0.024 -2.645) 3.263 5.684 ( -0.497 -2.641 1.027) 2.877 5.736 ( -2.662 3.071 -0.463) 4.090 6.002 ( -1.458 3.253 3.093) 4.720 6.111 ( -1.948 3.645 -0.625) 4.180 6.250 ( 0.102 2.528 2.379) 3.473 6.338 ( -6.640 1.230 -0.094) 6.754 6.493 ( 10.423 -2.274 0.085) 10.669 6.807 ( -11.356 -5.086 -6.887) 14.222 6.874 ( -6.895 -0.444 7.180) 9.965 6.975 ( 2.199 0.923 -5.239) 5.757 7.324 ( -6.299 -3.491 3.928) 8.203 7.395 ( 0.604 -2.462 -4.426) 5.100 7.835 ( -5.306 0.327 4.474) 6.948 7.966 ( 0.967 -0.297 -7.549) 7.617 8.140 ( -1.997 -1.072 2.287) 3.220 8.159 ( 3.077 -3.401 -2.244) 5.106 8.546 ( -3.614 -7.549 8.427) 11.878 8.667 ( 4.806 -5.937 -5.263) 9.276 9.078 ( -1.090 0.234 4.004) 4.156 9.147 ( 2.579 3.079 -1.849) 4.422 9.444 ( 2.445 0.145 6.849) 7.274 9.490 ( -0.088 -2.617 4.845) 5.507 9.593 ( -2.150 -0.657 -1.353) 2.624 9.782 ( -0.090 -2.005 -7.864) 8.116 10.271 ( 5.043 0.005 -0.136) 5.044 10.367 ( -6.049 2.554 -0.666) 6.600 10.672 ( 0.640 0.379 1.042) 1.280 10.750 ( -0.658 0.684 -3.404) 3.534 10.958 ( 5.929 -0.617 0.209) 5.965 11.031 ( -6.134 -3.995 2.799) 7.837 11.238 ( -2.221 -0.375 1.923) 2.962 11.282 ( -1.979 -1.716 -1.573) 3.056 11.510 ( 3.840 0.973 0.480) 3.990 11.608 ( -2.717 -0.699 -0.724) 2.897 12.186 ( -0.996 -4.447 1.156) 4.702 12.258 ( -0.310 -7.057 -2.388) 7.457 12.424 ( -1.054 1.690 2.502) 3.198 12.471 ( 0.770 1.998 -1.637) 2.695 13.065 ( -0.448 0.976 1.910) 2.191 13.108 ( 1.039 1.516 -1.938) 2.671 13.748 ( 0.349 -7.945 3.933) 8.872 13.863 ( 1.804 -6.329 -4.029) 7.717 15.925 ( -6.950 -2.203 6.089) 9.499 16.009 ( 2.841 -1.556 -5.584) 6.456 17.648 ( 7.900 5.498 3.185) 10.138 17.784 ( -1.041 8.766 0.305) 8.832 17.867 ( 7.898 4.354 -2.084) 9.256 18.080 ( -19.363 -7.061 -2.311) 20.739 18.911 ( 8.237 -11.686 -0.813) 14.320 19.025 ( -8.266 -13.008 0.934) 15.441 19.166 ( 5.394 -2.600 2.870) 6.640 19.376 ( -5.789 -6.670 -3.079) 9.354 20.101 ( 8.015 -10.564 1.397) 13.333 20.241 ( -3.890 -6.482 -1.466) 7.700 21.009 ( 9.586 12.292 0.811) 15.610 21.222 ( -13.521 11.791 -0.642) 17.952 21.969 ( 2.241 7.054 1.185) 7.496 22.034 ( -2.668 4.169 0.388) 4.965 22.314 ( -1.274 -2.841 3.509) 4.691 22.429 ( 2.808 0.195 -7.562) 8.069 22.869 ( -1.141 0.774 8.834) 8.941 23.057 ( 2.217 0.581 -6.907) 7.278 23.351 ( 1.539 2.568 6.082) 6.779 23.523 ( 4.276 -0.407 -6.332) 7.651 ======================= Grid point 148 (57/102) ======================= q-point: (-0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.717 ( -1.158 16.961 5.131) 17.758 0.933 ( 3.881 3.295 -13.220) 14.166 1.085 ( 8.137 20.318 7.976) 23.295 1.374 ( -7.194 12.862 -15.980) 21.739 1.576 ( -6.580 27.609 10.829) 30.378 1.686 ( 2.139 16.783 3.105) 17.202 2.065 ( 4.786 6.181 8.627) 11.642 2.106 ( -6.593 1.535 4.100) 7.914 2.575 ( 0.467 6.831 -5.434) 8.742 2.619 ( 1.423 3.442 -5.364) 6.530 2.651 ( -4.305 2.206 -0.407) 4.854 2.765 ( 8.170 -7.923 -7.703) 13.742 2.949 ( -3.416 2.215 5.389) 6.755 3.016 ( 1.001 3.430 0.498) 3.608 3.323 ( -7.645 0.181 2.748) 8.125 3.345 ( 2.369 2.216 2.098) 3.863 3.389 ( -1.298 -0.492 0.946) 1.679 3.444 ( 5.429 -0.792 -3.560) 6.540 3.581 ( -2.081 -2.229 3.932) 4.975 3.699 ( -1.552 -2.422 -5.043) 5.806 3.782 ( 0.301 2.497 1.654) 3.010 3.859 ( 1.733 -1.689 -3.204) 4.015 4.005 ( -2.405 1.063 3.586) 4.447 4.094 ( 5.480 -3.884 -3.755) 7.695 4.185 ( 1.240 3.489 -0.164) 3.706 4.223 ( -2.030 -3.354 -3.365) 5.167 4.485 ( 4.893 -6.796 6.469) 10.582 4.557 ( -8.303 -7.722 0.563) 11.353 4.676 ( -0.991 -3.293 3.654) 5.017 4.714 ( -1.110 -1.010 2.173) 2.641 4.814 ( 0.178 -0.537 -2.771) 2.828 4.905 ( 5.337 -2.400 -7.783) 9.738 5.157 ( -8.943 5.011 2.191) 10.483 5.205 ( 6.785 3.345 -2.908) 8.105 5.339 ( -0.144 -1.393 6.731) 6.875 5.466 ( -8.288 -3.042 3.443) 9.476 5.503 ( -0.148 -1.841 0.833) 2.026 5.507 ( 1.106 -2.107 -5.762) 6.234 5.678 ( 5.091 3.516 -1.779) 6.437 5.686 ( 0.901 2.914 -1.868) 3.577 5.959 ( 3.501 1.602 3.673) 5.321 6.041 ( -2.212 2.008 -3.113) 4.315 6.215 ( -1.213 2.545 4.116) 4.989 6.287 ( 0.083 0.598 -2.433) 2.507 6.626 ( 9.164 -2.682 3.430) 10.146 6.759 ( -10.971 -2.159 -5.659) 12.532 6.888 ( 2.348 -2.094 3.805) 4.937 6.998 ( 1.867 -0.738 -3.033) 3.637 7.322 ( -2.859 -0.268 1.236) 3.127 7.394 ( 0.659 2.969 -5.845) 6.589 7.786 ( -2.191 2.758 4.977) 6.097 7.942 ( 2.768 2.031 -8.333) 9.012 8.199 ( -1.548 -6.815 2.673) 7.482 8.266 ( 3.508 -6.315 -1.155) 7.316 8.653 ( -7.903 -5.925 9.589) 13.766 8.820 ( 4.707 -7.746 -5.297) 10.499 9.051 ( 0.611 3.760 2.415) 4.511 9.093 ( 0.049 1.641 0.048) 1.642 9.404 ( -3.418 3.682 7.866) 9.333 9.561 ( 2.270 1.868 -6.505) 7.139 9.599 ( -5.324 -6.346 12.320) 14.846 9.789 ( -1.888 -3.173 -1.769) 4.094 10.326 ( -2.617 -3.544 1.473) 4.645 10.416 ( 5.500 -9.489 -5.861) 12.436 10.684 ( 0.412 -0.834 1.056) 1.407 10.732 ( 1.705 0.186 -3.922) 4.281 11.005 ( 1.546 0.101 3.615) 3.933 11.042 ( -5.639 -0.786 -0.439) 5.710 11.230 ( -1.410 0.499 4.542) 4.782 11.309 ( 2.665 -1.920 -2.083) 3.889 11.504 ( 5.648 2.962 1.208) 6.491 11.562 ( -6.321 2.289 -3.690) 7.669 12.295 ( 5.391 -5.853 2.278) 8.277 12.343 ( -4.057 -4.334 -1.912) 6.237 12.411 ( -1.072 0.239 1.414) 1.791 12.448 ( 1.329 -0.552 -1.849) 2.343 13.059 ( -0.876 -0.254 1.648) 1.884 13.091 ( 0.606 0.862 -1.048) 1.486 13.876 ( -0.569 -5.474 3.180) 6.356 13.967 ( 1.378 -4.515 -4.579) 6.577 15.921 ( -10.338 -2.724 7.833) 13.253 16.075 ( 8.230 -3.481 -5.337) 10.408 17.558 ( 2.621 7.991 5.110) 9.840 17.630 ( -1.345 7.175 -0.235) 7.303 17.901 ( -4.822 0.411 1.278) 5.006 18.029 ( 2.183 -0.777 -9.542) 9.820 19.159 ( 1.885 -10.390 2.925) 10.957 19.204 ( -0.704 -11.497 -1.419) 11.606 19.341 ( 2.991 -11.614 5.355) 13.134 19.474 ( -2.585 -9.573 -5.666) 11.420 20.287 ( -1.496 -5.530 2.657) 6.315 20.361 ( 4.586 -6.158 -3.823) 8.578 20.806 ( -0.764 15.576 4.392) 16.201 20.907 ( -3.047 13.428 -4.399) 14.455 21.872 ( 2.667 5.771 4.128) 7.580 21.940 ( -1.825 3.838 -1.583) 4.535 22.351 ( -1.568 -1.527 1.896) 2.896 22.422 ( 2.299 1.005 -4.290) 4.970 22.876 ( -1.136 -0.188 7.182) 7.274 23.034 ( 0.439 1.345 -6.354) 6.509 23.299 ( 0.466 5.850 6.564) 8.805 23.492 ( -0.922 4.623 -10.696) 11.689 ======================= Grid point 151 (58/102) ======================= q-point: ( 0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.875 ( 9.594 0.000 16.516) 19.101 0.895 ( 16.250 0.000 10.283) 19.230 1.059 ( 19.317 0.000 -9.638) 21.588 1.189 ( 20.133 0.000 -9.332) 22.191 1.623 ( 36.608 0.000 7.705) 37.410 1.842 ( 23.188 0.000 -11.517) 25.891 2.079 ( 13.624 0.000 -12.344) 18.384 2.301 ( 7.968 0.000 5.505) 9.684 2.497 ( 8.964 0.000 0.929) 9.012 2.615 ( 3.364 0.000 3.883) 5.138 2.713 ( -13.599 -0.000 6.369) 15.017 2.860 ( -11.435 -0.000 -2.911) 11.800 2.906 ( 2.930 0.000 5.258) 6.019 2.986 ( 5.928 0.000 -2.761) 6.540 3.216 ( -5.439 -0.000 -4.063) 6.789 3.351 ( -6.972 -0.000 0.837) 7.022 3.378 ( 9.198 0.000 0.943) 9.246 3.502 ( 1.282 0.000 -6.526) 6.651 3.598 ( 0.248 0.000 6.843) 6.847 3.605 ( 3.538 0.000 -4.264) 5.541 3.728 ( -1.226 -0.000 3.333) 3.551 3.787 ( -5.297 -0.000 -0.922) 5.377 3.946 ( 1.562 0.000 2.483) 2.934 3.959 ( -0.659 -0.000 -4.704) 4.750 4.304 ( -0.055 -0.000 3.112) 3.112 4.469 ( -11.724 -0.000 3.116) 12.131 4.517 ( -5.808 -0.000 2.834) 6.462 4.572 ( -2.137 -0.000 -4.191) 4.705 4.685 ( -5.146 -0.000 -4.150) 6.611 4.810 ( -3.523 -0.000 0.039) 3.523 4.836 ( 3.960 0.000 -0.699) 4.021 4.950 ( 5.748 0.000 1.999) 6.086 5.078 ( -0.983 -0.000 2.705) 2.878 5.088 ( -9.634 -0.000 -3.214) 10.156 5.163 ( 3.684 0.000 -4.761) 6.020 5.261 ( -9.014 -0.000 6.463) 11.092 5.303 ( 2.435 0.000 -0.562) 2.499 5.363 ( -10.802 -0.000 0.195) 10.803 5.680 ( -9.639 -0.000 8.166) 12.633 5.871 ( -0.535 -0.000 -7.984) 8.002 5.938 ( 9.487 0.000 -7.788) 12.274 6.053 ( -0.184 -0.000 8.193) 8.195 6.380 ( -6.074 -0.000 3.975) 7.259 6.454 ( 0.392 0.000 -6.902) 6.913 6.749 ( 2.335 0.000 -1.707) 2.893 6.750 ( 11.025 0.000 4.409) 11.874 7.049 ( 11.484 0.000 -6.005) 12.959 7.204 ( 6.883 0.000 -2.732) 7.405 7.370 ( 5.023 0.000 10.566) 11.699 7.682 ( 7.251 0.000 -6.208) 9.545 7.914 ( 14.297 0.000 -3.737) 14.778 7.996 ( 3.232 0.000 -2.838) 4.301 8.272 ( -9.578 -0.000 4.042) 10.396 8.600 ( 2.936 0.000 -4.744) 5.579 8.635 ( -2.604 -0.000 -5.903) 6.452 8.875 ( -14.075 -0.000 9.490) 16.976 8.966 ( -0.256 -0.000 -2.886) 2.897 9.173 ( 3.092 0.000 -4.791) 5.702 9.432 ( -7.190 -0.000 19.846) 21.108 9.678 ( 22.066 0.000 -16.566) 27.592 9.717 ( 12.402 0.000 -8.692) 15.145 10.056 ( -0.419 -0.000 11.483) 11.491 10.396 ( -5.512 -0.000 -6.743) 8.709 10.510 ( -16.742 -0.000 2.658) 16.952 10.572 ( 0.161 0.000 -0.762) 0.779 10.694 ( -4.088 -0.000 4.522) 6.096 10.999 ( 3.815 0.000 3.262) 5.019 11.077 ( 5.852 0.000 -0.572) 5.880 11.106 ( 5.917 0.000 1.271) 6.052 11.440 ( 6.117 0.000 3.243) 6.923 11.605 ( 10.199 0.000 3.903) 10.920 11.827 ( -2.685 -0.000 1.867) 3.270 12.245 ( -7.443 -0.000 2.016) 7.711 12.270 ( -4.629 -0.000 -3.568) 5.845 12.854 ( 14.271 0.000 4.934) 15.100 12.888 ( 2.359 0.000 -3.652) 4.347 13.069 ( 8.018 0.000 2.291) 8.339 13.200 ( 9.215 0.000 -4.434) 10.226 13.895 ( -3.935 -0.000 0.235) 3.942 13.910 ( -3.597 -0.000 -0.717) 3.668 15.898 ( 1.132 0.000 0.151) 1.142 16.547 ( -17.167 -0.000 12.060) 20.979 17.417 ( 12.134 0.000 4.411) 12.911 17.503 ( 5.862 0.000 -3.466) 6.810 18.092 ( 12.625 0.000 3.235) 13.033 18.195 ( 10.541 0.000 -7.074) 12.695 19.098 ( -13.190 -0.000 -4.133) 13.822 19.144 ( -17.049 -0.000 1.759) 17.139 19.766 ( 2.834 0.000 -0.846) 2.958 20.054 ( -1.839 -0.000 1.883) 2.632 20.421 ( 3.830 0.000 8.560) 9.378 20.453 ( 19.625 0.000 -19.104) 27.388 20.714 ( 7.772 0.000 4.360) 8.912 20.859 ( 16.812 0.000 -6.013) 17.855 21.901 ( 1.014 0.000 2.204) 2.426 21.956 ( 5.302 0.000 -1.626) 5.546 22.383 ( 0.234 0.000 0.657) 0.697 22.421 ( -16.678 -0.000 16.378) 23.375 22.424 ( 1.356 0.000 -1.332) 1.901 22.802 ( -9.049 -0.000 -1.495) 9.171 22.995 ( -4.571 -0.000 0.115) 4.572 23.010 ( -5.032 -0.000 -0.945) 5.120 ======================= Grid point 152 (59/102) ======================= q-point: ( 0.27 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( 17.063 -4.547 5.727) 18.564 1.209 ( 17.452 -2.421 -8.472) 19.550 1.227 ( 9.221 -15.654 11.711) 21.615 1.378 ( 18.776 -5.550 -7.999) 21.150 1.918 ( 23.227 -0.799 3.055) 23.440 1.990 ( 23.034 -4.950 -1.517) 23.609 2.177 ( 13.435 1.239 -5.617) 14.614 2.381 ( 1.174 0.322 6.675) 6.785 2.527 ( 0.616 0.088 -1.867) 1.968 2.593 ( 8.634 -2.228 -1.962) 9.130 2.765 ( 0.188 -6.706 1.531) 6.881 2.820 ( -8.660 -4.504 -0.459) 9.772 2.938 ( -0.989 -0.773 2.305) 2.625 3.023 ( 6.014 0.681 -3.289) 6.888 3.175 ( -1.893 -1.482 -2.268) 3.305 3.296 ( -5.646 1.897 2.956) 6.649 3.423 ( 2.769 0.540 -1.301) 3.107 3.466 ( -0.638 2.749 0.959) 2.980 3.592 ( 1.874 -2.052 -4.354) 5.165 3.631 ( -2.785 3.661 4.854) 6.687 3.734 ( -0.082 -0.142 -0.720) 0.738 3.750 ( -3.484 -1.301 -0.522) 3.755 3.910 ( -2.309 2.732 -3.498) 5.003 3.960 ( 2.332 1.082 2.508) 3.591 4.240 ( -5.440 6.487 1.338) 8.571 4.370 ( -5.468 2.215 2.760) 6.514 4.503 ( -6.404 -0.902 -0.171) 6.469 4.551 ( -3.808 2.303 -0.876) 4.535 4.604 ( -2.439 -2.252 -0.483) 3.355 4.671 ( -0.782 5.755 0.586) 5.837 4.916 ( -6.032 0.999 -0.274) 6.120 4.967 ( 3.594 -0.070 -3.663) 5.132 5.025 ( 2.862 1.530 -1.354) 3.516 5.137 ( -9.033 -4.195 1.455) 10.065 5.193 ( -2.716 -1.296 -1.260) 3.263 5.266 ( -2.547 -6.647 0.468) 7.133 5.281 ( 1.308 0.108 2.317) 2.662 5.322 ( -6.844 -1.234 1.361) 7.086 5.615 ( -9.896 -0.104 5.741) 11.441 5.908 ( -0.257 -4.580 -6.046) 7.590 5.920 ( 5.228 4.657 -1.271) 7.116 6.131 ( 4.496 -4.656 2.066) 6.794 6.336 ( -5.889 0.053 4.340) 7.316 6.417 ( 0.300 2.089 -4.853) 5.292 6.745 ( 7.925 2.086 -1.471) 8.326 6.864 ( 8.360 -1.436 2.612) 8.875 7.081 ( 6.000 1.928 -1.586) 6.498 7.300 ( 0.269 -5.863 -1.649) 6.097 7.425 ( 6.667 0.461 4.214) 7.900 7.723 ( 6.846 0.780 -7.877) 10.466 7.990 ( 6.363 1.190 -1.759) 6.708 8.010 ( 5.101 -0.247 -1.541) 5.335 8.226 ( -6.237 -0.877 3.801) 7.357 8.519 ( -4.825 7.899 -0.389) 9.264 8.552 ( 3.877 5.733 -2.951) 7.524 8.706 ( -12.370 5.008 2.732) 13.622 9.031 ( -2.555 -3.084 0.028) 4.005 9.180 ( 0.908 -1.048 -5.067) 5.254 9.405 ( 0.072 3.885 13.487) 14.035 9.666 ( 11.657 7.818 -2.548) 14.266 9.816 ( 10.912 -0.033 -8.513) 13.840 9.994 ( -1.406 8.799 5.512) 10.478 10.336 ( -3.574 -0.014 -3.062) 4.706 10.469 ( -10.249 -5.613 -2.924) 12.045 10.505 ( 1.104 5.386 0.754) 5.550 10.711 ( -2.246 -1.321 3.763) 4.577 10.975 ( 6.022 5.799 0.062) 8.360 11.074 ( 6.589 0.235 3.410) 7.423 11.276 ( 5.526 -7.014 0.224) 8.932 11.529 ( 7.275 -2.527 0.300) 7.708 11.652 ( 8.860 2.984 4.133) 10.222 11.792 ( -4.838 0.746 -1.765) 5.204 12.190 ( -6.292 0.480 0.707) 6.349 12.246 ( -2.503 -1.014 -1.767) 3.227 12.849 ( 6.005 5.839 -1.698) 8.546 12.908 ( 6.784 1.638 2.213) 7.321 13.065 ( 6.725 7.089 2.045) 9.984 13.171 ( 9.566 9.480 -1.500) 13.551 13.837 ( -6.385 1.282 -1.131) 6.610 13.883 ( -4.190 1.923 0.052) 4.610 15.896 ( -2.078 -0.212 0.449) 2.136 16.372 ( -16.589 5.694 4.256) 18.048 17.410 ( 9.496 5.675 0.539) 11.076 17.621 ( 7.094 -4.196 0.328) 8.249 17.904 ( 12.999 8.884 -0.943) 15.773 18.568 ( 4.801 -10.095 2.166) 11.387 18.945 ( -10.499 2.936 -1.665) 11.028 19.198 ( -16.638 -14.437 0.261) 22.030 19.685 ( 1.862 10.112 0.147) 10.283 19.874 ( -2.182 14.121 1.239) 14.342 20.147 ( 10.697 23.098 -4.655) 25.877 20.453 ( 4.303 11.559 -3.714) 12.881 20.973 ( 7.541 -14.626 6.816) 17.811 21.051 ( 16.729 -6.645 -6.094) 19.004 21.888 ( 1.880 0.411 0.468) 1.980 22.009 ( 5.142 -1.653 1.744) 5.676 22.344 ( -0.961 2.872 -0.298) 3.044 22.426 ( -1.518 -2.629 -0.304) 3.051 22.556 ( -8.661 -13.142 4.115) 16.268 22.796 ( -7.817 -5.461 0.867) 9.576 22.969 ( -6.706 -1.692 0.330) 6.924 23.037 ( -6.449 -7.070 -0.986) 9.620 ======================= Grid point 154 (60/102) ======================= q-point: ( 0.36 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.265 ( 17.710 -8.094 -0.629) 19.482 1.323 ( 12.409 -1.187 -5.571) 13.654 1.539 ( 11.375 -6.111 -3.445) 13.364 1.647 ( 4.943 -15.964 9.959) 19.454 2.058 ( 8.828 -4.463 1.742) 10.044 2.118 ( 1.276 7.139 2.945) 7.827 2.324 ( 15.639 -8.213 -5.307) 18.444 2.385 ( 8.126 -4.232 2.715) 9.555 2.643 ( 3.269 -0.642 1.258) 3.561 2.721 ( 8.893 -7.236 -4.358) 12.265 2.834 ( -4.350 1.715 -1.936) 5.061 2.854 ( 2.547 -5.531 -2.574) 6.611 2.977 ( 2.509 -3.946 -2.344) 5.230 3.048 ( -1.835 -1.886 2.046) 3.333 3.202 ( -4.906 1.365 3.038) 5.930 3.241 ( 3.569 -0.563 2.040) 4.149 3.368 ( -3.037 2.529 -0.730) 4.019 3.448 ( -0.561 4.358 2.663) 5.138 3.525 ( -3.044 0.621 0.510) 3.148 3.641 ( 4.310 -0.116 -3.673) 5.664 3.705 ( -2.783 0.713 -0.584) 2.932 3.779 ( 0.641 -2.214 -1.737) 2.887 3.806 ( -4.851 4.900 0.085) 6.896 3.965 ( 0.840 0.884 1.331) 1.805 4.096 ( -4.492 2.714 -0.270) 5.255 4.272 ( -5.990 4.584 2.326) 7.893 4.393 ( -4.554 5.288 -0.468) 6.995 4.543 ( -0.584 -0.004 0.103) 0.593 4.594 ( -4.548 -1.358 1.242) 4.906 4.709 ( 1.588 -4.461 -0.358) 4.748 4.852 ( -3.574 0.963 -2.543) 4.491 4.938 ( 1.474 3.693 -2.581) 4.741 4.958 ( -6.189 2.324 2.504) 7.069 5.124 ( -2.347 -0.031 -1.933) 3.041 5.160 ( -6.362 -0.676 0.040) 6.398 5.288 ( -4.053 -0.832 3.691) 5.544 5.371 ( 1.041 -5.703 -0.281) 5.804 5.426 ( -0.330 -9.402 0.135) 9.409 5.587 ( -5.922 -2.410 3.698) 7.386 5.865 ( 3.383 3.011 -1.024) 4.643 5.991 ( 0.247 -3.273 -2.764) 4.291 6.235 ( 0.371 -2.557 1.340) 2.911 6.328 ( -0.675 -2.400 0.309) 2.513 6.415 ( 6.589 -0.947 -0.559) 6.681 6.768 ( 8.066 1.897 -1.675) 8.453 6.939 ( 6.689 -0.047 2.575) 7.167 7.080 ( 2.066 1.281 0.128) 2.435 7.370 ( -2.688 -3.308 0.714) 4.322 7.464 ( 4.657 0.954 -0.898) 4.838 7.663 ( 5.704 9.827 -7.665) 13.706 7.956 ( -3.009 2.579 0.182) 3.967 8.067 ( 4.192 -0.566 1.796) 4.596 8.218 ( -1.910 -0.198 0.203) 1.931 8.343 ( -5.026 6.283 -0.049) 8.046 8.497 ( 7.547 4.711 -1.143) 8.970 8.556 ( -8.134 2.345 0.737) 8.497 9.013 ( -3.631 1.234 -1.212) 4.023 9.183 ( -5.530 -0.929 -1.179) 5.730 9.319 ( 2.297 9.828 7.196) 12.395 9.606 ( 1.078 4.745 5.615) 7.430 9.782 ( -0.425 11.482 0.612) 11.507 9.876 ( 10.669 0.450 -7.689) 13.159 10.329 ( -0.304 0.536 0.795) 1.006 10.451 ( -2.503 -1.603 0.530) 3.019 10.523 ( 1.808 -3.880 -5.341) 6.845 10.718 ( -0.738 -0.369 3.269) 3.372 10.939 ( 6.059 3.415 -0.594) 6.981 11.119 ( 3.644 0.315 3.742) 5.232 11.421 ( 7.502 -3.591 -0.112) 8.318 11.586 ( 7.350 2.449 -1.386) 7.870 11.660 ( 4.328 3.965 1.518) 6.063 11.738 ( 0.870 1.677 -0.407) 1.933 12.142 ( -5.082 0.401 -0.130) 5.100 12.251 ( -1.252 -0.943 -0.546) 1.660 12.763 ( 11.475 11.106 -0.020) 15.969 12.908 ( 12.280 8.515 0.573) 14.955 13.014 ( -0.940 -0.659 0.529) 1.264 13.036 ( 0.436 6.557 -0.456) 6.587 13.742 ( -7.597 4.482 -0.586) 8.841 13.778 ( -5.410 4.105 -0.368) 6.801 15.881 ( -3.903 -0.577 0.548) 3.983 16.172 ( -11.191 4.844 0.574) 12.208 17.411 ( 6.098 0.890 -0.137) 6.165 17.729 ( 3.797 -3.161 0.598) 4.977 17.939 ( 12.944 -0.010 -0.631) 12.960 18.628 ( -0.552 2.963 2.879) 4.169 18.815 ( -6.379 4.349 -1.974) 7.969 19.280 ( -8.518 -1.094 -0.760) 8.622 19.509 ( 2.078 9.300 4.980) 10.752 19.644 ( 1.210 9.968 -0.097) 10.042 19.831 ( -2.653 11.947 -3.896) 12.843 20.230 ( 4.790 15.560 -2.929) 16.541 21.208 ( 12.865 -3.836 0.712) 13.444 21.330 ( 6.952 -12.951 1.723) 14.799 21.906 ( 2.486 -0.526 -2.774) 3.762 22.113 ( 4.554 -4.130 3.445) 7.047 22.276 ( -2.400 2.769 -0.157) 3.668 22.453 ( -0.480 -1.444 -3.926) 4.211 22.694 ( -5.509 -7.272 3.230) 9.678 22.853 ( -4.347 -4.798 -0.369) 6.485 22.974 ( -10.309 -6.776 1.465) 12.423 23.122 ( -7.209 -7.409 -0.804) 10.369 ======================= Grid point 155 (61/102) ======================= q-point: ( 0.45 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( 9.072 -3.642 -2.461) 10.081 1.520 ( 8.835 -3.817 1.656) 9.766 1.675 ( 7.908 -6.240 -3.852) 10.784 1.972 ( -1.668 -15.060 10.483) 18.425 2.068 ( 3.667 0.307 -1.619) 4.020 2.214 ( 5.547 -6.623 -2.221) 8.920 2.416 ( 1.315 -3.274 -1.246) 3.742 2.609 ( 4.124 2.178 -0.123) 4.666 2.681 ( 10.881 -6.882 -2.807) 13.177 2.732 ( -2.019 5.402 -1.932) 6.082 2.819 ( -3.061 -1.105 0.156) 3.258 2.938 ( 0.925 2.303 4.190) 4.870 3.024 ( 5.119 -0.368 -2.713) 5.805 3.118 ( 1.546 -7.583 -3.375) 8.443 3.187 ( 0.575 -1.787 2.206) 2.897 3.252 ( -2.187 0.593 2.541) 3.405 3.338 ( -2.436 1.160 4.579) 5.315 3.368 ( 1.757 0.720 -1.278) 2.289 3.536 ( -1.331 -0.197 0.719) 1.525 3.619 ( 3.238 3.037 -4.015) 5.986 3.680 ( -6.216 -0.041 0.525) 6.238 3.714 ( -4.083 -0.565 0.930) 4.226 3.829 ( 6.208 0.248 -4.346) 7.582 3.920 ( -2.015 1.796 -0.505) 2.746 4.112 ( -2.572 -5.118 2.968) 6.451 4.138 ( -7.534 5.005 2.196) 9.308 4.285 ( -1.603 4.227 -0.240) 4.527 4.496 ( -3.519 1.687 1.009) 4.031 4.619 ( -1.645 -0.242 -1.237) 2.072 4.694 ( -7.989 -0.247 -1.398) 8.114 4.855 ( 2.982 -1.082 -6.022) 6.806 4.895 ( -0.333 1.094 4.017) 4.177 4.959 ( -0.452 -4.747 2.540) 5.403 5.088 ( -1.623 1.022 -0.026) 1.918 5.162 ( -5.177 -4.466 -0.850) 6.890 5.300 ( -3.390 -1.952 0.929) 4.020 5.467 ( 1.082 -3.991 -0.815) 4.214 5.540 ( 0.269 -2.652 0.566) 2.725 5.645 ( -0.033 -5.626 1.973) 5.962 5.863 ( 3.232 -0.079 0.402) 3.258 5.988 ( -1.793 1.983 -1.609) 3.120 6.267 ( -1.210 -2.975 -3.753) 4.939 6.385 ( 2.970 -1.365 7.483) 8.165 6.538 ( 8.938 -4.843 -3.136) 10.638 6.785 ( 6.802 1.956 -1.811) 7.306 6.968 ( 3.299 1.939 2.671) 4.667 7.068 ( 0.076 0.937 1.474) 1.748 7.367 ( 0.670 5.266 -5.941) 7.967 7.427 ( -2.130 4.899 2.324) 5.826 7.479 ( 1.141 7.982 -1.764) 8.254 7.870 ( -3.473 3.432 0.307) 4.892 8.078 ( -2.666 0.815 5.183) 5.885 8.193 ( -8.819 4.521 -0.784) 9.941 8.201 ( 1.899 1.429 -6.697) 7.106 8.453 ( 1.012 2.155 1.053) 2.603 8.583 ( 8.969 -2.231 -1.516) 9.365 8.939 ( -2.437 4.559 -0.320) 5.180 9.123 ( -9.810 1.197 4.332) 10.790 9.157 ( 1.225 8.832 2.699) 9.316 9.478 ( -3.500 6.610 -2.287) 7.821 9.690 ( 4.276 2.722 7.386) 8.958 9.917 ( 10.087 2.336 -7.731) 12.922 10.308 ( 0.776 1.277 1.708) 2.269 10.505 ( -3.435 -5.059 -0.638) 6.148 10.609 ( 4.998 -4.110 -3.506) 7.360 10.738 ( -0.685 -1.809 2.371) 3.060 10.931 ( 4.755 1.925 -1.075) 5.241 11.130 ( -0.854 0.191 2.318) 2.478 11.473 ( 5.975 5.314 -1.103) 8.072 11.560 ( 5.691 6.078 0.842) 8.369 11.607 ( 2.781 1.382 1.676) 3.529 11.722 ( 9.710 6.234 -1.634) 11.654 12.096 ( -3.373 1.134 -0.632) 3.614 12.241 ( -2.166 1.146 0.333) 2.473 12.646 ( 8.827 9.140 0.116) 12.708 12.767 ( 8.882 13.164 0.122) 15.881 13.011 ( -2.805 -3.735 -0.075) 4.672 13.082 ( 1.054 -5.352 0.237) 5.460 13.570 ( -6.329 7.695 0.107) 9.964 13.673 ( -6.414 3.010 -0.926) 7.146 15.865 ( -3.949 -0.819 0.345) 4.048 16.041 ( -7.584 2.317 0.065) 7.931 17.455 ( 4.452 -1.213 -0.178) 4.617 17.787 ( -1.725 -2.400 0.742) 3.047 18.044 ( 11.303 -1.050 -0.958) 11.392 18.519 ( -4.057 6.961 2.149) 8.339 18.694 ( 1.622 6.369 -1.397) 6.719 19.169 ( -0.840 5.923 -3.766) 7.069 19.374 ( 7.188 11.177 7.551) 15.284 19.503 ( 2.711 7.936 -2.201) 8.670 19.718 ( -13.893 -3.969 -0.025) 14.449 19.981 ( -0.800 12.060 -2.413) 12.325 21.340 ( 14.731 0.470 0.041) 14.738 21.579 ( 2.749 -10.250 2.564) 10.918 21.935 ( 1.586 -1.871 -3.311) 4.121 22.133 ( -0.982 4.707 0.445) 4.829 22.271 ( -1.189 -3.056 4.394) 5.483 22.460 ( 0.845 -1.027 -7.592) 7.708 22.772 ( -3.394 -4.156 7.680) 9.369 22.892 ( -1.660 -3.655 -4.177) 5.794 23.065 ( -8.522 -9.666 1.419) 12.964 23.180 ( -6.249 -5.078 -0.731) 8.085 ======================= Grid point 156 (62/102) ======================= q-point: ( 0.55 0.18 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -1.093 -2.575 4.431) 5.240 1.570 ( 7.345 -3.773 -4.237) 9.281 1.870 ( 7.064 -5.756 -2.243) 9.384 2.105 ( 0.762 -1.539 -0.046) 1.718 2.182 ( -1.215 -7.515 3.538) 8.395 2.344 ( -0.532 -5.854 0.045) 5.878 2.461 ( 2.083 2.831 -0.834) 3.613 2.556 ( 3.334 2.100 -0.888) 4.040 2.604 ( -0.548 5.667 -3.085) 6.475 2.776 ( -2.888 2.486 5.304) 6.531 2.818 ( -1.038 -2.832 -3.564) 4.669 2.938 ( 3.862 -4.445 2.198) 6.285 3.082 ( 7.075 0.519 -2.295) 7.456 3.151 ( -3.364 0.821 1.756) 3.883 3.237 ( 1.981 -2.558 -2.914) 4.355 3.268 ( -1.534 1.492 2.970) 3.660 3.317 ( -0.525 1.010 0.141) 1.147 3.398 ( -3.136 0.512 4.407) 5.433 3.514 ( 4.135 -1.565 -5.372) 6.957 3.569 ( 1.027 1.956 -2.078) 3.033 3.662 ( -3.206 -1.920 -0.011) 3.737 3.754 ( -2.592 -3.306 1.111) 4.345 3.796 ( 1.845 1.802 -0.719) 2.677 3.949 ( 1.817 -3.109 0.356) 3.619 4.012 ( -6.944 2.781 1.207) 7.577 4.177 ( -3.492 -1.767 1.002) 4.040 4.244 ( 1.165 -2.119 -1.986) 3.130 4.412 ( -7.046 4.286 4.799) 9.542 4.585 ( -2.807 -0.964 -1.399) 3.281 4.689 ( -7.237 -4.079 -2.858) 8.785 4.852 ( 1.177 1.150 -0.834) 1.845 4.934 ( 4.947 -0.698 -0.441) 5.015 5.060 ( 2.836 -3.114 2.099) 4.706 5.107 ( 1.712 -4.203 1.896) 4.918 5.220 ( -4.101 -3.964 -0.928) 5.778 5.304 ( -3.962 -3.665 -0.177) 5.400 5.511 ( -1.866 -0.826 -1.188) 2.361 5.562 ( 6.176 1.918 -1.044) 6.551 5.734 ( -2.970 -3.913 1.669) 5.188 5.907 ( 5.705 1.858 3.420) 6.907 5.935 ( -0.729 -0.965 -3.195) 3.416 6.307 ( -0.476 -3.241 -4.704) 5.732 6.424 ( 0.883 1.803 7.948) 8.197 6.638 ( 4.825 0.126 -2.625) 5.495 6.803 ( 4.685 0.411 -2.286) 5.229 6.921 ( -2.385 4.296 2.190) 5.379 7.053 ( 2.293 3.534 2.992) 5.167 7.175 ( 3.134 9.666 -6.615) 12.125 7.278 ( -8.676 6.817 4.012) 11.741 7.420 ( -1.754 2.163 -1.510) 3.167 7.813 ( -2.288 0.537 -0.319) 2.372 8.029 ( -5.583 1.729 -1.175) 5.962 8.060 ( -7.867 1.346 3.141) 8.577 8.201 ( 2.912 0.418 -5.533) 6.266 8.407 ( 4.249 5.474 1.906) 7.187 8.642 ( -2.665 3.121 1.117) 4.253 8.878 ( 11.220 0.465 -3.047) 11.636 9.055 ( -5.517 -0.156 2.420) 6.027 9.083 ( 1.032 0.850 2.020) 2.422 9.388 ( -5.901 -0.431 1.061) 6.011 9.697 ( 5.528 2.967 4.797) 7.898 9.898 ( 7.009 5.177 -6.199) 10.694 10.318 ( 3.518 -0.275 0.907) 3.643 10.548 ( -5.339 -3.880 -1.068) 6.686 10.709 ( 3.281 -2.405 -0.178) 4.072 10.784 ( -1.390 -4.247 0.791) 4.538 10.931 ( 2.984 1.081 -1.781) 3.640 11.110 ( -5.341 -0.035 0.826) 5.405 11.363 ( 1.923 8.416 2.530) 8.996 11.466 ( 4.131 7.765 -2.067) 9.035 11.615 ( 8.911 6.065 1.614) 10.899 11.658 ( 9.221 6.447 -1.553) 11.358 12.052 ( -0.995 1.547 -0.894) 2.045 12.179 ( -3.969 2.844 1.067) 4.998 12.584 ( 4.896 3.872 0.041) 6.242 12.630 ( 3.496 6.959 0.049) 7.788 13.086 ( -0.693 -5.502 0.678) 5.587 13.202 ( 2.505 -6.036 -0.104) 6.536 13.395 ( -4.361 7.151 0.338) 8.382 13.575 ( -5.980 2.148 -1.375) 6.501 15.857 ( -2.988 -1.118 0.736) 3.274 15.971 ( -4.732 0.520 -0.414) 4.778 17.515 ( 4.350 -1.841 -0.097) 4.724 17.803 ( -6.149 -2.818 0.682) 6.798 18.119 ( 8.203 0.785 -2.111) 8.507 18.372 ( -4.994 5.275 2.220) 7.596 18.610 ( 7.189 6.716 0.900) 9.880 19.043 ( -0.755 6.999 -6.495) 9.579 19.268 ( 6.944 8.262 7.257) 13.006 19.434 ( 3.947 2.335 -2.228) 5.098 19.620 ( -4.692 6.774 0.619) 8.264 19.860 ( -13.221 -5.051 -0.748) 14.172 21.408 ( 14.499 4.101 0.196) 15.069 21.745 ( -0.115 -6.327 1.857) 6.594 21.982 ( -0.005 -3.038 -2.430) 3.890 22.020 ( -2.737 4.492 -0.940) 5.344 22.302 ( -1.762 -0.478 5.401) 5.701 22.467 ( 1.009 -0.212 -7.204) 7.278 22.842 ( -1.134 -4.301 5.948) 7.427 22.945 ( -0.217 -3.083 -2.432) 3.933 23.177 ( -4.874 -7.860 0.489) 9.262 23.222 ( -3.625 -4.482 -0.838) 5.825 ======================= Grid point 157 (63/102) ======================= q-point: (-0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( -0.283 -0.178 4.568) 4.580 1.706 ( 2.444 -5.732 -5.183) 8.105 1.904 ( 3.370 6.138 -1.896) 7.254 2.043 ( -5.338 6.314 -0.209) 8.271 2.286 ( -0.491 -0.160 4.671) 4.699 2.338 ( 3.420 7.796 1.122) 8.587 2.413 ( 4.436 2.524 -5.134) 7.240 2.489 ( -7.307 -2.729 3.400) 8.509 2.620 ( 1.023 -3.360 -1.704) 3.904 2.713 ( -4.751 0.902 1.022) 4.943 2.940 ( 5.817 -7.005 -1.600) 9.245 3.032 ( -0.594 3.534 0.648) 3.641 3.074 ( 5.399 -0.005 -2.261) 5.854 3.106 ( -6.515 2.924 2.473) 7.557 3.177 ( 0.416 4.908 3.562) 6.078 3.244 ( 0.100 -1.704 -0.145) 1.713 3.301 ( 1.434 -0.577 -1.245) 1.985 3.372 ( -3.701 -1.993 -0.971) 4.314 3.563 ( -1.647 -0.828 1.695) 2.504 3.614 ( 2.932 -1.940 -5.558) 6.577 3.689 ( 2.020 -1.802 1.530) 3.109 3.726 ( 2.911 1.866 -1.545) 3.787 3.865 ( -0.083 -4.025 0.988) 4.145 3.958 ( -5.365 -2.117 0.452) 5.785 4.018 ( 3.496 -1.940 -0.922) 4.103 4.139 ( -5.407 2.273 0.886) 5.932 4.314 ( 4.464 -2.536 -5.473) 7.504 4.331 ( -7.810 -1.444 6.921) 10.535 4.594 ( -3.378 -2.027 1.691) 4.287 4.704 ( -5.972 -3.891 -2.047) 7.416 4.847 ( 4.117 1.451 -0.157) 4.368 4.962 ( 2.278 0.237 0.630) 2.376 5.124 ( 3.974 -1.603 -1.529) 4.550 5.185 ( -2.543 -0.689 -2.567) 3.679 5.244 ( 1.527 -3.997 7.452) 8.593 5.410 ( -0.955 -7.275 -2.335) 7.700 5.467 ( -2.707 2.108 0.255) 3.441 5.567 ( 5.515 1.728 -5.233) 7.797 5.742 ( -4.228 0.315 4.092) 5.893 5.876 ( 0.742 2.085 -3.091) 3.801 6.010 ( 5.872 -1.892 3.989) 7.346 6.352 ( -6.145 2.984 0.238) 6.835 6.358 ( 4.357 -0.379 -2.413) 4.995 6.579 ( -2.193 6.891 0.233) 7.236 6.718 ( -2.361 9.232 2.706) 9.906 6.829 ( -1.266 6.293 -2.675) 6.954 6.998 ( 0.960 2.259 1.146) 2.709 7.098 ( 2.211 2.149 1.239) 3.323 7.178 ( -6.372 -2.238 1.242) 6.866 7.329 ( -2.483 5.242 -3.154) 6.602 7.805 ( -1.029 -0.755 -0.519) 1.377 7.969 ( -6.365 -0.494 -3.445) 7.255 8.022 ( -4.018 -0.756 5.338) 6.724 8.175 ( 3.044 3.081 -7.856) 8.971 8.378 ( 1.012 1.307 7.704) 7.880 8.528 ( 0.460 3.630 -2.582) 4.479 8.985 ( 2.325 -2.319 2.465) 4.106 9.076 ( 4.085 -2.845 -4.605) 6.782 9.154 ( 6.679 -5.257 2.570) 8.880 9.388 ( -7.840 -3.975 5.133) 10.179 9.677 ( 5.304 4.394 0.920) 6.949 9.820 ( 3.993 6.249 -5.726) 9.369 10.365 ( 5.537 -0.593 0.871) 5.637 10.572 ( -5.818 -3.798 -0.537) 6.969 10.716 ( -2.139 2.130 2.622) 3.999 10.841 ( -1.962 -1.196 -3.486) 4.175 10.924 ( 3.061 1.149 -0.433) 3.299 11.068 ( -6.794 -0.581 0.913) 6.880 11.239 ( -0.567 6.030 4.119) 7.324 11.362 ( 3.943 5.912 -5.811) 9.180 11.546 ( 7.729 6.918 2.421) 10.652 11.625 ( 6.323 4.303 -0.084) 7.649 12.036 ( 1.511 -0.126 -1.287) 1.989 12.110 ( -4.736 1.152 1.502) 5.100 12.559 ( 0.901 3.218 0.425) 3.369 12.561 ( 2.423 2.360 -0.531) 3.424 13.175 ( 0.575 -3.089 0.220) 3.150 13.257 ( -2.569 5.225 -0.077) 5.823 13.320 ( 2.264 -4.826 2.247) 5.785 13.533 ( -3.814 -2.997 -2.712) 5.557 15.863 ( -2.248 -1.359 1.959) 3.277 15.946 ( -2.059 -0.704 -1.639) 2.724 17.585 ( 5.581 -1.920 -0.046) 5.902 17.812 ( -8.632 -4.370 0.261) 9.678 18.133 ( 6.364 2.695 -2.466) 7.338 18.266 ( -3.745 4.412 1.694) 6.029 18.569 ( 6.087 3.544 3.867) 8.035 18.883 ( -2.728 7.196 -6.172) 9.865 19.207 ( 4.878 4.872 3.552) 7.755 19.360 ( -0.233 7.034 -0.684) 7.071 19.596 ( 3.468 -5.231 0.125) 6.277 19.889 ( -13.160 -8.236 -0.050) 15.525 21.413 ( 13.193 6.751 0.419) 14.826 21.746 ( -7.150 4.098 -0.111) 8.242 21.987 ( 1.174 -3.307 0.231) 3.517 22.049 ( -0.391 -3.835 -1.692) 4.209 22.297 ( -1.296 0.959 4.663) 4.934 22.446 ( 0.336 1.247 -5.597) 5.744 22.924 ( 0.443 -3.034 2.101) 3.717 22.973 ( -0.454 -1.235 0.702) 1.491 23.261 ( -2.231 -4.689 1.431) 5.386 23.307 ( 0.114 -6.376 -2.261) 6.766 ======================= Grid point 158 (64/102) ======================= q-point: (-0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -2.297 2.867 7.625) 8.464 1.683 ( -2.515 15.804 1.398) 16.064 1.759 ( 2.180 4.072 -2.016) 5.040 1.871 ( -0.776 8.049 -6.755) 10.537 2.153 ( -2.522 6.815 2.237) 7.603 2.246 ( 0.493 4.465 -4.594) 6.425 2.406 ( 4.294 3.804 0.241) 5.742 2.504 ( -4.689 2.723 -1.691) 5.680 2.666 ( -6.518 -1.301 5.023) 8.331 2.692 ( 3.653 -2.388 -2.758) 5.163 2.873 ( -0.758 7.963 7.040) 10.656 2.967 ( -1.283 3.814 0.488) 4.054 3.102 ( 4.333 -1.237 -4.097) 6.090 3.134 ( -3.142 -2.908 -1.469) 4.526 3.215 ( 5.038 -3.889 -0.417) 6.378 3.276 ( -4.003 0.231 2.148) 4.549 3.322 ( 2.665 -2.692 -0.528) 3.825 3.375 ( -0.737 -0.681 -2.093) 2.321 3.555 ( -2.253 0.038 3.693) 4.326 3.637 ( 3.695 -0.070 -4.294) 5.665 3.721 ( 0.682 -1.555 1.237) 2.101 3.759 ( 3.774 -1.046 -3.064) 4.972 3.912 ( 0.913 -1.437 2.396) 2.939 3.989 ( -4.920 -4.444 3.193) 7.359 4.041 ( -2.578 1.896 -0.348) 3.219 4.088 ( 2.537 -1.554 -3.575) 4.651 4.326 ( -6.672 -1.924 4.036) 8.032 4.376 ( 3.554 -2.041 -5.076) 6.525 4.607 ( -2.778 -0.905 6.176) 6.833 4.738 ( -1.713 -3.671 -3.402) 5.290 4.852 ( 6.346 2.738 -0.020) 6.911 4.952 ( -1.501 2.024 -0.388) 2.550 5.169 ( 1.796 -2.005 -0.400) 2.721 5.202 ( -0.073 -3.520 -0.702) 3.590 5.336 ( 3.121 -1.868 3.528) 5.068 5.385 ( -0.339 2.604 -0.283) 2.641 5.510 ( -0.659 -2.293 -0.758) 2.503 5.583 ( -2.789 -3.146 -5.122) 6.627 5.687 ( -1.050 3.998 4.141) 5.851 5.809 ( -0.632 5.090 -4.954) 7.131 6.079 ( 3.676 -0.025 8.384) 9.154 6.247 ( -2.393 2.916 -0.886) 3.875 6.376 ( 1.648 3.328 -1.171) 3.894 6.438 ( -3.304 4.134 1.884) 5.617 6.587 ( 3.233 5.243 -5.548) 8.290 6.636 ( -8.095 6.172 0.438) 10.189 6.962 ( -2.265 3.808 6.094) 7.534 7.115 ( 3.453 1.234 -4.155) 5.542 7.182 ( -4.197 -0.863 0.963) 4.391 7.250 ( -2.250 -2.722 -1.586) 3.872 7.809 ( -1.208 -0.264 2.217) 2.539 7.940 ( -2.239 -1.042 -5.488) 6.018 8.041 ( -2.603 -2.790 3.524) 5.194 8.146 ( 3.506 0.769 -6.499) 7.424 8.379 ( -4.277 -1.207 11.165) 12.017 8.542 ( 6.163 -1.656 -7.166) 9.596 9.032 ( -1.343 -2.395 5.088) 5.781 9.144 ( 3.182 -2.601 -5.027) 6.493 9.321 ( 6.510 -5.229 4.625) 9.545 9.425 ( -6.807 -4.484 6.118) 10.192 9.633 ( 3.485 3.720 -1.892) 5.437 9.735 ( 2.831 3.475 -7.803) 8.999 10.405 ( 5.787 2.141 2.593) 6.693 10.573 ( -8.505 0.991 -1.754) 8.740 10.638 ( -0.826 2.201 3.957) 4.603 10.782 ( -1.145 2.603 -5.816) 6.474 10.940 ( 1.784 0.506 2.500) 3.113 11.025 ( -3.379 1.229 -0.810) 3.686 11.191 ( -1.297 -0.509 3.249) 3.535 11.284 ( 0.805 3.421 -4.071) 5.378 11.519 ( 3.625 1.559 3.456) 5.245 11.604 ( 3.346 1.878 -1.842) 4.256 12.068 ( 0.105 -1.698 0.047) 1.702 12.086 ( -1.235 -2.071 -0.051) 2.412 12.509 ( -0.422 2.811 1.365) 3.153 12.536 ( 1.132 1.771 -1.277) 2.460 13.155 ( -1.264 3.710 1.474) 4.188 13.187 ( 0.941 2.402 -2.338) 3.481 13.450 ( 0.605 -7.709 5.079) 9.252 13.609 ( -0.704 -7.201 -4.469) 8.504 15.875 ( -2.426 -1.119 3.546) 4.439 15.955 ( 0.380 -1.499 -3.243) 3.593 17.670 ( 8.172 -2.040 0.256) 8.426 17.831 ( -10.482 -5.549 -0.580) 11.874 18.099 ( 4.134 6.039 -0.713) 7.353 18.139 ( -1.523 7.699 0.298) 7.854 18.608 ( 3.109 -3.410 4.374) 6.359 18.764 ( -3.262 1.013 -3.933) 5.210 19.180 ( 4.775 2.582 -0.025) 5.429 19.259 ( -4.817 1.473 0.056) 5.038 19.771 ( 9.106 -7.976 0.732) 12.127 19.949 ( -11.399 -8.668 -0.509) 14.329 21.372 ( 12.142 8.240 0.648) 14.688 21.565 ( -10.206 7.816 -0.967) 12.891 22.072 ( 0.281 -3.652 1.103) 3.825 22.096 ( 0.649 -1.192 -0.983) 1.676 22.268 ( -2.339 1.704 5.592) 6.297 22.423 ( 2.467 0.388 -8.148) 8.522 22.925 ( -2.289 1.683 6.155) 6.779 23.023 ( 2.008 -2.668 -3.317) 4.707 23.328 ( -0.742 -3.311 3.413) 4.813 23.415 ( 1.751 -5.293 -3.555) 6.613 ======================= Grid point 159 (65/102) ======================= q-point: (-0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.345 ( -2.132 18.312 4.389) 18.951 1.390 ( -0.912 15.922 2.905) 16.210 1.632 ( 1.573 8.723 1.437) 8.980 1.737 ( -1.592 6.933 -6.374) 9.551 2.025 ( -0.837 6.989 2.895) 7.611 2.228 ( 5.532 3.327 -10.685) 12.484 2.329 ( 0.250 9.221 1.931) 9.424 2.336 ( 0.471 3.019 -0.504) 3.096 2.597 ( -5.755 10.124 10.456) 15.651 2.710 ( -0.702 0.983 -0.372) 1.264 2.809 ( 3.099 0.677 0.564) 3.222 2.903 ( 1.580 5.359 -5.442) 7.799 3.085 ( -2.147 4.051 2.015) 5.007 3.107 ( -2.189 0.536 -0.253) 2.267 3.282 ( 2.877 -4.581 -0.254) 5.415 3.322 ( 0.863 0.472 -2.732) 2.903 3.358 ( -0.787 -2.779 0.958) 3.043 3.381 ( 0.694 -0.951 -1.648) 2.025 3.563 ( -0.246 0.799 1.958) 2.129 3.640 ( 1.907 0.461 -4.726) 5.117 3.759 ( -1.867 -3.720 2.040) 4.635 3.803 ( 0.505 -1.744 -2.396) 3.006 3.967 ( 3.573 -2.027 3.022) 5.100 3.991 ( -1.439 0.678 2.155) 2.678 4.072 ( -4.073 -7.029 2.177) 8.410 4.135 ( 2.900 -1.629 -0.880) 3.441 4.327 ( -7.944 -4.081 1.393) 9.039 4.422 ( 4.821 -1.037 -5.023) 7.039 4.615 ( -0.474 0.031 7.399) 7.414 4.779 ( 1.539 -1.374 -6.211) 6.545 4.818 ( 0.301 4.793 1.997) 5.201 4.889 ( 2.225 2.316 -3.259) 4.575 5.223 ( -1.866 -2.756 2.654) 4.257 5.285 ( 1.859 -4.518 -2.327) 5.411 5.338 ( -0.774 1.091 1.834) 2.270 5.394 ( 3.078 0.076 -3.374) 4.568 5.473 ( -8.835 5.262 5.224) 11.534 5.574 ( 4.458 -0.289 -2.491) 5.115 5.657 ( 0.080 1.562 0.711) 1.718 5.714 ( -0.534 0.487 -4.538) 4.595 6.099 ( 2.809 2.614 7.064) 8.039 6.189 ( 1.814 4.376 -2.459) 5.337 6.294 ( -1.805 4.635 3.545) 6.108 6.330 ( -7.759 3.162 2.802) 8.835 6.551 ( 10.824 -0.354 -2.718) 11.166 6.622 ( -4.025 -4.941 -7.433) 9.791 6.877 ( -3.160 3.887 7.053) 8.650 7.038 ( 2.576 4.512 -6.516) 8.333 7.231 ( -2.628 -4.239 5.288) 7.269 7.326 ( 1.463 -5.009 -3.106) 6.073 7.814 ( -0.839 -0.585 4.227) 4.349 7.942 ( 1.350 -1.248 -7.072) 7.307 8.101 ( -1.177 -3.272 0.843) 3.578 8.145 ( 1.941 -0.067 -2.560) 3.214 8.425 ( -4.027 -4.833 9.369) 11.285 8.605 ( 3.967 -2.784 -6.475) 8.088 9.065 ( -2.774 -1.394 5.232) 6.084 9.184 ( 1.741 -0.535 -4.316) 4.685 9.434 ( -4.498 -3.223 7.965) 9.698 9.461 ( 0.867 -2.630 5.593) 6.241 9.594 ( 2.178 1.908 -3.482) 4.529 9.724 ( 1.632 -1.757 -9.379) 9.681 10.364 ( 0.716 5.237 3.268) 6.214 10.424 ( -1.933 7.321 -1.643) 7.748 10.660 ( -0.335 -2.083 2.863) 3.556 10.749 ( 0.276 0.196 -4.946) 4.958 10.941 ( -0.996 -0.027 2.975) 3.138 11.003 ( 3.206 -0.271 -2.808) 4.270 11.207 ( -2.650 -1.100 2.897) 4.078 11.254 ( 0.894 -0.286 -1.217) 1.537 11.536 ( -0.787 -0.686 2.327) 2.551 11.592 ( 0.941 0.503 -2.322) 2.556 12.104 ( -0.901 -3.880 1.840) 4.388 12.157 ( 1.704 -4.389 -2.663) 5.409 12.459 ( -1.247 2.472 2.474) 3.713 12.508 ( 0.608 1.824 -1.722) 2.581 13.095 ( -0.755 2.465 1.757) 3.120 13.143 ( 0.853 2.341 -2.351) 3.425 13.610 ( -0.439 -8.433 5.398) 10.022 13.733 ( 0.440 -7.614 -5.002) 9.121 15.881 ( -2.552 -0.625 4.604) 5.301 15.988 ( 2.495 -1.947 -4.336) 5.369 17.763 ( 5.378 -0.159 3.021) 6.170 17.844 ( -9.057 -4.399 -3.410) 10.630 17.957 ( -0.754 9.444 1.848) 9.653 18.012 ( 4.965 6.561 -1.966) 8.460 18.742 ( -6.022 -10.232 3.334) 12.332 18.811 ( 5.464 -6.711 -2.455) 8.996 19.190 ( 4.318 0.157 1.648) 4.625 19.238 ( -4.552 -3.308 -2.388) 6.113 19.982 ( 0.327 -8.733 2.694) 9.145 20.045 ( -0.116 -9.456 -2.610) 9.811 21.299 ( 4.590 8.884 0.925) 10.043 21.323 ( -4.611 11.216 -0.961) 12.165 22.080 ( 0.061 2.821 0.740) 2.918 22.087 ( -0.575 2.840 0.345) 2.918 22.261 ( -1.900 -2.013 5.119) 5.819 22.432 ( 3.948 -0.487 -9.869) 10.640 22.891 ( -3.107 1.397 9.169) 9.782 23.058 ( 1.737 -0.662 -5.927) 6.212 23.375 ( -0.925 -1.246 5.288) 5.511 23.494 ( 0.758 -3.108 -4.862) 5.820 ======================= Grid point 160 (66/102) ======================= q-point: (-0.09 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.068 ( 1.894 17.637 -0.445) 17.744 1.080 ( 5.542 13.084 -0.775) 14.230 1.465 ( 3.318 12.922 0.981) 13.377 1.552 ( 4.842 12.323 -6.777) 14.874 1.905 ( 0.083 8.537 8.443) 12.007 2.033 ( 1.667 18.453 -1.136) 18.563 2.193 ( -0.348 7.815 5.772) 9.721 2.245 ( 2.731 11.049 6.575) 13.144 2.550 ( 3.063 -8.792 -5.501) 10.814 2.644 ( -1.427 4.379 -3.553) 5.817 2.753 ( 3.017 10.079 -8.342) 13.427 2.809 ( 6.191 3.853 -1.905) 7.537 3.016 ( -0.235 3.461 4.470) 5.658 3.078 ( 0.463 1.854 1.204) 2.258 3.283 ( -5.291 0.599 0.970) 5.413 3.371 ( -2.247 -0.140 0.470) 2.300 3.389 ( 0.490 -1.693 0.831) 1.949 3.431 ( 4.735 -3.663 -2.757) 6.591 3.520 ( -4.824 -0.620 2.546) 5.490 3.650 ( 0.863 -0.573 -4.422) 4.541 3.803 ( -1.127 0.420 -0.611) 1.348 3.819 ( -0.911 -2.950 -0.305) 3.102 3.971 ( -4.066 -0.744 -0.405) 4.153 4.061 ( 5.556 -3.474 -0.109) 6.554 4.138 ( -7.079 -2.518 0.722) 7.548 4.214 ( 3.791 -3.889 4.873) 7.296 4.362 ( -7.826 -6.427 -0.846) 10.162 4.476 ( 6.068 -1.618 1.712) 6.510 4.646 ( 1.780 -1.628 4.450) 5.062 4.719 ( -2.433 2.308 -2.716) 4.316 4.793 ( 1.061 0.614 -2.205) 2.523 4.906 ( 6.091 -0.744 -4.565) 7.647 5.200 ( -8.037 5.381 0.451) 9.683 5.261 ( -3.516 1.864 2.918) 4.935 5.338 ( -7.631 -3.848 0.676) 8.573 5.380 ( 4.927 -0.506 -0.296) 4.961 5.456 ( 0.384 -1.494 0.326) 1.577 5.521 ( 0.940 4.851 -2.497) 5.536 5.702 ( 0.606 -2.660 -0.279) 2.743 5.735 ( 5.498 0.082 -0.164) 5.501 6.064 ( 3.067 4.237 1.491) 5.440 6.088 ( 3.283 5.420 -1.320) 6.473 6.257 ( -2.656 2.548 2.190) 4.283 6.283 ( 2.653 -2.095 1.947) 3.901 6.605 ( -9.431 -2.822 -6.002) 11.530 6.706 ( 13.460 -0.798 2.411) 13.697 6.854 ( 3.123 -3.062 2.114) 4.858 7.013 ( 4.685 0.445 -4.299) 6.374 7.293 ( 0.112 -2.656 4.177) 4.951 7.405 ( 2.741 -2.072 -3.349) 4.798 7.831 ( 2.336 0.584 4.102) 4.757 7.973 ( 4.574 -0.436 -7.522) 8.815 8.096 ( -4.132 -2.253 2.031) 5.126 8.213 ( 4.326 -3.151 -2.633) 5.964 8.510 ( -6.206 -5.763 8.412) 11.937 8.690 ( 1.072 -6.457 -4.307) 7.835 9.066 ( -2.758 -0.412 3.896) 4.791 9.160 ( 0.321 2.930 -2.101) 3.620 9.431 ( -4.990 0.259 5.563) 7.478 9.527 ( -3.753 -2.239 9.513) 10.468 9.605 ( 6.928 -0.647 -4.377) 8.220 9.734 ( -1.739 -1.012 -7.350) 7.621 10.284 ( -4.012 1.082 -0.742) 4.221 10.359 ( 6.380 0.651 -0.254) 6.419 10.684 ( 0.262 0.315 1.052) 1.129 10.747 ( 2.492 -0.257 -4.141) 4.840 10.934 ( -6.269 -1.565 1.909) 6.737 11.055 ( 3.643 -0.264 1.449) 3.929 11.219 ( 0.532 -1.232 1.882) 2.311 11.286 ( 2.292 -2.311 -0.944) 3.389 11.528 ( -3.033 -0.455 -0.456) 3.100 11.600 ( 3.983 0.560 -0.362) 4.039 12.211 ( 2.574 -6.535 1.651) 7.215 12.237 ( -0.049 -4.615 -3.125) 5.574 12.421 ( -0.860 1.115 2.517) 2.884 12.472 ( 0.298 2.016 -1.570) 2.573 13.062 ( -0.991 1.074 1.888) 2.387 13.109 ( 0.146 1.419 -1.805) 2.300 13.759 ( -1.307 -7.622 4.003) 8.707 13.856 ( -0.212 -6.760 -4.334) 8.033 15.880 ( -1.995 0.008 5.017) 5.400 16.052 ( 5.523 -3.481 -4.393) 7.869 17.701 ( -5.619 5.858 2.065) 8.376 17.787 ( -11.270 1.606 -1.344) 11.463 17.794 ( 2.450 9.581 1.356) 9.982 18.088 ( 18.198 -4.308 -2.404) 18.855 18.899 ( -8.606 -14.023 -0.035) 16.453 19.021 ( 6.189 -9.430 0.916) 11.317 19.248 ( -1.244 -5.821 0.608) 5.984 19.311 ( 4.308 -5.704 -1.696) 7.346 20.104 ( -8.409 -10.213 1.220) 13.286 20.246 ( 5.448 -7.378 -1.720) 9.331 21.024 ( -10.399 12.116 -0.006) 15.966 21.197 ( 12.769 12.976 0.735) 18.220 21.990 ( -1.692 4.976 0.022) 5.256 22.022 ( 2.427 5.475 1.090) 6.087 22.304 ( -1.928 -2.602 3.120) 4.497 22.443 ( 3.445 0.275 -7.509) 8.266 22.873 ( -3.606 0.164 9.306) 9.982 23.046 ( 0.184 1.195 -6.736) 6.843 23.372 ( -2.663 1.822 6.486) 7.245 23.499 ( -3.366 0.764 -6.680) 7.519 ======================= Grid point 165 (67/102) ======================= q-point: ( 0.27 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( 13.027 0.000 10.166) 16.524 1.166 ( 14.923 0.000 5.897) 16.046 1.318 ( 19.907 0.000 -6.621) 20.979 1.469 ( 21.794 0.000 -7.129) 22.931 2.101 ( 12.042 0.000 0.236) 12.044 2.116 ( 26.763 0.000 -1.986) 26.837 2.275 ( 17.025 0.000 -6.645) 18.276 2.415 ( -0.312 -0.000 7.497) 7.504 2.569 ( -2.449 -0.000 3.682) 4.422 2.587 ( -11.765 -0.000 6.386) 13.386 2.642 ( 10.226 0.000 -7.196) 12.504 2.726 ( -3.168 -0.000 -2.075) 3.787 2.939 ( 1.087 0.000 0.291) 1.125 3.073 ( 6.796 0.000 -2.215) 7.148 3.140 ( -2.444 -0.000 -3.742) 4.469 3.268 ( -4.452 -0.000 3.899) 5.918 3.470 ( -2.076 -0.000 -5.631) 6.001 3.484 ( 3.973 0.000 1.571) 4.273 3.581 ( -3.203 -0.000 -4.905) 5.858 3.617 ( -1.881 -0.000 10.015) 10.190 3.712 ( -2.635 -0.000 4.200) 4.958 3.758 ( 3.212 0.000 -5.570) 6.430 3.925 ( -0.532 -0.000 -4.611) 4.642 4.005 ( 2.284 0.000 4.937) 5.439 4.290 ( -11.493 -0.000 1.492) 11.590 4.328 ( 1.089 0.000 3.316) 3.490 4.466 ( -2.599 -0.000 2.032) 3.299 4.495 ( -4.345 -0.000 -3.035) 5.300 4.573 ( -7.218 -0.000 -1.293) 7.333 4.760 ( -3.443 -0.000 -1.556) 3.779 4.903 ( 2.861 0.000 -3.569) 4.574 4.918 ( -8.931 -0.000 1.022) 8.989 4.999 ( -2.667 -0.000 2.253) 3.492 5.100 ( 4.422 0.000 -4.607) 6.385 5.148 ( -7.997 -0.000 0.871) 8.044 5.171 ( -3.709 -0.000 -2.411) 4.423 5.217 ( -5.746 -0.000 2.189) 6.149 5.367 ( 4.706 0.000 2.411) 5.287 5.566 ( -10.807 -0.000 9.814) 14.598 5.814 ( -0.419 -0.000 -10.025) 10.034 6.068 ( 9.492 0.000 -4.395) 10.461 6.068 ( 0.128 0.000 5.295) 5.297 6.291 ( -8.086 -0.000 5.810) 9.957 6.420 ( -0.758 -0.000 -4.132) 4.201 6.794 ( 5.156 0.000 -2.747) 5.842 6.943 ( 11.527 0.000 2.818) 11.866 7.167 ( 6.571 0.000 -1.982) 6.863 7.219 ( -2.415 -0.000 2.020) 3.148 7.481 ( 5.321 0.000 1.815) 5.622 7.739 ( 4.124 0.000 -6.491) 7.690 7.995 ( -2.469 -0.000 -2.668) 3.635 8.087 ( 10.843 0.000 -2.327) 11.090 8.186 ( -3.556 -0.000 5.330) 6.407 8.528 ( -9.138 -0.000 -1.448) 9.252 8.598 ( 0.431 0.000 -7.750) 7.762 8.699 ( -14.857 -0.000 10.799) 18.367 8.980 ( 2.850 0.000 -2.650) 3.892 9.165 ( -2.659 -0.000 -0.913) 2.812 9.452 ( -0.217 -0.000 10.368) 10.370 9.861 ( 8.775 0.000 -8.326) 12.096 9.878 ( 13.025 0.000 -8.238) 15.412 10.053 ( -8.524 -0.000 7.859) 11.594 10.318 ( -6.756 -0.000 4.275) 7.995 10.321 ( 2.075 0.000 -8.987) 9.224 10.604 ( 4.037 0.000 -1.995) 4.504 10.667 ( -3.021 -0.000 5.599) 6.362 11.086 ( 5.290 0.000 2.613) 5.900 11.165 ( 5.961 0.000 0.383) 5.973 11.228 ( 10.414 0.000 0.900) 10.453 11.548 ( 6.220 0.000 3.152) 6.973 11.739 ( -6.064 -0.000 -5.204) 7.991 11.760 ( 7.578 0.000 3.528) 8.359 12.151 ( -5.481 -0.000 1.438) 5.666 12.216 ( -1.571 -0.000 -1.959) 2.511 12.880 ( -1.827 -0.000 -0.666) 1.944 12.912 ( -1.514 -0.000 0.213) 1.529 13.302 ( 14.224 0.000 5.810) 15.365 13.323 ( 9.582 0.000 -4.351) 10.524 13.837 ( -3.940 -0.000 0.327) 3.953 13.841 ( -5.042 -0.000 -0.903) 5.123 15.867 ( -5.175 -0.000 0.834) 5.242 16.271 ( -21.259 -0.000 2.743) 21.435 17.599 ( 8.421 0.000 -2.742) 8.856 17.611 ( 10.411 0.000 4.014) 11.158 18.274 ( 8.714 0.000 6.053) 10.610 18.304 ( 8.011 0.000 -5.411) 9.667 18.901 ( -11.299 -0.000 -3.629) 11.867 18.926 ( -13.472 -0.000 2.370) 13.678 19.799 ( 1.283 0.000 1.244) 1.787 20.001 ( -5.233 -0.000 0.257) 5.239 20.444 ( -3.011 -0.000 6.128) 6.828 20.611 ( 12.764 0.000 -16.537) 20.890 20.876 ( 8.018 0.000 9.282) 12.266 21.082 ( 16.405 0.000 -9.224) 18.820 21.930 ( 0.778 0.000 4.791) 4.853 22.036 ( 6.449 0.000 -2.939) 7.087 22.263 ( -11.234 -0.000 12.477) 16.790 22.424 ( 2.333 0.000 2.427) 3.366 22.444 ( 1.772 0.000 -0.122) 1.776 22.660 ( -6.887 -0.000 -6.611) 9.547 22.915 ( -5.997 -0.000 -0.244) 6.002 22.930 ( -5.492 -0.000 0.236) 5.498 ======================= Grid point 166 (68/102) ======================= q-point: ( 0.36 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( 14.799 -4.904 2.473) 15.785 1.399 ( 7.931 -11.246 7.189) 15.526 1.439 ( 16.725 1.369 -3.924) 17.234 1.630 ( 18.643 -1.608 -6.457) 19.795 2.113 ( 5.954 2.914 2.567) 7.109 2.257 ( -7.190 8.624 5.174) 12.363 2.330 ( 19.642 -3.906 -7.947) 21.546 2.397 ( 7.286 -1.922 1.262) 7.640 2.603 ( -0.477 -5.959 2.792) 6.597 2.647 ( -6.524 -5.728 1.247) 8.771 2.727 ( -1.082 -3.675 1.420) 4.086 2.782 ( 11.016 -5.709 -6.529) 14.021 2.951 ( 4.488 0.124 -2.822) 5.303 3.089 ( 3.900 1.637 -1.035) 4.355 3.155 ( -1.569 -2.062 0.393) 2.621 3.255 ( -1.792 -0.425 4.662) 5.012 3.398 ( -2.198 3.116 -2.429) 4.521 3.491 ( 0.258 1.724 -0.581) 1.838 3.576 ( -4.643 0.283 2.962) 5.515 3.607 ( 1.869 0.323 -0.812) 2.063 3.702 ( -4.661 0.701 1.830) 5.057 3.767 ( 5.955 -0.176 -3.212) 6.768 3.882 ( 0.742 4.297 -2.284) 4.923 3.996 ( -1.948 0.836 5.029) 5.457 4.156 ( -2.309 6.394 -0.602) 6.825 4.314 ( -4.770 4.074 2.114) 6.620 4.415 ( -3.007 1.425 -1.299) 3.572 4.504 ( -3.123 -1.622 -0.162) 3.523 4.558 ( -2.881 -2.419 1.880) 4.205 4.689 ( 0.918 2.349 -2.076) 3.267 4.799 ( -5.641 -0.033 -3.710) 6.751 4.937 ( -6.237 2.090 2.154) 6.922 4.997 ( -6.635 -0.999 -0.089) 6.710 5.087 ( -4.085 0.186 -1.427) 4.331 5.128 ( -5.701 -2.111 0.286) 6.086 5.206 ( -0.294 -8.940 -3.668) 9.668 5.230 ( -1.525 0.719 1.640) 2.352 5.384 ( 5.731 -0.056 3.733) 6.840 5.508 ( -7.229 -1.547 5.175) 9.024 5.871 ( -0.752 -5.761 -7.450) 9.448 5.990 ( 4.176 4.758 1.314) 6.466 6.201 ( 0.753 -2.521 2.666) 3.745 6.267 ( -0.868 -3.211 0.590) 3.378 6.420 ( 0.716 -1.424 -0.820) 1.792 6.827 ( 5.836 0.473 -2.290) 6.287 7.021 ( 9.632 0.835 2.631) 10.020 7.137 ( 1.688 3.108 0.107) 3.538 7.283 ( -1.348 -4.399 0.925) 4.693 7.509 ( 3.850 0.944 -0.921) 4.070 7.751 ( 1.332 0.655 -6.659) 6.823 7.960 ( -4.436 0.697 -0.590) 4.529 8.120 ( 5.559 2.117 1.119) 6.053 8.209 ( 2.156 -1.031 1.113) 2.636 8.414 ( -9.139 4.569 -0.456) 10.228 8.546 ( -8.451 4.327 1.695) 9.644 8.577 ( -1.285 1.930 -0.027) 2.319 9.003 ( -0.363 -0.054 -1.460) 1.506 9.131 ( -5.431 0.169 0.063) 5.434 9.461 ( 1.945 2.163 4.975) 5.764 9.781 ( 1.010 9.833 2.212) 10.129 9.916 ( -6.587 3.355 0.984) 7.457 9.958 ( 11.125 3.398 -6.588) 13.369 10.309 ( -1.570 -0.485 4.785) 5.059 10.379 ( 2.786 -3.527 -6.794) 8.147 10.569 ( 5.684 3.495 -1.679) 6.881 10.700 ( -1.586 -1.869 3.388) 4.181 11.066 ( 5.680 5.114 0.910) 7.697 11.186 ( 5.674 1.998 2.231) 6.416 11.384 ( 9.242 -5.791 0.375) 10.913 11.633 ( 5.981 -1.726 -0.849) 6.283 11.703 ( -3.262 -2.622 -2.093) 4.680 11.780 ( 4.708 3.347 2.226) 6.191 12.117 ( -3.121 0.469 0.434) 3.186 12.217 ( -1.243 -1.335 -0.747) 1.971 12.863 ( -1.583 -0.412 0.046) 1.636 12.927 ( -1.643 -2.864 -0.185) 3.307 13.212 ( 9.733 13.851 0.399) 16.933 13.349 ( 12.333 10.973 0.768) 16.526 13.731 ( -7.141 2.973 -0.838) 7.780 13.814 ( -4.983 2.693 -0.145) 5.666 15.832 ( -6.257 -0.751 1.168) 6.409 16.115 ( -17.343 1.067 0.278) 17.378 17.559 ( 9.718 7.224 -0.152) 12.110 17.723 ( 5.739 -1.685 0.636) 6.015 18.108 ( 14.398 7.629 -0.138) 16.295 18.609 ( 0.202 -6.881 1.805) 7.117 18.799 ( -8.011 0.930 -1.755) 8.253 18.964 ( -14.759 -14.238 0.515) 20.514 19.697 ( -1.066 11.023 2.126) 11.277 19.831 ( -3.240 11.337 -0.546) 11.804 20.230 ( 2.369 19.926 3.186) 20.318 20.535 ( 8.976 12.607 -10.090) 18.474 21.091 ( 3.961 -12.645 8.424) 15.702 21.246 ( 13.448 -6.489 -8.254) 17.061 21.930 ( 2.570 0.615 3.591) 4.458 22.087 ( 4.047 -2.084 1.561) 4.813 22.306 ( -3.693 -2.754 -0.417) 4.626 22.387 ( -2.367 0.608 0.576) 2.510 22.521 ( 0.435 -6.985 1.933) 7.260 22.697 ( -4.925 -7.109 -0.640) 8.672 22.871 ( -6.488 -0.341 -0.246) 6.502 22.940 ( -6.034 -5.727 -0.865) 8.364 ======================= Grid point 167 (69/102) ======================= q-point: ( 0.45 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 6.337 -1.738 2.280) 6.956 1.510 ( 14.515 -2.925 -1.427) 14.876 1.648 ( 4.448 -7.415 -0.972) 8.701 1.754 ( 6.457 -5.067 -0.062) 8.208 2.118 ( -0.570 2.406 3.200) 4.043 2.164 ( 5.149 -2.531 -0.654) 5.774 2.405 ( 4.285 -0.041 -2.565) 4.994 2.577 ( 5.693 -6.840 -0.668) 8.925 2.660 ( 1.230 -1.859 -1.601) 2.744 2.712 ( -10.889 -5.257 1.233) 12.154 2.771 ( 4.377 -2.610 -0.653) 5.138 2.972 ( 5.637 -2.807 1.158) 6.402 3.002 ( 6.913 -3.881 -4.825) 9.281 3.096 ( 6.269 1.040 0.459) 6.371 3.150 ( -3.874 -0.887 4.157) 5.751 3.247 ( -3.820 0.345 1.263) 4.038 3.364 ( 3.520 0.812 0.296) 3.625 3.440 ( -6.190 5.369 2.599) 8.596 3.489 ( 1.887 -0.101 -1.699) 2.541 3.632 ( -5.182 0.964 -1.651) 5.524 3.670 ( -0.140 -2.318 0.210) 2.331 3.756 ( -1.392 7.667 -0.557) 7.812 3.839 ( 6.592 -1.410 -0.887) 6.800 4.019 ( 4.134 -0.344 3.477) 5.413 4.035 ( -1.298 4.740 -2.105) 5.346 4.180 ( -6.354 5.381 0.385) 8.336 4.343 ( -2.579 3.734 -0.877) 4.622 4.518 ( -2.325 2.695 1.178) 3.749 4.540 ( -2.662 -3.512 -1.329) 4.603 4.668 ( -6.846 1.300 -0.491) 6.986 4.801 ( -2.173 -3.494 -2.037) 4.591 4.902 ( 1.041 -1.345 -0.851) 1.902 4.930 ( -4.300 0.724 2.393) 4.974 5.051 ( -7.217 -1.959 -0.031) 7.478 5.124 ( 0.802 3.805 0.621) 3.938 5.195 ( -6.467 -4.634 0.693) 7.986 5.351 ( -1.877 -7.872 0.205) 8.095 5.512 ( 8.275 -5.390 -2.455) 10.176 5.537 ( -3.281 -4.221 4.642) 7.081 5.892 ( 0.332 0.293 -2.576) 2.613 5.995 ( 1.841 -0.113 -0.076) 1.846 6.203 ( -2.917 -1.642 -0.940) 3.477 6.370 ( 2.972 -3.969 4.652) 6.799 6.500 ( 5.495 -5.073 -2.412) 7.858 6.845 ( 4.675 1.463 -1.532) 5.133 7.065 ( 7.401 2.674 2.002) 8.121 7.095 ( 0.094 1.868 0.384) 1.909 7.336 ( -2.380 -2.980 0.332) 3.828 7.488 ( -0.240 3.331 -0.117) 3.342 7.664 ( -0.994 7.966 -5.585) 9.779 7.905 ( -3.099 2.314 1.264) 4.069 8.114 ( 0.612 2.603 3.713) 4.576 8.219 ( 1.351 1.804 -1.058) 2.490 8.243 ( -6.660 6.124 -4.504) 10.107 8.449 ( -2.986 0.794 1.117) 3.285 8.578 ( -0.100 -2.295 0.759) 2.420 8.979 ( 0.623 1.535 -2.218) 2.769 9.076 ( -8.021 0.710 2.483) 8.426 9.379 ( 2.944 10.377 1.156) 10.848 9.601 ( -4.415 8.972 1.063) 10.056 9.790 ( -0.097 4.827 7.564) 8.973 10.007 ( 11.081 1.177 -8.941) 14.286 10.315 ( -1.686 -0.455 3.844) 4.222 10.426 ( 0.213 -2.106 -2.009) 2.918 10.597 ( 8.191 -1.100 -4.697) 9.506 10.719 ( -1.219 -1.014 3.084) 3.467 11.024 ( 5.020 4.214 0.098) 6.555 11.164 ( 0.343 3.225 1.424) 3.542 11.538 ( 7.770 -2.878 -0.948) 8.340 11.647 ( 3.103 0.971 0.643) 3.314 11.714 ( 3.233 5.037 -1.080) 6.082 11.803 ( 5.055 -2.452 1.387) 5.787 12.091 ( -0.947 0.817 -0.534) 1.360 12.224 ( -2.700 -0.665 0.300) 2.797 12.877 ( 2.384 0.333 0.694) 2.506 12.984 ( -2.112 -3.407 -0.394) 4.028 13.017 ( 6.738 11.294 0.289) 13.154 13.142 ( 9.298 19.206 -0.308) 21.340 13.627 ( -7.337 3.538 0.262) 8.150 13.692 ( -5.466 4.982 -1.024) 7.466 15.811 ( -4.973 -1.464 0.835) 5.251 15.993 ( -11.754 0.426 -0.313) 11.766 17.524 ( 8.312 3.780 -0.125) 9.132 17.760 ( -0.066 -0.069 0.272) 0.288 18.154 ( 15.392 1.875 0.074) 15.506 18.599 ( -4.043 4.028 1.091) 5.811 18.744 ( -2.252 0.649 -0.789) 2.473 19.108 ( -12.598 -9.675 -1.515) 15.956 19.507 ( -3.316 5.599 3.616) 7.445 19.617 ( -2.774 9.327 -2.226) 9.982 19.888 ( 6.575 21.374 4.714) 22.854 20.290 ( 5.293 17.927 -6.530) 19.800 21.349 ( 3.589 -10.427 5.885) 12.500 21.442 ( 9.474 -7.222 -5.104) 12.960 21.949 ( 4.092 0.915 -0.067) 4.194 22.184 ( 1.985 -3.978 5.232) 6.865 22.233 ( -2.707 4.602 -1.877) 5.659 22.413 ( -1.580 -2.979 -5.537) 6.483 22.662 ( -0.757 -7.307 2.569) 7.783 22.802 ( -2.927 -6.978 2.336) 7.920 22.845 ( -7.435 -4.231 0.420) 8.565 23.017 ( -6.076 -7.302 -1.893) 9.686 ======================= Grid point 168 (70/102) ======================= q-point: ( 0.55 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 0.076 -1.709 5.302) 5.571 1.622 ( 6.673 1.197 -5.642) 8.820 1.789 ( 7.820 -7.722 -2.903) 11.367 1.951 ( -2.541 -11.622 0.646) 11.914 2.125 ( 2.359 -1.223 5.186) 5.828 2.259 ( 2.239 -3.504 -2.160) 4.686 2.455 ( 5.440 -2.576 -2.515) 6.523 2.608 ( -4.439 0.183 1.486) 4.685 2.674 ( -3.861 1.505 -0.831) 4.226 2.748 ( 0.042 -4.013 -4.003) 5.668 2.837 ( 0.621 3.254 5.660) 6.558 2.933 ( 2.016 1.071 1.135) 2.550 3.119 ( -1.072 0.227 1.211) 1.633 3.133 ( 9.035 -2.594 -4.300) 10.337 3.224 ( -1.419 -0.034 -0.507) 1.507 3.227 ( 1.111 -5.485 -0.322) 5.605 3.341 ( -0.093 3.673 5.133) 6.313 3.398 ( 3.934 -1.702 -0.259) 4.294 3.518 ( -1.383 -1.686 1.028) 2.411 3.582 ( -4.413 1.161 -3.998) 6.067 3.636 ( -1.306 0.970 0.543) 1.715 3.688 ( 1.045 1.213 -1.646) 2.296 3.887 ( -0.418 -1.805 3.056) 3.573 3.910 ( 0.399 6.841 -0.470) 6.868 4.046 ( -3.248 3.866 -1.674) 5.320 4.115 ( 2.625 -3.483 -0.360) 4.376 4.249 ( -1.955 3.141 0.323) 3.714 4.457 ( -4.114 4.398 1.584) 6.227 4.548 ( -5.944 -0.244 -1.319) 6.094 4.572 ( -5.810 -1.629 -1.412) 6.197 4.863 ( 0.410 -1.405 0.276) 1.490 4.933 ( 2.939 -3.046 2.369) 4.850 4.995 ( 3.448 -5.276 -1.149) 6.406 5.077 ( -4.431 -6.117 0.280) 7.559 5.085 ( -0.939 -0.036 2.233) 2.423 5.226 ( -4.449 -2.434 -2.538) 5.671 5.455 ( -0.531 -4.510 0.611) 4.582 5.617 ( -3.957 -5.955 4.231) 8.308 5.626 ( 7.978 -0.898 -4.102) 9.015 5.899 ( -0.795 -1.363 -2.911) 3.311 5.989 ( 3.342 1.903 3.712) 5.345 6.224 ( -2.222 -3.085 -4.107) 5.597 6.463 ( 2.528 -2.004 7.874) 8.509 6.627 ( 5.028 -4.220 -4.297) 7.846 6.839 ( 2.783 1.692 -0.843) 3.364 6.997 ( -1.119 5.248 -2.757) 6.033 7.117 ( 5.048 0.727 5.629) 7.596 7.345 ( -1.071 2.316 -4.089) 4.820 7.371 ( -5.309 7.604 3.709) 9.988 7.467 ( -1.233 9.389 -2.703) 9.848 7.840 ( -0.569 3.199 0.619) 3.307 8.043 ( -4.959 4.934 -3.435) 7.794 8.069 ( -4.763 4.024 4.873) 7.914 8.215 ( 2.635 0.680 -6.558) 7.100 8.467 ( 1.689 -1.115 1.709) 2.649 8.626 ( -3.609 -2.622 1.064) 4.586 8.967 ( 6.328 1.552 -3.850) 7.568 9.009 ( -7.599 0.313 4.596) 8.886 9.200 ( 2.896 9.932 2.603) 10.668 9.411 ( -4.408 7.190 -2.165) 8.707 9.778 ( 2.896 1.182 8.042) 8.629 10.016 ( 6.771 3.495 -7.495) 10.688 10.330 ( 1.275 -0.927 2.648) 3.081 10.456 ( -2.304 -2.561 -1.882) 3.926 10.685 ( 6.677 -2.923 -3.529) 8.098 10.736 ( -1.481 -1.416 2.570) 3.287 10.989 ( 3.263 3.042 -0.468) 4.486 11.097 ( -3.949 2.598 0.479) 4.751 11.527 ( 2.045 6.618 1.464) 7.080 11.623 ( 2.947 6.797 -2.324) 7.764 11.709 ( 7.973 -0.406 2.558) 8.384 11.842 ( 5.753 3.460 -0.877) 6.771 12.070 ( 1.049 1.320 -0.912) 1.917 12.190 ( -5.074 1.650 0.795) 5.394 12.770 ( 7.102 12.119 0.174) 14.048 12.856 ( 2.687 15.213 -0.152) 15.449 12.987 ( -0.512 -4.654 1.776) 5.008 13.095 ( 0.884 -6.390 -1.683) 6.666 13.488 ( -4.613 6.305 1.437) 7.943 13.579 ( -4.847 3.402 -2.059) 6.269 15.814 ( -2.469 -1.644 0.754) 3.061 15.925 ( -7.070 -0.607 -0.392) 7.107 17.542 ( 6.756 0.657 -0.030) 6.788 17.738 ( -4.915 -0.004 0.044) 4.915 18.220 ( 11.517 2.517 0.080) 11.789 18.455 ( -5.032 7.368 0.373) 8.930 18.731 ( 3.456 1.941 1.715) 4.319 19.099 ( -5.417 1.262 -6.572) 8.610 19.437 ( -0.256 3.151 3.381) 4.629 19.528 ( -7.888 -5.124 -0.160) 9.407 19.613 ( 6.599 16.018 5.688) 18.234 19.967 ( 0.082 18.317 -4.794) 18.934 21.526 ( 8.557 -3.439 1.589) 9.357 21.616 ( 2.213 -7.560 0.274) 7.882 21.959 ( 3.188 0.471 -2.174) 3.888 22.096 ( -3.241 6.364 -1.543) 7.306 22.268 ( -2.731 -2.889 6.906) 7.969 22.439 ( 1.369 -1.847 -8.361) 8.671 22.766 ( -2.103 -4.563 7.098) 8.696 22.867 ( 0.822 -4.744 -4.267) 6.433 22.973 ( -4.475 -10.632 2.424) 11.787 23.091 ( -5.031 -6.185 -1.492) 8.111 ======================= Grid point 169 (71/102) ======================= q-point: ( 0.64 0.27 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -0.556 -3.398 2.643) 4.341 1.644 ( 6.041 -1.149 -7.305) 9.549 1.942 ( 0.378 -4.040 3.154) 5.139 2.046 ( -2.187 -1.547 -3.137) 4.126 2.230 ( -1.520 -6.362 7.875) 10.237 2.319 ( 2.183 -3.703 -2.409) 4.928 2.498 ( 1.045 4.099 1.248) 4.410 2.565 ( -1.106 2.401 -1.816) 3.208 2.618 ( 2.916 3.018 -0.619) 4.242 2.689 ( -8.574 2.147 2.280) 9.129 2.864 ( 6.562 -4.712 -0.750) 8.113 2.969 ( -0.814 -2.285 -1.758) 2.996 3.122 ( 1.143 0.283 1.462) 1.877 3.179 ( 4.703 3.450 -2.464) 6.331 3.215 ( -2.988 -1.027 2.445) 3.996 3.276 ( -4.015 -1.471 0.226) 4.282 3.314 ( 5.005 1.349 -1.158) 5.311 3.360 ( -1.871 8.160 0.715) 8.402 3.529 ( -4.630 -1.430 0.900) 4.928 3.581 ( 6.503 -3.482 -7.337) 10.404 3.662 ( 1.696 -1.861 0.436) 2.555 3.705 ( -4.101 -4.134 1.245) 5.955 3.843 ( 3.234 1.627 2.341) 4.311 3.908 ( -5.451 -1.550 2.365) 6.140 4.015 ( 4.595 -0.913 -0.427) 4.704 4.112 ( -4.769 0.227 -1.593) 5.033 4.282 ( 2.710 -1.671 0.104) 3.186 4.320 ( -4.083 3.092 0.912) 5.202 4.548 ( -0.375 -1.415 -1.193) 1.888 4.578 ( -6.395 -4.019 -0.022) 7.553 4.883 ( 2.051 -0.374 2.757) 3.456 4.973 ( -0.533 -0.333 -0.777) 0.999 5.101 ( -0.980 -2.691 0.661) 2.939 5.133 ( 1.202 -4.133 0.500) 4.333 5.192 ( 1.551 -2.860 0.682) 3.324 5.247 ( -0.505 -8.429 -2.669) 8.856 5.494 ( 0.194 0.414 0.870) 0.983 5.631 ( -0.319 1.312 -6.840) 6.972 5.699 ( 0.999 -2.192 6.881) 7.290 5.887 ( -2.559 -0.037 -4.137) 4.865 6.034 ( 5.932 -1.089 5.590) 8.223 6.253 ( -3.291 -3.203 -5.975) 7.536 6.485 ( 2.673 3.515 7.546) 8.743 6.662 ( 0.688 2.825 -3.728) 4.727 6.828 ( -0.561 3.355 0.918) 3.524 6.888 ( -0.404 2.780 -3.339) 4.363 7.119 ( 0.815 4.678 4.297) 6.403 7.168 ( -5.054 9.785 4.391) 11.856 7.210 ( 4.528 6.770 -2.992) 8.677 7.375 ( -2.977 2.306 -3.199) 4.941 7.804 ( 1.175 0.916 0.113) 1.494 7.921 ( -5.555 1.764 -4.204) 7.186 8.021 ( -1.555 1.489 6.471) 6.820 8.206 ( 2.351 0.731 -8.928) 9.261 8.464 ( 1.639 4.145 4.498) 6.332 8.585 ( -2.938 2.872 -0.714) 4.170 8.963 ( -3.679 -0.808 4.746) 6.059 9.033 ( 3.289 -2.289 -3.852) 5.559 9.151 ( 7.177 -0.833 2.543) 7.660 9.299 ( -6.577 0.533 0.287) 6.604 9.784 ( 3.218 2.828 4.419) 6.155 9.951 ( 3.311 6.033 -6.222) 9.278 10.373 ( 1.089 -1.777 3.526) 4.096 10.482 ( -0.616 -2.710 -4.015) 4.883 10.728 ( -2.152 -0.283 3.103) 3.787 10.789 ( 2.899 -2.868 -2.941) 5.028 10.967 ( 2.629 1.533 -0.453) 3.077 11.025 ( -5.625 1.280 0.254) 5.774 11.390 ( -0.212 9.286 4.462) 10.304 11.503 ( 2.423 7.812 -4.495) 9.333 11.730 ( 4.712 4.891 2.033) 7.089 11.769 ( 4.894 7.500 -1.039) 9.015 12.058 ( 2.645 1.245 -0.962) 3.078 12.105 ( -5.874 2.426 0.952) 6.427 12.643 ( 2.552 6.169 0.108) 6.677 12.662 ( 0.747 7.633 -0.077) 7.669 13.096 ( 1.059 -6.126 2.677) 6.769 13.210 ( -1.010 -5.866 -2.540) 6.471 13.367 ( 0.010 5.101 2.600) 5.725 13.488 ( -3.734 2.126 -3.065) 5.278 15.834 ( -0.243 -1.351 1.386) 1.951 15.903 ( -3.378 -1.408 -1.035) 3.803 17.596 ( 6.252 -1.282 0.093) 6.383 17.704 ( -6.970 -1.460 -0.180) 7.123 18.235 ( 7.331 3.176 -0.706) 8.021 18.303 ( -4.683 5.041 0.592) 6.905 18.708 ( 3.476 4.911 5.350) 8.051 18.974 ( -2.783 6.219 -9.900) 12.018 19.398 ( 4.119 10.525 9.364) 14.678 19.506 ( 7.131 -0.833 -2.871) 7.732 19.546 ( -3.949 1.607 0.472) 4.290 19.688 ( -9.185 2.489 -2.173) 9.761 21.604 ( 11.058 3.221 0.658) 11.536 21.713 ( -5.749 -2.804 2.047) 6.716 21.971 ( -1.291 1.388 -1.183) 2.235 21.990 ( 1.660 -0.967 -4.086) 4.515 22.295 ( -2.572 -1.041 6.534) 7.099 22.447 ( 0.355 0.065 -6.139) 6.150 22.855 ( -0.390 -5.170 4.493) 6.861 22.942 ( 1.044 -2.569 -2.142) 3.504 23.127 ( -2.062 -8.438 1.196) 8.768 23.175 ( -1.710 -7.030 -1.390) 7.367 ======================= Grid point 170 (72/102) ======================= q-point: (-0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 1.680 0.288 3.165) 3.595 1.719 ( 3.909 -3.932 -8.691) 10.309 1.904 ( -5.921 6.428 4.405) 9.787 2.008 ( 3.535 5.980 -4.239) 8.138 2.262 ( -7.072 4.911 11.055) 14.012 2.350 ( -2.633 2.112 1.133) 3.561 2.403 ( -2.128 1.222 -0.371) 2.482 2.512 ( 8.508 1.708 -5.358) 10.199 2.636 ( -0.318 -1.193 0.050) 1.236 2.661 ( 0.699 -2.424 -1.558) 2.965 2.988 ( -6.405 -2.891 1.907) 7.282 3.016 ( -0.063 2.988 4.142) 5.108 3.036 ( 1.543 -0.262 -1.719) 2.325 3.131 ( 4.083 3.720 -4.535) 7.147 3.206 ( 0.466 1.651 4.859) 5.153 3.281 ( 4.040 -3.298 -0.143) 5.217 3.304 ( -0.974 -0.226 -3.118) 3.274 3.318 ( 0.065 -0.427 -2.571) 2.607 3.533 ( -3.108 -1.037 2.856) 4.346 3.635 ( 2.359 -1.870 -5.299) 6.095 3.695 ( -3.199 -0.878 2.375) 4.080 3.757 ( 1.501 -2.362 -2.452) 3.721 3.888 ( -0.011 -1.907 2.126) 2.856 3.904 ( 0.050 -1.866 0.796) 2.030 4.060 ( -1.751 1.757 0.243) 2.493 4.090 ( 3.375 -1.466 -2.232) 4.303 4.239 ( -7.072 -1.810 6.467) 9.752 4.385 ( 8.506 -1.646 -6.168) 10.635 4.575 ( -0.689 -1.848 3.819) 4.298 4.627 ( -3.132 -5.439 -0.911) 6.342 4.922 ( 3.859 -0.752 0.571) 3.973 4.951 ( -2.910 1.135 -1.158) 3.331 5.126 ( -3.775 -2.189 0.660) 4.414 5.163 ( 2.061 -0.714 -1.889) 2.886 5.282 ( -0.093 -6.003 5.908) 8.423 5.417 ( 4.080 -5.321 -6.061) 9.039 5.462 ( 0.836 1.982 2.837) 3.560 5.559 ( -3.582 3.085 -5.407) 7.182 5.735 ( 0.592 0.569 5.741) 5.799 5.858 ( -0.726 1.196 -4.312) 4.533 6.102 ( 0.463 -1.342 7.458) 7.592 6.242 ( -3.244 -0.314 -4.892) 5.878 6.460 ( 6.845 3.862 1.755) 8.053 6.515 ( -3.857 8.820 -2.723) 10.005 6.719 ( 0.296 6.178 3.623) 7.168 6.788 ( -1.850 10.815 -2.184) 11.188 7.037 ( 2.846 4.935 2.774) 6.337 7.084 ( -2.856 -4.352 -1.660) 5.464 7.174 ( 2.950 2.859 3.541) 5.423 7.279 ( -1.607 4.819 -4.872) 7.038 7.815 ( 1.370 -0.109 1.069) 1.741 7.885 ( -1.482 -1.760 -3.764) 4.412 8.007 ( -1.494 0.395 5.027) 5.259 8.183 ( 3.740 1.757 -9.575) 10.429 8.386 ( -3.823 3.530 8.987) 10.385 8.558 ( 5.055 0.214 -5.855) 7.739 8.979 ( -4.037 -2.665 5.528) 7.346 9.085 ( -0.440 -3.528 -2.199) 4.181 9.260 ( -4.058 -4.066 4.161) 7.094 9.310 ( 2.785 -5.423 1.002) 6.178 9.737 ( 1.807 4.922 0.723) 5.293 9.837 ( 1.883 6.710 -6.775) 9.719 10.410 ( -4.617 -2.301 5.155) 7.293 10.534 ( 5.623 -1.841 -5.492) 8.072 10.702 ( -1.288 2.552 4.320) 5.180 10.806 ( -0.632 1.422 -4.349) 4.619 10.970 ( -1.032 -0.429 1.624) 1.972 10.991 ( 0.523 -0.060 -0.094) 0.535 11.247 ( -1.111 6.169 4.597) 7.773 11.372 ( 1.149 6.542 -6.157) 9.057 11.623 ( 0.311 7.386 3.494) 8.177 11.678 ( -0.107 4.911 -1.556) 5.152 12.048 ( -3.331 0.338 0.894) 3.466 12.069 ( 3.395 -0.336 -0.905) 3.529 12.565 ( -0.510 3.683 0.663) 3.777 12.580 ( 0.355 2.965 -0.593) 3.045 13.193 ( 0.426 -0.663 1.347) 1.561 13.227 ( 0.190 1.005 -1.657) 1.947 13.355 ( -0.718 -2.758 5.262) 5.984 13.479 ( 0.091 -4.626 -5.213) 6.970 15.858 ( 0.284 -0.679 2.664) 2.764 15.918 ( -0.245 -2.037 -2.337) 3.110 17.678 ( 2.384 -2.733 0.619) 3.679 17.694 ( -2.691 -2.952 -0.726) 4.059 18.202 ( -4.689 2.906 0.439) 5.534 18.224 ( 6.234 3.902 -1.605) 7.528 18.634 ( -2.820 4.460 7.875) 9.480 18.829 ( 1.887 6.360 -9.064) 11.233 19.268 ( -1.510 6.056 4.607) 7.758 19.343 ( 1.045 9.474 -2.156) 9.772 19.694 ( 3.312 -7.466 1.042) 8.234 19.719 ( -3.118 -8.815 -0.977) 9.401 21.567 ( -1.753 6.554 2.968) 7.405 21.637 ( 1.558 5.770 -2.719) 6.566 21.991 ( -1.372 -3.997 1.559) 4.504 22.056 ( 3.017 -3.723 -3.973) 6.225 22.294 ( -2.244 1.012 6.136) 6.611 22.429 ( 0.826 0.456 -5.678) 5.756 22.937 ( -0.045 -1.039 2.219) 2.451 22.972 ( -0.003 -2.848 -0.055) 2.848 23.245 ( -0.877 -5.771 2.067) 6.192 23.304 ( 0.858 -7.244 -2.616) 7.749 ======================= Grid point 171 (73/102) ======================= q-point: (-0.18 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( -1.361 5.070 7.442) 9.107 1.655 ( -2.181 14.313 2.607) 14.712 1.790 ( 3.983 3.286 -4.011) 6.538 1.851 ( 1.814 9.952 -5.270) 11.407 2.132 ( -0.944 5.082 1.709) 5.444 2.254 ( 2.522 3.816 -3.258) 5.616 2.416 ( -2.690 -0.771 0.220) 2.807 2.512 ( 6.559 7.480 -3.056) 10.407 2.616 ( -2.210 -0.537 3.577) 4.239 2.741 ( 3.093 -1.472 -1.177) 3.622 2.876 ( -2.968 7.031 6.657) 10.127 2.970 ( 1.343 -0.001 1.391) 1.934 3.063 ( -2.824 -0.253 -2.298) 3.650 3.173 ( 5.861 0.797 -4.032) 7.158 3.207 ( -4.893 1.074 -0.248) 5.016 3.258 ( 0.447 -4.127 1.961) 4.591 3.342 ( -0.242 -2.878 -1.131) 3.101 3.417 ( 7.312 -1.543 -4.265) 8.604 3.528 ( -3.119 -1.738 4.890) 6.055 3.640 ( -5.428 1.530 -2.734) 6.267 3.696 ( -0.233 -1.768 0.977) 2.034 3.772 ( -0.520 -1.049 -2.796) 3.031 3.925 ( -4.745 -5.158 3.340) 7.764 3.970 ( 2.888 -1.328 1.348) 3.453 4.011 ( 1.032 1.020 0.235) 1.470 4.134 ( 4.793 -0.508 -4.367) 6.504 4.244 ( -5.095 -1.504 4.514) 6.971 4.449 ( 7.784 -0.107 -4.928) 9.213 4.610 ( -0.895 -1.157 7.060) 7.210 4.720 ( 1.339 -5.680 -2.913) 6.522 4.875 ( -6.023 2.870 -1.384) 6.814 4.955 ( 5.489 1.662 -0.748) 5.784 5.145 ( -4.182 -3.155 1.231) 5.381 5.209 ( 0.453 -3.093 -0.854) 3.240 5.362 ( -1.390 1.351 1.541) 2.476 5.418 ( 2.586 0.555 -3.187) 4.141 5.476 ( -3.527 -0.488 3.489) 4.985 5.530 ( 1.046 -3.247 -1.823) 3.868 5.710 ( 1.019 2.840 1.289) 3.281 5.797 ( 2.015 5.010 -3.618) 6.500 6.120 ( -4.348 -1.864 6.933) 8.393 6.237 ( 3.489 1.655 -1.567) 4.167 6.331 ( -5.981 3.757 1.311) 7.184 6.454 ( 3.496 7.348 0.862) 8.183 6.564 ( 0.336 6.502 -3.566) 7.423 6.676 ( 9.220 2.993 -2.608) 10.039 6.971 ( -0.584 5.211 6.659) 8.476 7.114 ( -0.027 1.597 -6.432) 6.628 7.173 ( 1.325 -0.048 2.934) 3.220 7.247 ( 3.127 -4.288 -1.480) 5.509 7.823 ( 1.402 0.067 2.608) 2.962 7.923 ( 3.638 -1.012 -6.129) 7.199 8.023 ( -1.886 -3.656 3.801) 5.601 8.163 ( 2.377 1.454 -6.301) 6.889 8.354 ( -4.935 -1.415 9.752) 11.021 8.594 ( 5.104 -0.895 -7.652) 9.241 9.008 ( -5.544 -2.805 5.709) 8.437 9.138 ( -1.373 -3.443 -3.215) 4.907 9.306 ( -8.669 -6.099 5.350) 11.873 9.426 ( 1.373 -3.330 4.756) 5.966 9.658 ( 0.644 4.095 -1.690) 4.476 9.739 ( 2.652 3.467 -8.732) 9.762 10.390 ( -8.461 0.640 3.227) 9.078 10.569 ( 7.422 4.290 -0.960) 8.626 10.665 ( 2.252 1.764 4.174) 5.061 10.751 ( 0.555 1.616 -5.678) 5.929 10.977 ( -1.296 -0.522 0.721) 1.572 10.997 ( 3.671 0.813 0.042) 3.760 11.194 ( -0.567 0.493 3.183) 3.271 11.283 ( 1.541 2.914 -4.054) 5.225 11.524 ( -5.077 2.544 3.337) 6.587 11.601 ( -2.560 1.324 -1.904) 3.454 12.047 ( -0.812 -1.944 0.732) 2.230 12.113 ( 2.787 -2.061 -1.049) 3.622 12.502 ( -1.311 2.941 1.411) 3.515 12.539 ( -0.079 1.800 -1.067) 2.094 13.147 ( -0.363 3.272 1.192) 3.501 13.197 ( 1.470 3.208 -2.208) 4.162 13.465 ( -2.092 -8.023 5.375) 9.881 13.592 ( 1.491 -7.306 -4.585) 8.754 15.874 ( 0.166 -0.258 3.467) 3.480 15.958 ( 1.853 -2.319 -3.227) 4.384 17.681 ( -8.620 -2.720 -0.300) 9.044 17.808 ( 8.904 -3.897 0.668) 9.743 18.096 ( -2.205 5.942 -0.264) 6.343 18.168 ( 4.061 6.932 -1.705) 8.213 18.576 ( -8.543 -2.135 5.160) 10.206 18.788 ( 7.345 -0.674 -4.214) 8.495 19.174 ( -5.991 1.734 0.398) 6.250 19.257 ( 4.643 2.699 0.184) 5.374 19.779 ( -9.222 -7.934 0.298) 12.169 19.943 ( 11.766 -8.702 -0.243) 14.636 21.374 ( -12.460 7.847 0.576) 14.736 21.564 ( 10.860 8.160 -0.943) 13.617 22.056 ( -2.159 -3.783 1.067) 4.485 22.114 ( 1.389 -0.281 -1.116) 1.804 22.259 ( -1.931 1.441 5.509) 6.013 22.431 ( 3.282 -0.493 -8.012) 8.673 22.915 ( -2.512 1.860 6.009) 6.773 23.032 ( 0.963 -2.401 -3.087) 4.027 23.329 ( -1.151 -3.679 3.517) 5.218 23.413 ( 0.027 -4.989 -3.574) 6.137 ======================= Grid point 172 (74/102) ======================= q-point: (-0.09 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( 0.122 15.735 3.338) 16.086 1.417 ( 2.733 14.501 2.565) 14.977 1.648 ( 1.498 9.586 1.518) 9.820 1.776 ( 7.459 5.475 -2.817) 9.672 2.041 ( 3.007 6.665 -0.185) 7.315 2.270 ( 4.966 1.025 -8.882) 10.228 2.359 ( 4.576 8.876 -0.265) 9.989 2.409 ( 7.558 2.904 -0.601) 8.119 2.556 ( -4.218 10.093 8.941) 14.128 2.678 ( -3.128 2.212 1.408) 4.082 2.850 ( 1.102 -0.365 0.060) 1.163 2.965 ( 9.406 6.525 -5.800) 12.833 3.050 ( -4.640 -1.014 2.287) 5.271 3.077 ( -1.733 1.619 1.112) 2.619 3.290 ( -1.804 -1.325 -1.763) 2.849 3.321 ( 1.319 -3.512 -0.777) 3.831 3.363 ( 0.185 0.162 -0.536) 0.590 3.399 ( 2.068 1.138 -0.374) 2.390 3.504 ( -7.283 2.926 0.076) 7.849 3.630 ( -0.743 -3.777 -0.933) 3.961 3.740 ( -1.203 -3.612 0.871) 3.905 3.786 ( -1.125 -1.103 -1.464) 2.151 3.952 ( -2.137 1.332 -1.014) 2.715 4.006 ( -4.764 -5.603 1.835) 7.580 4.070 ( 5.840 -1.947 2.457) 6.628 4.175 ( 1.431 -2.614 1.385) 3.286 4.241 ( -3.773 -1.584 1.121) 4.243 4.491 ( 4.822 -1.056 -2.171) 5.392 4.645 ( 2.103 -1.239 5.131) 5.682 4.735 ( -4.560 3.596 -5.842) 8.237 4.833 ( 3.570 -0.603 -0.236) 3.629 4.948 ( 3.626 1.937 -1.270) 4.302 5.172 ( -4.045 -2.645 1.209) 4.982 5.230 ( -6.146 -0.683 -1.569) 6.379 5.290 ( -7.096 2.329 1.767) 7.674 5.376 ( -1.021 1.292 0.199) 1.659 5.471 ( 1.693 1.898 -0.834) 2.677 5.631 ( 0.497 -5.070 0.547) 5.124 5.651 ( 1.972 5.740 -0.717) 6.112 5.777 ( 7.801 -0.234 -0.103) 7.806 6.117 ( -3.939 1.160 1.879) 4.516 6.229 ( 5.887 1.122 -3.204) 6.795 6.269 ( -0.067 1.578 2.535) 2.987 6.319 ( 3.135 6.454 4.949) 8.716 6.515 ( -2.826 0.675 -4.876) 5.676 6.778 ( 16.272 -4.353 -3.384) 17.181 6.889 ( 0.527 4.585 5.962) 7.540 7.066 ( 4.511 2.550 -5.751) 7.741 7.240 ( 1.628 -4.514 3.650) 6.030 7.364 ( 4.256 -4.422 -1.197) 6.253 7.861 ( 4.841 -0.908 3.550) 6.072 7.949 ( 2.692 -2.228 -5.421) 6.450 8.076 ( -1.543 0.427 0.188) 1.612 8.169 ( 2.394 -3.605 -2.624) 5.061 8.393 ( -5.671 -4.426 8.310) 10.991 8.621 ( 1.964 -1.187 -6.314) 6.718 9.018 ( -6.518 -2.318 5.177) 8.640 9.162 ( -2.366 -1.226 -3.107) 4.093 9.355 ( -7.536 -4.596 3.256) 9.408 9.480 ( -2.593 -2.394 9.171) 9.827 9.612 ( 0.132 0.469 -3.449) 3.484 9.714 ( 3.491 0.423 -8.819) 9.494 10.299 ( -4.943 2.994 1.486) 5.967 10.492 ( 5.786 7.393 0.778) 9.420 10.695 ( 3.306 -0.612 1.829) 3.827 10.737 ( 0.660 0.007 -4.201) 4.253 10.932 ( -1.497 3.280 1.422) 3.876 11.067 ( 5.969 -2.367 -1.255) 6.543 11.208 ( 1.608 -1.502 2.079) 3.027 11.270 ( 1.282 -0.319 -0.186) 1.334 11.474 ( -5.382 -1.649 0.111) 5.630 11.595 ( -1.384 -1.898 -0.550) 2.413 12.115 ( 1.131 -5.425 0.370) 5.554 12.173 ( 1.571 -2.947 -1.401) 3.622 12.450 ( -1.006 2.186 2.217) 3.272 12.505 ( 0.350 1.713 -1.364) 2.218 13.096 ( 0.051 2.683 1.637) 3.143 13.143 ( 0.240 2.811 -2.062) 3.494 13.605 ( -2.920 -8.516 2.958) 9.476 13.722 ( 0.307 -7.022 -2.737) 7.543 15.886 ( 0.481 0.006 3.578) 3.610 16.016 ( 3.264 -3.157 -3.400) 5.673 17.639 ( -10.405 -0.315 -0.880) 10.447 17.867 ( 0.398 5.121 2.191) 5.585 17.985 ( 3.094 8.382 0.449) 8.946 18.123 ( 11.902 -2.704 -2.500) 12.459 18.621 ( -8.976 -9.152 2.030) 12.979 18.927 ( 8.385 -7.381 -0.552) 11.185 19.132 ( -5.302 -2.276 -2.163) 6.162 19.293 ( 5.592 -2.100 1.481) 6.154 19.860 ( -9.091 -8.993 0.142) 12.788 20.168 ( 8.114 -7.035 -0.405) 10.747 21.134 ( -9.920 8.916 -0.177) 13.339 21.488 ( 10.901 9.547 0.335) 14.495 22.060 ( -1.950 4.397 0.100) 4.811 22.090 ( -0.268 -0.241 0.691) 0.780 22.264 ( -0.595 -1.095 4.632) 4.797 22.450 ( 4.178 -0.470 -9.640) 10.517 22.877 ( -4.000 1.380 9.149) 10.080 23.047 ( -0.000 0.158 -5.330) 5.332 23.366 ( -3.073 -0.968 4.722) 5.717 23.454 ( -3.253 -1.494 -4.410) 5.680 ======================= Grid point 178 (75/102) ======================= q-point: ( 0.36 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( 10.945 0.000 4.427) 11.806 1.376 ( 10.678 0.000 2.156) 10.894 1.583 ( 18.230 0.000 -3.140) 18.499 1.751 ( 18.479 0.000 -4.191) 18.948 2.184 ( -0.018 -0.000 2.437) 2.437 2.329 ( -9.732 -0.000 6.888) 11.923 2.388 ( -3.903 -0.000 -3.610) 5.317 2.414 ( -0.433 -0.000 0.955) 1.049 2.439 ( 12.375 0.000 -5.934) 13.724 2.577 ( -3.728 -0.000 3.199) 4.912 2.698 ( -0.171 -0.000 -0.758) 0.777 2.826 ( 16.113 0.000 -4.270) 16.669 3.008 ( 8.942 0.000 -2.723) 9.347 3.097 ( -2.543 -0.000 0.812) 2.669 3.134 ( -1.476 -0.000 2.142) 2.601 3.250 ( -0.213 -0.000 1.518) 1.532 3.425 ( 1.361 0.000 -3.467) 3.724 3.490 ( -5.877 -0.000 6.617) 8.850 3.523 ( 0.716 0.000 -10.742) 10.766 3.649 ( 0.320 0.000 4.562) 4.574 3.706 ( -0.435 -0.000 7.186) 7.199 3.783 ( 1.461 0.000 -5.375) 5.570 3.946 ( 8.070 0.000 -4.892) 9.437 3.971 ( -8.045 -0.000 6.868) 10.578 4.232 ( 1.665 0.000 1.267) 2.092 4.336 ( -2.326 -0.000 1.931) 3.023 4.426 ( -4.276 -0.000 -2.491) 4.949 4.462 ( 0.327 0.000 3.361) 3.376 4.500 ( 0.103 0.000 -0.807) 0.813 4.673 ( -5.399 -0.000 -5.632) 7.802 4.841 ( -5.021 -0.000 1.898) 5.368 4.878 ( -6.185 -0.000 -2.050) 6.516 4.917 ( -5.727 -0.000 2.415) 6.216 4.998 ( -10.048 -0.000 0.291) 10.052 5.059 ( -4.266 -0.000 -1.255) 4.447 5.107 ( -1.851 -0.000 -2.405) 3.034 5.299 ( 11.486 0.000 -6.038) 12.976 5.427 ( -7.562 -0.000 11.992) 14.177 5.459 ( -1.737 -0.000 4.747) 5.055 5.774 ( 1.009 0.000 -11.681) 11.725 6.081 ( 0.534 0.000 3.660) 3.699 6.179 ( -2.744 -0.000 4.314) 5.113 6.234 ( 6.605 0.000 -3.250) 7.361 6.393 ( -2.279 -0.000 0.347) 2.305 6.876 ( 6.994 0.000 -1.717) 7.202 7.102 ( 8.279 0.000 2.015) 8.520 7.184 ( -2.674 -0.000 0.397) 2.703 7.228 ( 2.086 0.000 0.595) 2.169 7.545 ( 3.792 0.000 -1.786) 4.192 7.742 ( -0.388 -0.000 -5.534) 5.548 7.929 ( -4.120 -0.000 0.843) 4.205 8.196 ( 0.662 0.000 4.669) 4.716 8.217 ( 7.927 0.000 -2.752) 8.391 8.365 ( -11.187 -0.000 -2.219) 11.405 8.546 ( -11.696 -0.000 10.910) 15.995 8.566 ( 0.417 0.000 -7.453) 7.464 9.012 ( 3.497 0.000 -4.267) 5.517 9.093 ( -6.947 -0.000 2.641) 7.432 9.497 ( 2.419 0.000 2.706) 3.630 9.829 ( -14.817 -0.000 1.748) 14.920 9.901 ( 0.338 0.000 3.065) 3.083 10.073 ( 10.910 0.000 -5.874) 12.391 10.334 ( 1.858 0.000 5.933) 6.217 10.366 ( 7.417 0.000 -9.387) 11.963 10.644 ( -3.237 -0.000 5.220) 6.142 10.664 ( 5.349 0.000 -3.151) 6.207 11.161 ( 2.996 0.000 3.167) 4.360 11.248 ( 4.522 0.000 0.557) 4.556 11.415 ( 13.490 0.000 0.179) 13.491 11.634 ( -0.429 -0.000 1.093) 1.174 11.652 ( 2.342 0.000 -4.090) 4.713 11.829 ( -0.390 -0.000 1.475) 1.526 12.115 ( 0.149 0.000 0.873) 0.886 12.193 ( -0.898 -0.000 -0.989) 1.336 12.838 ( -3.468 -0.000 0.795) 3.558 12.880 ( -2.150 -0.000 -0.783) 2.288 13.444 ( 8.703 0.000 -2.458) 9.043 13.481 ( 7.167 0.000 3.623) 8.031 13.760 ( -5.288 -0.000 -0.483) 5.310 13.783 ( -3.235 -0.000 -0.585) 3.288 15.777 ( -6.771 -0.000 1.980) 7.055 15.993 ( -15.703 -0.000 -0.922) 15.730 17.712 ( 7.422 0.000 -1.056) 7.497 17.752 ( 6.978 0.000 1.226) 7.085 18.390 ( 6.365 0.000 -3.537) 7.282 18.406 ( 6.316 0.000 4.793) 7.929 18.730 ( -9.919 -0.000 -2.550) 10.242 18.764 ( -9.669 -0.000 1.734) 9.823 19.811 ( -0.637 -0.000 2.524) 2.603 19.921 ( -4.815 -0.000 -0.846) 4.889 20.421 ( -3.166 -0.000 6.661) 7.375 20.695 ( 8.213 0.000 -16.215) 18.176 21.006 ( 3.621 0.000 10.422) 11.033 21.251 ( 11.946 0.000 -10.318) 15.785 21.963 ( -0.363 -0.000 8.839) 8.847 22.111 ( 5.579 0.000 -4.162) 6.961 22.183 ( -6.342 -0.000 9.669) 11.563 22.464 ( -0.375 -0.000 -0.511) 0.634 22.478 ( 3.475 0.000 2.363) 4.202 22.563 ( -0.411 -0.000 -8.177) 8.187 22.823 ( -5.935 -0.000 -0.403) 5.949 22.848 ( -5.921 -0.000 0.747) 5.967 ======================= Grid point 179 (76/102) ======================= q-point: ( 0.45 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( 5.295 -3.606 4.731) 7.964 1.517 ( 7.273 -7.281 -1.878) 10.461 1.655 ( 11.883 4.846 1.509) 12.922 1.838 ( 11.331 2.693 -4.908) 12.639 2.157 ( -0.632 1.714 2.742) 3.295 2.188 ( -0.280 2.949 -0.681) 3.040 2.427 ( 1.859 -0.829 -1.939) 2.811 2.461 ( -13.482 -9.073 4.849) 16.959 2.534 ( 2.736 -2.757 -1.681) 4.232 2.600 ( -0.034 -4.177 -3.896) 5.712 2.751 ( 8.101 -3.622 -1.410) 8.985 2.963 ( 9.970 -3.659 -0.889) 10.657 3.031 ( 4.150 1.823 -1.782) 4.871 3.095 ( -3.015 -1.374 2.871) 4.384 3.127 ( -4.287 -1.333 2.675) 5.226 3.248 ( 1.520 0.976 -1.870) 2.600 3.399 ( -1.216 2.507 2.540) 3.770 3.454 ( -0.552 1.036 1.881) 2.217 3.533 ( 0.360 -0.170 -5.609) 5.623 3.626 ( -5.220 2.053 1.180) 5.732 3.669 ( 4.243 2.304 0.120) 4.829 3.794 ( -6.409 0.340 0.776) 6.464 3.922 ( 7.814 2.282 2.034) 8.390 4.019 ( 7.096 -0.171 -1.306) 7.217 4.173 ( -0.453 6.267 3.115) 7.013 4.257 ( -1.365 5.788 -0.904) 6.015 4.370 ( -3.634 1.939 -0.908) 4.218 4.481 ( -0.045 -1.164 1.310) 1.754 4.546 ( 0.665 -0.326 0.136) 0.753 4.633 ( -4.239 -0.094 -5.050) 6.594 4.735 ( -4.528 0.784 0.622) 4.638 4.837 ( -12.222 -2.614 -0.489) 12.508 4.890 ( 0.345 -0.623 0.112) 0.722 4.999 ( -5.729 0.150 -0.471) 5.750 5.068 ( -0.849 -5.559 -0.646) 5.661 5.151 ( -5.027 -4.667 0.425) 6.873 5.279 ( 1.655 4.187 3.593) 5.760 5.420 ( -2.299 -3.287 0.367) 4.028 5.513 ( 5.864 -3.554 3.246) 7.586 5.815 ( -2.574 -4.754 -7.772) 9.467 6.057 ( 4.097 3.083 1.354) 5.303 6.158 ( -4.320 -0.738 2.798) 5.200 6.331 ( 4.549 -3.419 0.751) 5.740 6.425 ( 0.703 -5.185 -0.846) 5.300 6.912 ( 6.396 1.473 -0.691) 6.600 7.131 ( -1.597 2.331 -0.586) 2.886 7.155 ( 6.416 1.103 0.993) 6.585 7.268 ( -1.659 -2.596 1.087) 3.267 7.548 ( 2.758 2.285 -1.282) 3.805 7.711 ( -2.857 1.479 -4.812) 5.789 7.911 ( -1.651 0.216 3.044) 3.470 8.182 ( 1.372 2.636 3.670) 4.722 8.248 ( -3.265 1.507 -6.681) 7.587 8.271 ( -2.057 1.827 0.815) 2.870 8.463 ( -4.690 2.211 5.193) 7.338 8.547 ( -1.432 0.663 -2.894) 3.296 9.007 ( 0.842 1.573 -1.522) 2.345 9.046 ( -4.420 0.613 0.356) 4.477 9.509 ( 3.529 2.205 -0.188) 4.166 9.684 ( -11.525 4.970 2.825) 12.865 9.879 ( -0.764 3.534 7.644) 8.456 10.106 ( 10.578 2.668 -9.174) 14.254 10.323 ( -0.148 1.603 4.572) 4.847 10.414 ( 3.643 -0.551 -5.007) 6.216 10.633 ( 1.714 -0.220 1.396) 2.221 10.702 ( 2.034 -0.552 -1.117) 2.386 11.139 ( 2.765 4.384 2.467) 5.740 11.240 ( 1.185 3.775 -0.027) 3.957 11.537 ( 9.945 -3.011 -0.447) 10.400 11.659 ( 1.970 -2.296 -1.984) 3.617 11.716 ( 1.460 -3.662 1.320) 4.158 11.810 ( -0.891 0.327 0.306) 0.997 12.113 ( 2.114 1.039 -0.005) 2.356 12.192 ( -2.113 -0.621 -0.057) 2.203 12.832 ( -2.223 -1.996 1.223) 3.228 12.894 ( -1.918 -3.280 -1.089) 3.953 13.348 ( 8.303 13.118 0.737) 15.542 13.507 ( 8.282 10.796 0.491) 13.616 13.622 ( -6.736 3.740 -0.916) 7.759 13.736 ( -5.296 3.740 -0.559) 6.507 15.750 ( -4.778 -1.413 2.076) 5.398 15.898 ( -10.819 -0.780 -1.547) 10.957 17.686 ( 7.326 6.420 -0.170) 9.742 17.783 ( 1.764 1.647 0.150) 2.418 18.319 ( 13.786 3.880 0.230) 14.323 18.599 ( -2.546 -1.447 1.161) 3.151 18.691 ( -6.092 -3.990 -0.909) 7.339 18.777 ( -9.708 -11.351 -0.285) 14.939 19.680 ( -2.041 12.171 2.789) 12.652 19.783 ( -2.259 9.945 -2.318) 10.459 20.273 ( 0.377 14.803 8.323) 16.986 20.598 ( 5.949 12.326 -12.914) 18.818 21.163 ( 0.710 -11.039 8.716) 14.082 21.373 ( 8.996 -6.455 -10.293) 15.117 21.988 ( 1.255 -0.597 8.310) 8.425 22.132 ( 0.107 -1.815 3.515) 3.957 22.266 ( 0.144 -6.233 -2.745) 6.812 22.356 ( -1.424 5.567 -3.558) 6.758 22.552 ( 1.736 -5.104 2.779) 6.066 22.654 ( -0.723 -6.208 -0.715) 6.291 22.784 ( -4.506 -0.398 -0.322) 4.535 22.851 ( -5.286 -5.194 -1.050) 7.485 ======================= Grid point 180 (77/102) ======================= q-point: ( 0.55 0.36 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( -5.431 -0.124 10.758) 12.052 1.636 ( 1.373 -1.481 2.928) 3.557 1.732 ( 9.945 -7.004 -9.139) 15.214 1.825 ( 6.388 1.338 -8.759) 10.923 2.140 ( 0.421 0.152 5.464) 5.483 2.230 ( 4.690 -2.420 -3.506) 6.337 2.464 ( 2.369 -1.668 0.104) 2.900 2.503 ( -7.819 -4.324 2.302) 9.226 2.598 ( -4.050 -4.914 2.306) 6.772 2.667 ( -0.475 -4.301 -4.985) 6.601 2.898 ( 8.268 -1.047 -0.317) 8.340 2.961 ( -3.023 0.785 3.322) 4.560 3.108 ( 0.768 -1.836 0.690) 2.106 3.118 ( 2.137 -3.690 -0.518) 4.295 3.145 ( -1.319 -2.416 2.200) 3.524 3.224 ( -2.109 0.559 -2.659) 3.439 3.370 ( 1.494 -0.357 2.758) 3.156 3.445 ( 4.164 2.284 2.929) 5.580 3.508 ( 1.061 1.777 -4.381) 4.846 3.569 ( -1.317 0.799 -3.703) 4.011 3.646 ( -4.196 2.499 4.301) 6.507 3.725 ( -0.599 1.083 -3.239) 3.467 3.934 ( 4.425 5.027 3.240) 7.440 4.010 ( -1.128 4.361 2.593) 5.197 4.085 ( -1.086 2.703 -1.656) 3.350 4.157 ( 3.959 4.611 -4.013) 7.283 4.302 ( 0.491 3.072 2.059) 3.731 4.483 ( -3.855 -0.600 0.446) 3.927 4.515 ( -2.672 4.430 -1.761) 5.465 4.549 ( -3.353 1.805 -2.561) 4.588 4.785 ( -1.252 -6.177 2.156) 6.661 4.874 ( -1.053 -8.066 -2.235) 8.436 4.919 ( -1.341 -0.440 2.465) 2.840 4.980 ( -0.153 -2.804 -1.011) 2.985 5.088 ( -6.121 1.268 5.973) 8.646 5.167 ( 2.887 -2.130 -5.402) 6.484 5.355 ( 1.404 -6.485 2.339) 7.036 5.469 ( -5.647 -5.867 1.379) 8.259 5.651 ( 9.004 -3.703 -0.554) 9.752 5.835 ( -5.421 -2.646 -4.411) 7.473 6.048 ( 2.708 1.630 4.014) 5.109 6.160 ( -1.080 -1.642 -2.959) 3.552 6.428 ( 1.020 -4.609 5.708) 7.407 6.550 ( 2.907 -6.395 -3.987) 8.077 6.910 ( 4.287 3.094 0.697) 5.333 7.054 ( -3.114 3.653 -4.014) 6.257 7.185 ( 5.218 1.019 3.774) 6.520 7.296 ( -3.234 -2.497 -0.009) 4.086 7.487 ( 0.620 6.281 1.748) 6.549 7.610 ( -2.390 6.465 -4.647) 8.312 7.896 ( 0.386 2.248 3.979) 4.587 8.103 ( -5.031 5.692 -6.383) 9.922 8.140 ( -1.588 4.469 5.856) 7.535 8.250 ( 3.646 2.462 -5.784) 7.267 8.453 ( 1.645 -1.364 2.207) 3.072 8.534 ( -5.240 -2.689 1.240) 6.019 8.983 ( -3.628 0.756 1.808) 4.123 9.013 ( 3.207 1.006 -3.358) 4.751 9.419 ( 0.767 10.172 2.571) 10.520 9.520 ( -3.641 7.228 -2.331) 8.422 9.833 ( -0.323 2.179 11.058) 11.275 10.096 ( 5.413 2.989 -9.500) 11.335 10.325 ( 0.595 -0.789 3.276) 3.422 10.420 ( 0.489 -0.172 -3.287) 3.328 10.670 ( -1.243 -2.119 2.778) 3.708 10.722 ( 4.239 -0.513 -3.280) 5.384 11.077 ( 1.375 4.465 1.973) 5.072 11.150 ( -1.482 5.328 -0.826) 5.592 11.618 ( 3.897 1.140 -0.150) 4.064 11.703 ( -0.839 1.064 -1.324) 1.894 11.749 ( 5.257 -1.499 1.974) 5.812 11.850 ( 0.217 -2.817 -0.358) 2.848 12.115 ( 3.911 1.226 -0.469) 4.126 12.170 ( -4.551 0.416 0.470) 4.594 12.885 ( -0.152 -4.264 1.800) 4.631 12.953 ( -1.314 -4.100 -1.598) 4.593 13.126 ( 5.222 16.779 2.089) 17.697 13.228 ( 2.297 19.554 -2.270) 19.819 13.550 ( -2.581 3.625 1.500) 4.696 13.618 ( -3.216 4.301 -1.835) 5.676 15.765 ( -1.707 -2.314 2.157) 3.594 15.854 ( -5.287 -1.392 -1.858) 5.774 17.640 ( 6.976 4.208 0.028) 8.147 17.729 ( -3.976 2.732 -0.166) 4.828 18.366 ( 11.202 3.734 1.614) 11.918 18.526 ( -5.216 4.088 -1.455) 6.785 18.744 ( 1.459 -3.327 2.645) 4.494 18.928 ( -8.744 -11.003 -3.729) 14.541 19.479 ( -1.778 7.180 3.063) 8.006 19.570 ( -1.438 9.940 -3.740) 10.717 20.000 ( 3.255 18.496 10.431) 21.482 20.313 ( 2.262 19.415 -9.847) 21.887 21.388 ( -1.246 -11.602 6.594) 13.403 21.539 ( 6.932 -7.146 -8.254) 12.932 22.011 ( 1.467 1.366 5.067) 5.449 22.174 ( -2.450 0.734 -1.800) 3.128 22.217 ( -1.572 2.393 4.994) 5.757 22.387 ( 3.090 -4.003 -9.240) 10.533 22.670 ( -1.642 -5.980 4.965) 7.944 22.760 ( -2.829 -7.260 0.965) 7.851 22.801 ( 1.107 -4.979 1.006) 5.199 22.931 ( -3.816 -7.041 -2.799) 8.484 ======================= Grid point 181 (78/102) ======================= q-point: (-0.36 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( -3.473 -2.631 6.428) 7.766 1.676 ( 3.353 -0.081 -5.668) 6.586 1.807 ( -4.539 -5.666 1.112) 7.345 1.971 ( 7.642 -7.415 -7.882) 13.248 2.168 ( -1.024 -1.469 5.828) 6.097 2.288 ( 4.728 -2.407 -4.806) 7.158 2.483 ( -9.245 -3.992 4.134) 10.885 2.555 ( 5.798 -0.133 -1.261) 5.935 2.652 ( -0.077 -1.666 1.657) 2.351 2.675 ( -8.350 1.287 1.685) 8.614 2.854 ( 0.194 -0.240 3.986) 3.998 2.999 ( 4.004 2.618 -5.383) 7.202 3.134 ( 1.370 -1.366 1.599) 2.510 3.175 ( -3.955 -1.752 1.101) 4.464 3.183 ( -1.205 -2.502 1.403) 3.111 3.220 ( 1.703 -1.612 -2.991) 3.801 3.416 ( 7.491 2.886 1.399) 8.149 3.456 ( -1.698 0.592 2.362) 2.968 3.472 ( -0.573 -0.412 -4.176) 4.235 3.567 ( 3.608 -1.591 -4.702) 6.137 3.597 ( -4.972 -0.356 3.924) 6.344 3.697 ( 2.063 1.909 -3.797) 4.724 3.862 ( -4.229 1.980 5.188) 6.980 3.924 ( 3.140 4.200 0.967) 5.333 4.012 ( -5.435 1.463 1.678) 5.873 4.124 ( 2.989 1.660 -5.918) 6.834 4.314 ( 3.276 1.838 2.697) 4.624 4.364 ( -0.210 3.618 -2.299) 4.292 4.486 ( -3.457 -1.402 1.505) 4.023 4.536 ( 1.953 -0.248 -2.745) 3.378 4.875 ( -0.179 -2.980 4.507) 5.406 4.914 ( -7.092 -2.980 3.139) 8.309 5.041 ( 0.211 -2.661 1.113) 2.892 5.054 ( 2.230 -6.478 -1.169) 6.950 5.103 ( 2.534 -6.550 -1.137) 7.114 5.186 ( 3.575 -0.087 -5.143) 6.264 5.470 ( 0.678 -3.958 3.070) 5.054 5.539 ( -5.462 -5.468 -0.395) 7.738 5.745 ( 7.307 0.026 0.430) 7.320 5.826 ( -5.784 -2.257 -3.831) 7.295 6.056 ( -0.535 -0.400 6.117) 6.153 6.184 ( 1.270 -1.876 -5.704) 6.138 6.513 ( -0.406 -2.564 7.144) 7.601 6.655 ( 1.657 -4.015 -5.050) 6.661 6.880 ( 2.713 2.871 1.038) 4.084 6.940 ( -3.771 4.886 -4.162) 7.444 7.197 ( 0.210 2.919 6.264) 6.914 7.309 ( -1.813 -1.232 -3.205) 3.883 7.342 ( 0.584 9.978 4.477) 10.952 7.443 ( 1.069 9.664 -4.400) 10.672 7.854 ( 0.648 3.191 2.723) 4.245 7.949 ( -2.523 5.595 -4.695) 7.728 8.076 ( 1.097 3.551 4.330) 5.706 8.222 ( 3.186 1.296 -8.616) 9.277 8.515 ( 2.181 -1.237 3.495) 4.301 8.552 ( -5.162 -2.895 1.467) 6.098 8.935 ( -4.537 1.098 3.792) 6.014 9.046 ( 6.147 -0.572 -5.358) 8.174 9.249 ( -0.553 7.481 5.095) 9.068 9.344 ( -1.095 8.611 -2.919) 9.158 9.839 ( 0.039 0.543 8.367) 8.384 10.040 ( 1.274 3.834 -8.113) 9.063 10.350 ( -1.555 -0.853 3.375) 3.813 10.441 ( 2.970 -2.263 -4.548) 5.884 10.681 ( -5.882 -2.010 4.174) 7.488 10.777 ( 5.011 -1.655 -4.229) 6.763 11.015 ( -1.625 3.023 1.844) 3.896 11.050 ( 0.241 4.166 -0.935) 4.277 11.554 ( 0.177 7.489 3.003) 8.071 11.629 ( -0.331 5.221 -3.454) 6.269 11.814 ( 3.287 0.984 2.310) 4.137 11.856 ( -2.647 1.001 -1.399) 3.156 12.098 ( -4.123 1.965 1.464) 4.796 12.132 ( 3.883 2.262 -1.371) 4.698 12.835 ( -0.493 13.583 1.171) 13.643 12.863 ( 0.610 14.113 -1.266) 14.183 13.002 ( 0.449 -5.183 3.608) 6.331 13.085 ( -0.949 -5.170 -3.365) 6.241 13.463 ( 0.444 4.973 2.505) 5.586 13.528 ( -0.183 4.125 -2.932) 5.065 15.810 ( 0.753 -2.416 1.986) 3.217 15.855 ( -0.617 -1.283 -1.755) 2.260 17.637 ( 1.274 1.177 0.754) 1.891 17.656 ( -1.349 1.079 -0.880) 1.939 18.323 ( -3.814 4.837 3.524) 7.096 18.412 ( 4.924 6.371 -4.057) 9.016 18.791 ( -0.876 1.173 7.378) 7.522 18.992 ( -0.531 -0.955 -10.523) 10.579 19.425 ( -3.816 -2.018 3.788) 5.743 19.476 ( 2.734 -1.097 -1.427) 3.274 19.726 ( 2.517 16.419 9.202) 18.989 19.931 ( -0.918 20.536 -7.983) 22.052 21.567 ( -3.424 -8.464 4.329) 10.104 21.671 ( 4.461 -3.517 -3.841) 6.857 21.976 ( -2.764 2.000 1.322) 3.659 22.068 ( 3.814 6.333 -5.179) 9.026 22.248 ( -4.200 -3.114 8.436) 9.925 22.433 ( 2.337 -0.914 -7.856) 8.247 22.757 ( -3.040 -5.642 5.832) 8.665 22.883 ( 3.718 -5.514 -3.515) 7.523 22.962 ( 1.383 -9.310 2.418) 9.718 23.026 ( -2.470 -7.354 -1.560) 7.913 ======================= Grid point 182 (79/102) ======================= q-point: (-0.27 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.563 ( 0.979 -5.182 0.208) 5.277 1.692 ( 5.260 -0.785 -8.965) 10.424 1.870 ( -9.140 -4.387 4.899) 11.260 2.085 ( 6.143 -0.834 -2.739) 6.777 2.177 ( -8.067 -2.421 8.124) 11.703 2.378 ( 1.420 -0.869 -0.452) 1.725 2.483 ( -0.901 3.057 -0.980) 3.334 2.546 ( -3.648 -2.812 1.722) 4.918 2.578 ( -1.854 0.635 -0.156) 1.966 2.673 ( 2.210 1.349 2.223) 3.412 2.925 ( -2.034 -1.598 -2.218) 3.407 2.972 ( 6.989 -1.708 -2.413) 7.589 3.113 ( -3.409 2.144 1.776) 4.401 3.159 ( -4.771 -0.388 -0.618) 4.827 3.223 ( -0.773 0.815 0.682) 1.314 3.269 ( 5.740 -2.741 -0.236) 6.365 3.359 ( 0.498 7.214 -0.402) 7.242 3.392 ( 5.714 4.509 -1.576) 7.448 3.470 ( -2.866 -2.585 -0.963) 3.978 3.609 ( -0.073 -0.069 -4.517) 4.518 3.629 ( -2.895 -4.309 1.519) 5.409 3.717 ( 2.886 -2.423 0.705) 3.833 3.843 ( -5.433 -1.905 2.270) 6.189 3.910 ( 2.618 0.411 3.476) 4.371 4.012 ( -2.319 -4.008 -1.789) 4.964 4.121 ( 7.065 1.755 -2.028) 7.557 4.226 ( -3.767 2.473 2.611) 5.208 4.426 ( 11.852 -0.382 -4.375) 12.639 4.506 ( -3.358 -3.879 1.333) 5.301 4.565 ( 1.989 -1.314 1.061) 2.609 4.887 ( -6.436 -0.850 2.564) 6.980 4.948 ( 1.390 -2.307 0.683) 2.779 5.076 ( -1.694 -1.537 2.255) 3.212 5.149 ( -1.718 -1.267 -2.828) 3.543 5.173 ( 1.343 -6.552 1.481) 6.851 5.330 ( 8.837 -7.028 -5.770) 12.680 5.501 ( -2.141 0.601 3.720) 4.334 5.556 ( -3.173 -0.076 -2.513) 4.048 5.775 ( 3.779 1.264 3.895) 5.572 5.822 ( -3.496 -2.243 -3.607) 5.501 6.063 ( -6.258 -1.168 3.979) 7.507 6.217 ( 2.837 -1.367 -3.786) 4.925 6.551 ( 1.395 -0.194 6.191) 6.350 6.648 ( 0.911 5.880 -6.720) 8.976 6.792 ( -3.941 5.172 2.270) 6.887 6.910 ( 4.417 -0.935 -3.722) 5.851 7.049 ( -6.855 8.464 5.889) 12.382 7.214 ( 1.988 8.322 1.079) 8.624 7.277 ( 4.033 5.590 0.817) 6.942 7.321 ( 0.293 2.458 -4.344) 5.000 7.821 ( -0.155 0.728 -0.384) 0.838 7.876 ( 2.600 1.536 -1.031) 3.190 8.048 ( 1.748 2.196 4.071) 4.945 8.214 ( 4.567 0.865 -9.946) 10.979 8.470 ( -3.196 5.195 4.253) 7.436 8.586 ( 2.795 -0.474 -0.331) 2.854 8.905 ( -6.056 -1.218 4.331) 7.545 9.052 ( 0.953 1.144 -0.950) 1.766 9.180 ( -7.045 0.328 0.900) 7.110 9.282 ( 6.388 -1.704 0.531) 6.633 9.817 ( -1.959 3.129 4.615) 5.910 9.942 ( -0.327 5.587 -7.605) 9.442 10.349 ( -4.640 -1.014 3.534) 5.920 10.521 ( 6.476 -3.556 -5.367) 9.132 10.697 ( -3.006 -2.574 4.354) 5.884 10.806 ( 0.071 -0.091 -2.903) 2.906 10.949 ( -4.220 1.580 0.817) 4.580 11.030 ( 5.489 0.784 -0.133) 5.546 11.395 ( -1.886 9.507 4.559) 10.711 11.498 ( -0.328 8.037 -4.513) 9.223 11.736 ( -5.785 6.046 1.957) 8.593 11.768 ( -4.116 5.919 -1.239) 7.315 12.046 ( -1.034 1.102 -0.105) 1.514 12.117 ( 4.507 2.618 0.071) 5.213 12.642 ( -2.595 6.226 0.186) 6.748 12.663 ( -0.773 7.591 -0.110) 7.631 13.129 ( 0.630 -6.334 3.296) 7.167 13.171 ( -1.366 -5.412 -2.727) 6.213 13.389 ( 0.388 4.713 2.204) 5.217 13.470 ( 3.962 2.248 -3.007) 5.459 15.865 ( 2.813 -1.432 1.819) 3.643 15.875 ( 0.972 -1.292 -1.615) 2.286 17.599 ( -6.478 -1.258 -0.076) 6.599 17.698 ( 6.938 -1.398 0.137) 7.079 18.207 ( -6.797 2.987 0.804) 7.468 18.350 ( 6.777 5.183 -2.078) 8.782 18.709 ( -7.776 5.408 6.405) 11.434 18.936 ( 4.253 5.084 -8.159) 10.513 19.394 ( -6.803 6.858 6.484) 11.634 19.545 ( -6.374 -0.377 -1.512) 6.562 19.578 ( 4.238 13.907 -1.267) 14.593 19.644 ( 11.457 -5.987 -0.771) 12.950 21.589 ( -11.562 2.177 1.400) 11.848 21.725 ( 3.988 -1.161 1.588) 4.447 21.966 ( 2.140 -0.004 -2.309) 3.148 22.013 ( 3.399 -0.090 -4.353) 5.523 22.287 ( -2.582 -1.651 7.696) 8.284 22.428 ( 0.393 0.449 -5.252) 5.286 22.863 ( -0.954 -6.300 3.643) 7.340 22.952 ( 1.525 -0.937 -2.507) 3.080 23.130 ( 1.717 -7.390 1.576) 7.749 23.166 ( 1.385 -8.450 -1.409) 8.678 ======================= Grid point 183 (80/102) ======================= q-point: (-0.18 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( 1.605 0.246 2.676) 3.130 1.753 ( 6.402 -3.234 -12.018) 13.995 1.815 ( -7.046 4.287 3.352) 8.903 2.062 ( 4.316 7.820 -0.847) 8.972 2.183 ( -9.729 -1.149 12.081) 15.554 2.309 ( -2.463 -0.160 -0.205) 2.477 2.386 ( 0.093 7.527 -1.260) 7.632 2.602 ( 3.401 -2.289 -2.758) 4.942 2.615 ( 0.848 -1.601 -0.776) 1.971 2.714 ( 4.266 -2.843 0.936) 5.212 2.911 ( -3.454 -1.200 -0.010) 3.656 3.015 ( 0.678 4.553 1.407) 4.813 3.060 ( -1.070 0.454 -0.753) 1.385 3.155 ( 0.918 -1.239 -0.886) 1.778 3.217 ( -0.469 -0.418 1.076) 1.246 3.257 ( -3.002 -0.264 -0.536) 3.061 3.324 ( 2.260 5.802 -2.364) 6.660 3.384 ( 8.064 -3.827 -1.579) 9.064 3.500 ( -2.889 -2.272 2.210) 4.288 3.622 ( -1.558 -0.214 -3.482) 3.821 3.657 ( -2.092 -1.910 2.584) 3.834 3.739 ( -1.735 -1.186 -1.514) 2.590 3.847 ( -3.588 -1.258 1.794) 4.205 3.963 ( 3.336 -2.685 0.651) 4.332 4.046 ( 3.089 0.714 -2.956) 4.335 4.161 ( 5.588 -1.138 -0.524) 5.727 4.199 ( -1.800 0.054 3.809) 4.213 4.499 ( 8.857 0.087 -5.949) 10.670 4.590 ( -0.120 -5.698 2.534) 6.237 4.610 ( 0.457 -2.757 3.587) 4.547 4.845 ( -6.240 0.009 -0.062) 6.240 4.999 ( 3.509 -0.832 -1.573) 3.935 5.081 ( -3.013 -0.937 2.122) 3.803 5.167 ( -0.347 -1.827 -0.879) 2.056 5.314 ( 0.298 -6.333 2.617) 6.859 5.427 ( -0.384 -0.216 -3.730) 3.756 5.478 ( -0.846 -0.500 -0.216) 1.007 5.503 ( 0.957 2.244 -1.260) 2.745 5.771 ( 1.430 2.604 2.731) 4.035 5.833 ( -0.605 -0.878 -1.382) 1.745 6.034 ( -8.191 -2.131 2.294) 8.769 6.264 ( 2.544 -1.639 1.324) 3.303 6.454 ( 0.744 11.522 -4.471) 12.382 6.568 ( 4.028 2.776 1.043) 5.001 6.735 ( -1.190 0.161 3.744) 3.932 6.783 ( 2.813 13.032 -1.677) 13.438 7.034 ( -1.983 -3.587 -2.184) 4.644 7.093 ( 0.836 5.073 2.636) 5.778 7.233 ( 3.500 1.301 1.041) 3.876 7.269 ( 3.950 4.277 -2.743) 6.436 7.827 ( 2.158 -0.801 -1.995) 3.046 7.918 ( 4.329 -2.690 1.327) 5.267 8.025 ( 2.483 3.254 2.135) 4.616 8.196 ( 1.811 1.997 -7.154) 7.645 8.364 ( -3.121 3.879 5.840) 7.674 8.608 ( 4.790 0.069 -5.453) 7.259 8.902 ( -10.116 -3.628 5.154) 11.919 9.059 ( -2.030 -2.337 0.370) 3.117 9.161 ( -6.435 -3.722 1.319) 7.550 9.389 ( 3.459 -3.603 3.254) 5.961 9.727 ( -3.791 4.544 1.918) 6.221 9.818 ( 0.021 5.453 -8.413) 10.026 10.334 ( -5.629 -0.711 2.285) 6.116 10.625 ( 7.022 -2.865 -3.762) 8.466 10.730 ( 2.528 0.879 5.294) 5.931 10.784 ( -0.110 1.235 -3.006) 3.252 10.918 ( -3.273 -1.778 0.003) 3.724 11.070 ( 6.409 0.858 0.654) 6.499 11.242 ( -2.177 5.903 4.077) 7.497 11.350 ( -0.729 5.511 -4.931) 7.430 11.569 ( -9.488 5.830 0.891) 11.172 11.618 ( -5.186 5.493 0.194) 7.557 12.031 ( 0.560 0.312 -0.832) 1.050 12.118 ( 2.822 0.395 0.853) 2.975 12.550 ( -1.628 3.432 0.300) 3.811 12.567 ( -1.681 2.382 -0.261) 2.927 13.185 ( -0.762 -0.172 -0.353) 0.857 13.259 ( 3.434 0.055 -0.319) 3.449 13.331 ( -3.857 -2.745 2.258) 5.245 13.507 ( 4.769 -2.897 -1.782) 5.857 15.890 ( 2.221 0.385 2.134) 3.104 15.923 ( 2.070 -2.367 -1.994) 3.723 17.587 ( -5.684 -2.032 -0.160) 6.039 17.801 ( 8.091 -3.726 0.816) 8.945 18.127 ( -4.408 1.448 -1.686) 4.937 18.305 ( 4.701 5.231 -1.306) 7.153 18.552 ( -9.954 4.508 5.397) 12.188 18.863 ( 4.843 4.378 -4.971) 8.206 19.212 ( -5.776 6.852 2.921) 9.426 19.365 ( 0.622 7.032 -0.865) 7.112 19.604 ( -3.661 -5.258 -0.325) 6.415 19.885 ( 13.420 -8.335 0.178) 15.799 21.407 ( -13.540 6.340 0.721) 14.968 21.747 ( 6.782 3.794 -0.113) 7.772 21.975 ( -0.785 -2.201 0.134) 2.341 22.088 ( 2.999 -3.737 -3.544) 5.960 22.285 ( -2.510 1.478 6.227) 6.874 22.424 ( 1.480 -0.766 -4.696) 4.983 22.943 ( -0.024 1.146 1.202) 1.661 22.969 ( -0.590 -4.389 0.629) 4.473 23.254 ( 1.073 -4.889 1.597) 5.254 23.310 ( 1.330 -6.290 -2.178) 6.788 ======================= Grid point 185 (81/102) ======================= q-point: (-0.09 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.563 ( -3.145 7.931 7.550) 11.393 1.649 ( 0.236 10.139 1.376) 10.235 1.832 ( 3.840 -0.904 -9.525) 10.310 1.896 ( 6.995 11.963 1.076) 13.900 2.152 ( 2.584 1.459 0.989) 3.128 2.285 ( 3.038 2.507 -1.751) 4.311 2.369 ( -3.001 -4.149 -0.745) 5.174 2.600 ( 4.237 4.206 -1.023) 6.057 2.631 ( 2.312 0.707 1.266) 2.729 2.772 ( 2.524 4.271 1.066) 5.075 2.849 ( -3.793 3.565 5.210) 7.365 2.967 ( -2.752 -1.082 0.387) 2.982 3.066 ( 4.801 -1.081 -2.699) 5.613 3.131 ( -4.580 3.323 -3.769) 6.799 3.219 ( 0.107 -1.040 -2.564) 2.769 3.270 ( 1.422 -1.716 1.437) 2.652 3.328 ( -1.534 -4.649 1.341) 5.075 3.483 ( 0.634 2.086 -2.034) 2.982 3.514 ( -2.893 -3.167 3.051) 5.264 3.534 ( -1.231 3.123 1.008) 3.505 3.704 ( 0.218 -1.371 -0.271) 1.414 3.751 ( 0.346 -1.415 -4.195) 4.441 3.876 ( -3.649 -5.047 4.223) 7.525 3.979 ( 0.287 2.467 -1.041) 2.693 4.087 ( 6.422 -1.951 -0.530) 6.733 4.173 ( 0.542 1.375 -0.863) 1.712 4.222 ( 0.573 -1.008 2.082) 2.383 4.504 ( -0.100 1.048 -2.722) 2.919 4.656 ( 4.373 -1.468 5.088) 6.867 4.714 ( -2.071 -3.384 -2.926) 4.930 4.822 ( 1.466 -1.254 0.151) 1.935 4.998 ( 0.378 2.129 -0.970) 2.370 5.093 ( -3.427 -2.643 0.900) 4.421 5.185 ( -2.996 -0.777 -0.499) 3.135 5.282 ( -7.594 2.783 0.422) 8.099 5.425 ( 2.816 3.259 -0.340) 4.320 5.501 ( 1.402 -0.687 -1.323) 2.047 5.539 ( -0.365 -5.144 1.073) 5.267 5.729 ( 1.752 2.867 -0.327) 3.376 5.834 ( 2.587 0.768 0.303) 2.716 6.031 ( -7.881 -3.246 1.791) 8.709 6.287 ( -0.382 0.966 1.064) 1.487 6.326 ( 7.876 4.259 -0.400) 8.962 6.509 ( 2.030 6.391 1.539) 6.880 6.591 ( 5.685 9.333 -4.107) 11.675 6.789 ( 5.175 -3.589 0.713) 6.338 6.992 ( 0.220 4.457 3.407) 5.614 7.088 ( -0.137 -1.936 -4.679) 5.065 7.238 ( 6.025 1.811 1.244) 6.413 7.317 ( 5.902 -4.485 -0.187) 7.415 7.877 ( 6.163 -2.194 -1.075) 6.629 7.971 ( 2.018 3.918 -0.912) 4.500 8.027 ( 2.522 -5.196 1.417) 5.947 8.155 ( -0.638 1.133 -3.264) 3.513 8.322 ( -4.412 -0.360 6.763) 8.083 8.624 ( 3.475 0.417 -7.825) 8.572 8.903 ( -11.909 -4.486 5.678) 13.935 9.091 ( -2.687 -2.846 -1.169) 4.085 9.206 ( -6.195 -5.443 1.333) 8.354 9.452 ( -0.356 -1.512 6.628) 6.807 9.630 ( -3.923 3.109 0.434) 5.024 9.742 ( 3.031 1.731 -9.122) 9.767 10.298 ( -4.633 0.759 1.571) 4.951 10.651 ( 2.540 4.890 2.313) 5.976 10.737 ( 4.160 0.287 -1.192) 4.337 10.758 ( 4.097 2.611 -1.574) 5.107 10.959 ( -0.867 -1.691 0.072) 1.901 11.085 ( 7.543 0.648 -0.702) 7.604 11.196 ( -0.754 -0.474 2.313) 2.479 11.289 ( 0.629 1.059 -2.100) 2.435 11.419 ( -8.849 2.031 1.025) 9.137 11.536 ( -4.489 -0.702 -0.084) 4.545 12.049 ( 0.535 -2.377 -0.966) 2.621 12.145 ( 1.576 -1.336 0.812) 2.220 12.489 ( -0.774 2.465 0.869) 2.726 12.529 ( -0.411 1.176 -0.694) 1.426 13.158 ( 1.268 2.887 1.045) 3.322 13.205 ( 0.697 4.226 -1.876) 4.676 13.434 ( -3.626 -8.071 1.294) 8.942 13.610 ( 1.803 -5.486 -0.632) 5.810 15.901 ( 1.259 0.306 2.545) 2.856 15.977 ( 2.173 -2.621 -2.488) 4.217 17.571 ( -5.613 -0.635 -0.415) 5.664 17.923 ( 4.271 -1.109 2.860) 5.258 18.091 ( 3.514 0.001 -1.953) 4.020 18.195 ( 0.463 6.546 -3.715) 7.541 18.475 ( -6.798 -1.333 5.007) 8.548 18.878 ( 6.110 -3.328 -3.340) 7.718 19.098 ( -4.050 2.381 1.538) 4.943 19.312 ( 2.478 0.589 0.266) 2.561 19.669 ( -5.444 -5.906 -0.308) 8.038 20.111 ( 9.518 -6.507 0.075) 11.530 21.198 ( -10.041 6.523 0.115) 11.975 21.703 ( 7.878 6.689 -0.374) 10.341 22.026 ( -2.154 -4.121 0.279) 4.658 22.116 ( -0.833 2.129 -0.067) 2.287 22.263 ( -0.366 -0.186 3.951) 3.972 22.448 ( 3.198 -1.006 -6.665) 7.461 22.905 ( -2.003 2.458 5.031) 5.947 23.024 ( -0.579 -1.799 -1.894) 2.676 23.325 ( -1.066 -2.432 2.333) 3.534 23.387 ( -1.537 -2.824 -2.740) 4.224 ======================= Grid point 192 (82/102) ======================= q-point: ( 0.45 0.45 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( 6.426 0.000 -0.167) 6.429 1.490 ( 4.436 0.000 -1.352) 4.637 1.811 ( 11.206 0.000 2.462) 11.473 1.921 ( 1.670 0.000 2.001) 2.606 2.159 ( -4.249 -0.000 2.952) 5.173 2.238 ( -6.167 -0.000 -2.950) 6.836 2.263 ( -0.695 -0.000 3.615) 3.681 2.420 ( 4.771 0.000 -5.650) 7.395 2.507 ( -5.923 -0.000 2.731) 6.522 2.538 ( -0.370 -0.000 -6.843) 6.853 2.808 ( 16.810 0.000 -2.216) 16.955 2.974 ( -4.030 -0.000 2.270) 4.625 3.036 ( -1.977 -0.000 -0.690) 2.094 3.052 ( -3.322 -0.000 0.953) 3.456 3.130 ( 5.012 0.000 2.009) 5.400 3.260 ( -0.692 -0.000 -2.660) 2.749 3.387 ( -12.422 -0.000 10.933) 16.548 3.497 ( 8.311 0.000 -2.092) 8.570 3.537 ( 9.339 0.000 -12.035) 15.234 3.607 ( -6.580 -0.000 1.976) 6.871 3.721 ( -1.605 -0.000 2.584) 3.041 3.753 ( -3.015 -0.000 -0.125) 3.018 3.999 ( 6.946 0.000 5.570) 8.904 4.093 ( 11.015 0.000 -3.569) 11.579 4.246 ( -2.894 -0.000 2.870) 4.076 4.280 ( -5.551 -0.000 -0.445) 5.569 4.362 ( -2.121 -0.000 1.920) 2.861 4.478 ( -0.739 -0.000 2.974) 3.065 4.561 ( 6.944 0.000 -1.284) 7.062 4.593 ( -0.855 -0.000 -6.664) 6.719 4.695 ( -12.477 -0.000 0.696) 12.496 4.743 ( -4.309 -0.000 -3.650) 5.647 4.913 ( 1.423 0.000 0.796) 1.630 4.943 ( -0.178 -0.000 -1.208) 1.221 5.004 ( -2.450 -0.000 0.814) 2.582 5.064 ( -2.129 -0.000 -2.114) 3.001 5.307 ( -11.731 -0.000 13.144) 17.618 5.442 ( 12.023 0.000 -9.598) 15.384 5.492 ( -1.170 -0.000 7.889) 7.975 5.730 ( -1.443 -0.000 -9.157) 9.270 6.123 ( 4.213 0.000 0.006) 4.213 6.127 ( -3.573 -0.000 4.126) 5.457 6.343 ( -5.867 -0.000 3.602) 6.884 6.351 ( 8.035 0.000 -4.307) 9.116 6.977 ( 6.686 0.000 0.289) 6.692 7.128 ( -4.539 -0.000 -2.272) 5.076 7.206 ( 4.564 0.000 0.769) 4.628 7.237 ( -1.324 -0.000 1.444) 1.959 7.592 ( 3.900 0.000 -1.493) 4.176 7.688 ( -3.337 -0.000 -3.895) 5.129 7.920 ( 1.768 0.000 5.112) 5.409 8.195 ( -8.189 -0.000 -6.091) 10.206 8.220 ( -0.603 -0.000 4.857) 4.895 8.298 ( 3.994 0.000 -2.359) 4.638 8.447 ( -7.463 -0.000 8.340) 11.191 8.563 ( 3.695 0.000 -6.972) 7.891 9.004 ( -6.312 -0.000 4.069) 7.510 9.051 ( 4.690 0.000 -5.232) 7.026 9.553 ( 4.773 0.000 -0.183) 4.777 9.641 ( -10.533 -0.000 2.058) 10.732 9.929 ( -0.175 -0.000 8.945) 8.947 10.173 ( 5.925 0.000 -8.740) 10.559 10.356 ( -2.708 -0.000 4.293) 5.075 10.427 ( 5.217 0.000 -6.446) 8.293 10.623 ( -2.601 -0.000 5.674) 6.242 10.723 ( 4.284 0.000 -4.594) 6.282 11.201 ( 0.300 0.000 4.240) 4.251 11.287 ( 0.753 0.000 -1.082) 1.318 11.593 ( 9.322 0.000 -1.027) 9.378 11.620 ( 1.302 0.000 -1.252) 1.806 11.701 ( 1.723 0.000 1.262) 2.136 11.778 ( -5.444 -0.000 -0.296) 5.452 12.140 ( 1.722 0.000 0.608) 1.826 12.177 ( -0.813 -0.000 -0.713) 1.081 12.800 ( -1.781 -0.000 1.790) 2.525 12.850 ( -0.932 -0.000 -1.586) 1.839 13.554 ( 1.017 0.000 2.627) 2.817 13.558 ( 7.595 0.000 -1.136) 7.680 13.685 ( -4.663 -0.000 0.741) 4.722 13.737 ( -1.903 -0.000 -2.431) 3.087 15.713 ( -2.406 -0.000 2.701) 3.617 15.819 ( -6.461 -0.000 -2.240) 6.838 17.794 ( 3.434 0.000 0.296) 3.447 17.824 ( 2.149 0.000 -0.346) 2.177 18.464 ( 4.933 0.000 -1.176) 5.071 18.510 ( 4.949 0.000 1.943) 5.316 18.589 ( -7.188 -0.000 -0.424) 7.200 18.655 ( -5.532 -0.000 -0.020) 5.532 19.808 ( -0.917 -0.000 2.527) 2.688 19.865 ( -1.842 -0.000 -1.287) 2.247 20.415 ( -2.200 -0.000 8.416) 8.699 20.716 ( 4.192 0.000 -16.183) 16.717 21.075 ( -0.249 -0.000 10.443) 10.446 21.346 ( 7.634 0.000 -12.385) 14.549 21.991 ( -2.226 -0.000 12.479) 12.676 22.154 ( -2.879 -0.000 8.378) 8.859 22.162 ( 3.821 0.000 -4.599) 5.979 22.410 ( -3.046 -0.000 -6.748) 7.403 22.536 ( 1.940 0.000 2.461) 3.134 22.585 ( 4.439 0.000 -3.495) 5.650 22.752 ( -2.438 -0.000 -0.373) 2.466 22.766 ( -4.917 -0.000 0.624) 4.956 ======================= Grid point 193 (83/102) ======================= q-point: (-0.45 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( -3.692 0.482 5.497) 6.639 1.608 ( 6.327 -5.939 -6.647) 10.931 1.738 ( -4.085 5.999 6.465) 9.719 1.923 ( 2.568 2.675 -6.700) 7.658 2.146 ( -1.258 -0.039 2.767) 3.040 2.220 ( 3.375 -1.185 -2.623) 4.435 2.319 ( -6.170 -4.893 5.716) 9.730 2.495 ( 3.240 -2.952 -3.436) 5.570 2.504 ( 2.828 -3.530 -1.127) 4.662 2.562 ( -0.990 -4.156 -3.259) 5.373 2.900 ( -11.918 -0.077 1.635) 12.029 2.957 ( 16.324 -2.313 -3.355) 16.825 3.042 ( -6.247 -2.298 2.455) 7.095 3.075 ( 1.455 -2.676 -0.381) 3.069 3.149 ( 0.987 1.190 2.951) 3.331 3.209 ( -3.940 1.652 -0.989) 4.386 3.352 ( -7.129 -2.445 7.765) 10.821 3.518 ( 1.860 2.333 0.058) 2.984 3.566 ( 6.426 1.923 -8.137) 10.545 3.580 ( 5.408 1.446 -4.397) 7.119 3.674 ( -6.222 3.078 4.502) 8.274 3.736 ( 2.326 0.348 -0.556) 2.417 4.047 ( 1.723 -0.206 2.721) 3.228 4.108 ( -1.822 7.756 5.733) 9.815 4.127 ( 0.354 3.242 -2.214) 3.942 4.220 ( -4.351 4.005 -4.360) 7.347 4.374 ( 4.734 0.297 4.234) 6.358 4.470 ( -2.679 0.680 0.392) 2.792 4.552 ( -3.581 2.648 -3.087) 5.419 4.583 ( 4.367 2.295 -2.635) 5.593 4.679 ( -1.881 -3.573 1.088) 4.182 4.750 ( 4.940 -4.647 -4.745) 8.278 4.913 ( -3.687 0.826 0.790) 3.860 4.937 ( 2.570 -1.754 -0.295) 3.125 5.065 ( -2.633 -1.446 2.186) 3.715 5.106 ( 2.314 -6.661 -1.918) 7.308 5.273 ( -5.392 -3.224 8.441) 10.523 5.407 ( 0.238 3.024 0.364) 3.055 5.620 ( 7.156 -6.262 -0.868) 9.549 5.725 ( -5.534 -2.967 -5.577) 8.398 6.098 ( -1.700 1.983 2.677) 3.740 6.150 ( 4.816 0.288 -2.169) 5.290 6.344 ( -4.273 -4.559 5.149) 8.096 6.450 ( 3.193 -5.404 -3.976) 7.431 7.001 ( 4.918 2.499 1.729) 5.781 7.064 ( -5.397 1.933 -3.852) 6.907 7.232 ( 2.520 0.174 1.686) 3.037 7.238 ( -3.144 -1.269 0.911) 3.511 7.592 ( 3.188 3.144 0.229) 4.483 7.648 ( -1.705 1.456 -4.542) 5.065 7.950 ( 3.859 1.080 6.532) 7.663 8.112 ( -5.601 1.880 -6.530) 8.806 8.204 ( -1.140 2.066 4.539) 5.115 8.308 ( 3.279 1.065 -3.783) 5.118 8.427 ( -3.903 -1.538 5.232) 6.706 8.534 ( 2.029 4.246 -3.218) 5.701 8.973 ( -2.729 -0.016 2.479) 3.687 9.057 ( 4.200 1.791 -4.623) 6.498 9.543 ( -4.597 4.420 2.565) 6.874 9.590 ( 4.933 1.352 -1.688) 5.386 9.906 ( -1.989 3.812 11.122) 11.924 10.160 ( 2.150 2.656 -10.719) 11.250 10.327 ( -1.811 0.249 4.040) 4.434 10.433 ( 2.176 1.359 -4.811) 5.452 10.625 ( -3.962 -0.973 5.345) 6.724 10.739 ( 3.416 -0.237 -4.685) 5.803 11.167 ( -0.829 4.160 4.193) 5.965 11.238 ( -0.294 4.674 -1.878) 5.045 11.642 ( 3.260 -1.832 -0.347) 3.756 11.659 ( -3.190 -1.750 -1.396) 3.897 11.741 ( 2.631 -2.431 2.397) 4.310 11.781 ( -2.391 -3.610 -1.193) 4.491 12.152 ( -0.617 0.134 0.138) 0.647 12.158 ( 0.767 1.046 -0.252) 1.321 12.823 ( 0.247 -2.766 2.056) 3.455 12.871 ( -0.057 -3.008 -1.945) 3.582 13.444 ( 0.079 12.596 3.189) 12.993 13.522 ( -0.750 11.439 -3.348) 11.943 13.615 ( 1.366 3.426 2.059) 4.224 13.664 ( -0.850 3.962 -2.101) 4.564 15.728 ( 0.432 -1.441 3.213) 3.548 15.800 ( -0.512 -1.560 -2.866) 3.303 17.763 ( 1.023 4.523 0.447) 4.658 17.775 ( -1.022 4.666 -0.541) 4.807 18.486 ( -5.715 2.828 1.820) 6.631 18.528 ( 6.888 -1.017 -1.755) 7.180 18.641 ( -0.350 -6.833 2.366) 7.239 18.696 ( -0.991 -8.222 -2.287) 8.591 19.676 ( 0.012 12.081 3.234) 12.506 19.751 ( -0.270 10.403 -3.116) 10.864 20.311 ( -1.127 11.652 10.479) 15.712 20.597 ( 1.886 12.161 -13.985) 18.629 21.189 ( -2.205 -9.865 8.486) 13.198 21.428 ( 5.253 -6.483 -12.313) 14.874 22.022 ( -3.201 -1.413 12.098) 12.594 22.122 ( -3.282 -0.422 4.319) 5.441 22.292 ( 4.998 -7.010 -4.111) 9.541 22.319 ( 0.067 4.778 -6.811) 8.320 22.574 ( -1.816 -3.881 4.438) 6.169 22.646 ( -0.734 -3.717 -0.755) 3.864 22.756 ( 0.893 -1.731 0.368) 1.982 22.794 ( -0.067 -5.109 -2.055) 5.507 ======================= Grid point 194 (84/102) ======================= q-point: (-0.36 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -8.042 -0.955 9.485) 12.472 1.597 ( -8.477 -1.615 4.804) 9.876 1.803 ( 4.962 0.165 -12.360) 13.320 1.878 ( 4.217 -5.085 -7.269) 9.822 2.149 ( -1.363 -0.435 2.194) 2.619 2.269 ( 3.261 -2.209 -4.862) 6.257 2.359 ( -6.332 -3.228 6.313) 9.507 2.558 ( -4.099 -5.148 4.704) 8.089 2.612 ( 7.473 -1.033 -3.011) 8.122 2.630 ( 1.926 -3.173 -1.964) 4.199 2.828 ( -8.732 -0.432 2.855) 9.197 3.028 ( -3.770 -1.070 0.095) 3.920 3.054 ( -4.300 -2.612 1.861) 5.364 3.147 ( -0.136 0.040 2.482) 2.486 3.157 ( 5.880 -3.753 -0.405) 6.988 3.195 ( 0.179 -1.500 -2.293) 2.746 3.392 ( -3.345 -4.543 2.753) 6.277 3.482 ( 0.814 3.307 -1.444) 3.699 3.510 ( 1.864 2.475 -2.981) 4.299 3.572 ( 3.456 2.255 -3.452) 5.380 3.622 ( -0.310 1.887 3.125) 3.664 3.741 ( 4.173 1.890 -2.473) 5.206 3.946 ( -3.206 7.096 4.148) 8.823 4.006 ( -8.174 4.126 2.071) 9.388 4.074 ( 5.707 6.239 -1.777) 8.640 4.116 ( -3.402 -0.850 -1.501) 3.814 4.375 ( -2.254 5.172 -2.035) 5.997 4.442 ( 8.138 0.090 1.304) 8.242 4.499 ( 1.259 1.936 -0.123) 2.313 4.559 ( 3.968 1.975 -2.949) 5.324 4.767 ( -0.343 -5.589 2.163) 6.003 4.845 ( -4.211 -2.430 2.596) 5.512 4.953 ( 5.085 -6.387 -2.206) 8.457 5.012 ( 4.398 -2.741 -2.047) 5.572 5.049 ( -1.573 -0.729 4.688) 4.998 5.210 ( 5.700 -0.632 -4.862) 7.519 5.372 ( -3.413 -8.512 2.846) 9.602 5.408 ( -0.989 -3.503 3.420) 4.994 5.712 ( -8.065 -3.428 -2.871) 9.222 5.773 ( 7.460 -3.282 -1.115) 8.226 6.049 ( -4.300 1.135 2.975) 5.351 6.180 ( 4.666 -0.204 -3.381) 5.766 6.435 ( -3.219 -6.172 5.363) 8.787 6.552 ( -0.165 -5.591 -4.255) 7.028 6.966 ( -4.163 2.956 -3.241) 6.048 6.975 ( 1.599 4.191 1.805) 4.835 7.230 ( -3.766 -0.372 1.407) 4.038 7.255 ( -0.040 -1.070 1.538) 1.874 7.528 ( 3.177 6.723 1.883) 7.671 7.580 ( 2.020 5.516 -5.364) 7.955 7.936 ( 1.101 4.396 4.694) 6.525 8.020 ( -1.587 3.836 -2.066) 4.637 8.168 ( 2.620 2.922 0.258) 3.933 8.279 ( 3.966 4.180 -6.542) 8.718 8.455 ( -4.436 -2.681 2.033) 5.568 8.500 ( 1.318 -1.696 3.739) 4.311 8.954 ( -0.748 2.089 0.916) 2.401 9.059 ( 3.975 -0.563 -3.554) 5.362 9.401 ( -2.363 8.989 3.095) 9.797 9.540 ( 6.428 9.639 -2.987) 11.965 9.853 ( -4.258 1.007 11.406) 12.216 10.083 ( -0.844 3.216 -9.931) 10.473 10.340 ( -0.728 -0.475 2.785) 2.918 10.419 ( 1.630 -0.794 -4.352) 4.715 10.609 ( -7.191 -1.071 4.144) 8.369 10.769 ( 2.106 -1.326 -3.369) 4.189 11.075 ( -2.946 4.934 2.442) 6.244 11.143 ( 1.250 5.140 -0.687) 5.334 11.638 ( -5.635 -0.653 -1.583) 5.889 11.667 ( 2.099 3.174 1.343) 4.035 11.797 ( -4.397 -3.081 -1.346) 5.535 11.826 ( 0.203 -1.815 1.312) 2.249 12.102 ( -3.257 1.857 0.309) 3.762 12.182 ( 3.807 -0.039 -0.210) 3.813 12.903 ( 1.062 -4.599 1.796) 5.050 12.941 ( 1.175 -4.437 -1.915) 4.973 13.124 ( -7.261 18.128 2.358) 19.670 13.219 ( -1.582 18.835 -1.952) 19.002 13.563 ( 2.804 3.585 1.484) 4.786 13.607 ( 3.346 4.486 -1.947) 5.926 15.773 ( 1.465 -2.204 2.040) 3.341 15.848 ( 5.663 -1.585 -1.857) 6.167 17.642 ( -7.137 4.178 -0.112) 8.271 17.726 ( 4.169 2.795 0.007) 5.019 18.354 ( -11.876 3.829 2.014) 12.639 18.552 ( 7.884 4.496 -2.922) 9.535 18.740 ( -4.766 -4.579 3.476) 7.468 18.912 ( 9.603 -9.878 -3.100) 14.121 19.486 ( 0.861 8.851 3.439) 9.534 19.552 ( 1.261 8.560 -3.319) 9.267 20.056 ( -2.553 17.247 10.459) 20.331 20.274 ( -0.866 19.751 -11.045) 22.646 21.375 ( -4.149 -10.659 5.787) 12.819 21.575 ( 3.059 -7.997 -9.259) 12.612 21.989 ( -7.331 2.507 6.192) 9.918 22.154 ( -2.365 -3.897 4.660) 6.519 22.218 ( 2.403 5.652 -2.200) 6.524 22.417 ( 5.381 -2.298 -8.675) 10.464 22.643 ( -3.645 -5.024 4.821) 7.859 22.767 ( 1.619 -9.825 2.872) 10.364 22.848 ( 4.553 -6.069 -0.164) 7.588 22.894 ( 1.024 -5.536 -2.704) 6.245 ======================= Grid point 195 (85/102) ======================= q-point: (-0.27 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( -4.133 -5.696 3.155) 7.713 1.631 ( -9.461 -7.047 4.847) 12.754 1.755 ( 0.468 0.215 -8.932) 8.947 2.054 ( 5.638 -7.004 -4.634) 10.115 2.137 ( -4.791 0.547 3.750) 6.109 2.322 ( -0.332 -3.301 -5.076) 6.064 2.402 ( -1.319 -5.248 1.366) 5.581 2.559 ( -6.111 3.874 5.545) 9.116 2.616 ( 0.983 0.469 2.030) 2.304 2.697 ( 4.549 -0.240 -0.340) 4.568 2.825 ( -5.847 -4.667 1.828) 7.701 3.047 ( 1.520 2.071 -1.338) 2.896 3.052 ( -4.021 -4.384 1.052) 6.040 3.127 ( -4.297 0.244 -0.160) 4.306 3.225 ( 0.313 -2.195 -0.931) 2.405 3.256 ( 4.705 -1.880 -1.653) 5.330 3.378 ( -4.574 0.872 0.620) 4.698 3.463 ( -1.307 0.290 -1.627) 2.107 3.523 ( 0.192 4.944 0.381) 4.963 3.562 ( 6.488 -1.312 -1.001) 6.695 3.604 ( 1.803 -3.161 -1.561) 3.960 3.720 ( 2.465 2.550 -2.603) 4.400 3.827 ( -5.778 4.485 5.941) 9.423 3.896 ( -4.910 0.088 1.043) 5.020 4.028 ( 8.334 3.268 -0.423) 8.961 4.155 ( 0.468 -3.300 -2.171) 3.978 4.268 ( 0.322 4.613 -0.830) 4.699 4.466 ( 1.257 1.240 1.992) 2.662 4.521 ( 9.251 0.403 -0.777) 9.292 4.574 ( 5.614 0.240 -1.738) 5.882 4.815 ( -6.727 -2.037 3.253) 7.744 4.897 ( 1.204 -4.049 2.531) 4.924 5.046 ( -0.061 -1.647 1.497) 2.227 5.066 ( 0.184 -4.568 -2.098) 5.031 5.115 ( 1.190 -2.411 -1.372) 3.018 5.283 ( 9.309 -4.288 -5.493) 11.628 5.468 ( -2.302 -2.707 2.878) 4.572 5.496 ( -0.808 -5.093 2.381) 5.679 5.718 ( -6.101 -4.323 -2.168) 7.786 5.835 ( 3.750 0.940 1.121) 4.026 6.015 ( -4.905 -0.026 1.487) 5.125 6.208 ( 2.446 -0.889 -2.557) 3.649 6.511 ( -3.629 -3.847 6.172) 8.128 6.631 ( -1.667 -4.872 -6.316) 8.149 6.853 ( -5.247 4.443 -2.118) 7.194 6.935 ( 3.237 2.730 2.000) 4.683 7.187 ( -4.414 3.890 5.317) 7.930 7.246 ( -3.601 1.589 -2.630) 4.734 7.414 ( 4.525 7.916 2.322) 9.409 7.472 ( 5.027 7.871 -4.335) 10.297 7.861 ( 0.733 3.681 -0.380) 3.772 7.954 ( 2.614 3.935 2.543) 5.365 8.133 ( 5.287 4.135 0.349) 6.721 8.239 ( 3.799 0.886 -9.084) 9.887 8.478 ( -3.495 -2.011 1.533) 4.314 8.566 ( -0.608 -2.461 5.083) 5.680 8.902 ( -1.510 2.483 1.161) 3.130 9.103 ( 3.383 -0.402 -2.482) 4.216 9.214 ( -2.820 9.665 2.579) 10.393 9.382 ( 5.026 8.717 -0.884) 10.101 9.835 ( -5.726 0.628 7.926) 9.798 9.995 ( -1.978 3.485 -9.427) 10.243 10.326 ( -2.820 0.687 2.714) 3.973 10.482 ( 4.184 -4.055 -3.996) 7.066 10.608 ( -4.910 -4.019 2.689) 6.891 10.786 ( -1.647 -0.789 -1.387) 2.293 10.971 ( -3.958 3.824 0.667) 5.544 11.094 ( 4.006 2.224 0.532) 4.612 11.548 ( -2.869 7.732 1.221) 8.337 11.595 ( -2.000 3.965 -1.361) 4.645 11.769 ( -7.318 1.151 -1.419) 7.543 11.795 ( -7.110 4.077 1.981) 8.432 12.064 ( 0.963 0.973 -0.514) 1.462 12.197 ( 3.481 1.735 0.315) 3.902 12.770 ( -7.073 12.518 0.146) 14.379 12.857 ( -2.654 15.113 -0.154) 15.345 13.020 ( -0.419 -6.010 1.438) 6.194 13.056 ( -0.031 -5.480 -1.025) 5.575 13.512 ( 4.089 6.427 1.255) 7.720 13.556 ( 5.420 3.299 -1.889) 6.620 15.835 ( 2.950 -2.435 -0.383) 3.844 15.909 ( 6.739 0.178 0.446) 6.756 17.543 ( -6.917 0.632 -0.118) 6.946 17.735 ( 5.267 0.098 0.195) 5.271 18.203 ( -11.022 3.174 0.923) 11.507 18.497 ( 6.055 6.233 -2.137) 8.949 18.725 ( -7.471 1.982 2.620) 8.162 19.044 ( 7.825 2.909 -3.082) 8.899 19.405 ( -0.730 2.002 3.598) 4.182 19.538 ( 4.415 -2.737 -0.456) 5.215 19.739 ( -3.083 13.036 2.073) 13.555 19.901 ( 1.094 18.701 -4.014) 19.158 21.489 ( -9.143 -4.784 2.481) 10.613 21.679 ( -1.611 -4.180 -1.627) 4.766 21.931 ( -1.566 -1.655 -1.820) 2.917 22.127 ( 4.304 6.532 -2.678) 8.268 22.228 ( -2.710 -4.316 7.787) 9.307 22.435 ( 1.847 0.765 -5.945) 6.272 22.739 ( -1.990 -6.818 4.661) 8.496 22.934 ( 4.594 -2.850 -4.570) 7.079 23.010 ( 3.099 -9.883 0.574) 10.373 23.030 ( 4.344 -7.632 1.663) 8.938 ======================= Grid point 196 (86/102) ======================= q-point: (-0.18 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( -0.382 -7.605 -3.107) 8.224 1.695 ( -3.747 -5.250 -1.701) 6.670 1.785 ( -0.655 -3.257 -2.447) 4.126 2.071 ( -11.102 -0.635 7.798) 13.582 2.159 ( 3.868 -0.269 0.517) 3.912 2.312 ( -7.241 1.426 1.046) 7.454 2.485 ( -2.855 -0.733 3.031) 4.228 2.526 ( 5.122 -3.632 -3.862) 7.372 2.600 ( 2.562 1.727 -1.984) 3.672 2.718 ( 2.677 -0.765 3.733) 4.657 2.871 ( -4.405 -3.672 -1.547) 5.940 2.991 ( -4.449 1.327 -0.584) 4.679 3.082 ( -2.528 0.444 -1.942) 3.219 3.137 ( 3.836 -3.679 1.978) 5.671 3.216 ( 0.494 4.079 -1.964) 4.554 3.317 ( 0.177 -2.553 -0.985) 2.742 3.340 ( -2.637 1.158 2.173) 3.608 3.443 ( -0.666 1.751 -3.995) 4.412 3.452 ( 0.274 1.236 3.927) 4.126 3.590 ( 4.450 -0.397 -5.404) 7.012 3.647 ( 2.377 0.631 0.144) 2.464 3.734 ( -2.349 1.659 1.541) 3.263 3.776 ( -1.551 -4.930 2.008) 5.544 3.919 ( -0.712 -3.594 1.609) 4.002 4.059 ( 6.781 0.160 -1.063) 6.866 4.200 ( 1.972 -0.212 0.131) 1.988 4.233 ( 5.172 1.347 -1.658) 5.596 4.482 ( -1.785 -2.975 3.832) 5.169 4.559 ( 4.594 0.963 -2.991) 5.566 4.618 ( 6.519 -0.250 0.803) 6.573 4.802 ( -3.468 -0.830 1.652) 3.929 4.968 ( 0.500 -2.899 -1.343) 3.234 5.061 ( -2.060 -0.642 2.186) 3.071 5.136 ( 2.144 -2.374 -1.695) 3.619 5.196 ( 0.307 -6.582 1.130) 6.685 5.387 ( 1.419 -2.294 -5.697) 6.303 5.472 ( -2.034 0.186 2.683) 3.372 5.545 ( 1.893 0.202 -0.370) 1.939 5.766 ( -2.858 -4.371 -0.094) 5.223 5.838 ( 2.624 1.349 3.809) 4.818 5.963 ( -5.866 0.708 -1.351) 6.061 6.244 ( 0.920 -1.997 0.618) 2.284 6.562 ( -3.279 -3.420 4.532) 6.556 6.621 ( -0.286 4.840 -9.220) 10.417 6.745 ( -5.009 2.199 2.785) 6.138 6.949 ( 0.612 -1.354 1.505) 2.115 7.014 ( 0.492 11.209 1.910) 11.381 7.172 ( -4.562 2.357 -2.942) 5.918 7.336 ( 3.919 6.718 0.072) 7.778 7.376 ( 5.240 4.848 0.158) 7.140 7.842 ( 4.625 0.395 -2.704) 5.372 7.937 ( 3.343 1.202 4.261) 5.547 8.116 ( 6.489 2.692 0.327) 7.033 8.236 ( 2.643 1.526 -8.062) 8.621 8.427 ( -4.715 4.864 0.854) 6.827 8.599 ( -4.675 -3.141 4.637) 7.295 8.846 ( -0.261 3.519 -1.455) 3.816 9.061 ( -0.375 4.241 2.461) 4.917 9.096 ( -3.364 0.339 0.752) 3.463 9.376 ( 5.706 -1.599 1.190) 6.044 9.762 ( -7.946 3.089 5.299) 10.038 9.881 ( -2.653 4.817 -8.974) 10.525 10.300 ( -3.324 0.050 1.780) 3.771 10.591 ( 5.450 -4.713 -4.177) 8.329 10.696 ( 0.263 -6.320 1.925) 6.612 10.781 ( -1.020 -0.565 0.451) 1.250 10.891 ( -4.213 1.794 0.787) 4.647 11.116 ( 4.941 -0.301 0.280) 4.958 11.374 ( -2.867 8.671 2.415) 9.446 11.464 ( -1.756 8.848 -2.602) 9.388 11.591 ( -13.138 6.655 2.107) 14.877 11.677 ( -6.565 4.333 -1.626) 8.032 12.058 ( 2.109 1.500 -1.336) 2.912 12.173 ( 2.291 2.973 1.480) 4.034 12.588 ( -4.254 3.766 -0.152) 5.683 12.629 ( -3.660 7.161 0.105) 8.043 13.117 ( -1.204 -5.153 -1.523) 5.506 13.170 ( -0.141 -6.557 2.079) 6.880 13.414 ( 3.016 7.138 -0.549) 7.769 13.552 ( 6.883 2.226 -0.204) 7.237 15.896 ( 3.453 -1.930 -2.207) 4.530 15.937 ( 4.208 1.437 2.221) 4.971 17.516 ( -4.347 -1.836 -0.135) 4.720 17.803 ( 6.704 -2.590 0.699) 7.221 18.100 ( -7.224 0.646 -0.867) 7.305 18.429 ( 5.132 5.300 -1.652) 7.560 18.583 ( -10.420 6.369 3.009) 12.577 18.980 ( 2.785 6.309 -1.686) 7.099 19.316 ( -6.616 8.254 3.483) 11.137 19.436 ( -5.145 2.975 -2.669) 6.514 19.641 ( 3.705 10.190 -0.540) 10.856 19.843 ( 14.831 -8.150 0.140) 16.924 21.396 ( -14.591 3.691 0.857) 15.075 21.745 ( -1.491 -4.633 1.797) 5.188 22.003 ( 3.815 -3.038 -3.741) 6.147 22.046 ( 2.980 3.281 -2.863) 5.277 22.286 ( -2.264 -1.559 8.278) 8.722 22.415 ( 0.942 0.484 -5.055) 5.165 22.862 ( -1.282 -6.690 3.986) 7.893 22.966 ( 2.226 0.280 -3.385) 4.061 23.186 ( 4.277 -5.419 1.291) 7.023 23.202 ( 4.225 -7.570 -0.931) 8.719 ======================= Grid point 197 (87/102) ======================= q-point: (-0.09 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( -1.426 0.406 3.857) 4.132 1.734 ( -4.576 -0.426 1.151) 4.738 1.795 ( 5.460 -1.250 -12.466) 13.667 2.085 ( -9.134 -6.634 8.160) 13.930 2.129 ( 4.700 6.605 1.251) 8.203 2.278 ( -1.867 -2.947 -0.459) 3.519 2.389 ( -0.309 7.349 0.801) 7.399 2.588 ( -0.075 -2.425 -2.032) 3.165 2.652 ( 1.871 -1.601 0.029) 2.463 2.783 ( 3.891 -2.133 2.694) 5.191 2.902 ( 2.499 -1.445 -1.811) 3.408 2.983 ( -7.254 -4.199 0.260) 8.386 3.042 ( 0.929 3.414 -2.839) 4.536 3.148 ( -1.632 1.027 0.365) 1.963 3.194 ( -2.413 6.094 -2.176) 6.906 3.234 ( 0.059 -3.053 3.598) 4.719 3.325 ( -0.853 2.520 0.456) 2.700 3.461 ( -3.545 -2.881 2.840) 5.379 3.502 ( 7.501 -1.854 -2.384) 8.086 3.590 ( -1.005 3.546 -2.269) 4.328 3.645 ( -0.180 -3.414 0.380) 3.440 3.732 ( 0.654 -0.440 -1.661) 1.838 3.830 ( 2.033 -0.990 1.991) 3.013 3.987 ( -0.191 -2.789 0.009) 2.796 4.114 ( 6.079 -1.116 -3.124) 6.925 4.181 ( -2.077 2.238 2.248) 3.791 4.252 ( 6.227 1.281 -1.817) 6.612 4.503 ( -6.867 0.820 3.289) 7.658 4.601 ( 1.039 -6.111 -1.657) 6.416 4.682 ( 6.692 -0.978 2.110) 7.085 4.817 ( 2.069 -1.046 0.081) 2.320 5.003 ( -1.024 -1.467 -4.020) 4.400 5.055 ( -1.639 0.384 2.063) 2.662 5.166 ( -0.215 0.065 2.576) 2.586 5.263 ( -4.988 -0.128 -1.916) 5.345 5.435 ( 0.182 -4.829 1.432) 5.040 5.463 ( -0.774 -1.945 -0.161) 2.099 5.531 ( 4.363 3.203 -2.659) 6.030 5.805 ( 2.166 2.760 0.362) 3.527 5.815 ( -2.837 -1.370 2.155) 3.817 5.949 ( -3.238 -2.034 0.066) 3.824 6.285 ( 0.476 -1.296 1.246) 1.860 6.479 ( 3.258 7.188 -2.992) 8.439 6.577 ( -3.134 0.972 -0.248) 3.291 6.721 ( -2.832 -2.370 2.577) 4.503 6.825 ( 2.273 8.876 -0.215) 9.165 7.009 ( 0.515 -2.146 -2.238) 3.143 7.077 ( -2.762 3.841 0.263) 4.739 7.302 ( 3.971 -0.146 1.056) 4.112 7.345 ( 5.577 3.301 -0.853) 6.536 7.892 ( 8.006 -1.385 -3.268) 8.758 7.974 ( 1.262 -1.641 4.115) 4.607 8.107 ( 6.578 6.263 -1.208) 9.163 8.158 ( -2.974 2.167 -1.493) 3.971 8.320 ( -6.321 1.623 0.561) 6.550 8.633 ( -3.297 -2.744 1.962) 4.716 8.772 ( -2.435 2.112 -3.147) 4.505 9.045 ( -0.150 -1.164 1.813) 2.160 9.103 ( -2.382 -2.608 1.240) 3.744 9.447 ( 2.571 -1.302 4.451) 5.303 9.654 ( -7.042 3.286 3.734) 8.622 9.772 ( -0.589 2.809 -9.175) 9.613 10.281 ( -2.219 0.086 0.639) 2.311 10.687 ( 2.885 -1.933 -1.746) 3.887 10.767 ( -0.884 -0.452 -1.141) 1.513 10.821 ( 5.937 -0.590 3.806) 7.077 10.882 ( -0.986 -4.395 -1.499) 4.747 11.160 ( 3.774 -0.240 0.982) 3.907 11.226 ( -1.031 6.289 2.572) 6.872 11.307 ( -2.650 3.578 -3.198) 5.481 11.407 ( -10.366 4.387 0.172) 11.257 11.545 ( -4.438 4.464 0.156) 6.296 12.038 ( 0.810 0.974 -1.618) 2.055 12.153 ( 0.889 0.851 2.064) 2.403 12.526 ( -1.388 2.363 -0.459) 2.778 12.537 ( -2.004 0.844 0.206) 2.184 13.177 ( -0.096 -2.212 -0.428) 2.255 13.278 ( -3.524 -5.036 0.308) 6.154 13.312 ( 3.461 5.202 -0.392) 6.260 13.576 ( 4.346 -0.272 0.385) 4.371 15.931 ( 2.075 1.165 0.823) 2.518 15.950 ( 1.901 -1.434 -0.853) 2.529 17.524 ( -2.493 -1.427 -0.155) 2.876 17.924 ( 6.986 -3.880 2.797) 8.466 18.068 ( -1.476 -1.675 -3.901) 4.495 18.314 ( -4.690 9.049 -2.126) 10.412 18.454 ( -3.516 0.868 4.463) 5.748 18.898 ( 1.667 2.994 -2.191) 4.067 19.149 ( -3.891 5.494 1.777) 6.963 19.348 ( -1.654 2.781 -0.509) 3.275 19.589 ( 0.889 -0.198 -0.314) 0.963 20.078 ( 11.465 -5.915 0.092) 12.901 21.217 ( -11.278 4.342 0.421) 12.092 21.805 ( 0.766 -1.294 0.598) 1.618 21.980 ( 1.734 1.896 -1.020) 2.764 22.108 ( 1.445 -2.943 -2.407) 4.068 22.276 ( -1.823 1.488 5.061) 5.581 22.429 ( 1.542 -1.703 -3.742) 4.391 22.948 ( -0.063 1.164 -0.008) 1.165 22.963 ( -0.450 -3.344 1.955) 3.900 23.284 ( 2.009 -2.775 0.437) 3.454 23.325 ( 1.867 -3.657 -1.245) 4.291 ======================= Grid point 204 (88/102) ======================= q-point: (-0.45 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( 0.131 0.000 -1.797) 1.802 1.511 ( 0.690 0.000 -4.709) 4.759 1.795 ( -15.345 -0.000 1.736) 15.443 1.833 ( -12.856 -0.000 9.088) 15.743 2.185 ( 7.418 0.000 2.742) 7.909 2.220 ( 2.485 0.000 -2.643) 3.628 2.303 ( 1.404 0.000 2.514) 2.879 2.436 ( 1.282 0.000 -9.003) 9.093 2.454 ( -2.170 -0.000 1.931) 2.905 2.575 ( 9.869 0.000 -4.085) 10.681 2.818 ( -7.858 -0.000 -2.932) 8.387 2.958 ( -11.000 -0.000 2.859) 11.366 3.044 ( -3.195 -0.000 0.481) 3.231 3.060 ( 14.554 0.000 -2.184) 14.717 3.171 ( -2.459 -0.000 5.305) 5.847 3.203 ( -3.872 -0.000 -3.700) 5.355 3.270 ( -5.561 -0.000 10.248) 11.659 3.525 ( -3.266 -0.000 -3.615) 4.872 3.598 ( 6.830 0.000 -7.003) 9.782 3.665 ( 5.227 0.000 -1.748) 5.511 3.709 ( -1.831 -0.000 3.653) 4.087 3.748 ( 8.326 0.000 -1.007) 8.387 3.986 ( -14.049 -0.000 4.322) 14.699 4.163 ( -2.316 -0.000 -8.274) 8.592 4.186 ( -3.751 -0.000 5.438) 6.606 4.242 ( 3.483 0.000 4.357) 5.578 4.406 ( 4.680 0.000 3.195) 5.667 4.457 ( -3.556 -0.000 2.372) 4.275 4.565 ( 0.304 0.000 -7.825) 7.831 4.581 ( -1.463 -0.000 -0.750) 1.644 4.704 ( 11.433 0.000 0.457) 11.442 4.766 ( 9.923 0.000 -5.616) 11.402 4.925 ( -0.219 -0.000 -0.115) 0.247 4.942 ( 0.330 0.000 -1.479) 1.515 5.006 ( 1.654 0.000 3.618) 3.978 5.043 ( 1.184 0.000 -2.622) 2.877 5.218 ( -6.738 -0.000 10.170) 12.199 5.494 ( -3.127 -0.000 10.123) 10.595 5.568 ( 9.719 0.000 -9.643) 13.691 5.644 ( -4.996 -0.000 -5.271) 7.262 6.121 ( 1.102 0.000 0.727) 1.320 6.201 ( 6.275 0.000 -1.657) 6.490 6.249 ( -8.644 -0.000 3.919) 9.491 6.409 ( 1.268 0.000 -2.024) 2.389 7.025 ( -7.013 -0.000 -3.965) 8.056 7.065 ( 3.647 0.000 3.143) 4.814 7.204 ( -3.553 -0.000 0.633) 3.609 7.243 ( -0.302 -0.000 1.041) 1.084 7.637 ( 0.054 0.000 -5.352) 5.353 7.648 ( 3.662 0.000 -0.203) 3.667 8.018 ( 6.581 0.000 8.248) 10.552 8.080 ( -2.786 -0.000 -8.330) 8.784 8.218 ( -2.076 -0.000 4.534) 4.986 8.316 ( -0.186 -0.000 -2.973) 2.979 8.394 ( -4.026 -0.000 7.150) 8.205 8.614 ( 6.603 0.000 -5.582) 8.647 8.956 ( -2.098 -0.000 2.860) 3.547 9.100 ( 4.197 0.000 -4.156) 5.906 9.555 ( -1.034 -0.000 -0.135) 1.042 9.646 ( 7.444 0.000 1.451) 7.585 9.957 ( -2.037 -0.000 9.757) 9.967 10.160 ( -1.916 -0.000 -10.739) 10.909 10.305 ( -5.695 -0.000 3.841) 6.869 10.466 ( 3.255 0.000 -4.907) 5.888 10.605 ( -3.501 -0.000 5.653) 6.649 10.742 ( 1.242 0.000 -4.698) 4.859 11.215 ( -0.883 -0.000 5.085) 5.161 11.270 ( -1.985 -0.000 -1.665) 2.591 11.594 ( -5.930 -0.000 -1.373) 6.087 11.620 ( -5.955 -0.000 -0.677) 5.994 11.726 ( 0.094 0.000 -1.281) 1.285 11.750 ( 4.803 0.000 2.185) 5.277 12.157 ( 0.196 0.000 0.940) 0.960 12.163 ( -0.559 -0.000 -1.223) 1.345 12.809 ( 1.813 0.000 1.892) 2.620 12.844 ( 1.218 0.000 -1.870) 2.231 13.528 ( -5.857 -0.000 1.348) 6.010 13.608 ( -2.951 -0.000 -1.304) 3.226 13.675 ( 5.080 0.000 2.112) 5.501 13.721 ( 1.550 0.000 -2.249) 2.732 15.748 ( 5.615 0.000 3.697) 6.723 15.784 ( 2.928 0.000 -3.206) 4.342 17.807 ( -4.131 -0.000 -0.772) 4.203 17.810 ( -1.558 -0.000 0.772) 1.738 18.447 ( -7.964 -0.000 0.176) 7.966 18.519 ( 1.298 0.000 0.862) 1.558 18.610 ( 1.260 0.000 -1.820) 2.214 18.643 ( 8.321 0.000 1.037) 8.386 19.819 ( 1.184 0.000 2.728) 2.973 19.856 ( 1.261 0.000 -1.595) 2.033 20.420 ( -2.579 -0.000 9.144) 9.501 20.687 ( 1.404 0.000 -15.189) 15.254 21.089 ( -3.954 -0.000 9.973) 10.728 21.373 ( 4.316 0.000 -15.425) 16.017 22.001 ( -3.598 -0.000 11.775) 12.313 22.167 ( -1.342 -0.000 12.067) 12.142 22.181 ( 0.846 0.000 -4.544) 4.622 22.343 ( -1.044 -0.000 -7.818) 7.887 22.532 ( -3.387 -0.000 1.693) 3.786 22.605 ( -0.804 -0.000 -3.371) 3.466 22.745 ( 2.852 0.000 0.223) 2.861 22.770 ( 4.451 0.000 0.222) 4.456 ======================= Grid point 205 (89/102) ======================= q-point: (-0.36 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -7.635 2.897 3.526) 8.895 1.554 ( -12.967 2.777 2.954) 13.586 1.707 ( 1.951 -8.432 -8.163) 11.897 1.783 ( -17.096 -2.260 1.710) 17.329 2.217 ( 8.446 5.066 -2.343) 10.123 2.243 ( 2.017 -1.215 -4.388) 4.979 2.284 ( -5.971 -2.665 7.785) 10.167 2.465 ( -2.074 -2.725 2.535) 4.260 2.540 ( 2.579 -6.244 -1.312) 6.882 2.659 ( 10.153 -1.988 -6.142) 12.032 2.769 ( -3.440 0.486 -2.475) 4.265 2.896 ( -14.708 -3.174 3.645) 15.481 3.008 ( -6.572 -0.864 0.164) 6.630 3.115 ( -2.836 -2.188 4.321) 5.613 3.163 ( -4.208 0.844 -1.110) 4.433 3.202 ( 9.011 -0.295 -1.241) 9.100 3.310 ( 1.520 -3.419 5.737) 6.849 3.490 ( -1.902 0.385 -4.467) 4.870 3.609 ( -5.181 3.046 4.960) 7.793 3.633 ( 6.225 3.333 -5.431) 8.908 3.669 ( 3.393 3.003 -1.787) 4.871 3.817 ( 8.074 1.672 -1.033) 8.310 3.929 ( -10.968 -3.391 2.153) 11.681 4.044 ( -2.768 6.208 -4.036) 7.905 4.121 ( -5.565 4.794 5.691) 9.292 4.243 ( 5.316 5.325 0.715) 7.558 4.416 ( -2.126 -0.686 0.307) 2.255 4.473 ( 5.260 1.059 0.005) 5.366 4.532 ( 2.505 -0.192 -1.967) 3.191 4.619 ( 2.873 -0.757 -2.912) 4.160 4.749 ( 1.466 2.224 -0.272) 2.677 4.818 ( 8.164 0.403 1.427) 8.298 4.906 ( 5.430 -2.398 -1.386) 6.095 5.015 ( 7.706 -1.862 -0.493) 7.943 5.048 ( 0.594 -0.310 0.194) 0.698 5.153 ( 1.773 -10.122 0.173) 10.278 5.225 ( -2.648 -2.966 3.988) 5.632 5.422 ( 0.320 4.198 4.441) 6.120 5.589 ( -8.554 -2.454 -1.400) 9.008 5.733 ( 7.737 -6.521 -3.988) 10.876 6.066 ( -3.561 3.840 0.853) 5.306 6.228 ( 5.663 1.820 -2.668) 6.519 6.286 ( -4.919 -7.386 3.697) 9.614 6.451 ( -1.394 -4.410 -1.696) 4.926 6.951 ( -6.883 1.368 -4.069) 8.112 7.062 ( 0.692 2.790 4.382) 5.241 7.182 ( -4.004 -0.499 -0.848) 4.123 7.242 ( -2.255 -0.831 2.688) 3.606 7.614 ( 2.606 2.270 -5.000) 6.078 7.665 ( 4.118 1.514 -1.901) 4.782 8.025 ( -0.137 3.159 -4.846) 5.787 8.069 ( 3.805 1.535 7.439) 8.495 8.197 ( -1.660 1.038 0.698) 2.078 8.322 ( 1.445 -1.111 -2.672) 3.234 8.409 ( -1.345 -2.191 5.905) 6.440 8.572 ( 4.143 7.229 -1.650) 8.494 8.972 ( 1.455 -1.056 0.270) 1.818 9.092 ( 1.965 2.297 -2.107) 3.684 9.529 ( 3.739 4.388 -1.438) 5.942 9.704 ( 8.693 1.439 1.478) 8.934 9.893 ( -5.847 5.883 8.932) 12.189 10.094 ( -3.895 1.939 -10.069) 10.969 10.302 ( -3.968 -2.923 3.524) 6.058 10.439 ( 1.033 2.859 -4.813) 5.692 10.573 ( -5.320 1.309 4.198) 6.902 10.750 ( 0.631 -1.013 -2.937) 3.170 11.147 ( -4.150 5.355 2.610) 7.260 11.230 ( -0.037 3.456 0.094) 3.457 11.539 ( -9.238 -2.500 -0.530) 9.585 11.646 ( -5.347 -5.599 -0.744) 7.778 11.739 ( -0.993 -0.708 -0.896) 1.513 11.795 ( 2.309 -0.809 1.583) 2.914 12.122 ( -1.052 2.081 -0.490) 2.383 12.187 ( 1.257 -1.402 0.235) 1.898 12.851 ( 2.122 -2.309 0.903) 3.264 12.882 ( 2.289 -2.996 -1.079) 3.922 13.350 ( -9.674 12.706 0.662) 15.983 13.503 ( -6.994 13.232 0.598) 14.978 13.628 ( 6.154 2.181 -1.083) 6.619 13.728 ( 5.718 3.589 -0.099) 6.751 15.785 ( 5.829 0.418 0.882) 5.910 15.864 ( 9.643 -2.765 -0.417) 10.041 17.686 ( -7.734 6.428 -0.174) 10.058 17.782 ( -1.291 1.576 0.176) 2.044 18.310 ( -13.565 3.596 0.703) 14.052 18.651 ( 5.829 -0.178 -2.553) 6.366 18.658 ( 0.761 -4.228 1.711) 4.624 18.765 ( 11.554 -11.551 0.429) 16.343 19.711 ( 2.652 11.774 3.493) 12.564 19.751 ( 1.798 11.139 -2.884) 11.646 20.317 ( -4.427 11.333 9.244) 15.280 20.542 ( -0.990 13.022 -12.863) 18.330 21.168 ( -5.411 -9.282 7.664) 13.197 21.426 ( 2.288 -6.734 -14.159) 15.845 21.989 ( -7.947 2.005 11.197) 13.876 22.081 ( -4.215 -0.399 3.550) 5.525 22.310 ( 2.410 2.179 -5.573) 6.451 22.372 ( 7.567 -7.813 -3.196) 11.337 22.541 ( -3.992 -4.957 4.088) 7.564 22.617 ( -2.543 -4.603 0.688) 5.304 22.804 ( 5.605 -2.921 -1.330) 6.459 22.838 ( 5.164 -3.045 -0.231) 5.999 ======================= Grid point 206 (90/102) ======================= q-point: (-0.27 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( -10.528 -2.548 6.269) 12.515 1.451 ( -12.171 -3.109 1.873) 12.700 1.701 ( -13.112 -2.305 -1.805) 13.435 1.904 ( 2.557 -11.301 -7.361) 13.727 2.167 ( 2.869 4.013 -1.731) 5.228 2.258 ( -3.000 -0.979 -5.919) 6.708 2.319 ( -3.317 -3.988 3.545) 6.283 2.521 ( -2.929 -4.684 3.078) 6.323 2.616 ( 0.747 -0.588 2.009) 2.222 2.731 ( 3.013 0.022 -1.476) 3.355 2.744 ( -3.529 -1.527 2.123) 4.393 2.888 ( -10.368 -6.164 2.034) 12.232 3.020 ( -6.224 -4.303 -1.241) 7.668 3.102 ( -0.462 0.817 -0.454) 1.043 3.176 ( -0.339 -3.409 1.078) 3.591 3.249 ( 1.999 -1.365 1.827) 3.033 3.398 ( 1.482 0.930 -2.518) 3.066 3.477 ( 1.248 -0.775 -0.359) 1.512 3.488 ( -2.487 2.123 1.994) 3.830 3.635 ( 1.379 1.152 -0.149) 1.803 3.640 ( 5.503 3.322 -2.619) 6.941 3.788 ( 1.749 3.850 -1.427) 4.463 3.867 ( -6.844 3.162 -2.390) 7.909 3.941 ( -0.108 5.998 3.510) 6.951 4.053 ( -3.455 -3.303 1.196) 4.927 4.180 ( 7.046 5.850 0.812) 9.194 4.365 ( 2.122 4.772 -2.299) 5.706 4.524 ( 2.374 -2.313 0.275) 3.326 4.552 ( 6.837 3.422 -1.458) 7.783 4.644 ( 7.256 -0.635 -0.598) 7.309 4.743 ( -5.441 -2.868 3.656) 7.155 4.884 ( 8.673 0.313 -0.203) 8.681 4.990 ( 1.778 -3.634 -0.842) 4.132 5.042 ( 0.054 1.028 0.996) 1.432 5.101 ( 4.648 -1.290 -0.726) 4.878 5.283 ( 6.942 -2.490 -3.951) 8.367 5.352 ( 1.610 -9.960 0.336) 10.095 5.420 ( -1.892 -2.286 5.250) 6.031 5.588 ( -6.401 -4.182 0.582) 7.668 5.858 ( 3.718 -1.579 -1.317) 4.248 5.990 ( -3.614 0.492 0.590) 3.695 6.220 ( 1.406 1.167 -1.668) 2.474 6.393 ( -4.110 -6.767 3.165) 8.527 6.512 ( -2.780 -4.332 -3.099) 6.008 6.863 ( -6.224 2.245 -3.014) 7.271 7.015 ( -0.206 3.032 3.711) 4.797 7.154 ( -4.976 -0.430 -1.638) 5.256 7.248 ( -3.075 -0.575 4.507) 5.486 7.574 ( 3.064 3.883 -2.280) 5.446 7.620 ( 4.695 6.945 -4.704) 9.612 7.945 ( 1.030 4.378 -1.296) 4.681 8.054 ( 2.323 4.229 7.129) 8.608 8.185 ( -0.812 -1.356 -3.915) 4.222 8.325 ( 6.627 5.030 -5.020) 9.717 8.438 ( 1.625 -0.106 1.733) 2.378 8.521 ( -1.673 -1.644 4.976) 5.501 8.955 ( 0.104 3.663 -0.264) 3.674 9.094 ( 2.104 -1.434 0.583) 2.613 9.427 ( 5.257 10.620 -1.420) 11.935 9.633 ( 6.076 13.559 -1.634) 14.947 9.797 ( -8.821 -0.595 9.554) 13.017 10.004 ( -3.240 2.423 -10.419) 11.177 10.326 ( -3.572 -0.235 4.357) 5.639 10.424 ( 1.260 -3.043 -3.156) 4.562 10.525 ( -4.472 -0.806 0.737) 4.603 10.760 ( -1.172 -0.471 -0.427) 1.333 11.017 ( -5.635 4.904 0.592) 7.494 11.165 ( 0.876 3.358 1.328) 3.716 11.535 ( -7.180 -2.787 -0.760) 7.740 11.677 ( -2.512 1.363 -0.141) 2.861 11.694 ( -6.677 0.826 -0.948) 6.794 11.803 ( -3.735 0.774 1.529) 4.109 12.092 ( 1.877 1.073 -0.611) 2.246 12.222 ( 1.632 -0.919 0.434) 1.922 12.913 ( -1.275 -1.220 -2.105) 2.747 12.962 ( -1.462 -1.795 1.965) 3.036 13.000 ( -5.375 11.898 0.893) 13.086 13.138 ( -8.345 18.664 -0.114) 20.445 13.643 ( 7.153 1.960 -0.405) 7.428 13.676 ( 5.766 6.630 -0.313) 8.793 15.835 ( 6.180 -0.892 -0.513) 6.265 15.975 ( 10.593 -0.273 0.703) 10.620 17.523 ( -8.437 3.673 -0.071) 9.203 17.763 ( 0.770 0.020 0.076) 0.774 18.149 ( -15.498 2.049 0.364) 15.637 18.635 ( 3.960 4.470 -0.831) 6.029 18.713 ( 1.121 -0.069 0.852) 1.410 19.087 ( 13.053 -8.065 -0.243) 15.345 19.537 ( 3.848 9.587 4.222) 11.160 19.577 ( 3.576 6.031 -2.461) 7.431 19.986 ( -10.778 19.112 1.527) 21.995 20.220 ( -1.257 17.553 -4.759) 18.230 21.309 ( -7.969 -8.772 4.178) 12.566 21.548 ( -1.624 -7.698 -8.143) 11.322 21.894 ( -7.108 1.139 3.738) 8.111 22.124 ( -4.627 -4.705 6.783) 9.463 22.264 ( 4.576 4.515 -3.610) 7.372 22.448 ( 2.294 -0.083 -5.161) 5.649 22.631 ( 0.108 -5.069 2.743) 5.764 22.828 ( 5.174 -13.802 3.468) 15.142 22.909 ( 5.654 -3.370 -5.571) 8.623 22.952 ( 5.782 -5.936 2.845) 8.762 ======================= Grid point 207 (91/102) ======================= q-point: (-0.18 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -6.618 -9.067 -1.553) 11.332 1.486 ( -11.856 -9.170 4.710) 15.711 1.694 ( -5.891 -5.889 -3.544) 9.052 2.038 ( -5.728 0.668 3.973) 7.003 2.128 ( 1.863 -3.063 -2.222) 4.218 2.225 ( -8.520 -2.688 -4.176) 9.862 2.417 ( 0.931 -7.450 -1.081) 7.586 2.540 ( -0.830 3.479 2.267) 4.234 2.634 ( -1.181 -3.050 1.039) 3.432 2.723 ( -2.446 0.738 0.522) 2.608 2.770 ( 0.918 -2.156 1.759) 2.930 2.938 ( -7.615 -4.841 1.632) 9.170 3.012 ( -7.044 -2.670 -1.334) 7.650 3.139 ( 5.109 -0.745 -1.916) 5.507 3.230 ( 0.403 -2.200 0.594) 2.314 3.292 ( 2.221 -0.322 -0.868) 2.406 3.323 ( -3.558 0.746 -0.967) 3.762 3.433 ( -2.460 -0.347 3.116) 3.985 3.525 ( -1.444 7.235 -1.799) 7.594 3.612 ( 6.405 -4.062 -2.634) 8.029 3.685 ( 4.497 -0.843 0.055) 4.575 3.737 ( -5.199 1.450 1.850) 5.706 3.749 ( 2.968 3.983 -2.100) 5.393 3.892 ( 1.616 0.694 1.111) 2.080 4.135 ( -1.139 -5.303 0.930) 5.503 4.156 ( 7.158 2.023 1.877) 7.671 4.290 ( 1.568 4.263 -0.716) 4.599 4.526 ( 5.555 3.970 -1.272) 6.946 4.570 ( 0.630 -0.438 1.968) 2.113 4.699 ( 8.000 1.490 -2.081) 8.400 4.773 ( 0.223 -2.055 1.783) 2.730 4.928 ( 1.431 -1.320 -0.320) 1.973 5.027 ( -2.390 -1.593 -0.003) 2.872 5.080 ( 3.754 -4.398 -1.457) 5.963 5.144 ( 3.185 -0.981 0.339) 3.350 5.361 ( 1.949 -0.972 -3.398) 4.036 5.451 ( -1.080 -1.988 1.480) 2.704 5.519 ( 3.453 -5.785 1.151) 6.835 5.651 ( -2.515 -5.526 2.180) 6.451 5.849 ( -2.374 0.154 0.897) 2.542 5.979 ( 0.600 1.868 -1.116) 2.257 6.217 ( -0.445 -1.120 0.551) 1.326 6.466 ( -4.946 -4.288 3.635) 7.487 6.553 ( -4.949 -4.790 -6.393) 9.398 6.755 ( -8.207 3.840 0.467) 9.073 6.987 ( 2.406 1.172 0.566) 2.735 7.116 ( -6.108 0.462 1.425) 6.289 7.200 ( -2.836 5.375 1.641) 6.294 7.465 ( 1.514 7.529 -0.440) 7.693 7.527 ( 3.688 6.118 -3.906) 8.142 7.899 ( 4.788 2.575 -1.884) 5.754 8.011 ( 1.817 3.262 6.745) 7.710 8.203 ( 0.226 -1.517 -4.351) 4.614 8.265 ( 8.248 5.146 -5.103) 10.980 8.460 ( -1.697 1.385 0.783) 2.326 8.518 ( -6.647 -0.524 2.924) 7.281 8.910 ( 2.261 1.438 1.798) 3.227 9.110 ( -1.155 1.978 1.788) 2.905 9.246 ( 4.803 12.568 0.696) 13.473 9.457 ( 5.563 6.821 -1.600) 8.946 9.743 ( -10.386 1.164 7.456) 12.838 9.912 ( -2.683 3.242 -10.749) 11.543 10.289 ( -3.938 0.972 3.157) 5.140 10.525 ( 3.570 -5.601 -1.965) 6.926 10.570 ( -1.606 -6.113 -0.681) 6.357 10.759 ( -0.575 -0.891 0.781) 1.317 10.906 ( -4.809 3.048 0.534) 5.719 11.142 ( 1.214 0.607 1.473) 2.003 11.478 ( -5.647 4.632 -1.385) 7.434 11.560 ( -4.316 4.602 0.566) 6.335 11.638 ( -8.626 3.967 1.679) 9.642 11.683 ( -7.011 5.767 -0.919) 9.125 12.100 ( 3.611 0.950 -0.896) 3.840 12.234 ( 1.362 1.352 0.763) 2.066 12.650 ( -8.493 8.970 -0.067) 12.353 12.769 ( -8.791 13.184 -0.014) 15.846 13.018 ( 0.881 -4.575 -0.577) 4.694 13.072 ( 1.025 -5.022 0.923) 5.208 13.582 ( 5.146 8.047 -0.547) 9.568 13.655 ( 7.595 2.865 0.058) 8.118 15.896 ( 5.335 -1.103 -1.691) 5.704 16.017 ( 6.053 2.683 1.697) 6.835 17.455 ( -4.331 -1.265 -0.183) 4.516 17.798 ( 3.026 -2.425 0.169) 3.882 18.030 ( -11.845 -0.553 -0.160) 11.859 18.561 ( 2.264 5.870 0.399) 6.304 18.655 ( -1.721 6.862 0.184) 7.077 19.118 ( 2.068 7.173 0.129) 7.466 19.427 ( -0.283 7.400 4.498) 8.664 19.499 ( -7.789 10.354 -2.932) 13.284 19.794 ( 12.258 -6.455 -4.811) 14.665 19.912 ( 0.882 14.708 1.976) 14.866 21.321 ( -14.039 -0.548 1.073) 14.090 21.628 ( -4.630 -6.023 0.421) 7.609 21.917 ( 0.913 -5.478 -3.534) 6.582 22.142 ( -1.708 2.263 1.987) 3.462 22.249 ( 1.729 -1.244 3.534) 4.127 22.434 ( 1.139 1.429 -4.685) 5.029 22.745 ( 0.075 -6.343 5.095) 8.136 22.971 ( 3.990 -1.267 -5.718) 7.086 23.091 ( 6.931 -9.026 -0.261) 11.383 23.131 ( 7.681 -6.794 2.722) 10.609 ======================= Grid point 208 (92/102) ======================= q-point: (-0.09 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( -3.398 -10.826 -4.523) 12.215 1.598 ( -7.998 -9.803 2.875) 12.975 1.797 ( 2.701 -5.423 -5.947) 8.490 1.919 ( -13.102 0.741 7.714) 15.222 2.193 ( -1.512 -1.602 0.417) 2.242 2.216 ( -4.047 -1.794 1.065) 4.553 2.457 ( -2.834 3.280 -0.317) 4.346 2.584 ( 2.271 -8.664 -1.445) 9.072 2.639 ( 5.202 4.309 -0.324) 6.762 2.721 ( -8.529 -6.027 0.938) 10.486 2.836 ( 4.641 -2.850 -0.052) 5.446 2.923 ( -4.212 1.316 0.393) 4.430 3.019 ( -3.696 -2.409 -0.994) 4.523 3.174 ( 0.215 -0.596 0.231) 0.674 3.248 ( 3.898 0.868 -2.139) 4.531 3.296 ( -2.161 3.553 1.356) 4.374 3.338 ( 1.456 -0.334 -0.227) 1.511 3.389 ( -3.157 0.454 -0.047) 3.190 3.457 ( -0.428 -3.497 -0.113) 3.525 3.625 ( -2.528 2.340 3.223) 4.718 3.668 ( 4.741 2.486 -4.797) 7.188 3.750 ( 1.989 0.742 -0.138) 2.128 3.808 ( 4.799 -5.426 0.230) 7.247 3.924 ( 0.281 -2.305 1.839) 2.962 4.138 ( 2.730 1.785 1.277) 3.503 4.237 ( 2.707 2.474 -1.793) 4.082 4.273 ( 1.157 -4.626 -0.795) 4.835 4.480 ( -0.706 3.052 4.777) 5.712 4.558 ( -0.296 0.536 -1.450) 1.574 4.728 ( 6.134 0.364 -1.325) 6.286 4.815 ( 2.919 -1.201 -0.274) 3.168 4.955 ( -0.963 -1.763 -1.423) 2.462 5.055 ( 1.097 -1.007 1.981) 2.478 5.172 ( 2.970 -1.611 -2.871) 4.434 5.199 ( -0.269 -3.224 2.183) 3.902 5.361 ( -1.111 -2.400 -1.054) 2.847 5.450 ( -1.583 1.170 -0.326) 1.995 5.601 ( 4.953 0.346 -0.655) 5.009 5.725 ( -3.490 -4.343 1.982) 5.914 5.880 ( -0.419 -3.791 2.368) 4.489 5.915 ( 1.857 5.063 -1.177) 5.520 6.256 ( 0.326 -2.547 1.303) 2.880 6.496 ( -6.581 -3.528 1.044) 7.540 6.569 ( -2.165 1.788 -6.010) 6.633 6.628 ( -12.132 -2.006 1.890) 12.442 6.959 ( -1.799 7.455 5.460) 9.414 7.035 ( 0.845 1.868 -2.071) 2.914 7.098 ( -2.894 1.636 -3.869) 5.101 7.376 ( 0.876 5.223 0.687) 5.341 7.433 ( 1.438 4.223 -0.267) 4.469 7.921 ( 6.959 -0.720 -3.825) 7.973 7.999 ( 1.551 1.416 6.126) 6.476 8.211 ( -1.948 0.349 -5.612) 5.950 8.218 ( 0.336 5.220 0.167) 5.234 8.304 ( -5.544 5.746 -0.490) 7.999 8.527 ( -4.053 -2.168 2.285) 5.133 8.909 ( 7.694 5.046 -1.530) 9.327 9.053 ( -0.857 1.904 2.485) 3.246 9.108 ( 2.983 4.348 2.438) 5.810 9.467 ( 5.937 -0.397 0.969) 6.028 9.650 ( -9.563 1.942 6.509) 11.730 9.801 ( -2.007 4.031 -10.118) 11.075 10.267 ( -1.954 -0.390 1.228) 2.341 10.646 ( 4.097 -4.848 -3.053) 7.043 10.671 ( -3.669 -6.416 -0.495) 7.407 10.802 ( -0.396 -2.815 -0.008) 2.843 10.861 ( 2.318 -0.329 2.392) 3.347 11.154 ( -0.808 -0.796 2.154) 2.434 11.337 ( -2.196 5.582 -1.315) 6.141 11.394 ( -11.761 9.005 2.689) 15.054 11.447 ( -1.437 7.141 -1.335) 7.406 11.581 ( -4.711 3.121 -1.091) 5.756 12.084 ( 2.140 2.965 -1.203) 3.850 12.196 ( -0.126 2.993 1.681) 3.435 12.528 ( -3.474 1.040 0.133) 3.629 12.564 ( -4.663 4.315 -0.455) 6.369 13.102 ( -0.345 -4.569 -0.473) 4.606 13.166 ( -0.981 -5.081 0.432) 5.192 13.469 ( 4.382 8.198 -0.404) 9.304 13.651 ( 5.895 3.339 0.375) 6.786 15.941 ( 3.426 -0.796 -2.144) 4.119 15.990 ( 1.128 3.216 2.095) 4.000 17.479 ( -0.210 -2.477 -0.307) 2.504 17.897 ( 5.223 -4.935 1.122) 7.273 17.998 ( -5.301 -2.995 -1.534) 6.279 18.437 ( -10.931 9.741 2.092) 14.790 18.494 ( 4.584 5.479 -1.016) 7.216 18.985 ( -1.622 6.448 0.520) 6.669 19.225 ( -6.122 6.871 -0.972) 9.254 19.386 ( -1.312 3.544 0.233) 3.786 19.687 ( 3.103 8.817 -0.425) 9.357 20.063 ( 13.755 -6.639 -0.145) 15.274 21.187 ( -12.936 2.236 0.593) 13.141 21.710 ( -4.103 -6.183 1.173) 7.513 22.032 ( 2.319 -5.842 -3.731) 7.310 22.075 ( 1.894 4.650 -0.976) 5.115 22.288 ( -2.258 -0.600 7.941) 8.277 22.412 ( 1.771 0.219 -6.029) 6.287 22.864 ( -1.056 -5.670 5.385) 7.890 22.990 ( 3.232 0.831 -4.312) 5.453 23.247 ( 3.552 -4.299 1.109) 5.685 23.289 ( 7.206 -3.766 -0.821) 8.172 ======================= Grid point 216 (93/102) ======================= q-point: (-0.36 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -16.050 -0.000 3.635) 16.456 1.471 ( -2.613 -0.000 -7.743) 8.173 1.584 ( -10.984 -0.000 -6.209) 12.617 1.595 ( -22.310 -0.000 8.609) 23.913 2.201 ( -13.856 -0.000 7.498) 15.754 2.239 ( 0.769 0.000 -3.027) 3.123 2.348 ( 4.953 0.000 5.228) 7.201 2.466 ( 6.395 0.000 -2.923) 7.031 2.471 ( 4.113 0.000 -2.856) 5.007 2.673 ( -0.802 -0.000 -5.392) 5.452 2.746 ( -12.914 -0.000 1.580) 13.011 2.784 ( 4.802 0.000 -7.249) 8.695 2.958 ( -5.931 -0.000 0.727) 5.976 3.040 ( -10.800 -0.000 8.972) 14.040 3.131 ( -4.101 -0.000 -1.939) 4.536 3.258 ( 4.169 0.000 2.682) 4.957 3.331 ( 7.032 0.000 1.990) 7.308 3.468 ( -1.333 -0.000 -3.669) 3.903 3.588 ( -3.131 -0.000 -1.496) 3.470 3.692 ( -1.925 -0.000 2.969) 3.538 3.743 ( 6.889 0.000 -3.474) 7.715 3.827 ( -5.950 -0.000 4.618) 7.532 3.888 ( 5.525 0.000 -7.370) 9.211 4.107 ( 3.865 0.000 -5.811) 6.979 4.136 ( -7.443 -0.000 8.247) 11.109 4.304 ( 1.064 0.000 4.694) 4.813 4.421 ( -1.648 -0.000 2.869) 3.309 4.479 ( 3.138 0.000 -0.123) 3.140 4.570 ( 6.165 0.000 -10.048) 11.789 4.598 ( 4.499 0.000 2.233) 5.022 4.847 ( -0.528 -0.000 1.373) 1.471 4.896 ( 8.394 0.000 -2.904) 8.882 4.955 ( 4.318 0.000 2.692) 5.088 4.966 ( 8.973 0.000 -0.020) 8.973 5.068 ( 3.082 0.000 -3.177) 4.426 5.083 ( 7.123 0.000 -0.196) 7.125 5.193 ( -0.703 -0.000 3.648) 3.715 5.497 ( -9.914 -0.000 0.503) 9.927 5.507 ( -0.703 -0.000 10.700) 10.723 5.696 ( 10.403 0.000 -11.000) 15.140 6.113 ( -11.264 -0.000 4.297) 12.056 6.155 ( 3.324 0.000 -1.373) 3.596 6.304 ( 8.313 0.000 -3.637) 9.074 6.377 ( -4.708 -0.000 1.650) 4.989 6.902 ( -6.964 -0.000 -3.947) 8.005 7.081 ( -5.332 -0.000 4.832) 7.196 7.163 ( -0.425 -0.000 -0.116) 0.440 7.206 ( -5.449 -0.000 2.041) 5.818 7.657 ( 7.063 0.000 -10.787) 12.894 7.685 ( 0.988 0.000 0.447) 1.084 8.034 ( 0.704 0.000 -7.943) 7.974 8.105 ( -2.717 -0.000 6.200) 6.769 8.249 ( 5.318 0.000 7.291) 9.025 8.285 ( -1.262 -0.000 -2.740) 3.017 8.390 ( -1.015 -0.000 7.609) 7.676 8.703 ( 7.879 0.000 -3.144) 8.483 8.957 ( 0.833 0.000 0.106) 0.840 9.126 ( 0.348 0.000 -0.445) 0.565 9.607 ( 8.791 0.000 -5.711) 10.484 9.751 ( 0.326 0.000 8.123) 8.130 9.976 ( 4.189 0.000 3.464) 5.436 10.043 ( -7.550 -0.000 -8.755) 11.560 10.231 ( -5.663 -0.000 2.747) 6.294 10.468 ( -0.221 -0.000 -5.905) 5.909 10.569 ( -4.164 -0.000 4.604) 6.208 10.738 ( 1.197 0.000 -2.792) 3.038 11.217 ( -2.221 -0.000 4.275) 4.817 11.219 ( -3.825 -0.000 -1.505) 4.111 11.454 ( -10.277 -0.000 -3.535) 10.868 11.513 ( -7.329 -0.000 5.176) 8.973 11.704 ( -2.266 -0.000 -3.008) 3.767 11.828 ( 3.225 0.000 1.530) 3.569 12.154 ( 0.951 0.000 -2.295) 2.484 12.159 ( -0.597 -0.000 1.906) 1.997 12.858 ( 3.488 0.000 1.107) 3.659 12.865 ( 2.174 0.000 -1.434) 2.605 13.406 ( -10.610 -0.000 0.862) 10.645 13.538 ( -5.782 -0.000 -0.704) 5.825 13.758 ( 3.929 0.000 -0.534) 3.966 13.764 ( 5.584 0.000 0.535) 5.609 15.858 ( 8.509 0.000 -4.769) 9.754 15.914 ( 13.964 0.000 5.719) 15.090 17.701 ( -9.329 -0.000 -0.151) 9.331 17.762 ( -4.919 -0.000 0.379) 4.934 18.331 ( -8.162 -0.000 1.620) 8.321 18.497 ( -2.587 -0.000 -2.046) 3.298 18.686 ( 7.801 0.000 0.624) 7.826 18.787 ( 10.874 0.000 -0.334) 10.879 19.870 ( 3.647 0.000 3.731) 5.218 19.875 ( 1.802 0.000 -2.641) 3.197 20.406 ( -4.681 -0.000 8.082) 9.340 20.637 ( 0.442 0.000 -12.540) 12.548 21.041 ( -8.133 -0.000 8.731) 11.932 21.342 ( 1.448 0.000 -19.029) 19.084 21.986 ( -4.210 -0.000 8.271) 9.281 22.132 ( -4.248 -0.000 -5.028) 6.582 22.218 ( -0.756 -0.000 18.884) 18.899 22.335 ( 3.684 0.000 -5.261) 6.423 22.478 ( -3.940 -0.000 0.835) 4.028 22.567 ( -0.774 -0.000 -4.785) 4.848 22.822 ( 6.456 0.000 -0.311) 6.464 22.854 ( 5.927 0.000 0.305) 5.935 ======================= Grid point 217 (94/102) ======================= q-point: (-0.27 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( -16.659 1.630 6.709) 18.033 1.356 ( -11.559 2.528 -4.007) 12.493 1.496 ( -22.222 -4.596 5.034) 23.244 1.656 ( -4.090 -13.036 -9.748) 16.783 2.121 ( -15.375 -2.285 4.570) 16.202 2.229 ( -6.264 -1.861 -2.711) 7.075 2.345 ( 3.262 4.115 0.968) 5.340 2.441 ( -0.673 0.207 -2.858) 2.943 2.587 ( -7.638 -4.556 4.474) 9.956 2.617 ( -5.691 -3.517 0.287) 6.696 2.737 ( -0.005 -1.133 -4.388) 4.531 2.799 ( 2.724 0.261 -0.420) 2.768 2.921 ( -1.783 -1.743 -1.745) 3.044 3.067 ( -3.247 -4.567 1.544) 5.812 3.101 ( -3.804 -1.856 1.761) 4.585 3.272 ( 1.664 1.507 4.487) 5.017 3.387 ( 0.948 -2.330 -3.450) 4.270 3.476 ( 5.340 0.149 0.029) 5.342 3.550 ( -5.171 1.827 3.383) 6.443 3.690 ( 1.579 0.881 0.191) 1.818 3.695 ( 4.295 4.897 -2.948) 7.150 3.842 ( -1.229 -0.911 -2.127) 2.620 3.864 ( 0.285 2.629 -5.997) 6.554 4.033 ( -7.908 3.753 4.441) 9.816 4.085 ( 6.893 6.411 2.730) 9.801 4.314 ( 3.065 3.451 2.085) 5.064 4.418 ( 3.130 -1.107 0.147) 3.323 4.546 ( 5.353 1.639 -3.517) 6.611 4.578 ( 2.357 -4.671 -0.188) 5.235 4.674 ( 4.432 0.725 -1.206) 4.650 4.721 ( 2.516 4.073 1.592) 5.045 4.960 ( 1.673 1.710 1.225) 2.688 5.017 ( 12.441 -0.056 -1.938) 12.592 5.077 ( 2.342 1.023 -1.049) 2.762 5.114 ( 0.382 -2.279 1.260) 2.632 5.157 ( 6.380 -8.921 0.405) 10.975 5.268 ( 5.714 -5.186 -1.659) 7.893 5.411 ( -6.835 1.891 1.688) 7.290 5.513 ( 0.936 -0.649 5.999) 6.107 5.821 ( 6.352 -5.581 -5.010) 9.829 5.991 ( -7.101 3.359 1.290) 7.961 6.220 ( -3.026 -2.413 0.918) 3.978 6.305 ( 3.028 0.050 -1.188) 3.253 6.423 ( -0.059 -3.762 -0.976) 3.887 6.836 ( -6.307 0.910 -3.106) 7.089 7.029 ( -7.183 0.818 2.773) 7.743 7.130 ( -3.826 1.439 -0.013) 4.088 7.204 ( -3.460 -2.177 4.050) 5.754 7.638 ( 2.548 2.764 -5.725) 6.849 7.711 ( 3.860 0.817 -5.819) 7.030 8.005 ( 0.491 2.066 -2.863) 3.565 8.102 ( -4.485 -2.364 0.015) 5.070 8.190 ( 1.501 5.741 4.394) 7.384 8.373 ( 4.493 -3.056 1.396) 5.610 8.426 ( 0.496 -2.096 6.392) 6.745 8.641 ( 6.068 9.818 -1.213) 11.606 9.000 ( 1.720 -0.620 -1.085) 2.126 9.098 ( -0.696 1.010 1.702) 2.098 9.619 ( 8.656 5.343 -6.372) 12.003 9.739 ( -10.632 0.053 10.096) 14.662 9.887 ( 3.588 8.166 -5.134) 10.292 10.010 ( 1.454 3.350 -5.532) 6.629 10.254 ( -3.753 -4.366 5.164) 7.734 10.413 ( -1.359 2.110 -4.710) 5.337 10.523 ( -2.429 2.270 1.175) 3.526 10.750 ( 0.733 -0.351 -0.582) 0.999 11.070 ( -6.763 6.431 0.811) 9.368 11.225 ( -1.758 2.710 0.281) 3.242 11.398 ( -8.845 -4.716 -0.327) 10.029 11.558 ( -5.405 -5.281 2.503) 7.960 11.696 ( -3.560 -1.150 -0.348) 3.757 11.816 ( -1.168 2.459 -0.428) 2.756 12.130 ( 2.441 1.430 -0.155) 2.833 12.201 ( 1.071 -2.171 0.041) 2.421 12.879 ( 0.989 -0.914 -1.085) 1.730 12.917 ( 2.139 -2.620 0.571) 3.431 13.196 ( -10.866 12.895 1.218) 16.907 13.367 ( -11.031 13.548 -0.128) 17.472 13.730 ( 7.434 2.366 -0.809) 7.843 13.810 ( 5.273 2.697 0.127) 5.924 15.894 ( 8.692 1.302 -3.152) 9.337 16.062 ( 15.287 -0.903 4.117) 15.858 17.551 ( -10.058 6.533 0.281) 11.997 17.738 ( -4.282 -1.233 -0.197) 4.461 18.103 ( -14.498 7.612 0.147) 16.375 18.663 ( 0.570 -5.819 -0.821) 5.904 18.751 ( 7.783 -0.006 0.574) 7.805 18.971 ( 15.209 -12.968 0.138) 19.987 19.764 ( 1.464 11.073 -3.139) 11.602 19.781 ( 4.042 11.396 3.879) 12.698 20.239 ( -10.413 15.912 3.632) 19.360 20.476 ( -1.374 13.341 -7.362) 15.299 21.091 ( -8.965 -9.102 5.842) 14.048 21.370 ( -1.396 -7.020 -15.621) 17.183 21.899 ( -9.204 5.560 8.741) 13.857 22.034 ( -4.139 -2.085 3.521) 5.820 22.336 ( 3.391 0.788 -3.344) 4.827 22.443 ( 0.590 -0.329 -1.849) 1.969 22.551 ( 6.593 -11.822 1.044) 13.576 22.603 ( 0.305 -10.221 4.452) 11.152 22.893 ( 6.868 -2.426 -2.031) 7.562 22.921 ( 5.529 -2.720 0.861) 6.222 ======================= Grid point 218 (95/102) ======================= q-point: (-0.18 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( -14.091 -5.637 3.662) 15.613 1.278 ( -10.733 -4.050 -1.518) 11.572 1.468 ( -17.453 -8.372 2.653) 19.538 1.860 ( -4.909 -13.947 -4.250) 15.384 2.080 ( -11.144 -3.618 0.748) 11.740 2.216 ( -7.273 2.490 -1.266) 7.790 2.249 ( -7.398 -2.177 -1.592) 7.874 2.456 ( -4.061 -4.907 -2.474) 6.833 2.605 ( -13.231 -8.201 2.085) 15.706 2.652 ( 1.708 2.098 2.308) 3.556 2.753 ( 0.764 -1.523 -0.145) 1.710 2.833 ( -1.719 -2.457 1.307) 3.271 2.952 ( 1.905 -1.474 -1.722) 2.961 3.108 ( 0.257 -3.847 -2.520) 4.606 3.190 ( -0.036 -5.609 2.825) 6.281 3.256 ( -1.726 1.162 3.320) 3.919 3.360 ( -0.502 3.607 -2.273) 4.293 3.466 ( -1.420 3.991 4.101) 5.896 3.571 ( 7.082 -5.153 -1.979) 8.979 3.631 ( 0.747 4.518 -4.118) 6.159 3.704 ( 2.468 -0.595 0.478) 2.583 3.770 ( -0.521 5.973 -2.881) 6.652 3.839 ( 2.773 2.559 -2.164) 4.350 3.938 ( -1.158 1.848 2.513) 3.327 4.056 ( 1.426 0.368 3.251) 3.569 4.266 ( 2.921 4.106 2.455) 5.605 4.413 ( 5.168 6.186 -1.296) 8.164 4.557 ( 2.387 -0.733 -1.470) 2.897 4.635 ( 2.259 1.476 0.089) 2.700 4.703 ( 2.773 -5.488 0.335) 6.158 4.774 ( 9.375 0.719 0.016) 9.402 4.932 ( -3.125 0.750 1.550) 3.567 5.005 ( -2.115 2.427 -2.647) 4.168 5.101 ( 11.295 0.700 -0.435) 11.325 5.169 ( 5.050 -0.439 -0.839) 5.138 5.352 ( -3.745 -0.239 -0.514) 3.788 5.388 ( 1.603 -8.755 0.797) 8.936 5.398 ( 5.618 -6.016 -0.519) 8.248 5.580 ( 2.854 -3.255 5.280) 6.827 5.845 ( -4.068 2.281 -0.827) 4.737 5.977 ( 1.747 -3.064 -1.607) 3.876 6.203 ( -3.198 0.238 2.454) 4.038 6.358 ( -1.506 -4.169 -1.127) 4.573 6.453 ( -3.236 -1.220 -2.350) 4.181 6.750 ( -8.934 2.731 -0.259) 9.346 6.985 ( -3.510 -0.850 -0.885) 3.718 7.077 ( -6.193 0.387 1.128) 6.307 7.226 ( -1.859 -0.615 4.827) 5.209 7.582 ( -2.056 4.117 -1.395) 4.809 7.638 ( 1.134 6.484 -8.260) 10.562 7.978 ( 3.533 2.309 -1.179) 4.382 8.108 ( -2.786 1.672 3.060) 4.463 8.120 ( -1.371 0.218 0.176) 1.399 8.420 ( 3.565 1.329 -2.440) 4.520 8.460 ( -0.026 2.047 0.614) 2.137 8.533 ( 5.103 4.540 2.118) 7.151 8.956 ( -0.067 2.384 2.746) 3.637 9.129 ( 1.454 -0.712 1.358) 2.113 9.499 ( 3.604 10.231 -4.287) 11.664 9.643 ( -5.942 6.232 6.685) 10.901 9.743 ( -0.425 9.325 1.149) 9.405 9.916 ( -1.497 2.364 -11.652) 11.984 10.276 ( -5.130 0.087 5.007) 7.169 10.441 ( 1.494 -4.637 1.377) 5.063 10.501 ( 2.604 -1.209 -3.771) 4.739 10.751 ( 0.022 0.124 0.679) 0.690 10.927 ( -5.975 3.842 0.174) 7.105 11.162 ( -2.411 1.655 1.493) 3.283 11.428 ( -6.566 -3.380 -0.678) 7.415 11.564 ( -8.772 0.083 -0.163) 8.774 11.650 ( -1.964 3.490 2.143) 4.542 11.741 ( -5.427 3.801 -0.567) 6.650 12.141 ( 4.531 0.442 -0.086) 4.553 12.244 ( 1.828 -1.158 -0.167) 2.171 12.770 ( -12.707 11.697 -0.484) 17.278 12.905 ( -10.111 7.479 0.834) 12.604 13.014 ( 1.211 0.919 0.659) 1.657 13.032 ( -1.290 5.497 -0.359) 5.658 13.747 ( 6.366 3.783 -1.136) 7.492 13.768 ( 6.843 4.956 0.456) 8.462 15.930 ( 6.665 0.450 -2.747) 7.223 16.134 ( 8.423 4.174 3.265) 9.951 17.410 ( -5.825 0.802 -0.112) 5.881 17.752 ( -1.960 -3.155 -0.647) 3.770 17.922 ( -14.344 0.392 0.269) 14.352 18.665 ( 0.098 4.189 1.771) 4.549 18.779 ( 6.867 3.776 -0.858) 7.883 19.256 ( 8.345 1.832 0.683) 8.571 19.607 ( 2.470 9.449 1.331) 9.857 19.646 ( 2.958 6.999 0.316) 7.605 19.789 ( -9.183 10.376 -4.137) 14.461 20.192 ( -0.993 15.759 -0.581) 15.801 21.172 ( -12.094 -5.577 1.984) 13.465 21.457 ( -6.597 -7.851 -5.287) 11.537 21.829 ( -3.367 -2.596 2.223) 4.798 22.080 ( -4.635 -4.421 4.741) 7.969 22.311 ( 3.322 3.235 -2.271) 5.163 22.443 ( -0.307 -0.195 -2.292) 2.321 22.671 ( 3.487 -4.531 2.788) 6.361 22.936 ( 7.392 -8.220 -3.799) 11.689 22.996 ( 9.063 -6.403 -0.720) 11.120 23.064 ( 7.832 -7.722 3.424) 11.519 ======================= Grid point 219 (96/102) ======================= q-point: (-0.09 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -8.606 -12.275 -3.136) 15.316 1.336 ( -10.167 -10.832 2.339) 15.039 1.558 ( -10.545 -12.843 0.039) 16.618 1.970 ( -6.806 2.517 8.921) 11.500 2.065 ( -9.440 -3.188 -6.226) 11.749 2.134 ( -0.119 -5.967 -1.097) 6.068 2.342 ( -11.863 -12.718 0.934) 17.417 2.517 ( -0.373 -0.036 -4.423) 4.439 2.577 ( -6.961 -0.260 1.842) 7.205 2.675 ( -6.065 -5.851 0.405) 8.437 2.800 ( 2.124 -3.353 -4.093) 5.701 2.852 ( -2.241 -1.762 6.599) 7.188 3.010 ( 5.105 -0.547 -3.343) 6.127 3.162 ( -0.761 -2.686 0.006) 2.791 3.224 ( -1.306 -0.186 -2.256) 2.613 3.287 ( -0.081 -4.460 1.824) 4.820 3.325 ( 2.152 1.391 1.407) 2.923 3.423 ( -1.142 0.615 3.116) 3.375 3.507 ( 2.228 8.439 -5.149) 10.134 3.661 ( -3.247 3.529 1.506) 5.027 3.725 ( 8.218 -2.370 -3.901) 9.400 3.737 ( 1.524 -2.933 1.917) 3.820 3.796 ( 3.914 2.879 -1.676) 5.140 3.934 ( 2.826 1.103 1.245) 3.279 4.129 ( -1.356 -6.141 3.840) 7.368 4.233 ( 1.745 2.444 2.317) 3.793 4.314 ( 2.084 5.511 -0.030) 5.892 4.563 ( 1.034 1.875 -1.901) 2.863 4.613 ( 3.807 4.579 0.026) 5.955 4.768 ( 1.538 1.056 0.655) 1.977 4.809 ( 2.971 -1.165 -3.795) 4.958 4.919 ( -2.237 -1.815 2.010) 3.513 5.023 ( 3.472 -3.876 -0.649) 5.244 5.172 ( 8.016 -0.069 -1.390) 8.136 5.191 ( 1.796 -0.082 0.751) 1.949 5.333 ( -0.329 -0.147 -1.086) 1.144 5.455 ( 0.661 -0.513 -1.906) 2.081 5.569 ( 0.493 -6.588 1.869) 6.866 5.664 ( 2.533 -1.901 2.890) 4.287 5.807 ( -2.918 -2.327 0.382) 3.751 6.007 ( 3.170 1.969 -0.386) 3.751 6.209 ( -1.421 -2.534 2.570) 3.879 6.409 ( -3.419 -2.748 0.198) 4.391 6.432 ( -8.796 -3.860 -3.455) 10.208 6.601 ( -12.093 4.422 0.302) 12.880 7.004 ( 0.735 -2.160 -3.497) 4.176 7.027 ( -7.491 0.259 4.096) 8.542 7.159 ( -4.625 7.441 1.247) 8.850 7.454 ( -2.071 4.210 -1.402) 4.897 7.525 ( -1.953 6.000 -4.164) 7.560 7.964 ( 4.303 1.541 -2.209) 5.077 8.061 ( 0.661 3.045 7.010) 7.671 8.115 ( -8.561 -2.453 -2.514) 9.254 8.311 ( -10.629 6.418 -3.087) 12.794 8.413 ( 10.620 4.787 -2.485) 11.911 8.535 ( 3.625 1.997 1.376) 4.362 8.980 ( 4.841 -1.059 3.947) 6.335 9.103 ( -0.620 3.192 1.191) 3.463 9.311 ( 2.183 12.635 3.073) 13.185 9.527 ( 4.034 2.325 -2.241) 5.167 9.628 ( -7.693 2.344 7.043) 10.690 9.840 ( -0.045 3.603 -11.694) 12.236 10.243 ( -3.554 -0.197 2.846) 4.558 10.522 ( -3.781 -5.510 0.049) 6.682 10.591 ( 5.533 -4.378 -1.995) 7.332 10.766 ( -0.186 -1.079 -0.359) 1.152 10.865 ( 0.142 -0.184 0.517) 0.567 11.140 ( -2.370 -0.207 2.830) 3.697 11.384 ( -6.311 2.480 -0.994) 6.853 11.430 ( -10.611 5.611 1.891) 12.152 11.581 ( -5.349 7.789 -0.902) 9.492 11.599 ( -0.142 2.144 0.005) 2.149 12.156 ( 4.140 2.243 -0.300) 4.718 12.250 ( 0.779 2.271 -0.010) 2.401 12.536 ( -6.476 4.334 0.313) 7.799 12.616 ( -10.887 8.072 -0.373) 13.559 13.038 ( 1.344 -2.582 0.688) 2.991 13.087 ( 0.943 -3.616 -0.509) 3.771 13.655 ( 4.623 8.481 -0.024) 9.659 13.761 ( 6.332 3.620 -0.158) 7.296 15.958 ( 3.749 0.218 -2.419) 4.467 16.074 ( -0.169 5.340 2.564) 5.926 17.431 ( 1.744 -3.450 -0.472) 3.894 17.822 ( 0.298 -5.715 -1.522) 5.922 17.879 ( -7.748 -4.274 1.416) 8.962 18.533 ( -7.092 8.763 3.252) 11.733 18.693 ( 6.146 10.401 -2.166) 12.274 19.108 ( -3.133 9.831 1.627) 10.446 19.308 ( -10.067 10.169 -3.474) 14.724 19.478 ( 0.590 6.835 1.208) 6.966 19.909 ( 3.788 12.146 -1.714) 12.837 20.030 ( 14.452 -8.643 0.767) 16.857 21.110 ( -13.796 0.078 0.544) 13.807 21.543 ( -7.288 -8.110 0.422) 10.912 21.921 ( 1.389 -6.982 -2.614) 7.584 22.113 ( -3.266 -1.194 2.749) 4.433 22.288 ( 1.393 1.113 2.530) 3.095 22.429 ( 1.151 1.066 -5.101) 5.337 22.783 ( 1.365 -4.594 6.565) 8.128 23.008 ( 4.349 -0.748 -6.174) 7.589 23.191 ( 6.098 -6.102 1.572) 8.769 23.278 ( 10.938 -5.367 -0.094) 12.184 ======================= Grid point 228 (97/102) ======================= q-point: (-0.27 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -21.939 -0.000 8.067) 23.375 1.266 ( -25.045 -0.000 6.318) 25.830 1.383 ( -11.608 -0.000 -10.195) 15.450 1.384 ( -4.858 -0.000 -7.972) 9.336 1.981 ( -17.155 -0.000 4.518) 17.740 2.091 ( -25.851 -0.000 0.810) 25.864 2.278 ( -16.136 -0.000 -2.207) 16.286 2.436 ( -10.458 -0.000 2.948) 10.866 2.560 ( 5.230 0.000 6.576) 8.402 2.603 ( 8.270 0.000 -3.783) 9.094 2.726 ( 2.926 0.000 -6.981) 7.569 2.799 ( 1.838 0.000 -8.658) 8.850 2.922 ( -9.892 -0.000 9.873) 13.975 2.996 ( 10.874 0.000 -1.178) 10.938 3.062 ( -5.173 -0.000 0.857) 5.243 3.315 ( 2.734 0.000 2.430) 3.658 3.348 ( -0.944 -0.000 0.143) 0.955 3.529 ( 5.106 0.000 1.911) 5.452 3.529 ( -3.622 -0.000 -1.768) 4.030 3.707 ( 3.236 0.000 0.216) 3.243 3.805 ( 3.258 0.000 -3.299) 4.636 3.821 ( 0.915 0.000 3.232) 3.359 3.842 ( -3.176 -0.000 -9.427) 9.947 4.017 ( -7.517 -0.000 3.118) 8.138 4.256 ( 8.414 0.000 5.546) 10.077 4.315 ( -0.776 -0.000 2.884) 2.986 4.443 ( 3.539 0.000 1.781) 3.962 4.519 ( 4.179 0.000 -2.246) 4.744 4.651 ( 9.346 0.000 -8.778) 12.822 4.719 ( 8.183 0.000 2.707) 8.620 4.836 ( 0.032 0.000 1.425) 1.425 4.933 ( 2.384 0.000 -0.746) 2.498 5.021 ( 3.057 0.000 3.041) 4.312 5.087 ( 1.413 0.000 -4.314) 4.539 5.139 ( -0.007 -0.000 -0.097) 0.097 5.169 ( 12.580 0.000 -1.325) 12.650 5.262 ( 8.433 0.000 -1.311) 8.535 5.366 ( -7.113 -0.000 2.639) 7.587 5.568 ( 2.075 0.000 10.880) 11.076 5.789 ( 8.092 0.000 -9.630) 12.578 5.961 ( -10.544 -0.000 2.725) 10.890 6.194 ( 2.155 0.000 -1.374) 2.556 6.322 ( -2.707 -0.000 3.211) 4.200 6.413 ( 8.415 0.000 -4.362) 9.479 6.793 ( -5.583 -0.000 -2.711) 6.206 6.973 ( -9.698 -0.000 1.165) 9.767 7.102 ( -9.706 -0.000 2.628) 10.056 7.169 ( -0.734 -0.000 2.382) 2.492 7.672 ( -3.873 -0.000 1.833) 4.285 7.715 ( 6.664 0.000 -16.037) 17.367 8.020 ( 0.987 0.000 -4.184) 4.299 8.029 ( -8.001 -0.000 1.603) 8.160 8.268 ( -0.000 -0.000 -0.713) 0.713 8.370 ( 3.368 0.000 10.792) 11.305 8.439 ( 4.554 0.000 4.440) 6.360 8.823 ( 9.465 0.000 -0.472) 9.477 8.964 ( 0.064 0.000 -1.818) 1.819 9.098 ( -5.340 -0.000 3.313) 6.284 9.679 ( -12.602 -0.000 9.912) 16.033 9.704 ( 4.183 0.000 -8.149) 9.160 9.896 ( -3.040 -0.000 -11.899) 12.282 10.160 ( 16.790 0.000 -0.187) 16.791 10.190 ( -1.110 -0.000 4.990) 5.112 10.418 ( -1.709 -0.000 -6.336) 6.562 10.536 ( -1.604 -0.000 2.480) 2.954 10.756 ( 1.974 0.000 -1.651) 2.574 11.151 ( -4.130 -0.000 -1.838) 4.520 11.164 ( -6.223 -0.000 1.126) 6.324 11.288 ( -8.790 -0.000 -5.205) 10.215 11.486 ( -2.105 -0.000 10.823) 11.026 11.656 ( -1.419 -0.000 0.240) 1.439 11.822 ( -4.486 -0.000 -1.674) 4.788 12.162 ( 0.062 0.000 2.274) 2.275 12.192 ( 5.629 0.000 -2.112) 6.012 12.878 ( -0.666 -0.000 -0.578) 0.882 12.912 ( 3.130 0.000 0.222) 3.138 13.242 ( -11.468 -0.000 2.763) 11.796 13.420 ( -9.523 -0.000 -3.416) 10.117 13.825 ( 4.824 0.000 0.370) 4.839 13.842 ( 4.784 0.000 -0.313) 4.794 15.963 ( 8.132 0.000 -6.977) 10.715 16.205 ( 20.771 0.000 8.841) 22.574 17.551 ( -10.353 -0.000 1.395) 10.447 17.677 ( -6.206 -0.000 -1.075) 6.299 18.217 ( -8.592 -0.000 2.440) 8.931 18.436 ( -3.584 -0.000 -6.067) 7.047 18.824 ( 9.751 0.000 2.029) 9.960 18.961 ( 12.890 0.000 -0.799) 12.915 19.867 ( -1.299 -0.000 -4.427) 4.614 19.945 ( 2.960 0.000 5.485) 6.233 20.347 ( -7.106 -0.000 5.293) 8.861 20.602 ( 1.208 0.000 -8.505) 8.591 20.924 ( -11.779 -0.000 6.586) 13.495 21.244 ( -2.745 -0.000 -23.624) 23.783 21.951 ( -4.238 -0.000 5.047) 6.590 22.037 ( -5.223 -0.000 -3.868) 6.499 22.309 ( -0.018 -0.000 24.205) 24.205 22.382 ( 3.826 0.000 -2.209) 4.418 22.440 ( -0.797 -0.000 1.804) 1.972 22.563 ( 4.535 0.000 -7.192) 8.502 22.919 ( 6.608 0.000 -0.527) 6.629 22.937 ( 5.048 0.000 -0.042) 5.048 ======================= Grid point 229 (98/102) ======================= q-point: (-0.18 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( -20.835 -1.512 9.131) 22.798 1.161 ( -17.773 -4.893 0.679) 18.447 1.205 ( -13.078 -0.057 -4.204) 13.738 1.525 ( -7.492 -14.971 -7.942) 18.530 1.901 ( -18.079 -4.806 1.976) 18.811 1.946 ( -27.828 -8.404 3.341) 29.261 2.140 ( -21.084 -1.496 -3.053) 21.356 2.412 ( -6.190 -2.266 0.251) 6.597 2.571 ( 10.249 6.397 -0.581) 12.095 2.660 ( -1.487 -2.658 2.595) 4.001 2.670 ( -5.622 -1.394 -3.142) 6.590 2.823 ( 1.412 1.332 0.905) 2.142 2.929 ( -0.240 -3.550 0.754) 3.637 3.041 ( -2.106 -2.309 -1.445) 3.443 3.118 ( 8.649 -3.583 0.756) 9.392 3.314 ( 1.361 3.300 1.783) 3.991 3.378 ( -0.277 -1.860 0.387) 1.920 3.489 ( -1.554 -0.206 -1.178) 1.961 3.542 ( -0.365 0.276 1.795) 1.853 3.720 ( 3.223 2.561 -0.205) 4.122 3.755 ( 4.868 4.676 -3.384) 7.551 3.822 ( -0.388 -0.867 -6.315) 6.386 3.852 ( 1.380 -1.074 0.416) 1.797 3.959 ( -2.943 1.976 2.045) 4.093 4.183 ( 2.784 8.116 5.685) 10.293 4.343 ( -1.016 2.117 3.644) 4.335 4.506 ( 7.933 -1.840 -0.400) 8.153 4.573 ( 1.260 -0.954 -0.160) 1.589 4.646 ( 8.273 3.857 -4.937) 10.377 4.718 ( 4.414 2.218 -1.520) 5.169 4.860 ( 10.672 -0.402 0.413) 10.687 4.951 ( -3.363 4.374 1.831) 5.813 5.027 ( -3.300 0.702 -2.008) 3.926 5.134 ( 3.734 -4.471 -0.383) 5.838 5.207 ( 4.704 -5.247 -1.546) 7.214 5.251 ( 7.339 -2.062 0.982) 7.686 5.312 ( -0.403 -0.759 1.098) 1.394 5.378 ( 6.757 -2.771 -2.864) 7.845 5.592 ( 2.462 0.080 8.997) 9.328 5.853 ( -1.983 0.907 -2.387) 3.233 5.909 ( 0.110 -3.810 -2.369) 4.488 6.188 ( -2.033 0.893 0.677) 2.322 6.320 ( -0.152 -0.144 1.201) 1.219 6.451 ( 3.807 1.175 -4.189) 5.781 6.727 ( -8.548 2.290 0.027) 8.850 6.919 ( -6.587 -1.885 -1.161) 6.949 7.029 ( -9.222 0.162 1.831) 9.403 7.190 ( -1.767 -2.521 3.026) 4.317 7.607 ( -6.285 2.441 0.381) 6.753 7.699 ( -0.599 2.558 -11.858) 12.145 7.996 ( -5.077 -2.503 -2.218) 6.080 8.018 ( -0.866 0.018 -3.184) 3.299 8.237 ( 2.086 4.250 3.298) 5.770 8.394 ( -3.412 0.504 8.349) 9.033 8.516 ( 8.594 -1.489 -0.291) 8.727 8.740 ( 7.257 10.576 -0.193) 12.828 8.990 ( -4.006 1.545 3.843) 5.763 9.094 ( -0.272 -4.207 0.023) 4.216 9.572 ( -10.980 3.014 2.826) 11.732 9.666 ( -4.948 1.692 0.127) 5.231 9.877 ( 5.990 0.441 -15.654) 16.766 10.073 ( 2.290 14.644 2.058) 14.964 10.268 ( 2.288 0.719 0.447) 2.440 10.416 ( 5.895 -1.488 1.897) 6.369 10.525 ( 3.462 1.182 -1.938) 4.140 10.762 ( 0.735 0.487 -0.049) 0.883 10.969 ( -6.683 6.744 0.466) 9.505 11.166 ( -4.851 1.678 -2.876) 5.883 11.287 ( -6.042 -6.680 -0.231) 9.010 11.499 ( -5.500 -0.988 2.406) 6.085 11.685 ( 1.678 -0.208 7.725) 7.908 11.743 ( -7.149 2.535 -3.657) 8.421 12.174 ( 2.387 -0.214 1.215) 2.687 12.245 ( 5.714 -0.950 -1.342) 5.946 12.828 ( -8.630 4.463 0.121) 9.717 12.934 ( -1.527 1.129 -0.013) 1.899 13.082 ( -4.332 7.564 1.577) 8.858 13.176 ( -13.175 13.018 -2.079) 18.638 13.832 ( 6.590 1.431 -0.904) 6.804 13.883 ( 4.550 1.714 0.068) 4.863 15.987 ( 6.041 1.207 -6.450) 8.919 16.329 ( 15.792 6.694 8.385) 19.092 17.410 ( -8.377 5.221 0.436) 9.880 17.663 ( -4.998 -3.308 -1.770) 6.249 17.887 ( -14.314 9.981 -0.074) 17.450 18.656 ( -1.352 -8.123 -2.634) 8.646 18.887 ( 9.681 1.730 1.450) 9.941 19.211 ( 17.193 -15.164 -0.450) 22.929 19.744 ( -2.271 8.458 -4.848) 10.010 19.855 ( 2.743 10.532 4.943) 11.953 20.038 ( -17.105 24.778 -0.202) 30.109 20.447 ( 0.460 13.042 -2.330) 13.256 20.959 ( -11.013 -8.704 3.091) 14.374 21.239 ( -7.445 -7.640 -15.970) 19.205 21.815 ( -6.612 5.262 8.275) 11.827 21.987 ( -3.982 -2.624 2.399) 5.338 22.370 ( 2.570 1.332 -2.489) 3.818 22.418 ( -2.288 -1.042 0.716) 2.615 22.631 ( 5.827 -4.409 -1.091) 7.388 22.755 ( 14.581 -20.619 4.809) 25.707 22.983 ( 6.374 -2.078 -1.297) 6.828 23.005 ( 5.327 -4.234 1.156) 6.902 ======================= Grid point 230 (99/102) ======================= q-point: (-0.09 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -13.870 -9.604 2.121) 17.003 1.123 ( -8.534 -4.032 -4.718) 10.552 1.228 ( -16.177 -13.111 3.856) 21.177 1.733 ( -9.131 -14.910 -2.753) 17.700 1.942 ( -10.049 -12.023 0.573) 15.680 1.990 ( -19.145 -13.572 -0.509) 23.473 2.031 ( -16.268 -2.128 2.804) 16.645 2.375 ( -10.888 -1.318 6.968) 12.994 2.535 ( 5.654 0.384 -8.946) 10.590 2.669 ( 0.209 1.179 -2.867) 3.107 2.736 ( -1.501 -1.595 -1.989) 2.958 2.786 ( -5.461 -4.271 3.287) 7.672 2.990 ( 0.026 -3.809 1.304) 4.027 3.091 ( -2.302 -2.699 -0.080) 3.549 3.232 ( 6.655 -1.372 -1.842) 7.040 3.253 ( 1.105 0.973 1.113) 1.846 3.376 ( 1.622 1.328 2.160) 3.011 3.467 ( -1.510 3.304 2.720) 4.538 3.600 ( -0.301 -1.583 -1.880) 2.476 3.659 ( 4.679 0.909 -4.963) 6.881 3.752 ( 3.376 1.691 2.260) 4.400 3.768 ( 2.082 3.248 -3.957) 5.526 3.887 ( 4.573 2.632 -1.783) 5.569 3.960 ( 3.319 -2.389 1.171) 4.254 4.093 ( 0.660 3.409 5.120) 6.186 4.288 ( -0.489 2.778 2.881) 4.032 4.476 ( 1.885 9.399 -0.364) 9.593 4.578 ( 2.155 -0.474 -0.661) 2.304 4.671 ( 4.623 -0.140 -1.364) 4.823 4.772 ( 2.774 -1.254 -0.038) 3.045 4.858 ( -7.836 0.812 4.923) 9.290 4.879 ( 4.416 3.949 -5.834) 8.315 5.008 ( 5.460 -1.299 -0.920) 5.687 5.189 ( -0.495 -1.185 1.075) 1.674 5.276 ( 9.881 2.882 -2.664) 10.632 5.340 ( 6.366 -1.297 -1.419) 6.650 5.389 ( -2.533 -6.153 2.349) 7.057 5.488 ( 5.917 -3.736 -3.273) 7.726 5.647 ( -0.181 -3.070 8.156) 8.716 5.782 ( -1.937 2.281 -2.030) 3.616 6.006 ( 2.877 -4.098 -2.406) 5.555 6.160 ( -4.332 -0.827 2.002) 4.843 6.306 ( -6.886 -0.559 2.164) 7.240 6.414 ( 0.137 2.349 -3.249) 4.012 6.584 ( -12.007 4.001 0.144) 12.657 6.940 ( -1.469 -3.229 -3.429) 4.934 6.976 ( -7.615 -0.548 3.098) 8.240 7.210 ( -4.652 1.030 3.179) 5.727 7.483 ( -9.466 3.695 -0.194) 10.164 7.594 ( -1.714 4.804 -10.482) 11.657 7.987 ( -7.431 -1.130 0.643) 7.544 8.013 ( -1.253 -1.159 -4.464) 4.779 8.163 ( 1.638 5.675 4.806) 7.614 8.313 ( -8.906 4.275 0.741) 9.907 8.582 ( 12.093 2.874 -6.406) 13.984 8.634 ( 4.823 6.280 4.973) 9.350 8.985 ( 1.318 -2.166 5.335) 5.907 9.134 ( -1.161 0.204 -0.189) 1.194 9.466 ( -4.465 2.462 -0.565) 5.130 9.593 ( -5.159 3.935 6.465) 9.159 9.733 ( -2.607 15.866 1.092) 16.116 9.873 ( 2.021 1.809 -11.876) 12.182 10.243 ( -0.086 2.106 0.924) 2.302 10.454 ( -0.843 0.475 1.700) 1.956 10.580 ( 7.492 -1.929 -0.598) 7.759 10.755 ( -0.016 -0.009 -0.136) 0.137 10.870 ( -0.735 1.113 -0.298) 1.366 11.117 ( -3.431 -0.445 1.204) 3.663 11.332 ( -6.355 -2.534 -0.113) 6.843 11.438 ( -7.732 2.524 0.364) 8.141 11.629 ( -8.100 3.386 -2.830) 9.224 11.659 ( 0.045 4.339 5.828) 7.266 12.206 ( 3.726 -0.195 -0.176) 3.735 12.293 ( 5.509 0.393 -1.119) 5.635 12.589 ( -11.039 8.351 0.279) 13.844 12.684 ( -17.026 11.127 -0.421) 20.344 13.037 ( 1.297 0.781 1.503) 2.134 13.052 ( 2.147 -1.396 -0.975) 2.740 13.819 ( 3.728 5.620 0.542) 6.766 13.869 ( 6.404 3.267 -1.242) 7.296 15.990 ( 3.489 1.007 -4.917) 6.112 16.207 ( -2.639 10.797 5.996) 12.630 17.378 ( 2.352 -4.068 -0.370) 4.713 17.706 ( -2.500 -4.864 -2.981) 6.228 17.756 ( -8.173 -3.104 2.442) 9.077 18.628 ( -7.722 5.841 0.336) 9.688 18.897 ( 9.200 5.835 0.059) 10.894 19.320 ( -0.682 14.169 1.052) 14.225 19.447 ( -15.580 17.509 -3.647) 23.720 19.621 ( -1.113 8.297 -1.001) 8.431 19.922 ( 16.854 -13.235 1.392) 21.475 20.197 ( 2.336 14.760 0.035) 14.944 20.987 ( -12.685 -3.044 0.474) 13.054 21.308 ( -11.067 -10.188 -3.650) 15.479 21.810 ( -0.728 -5.021 2.508) 5.659 22.029 ( -4.151 -4.287 2.378) 6.423 22.342 ( 1.751 2.476 -0.707) 3.114 22.427 ( -0.428 -0.792 -2.204) 2.381 22.750 ( 4.653 -3.293 4.606) 7.329 23.002 ( 5.016 -2.303 -6.016) 8.165 23.130 ( 7.390 -6.573 1.271) 9.972 23.242 ( 14.738 -9.815 0.289) 17.709 ======================= Grid point 241 (100/102) ======================= q-point: (-0.18 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.842 ( -22.319 -0.000 10.762) 24.778 0.915 ( -26.060 -0.000 9.216) 27.641 1.165 ( -10.687 -0.000 -12.133) 16.169 1.291 ( -0.953 -0.000 -11.505) 11.545 1.570 ( -42.249 -0.000 9.684) 43.345 1.737 ( -18.456 -0.000 -2.683) 18.650 1.972 ( -17.699 -0.000 -4.081) 18.164 2.360 ( -2.614 -0.000 -1.469) 2.999 2.569 ( -9.481 -0.000 5.599) 11.010 2.578 ( -5.380 -0.000 -4.580) 7.065 2.822 ( -3.552 -0.000 7.386) 8.196 2.836 ( 6.621 0.000 0.216) 6.625 2.877 ( 11.173 0.000 -2.545) 11.459 2.987 ( -4.773 -0.000 0.221) 4.778 3.178 ( 12.872 0.000 -2.349) 13.085 3.330 ( -0.268 -0.000 0.192) 0.330 3.384 ( 2.744 0.000 3.651) 4.567 3.470 ( -1.898 -0.000 -5.622) 5.934 3.547 ( -3.888 -0.000 2.579) 4.665 3.749 ( -3.805 -0.000 -6.786) 7.780 3.785 ( 6.415 0.000 0.330) 6.423 3.822 ( 1.253 0.000 -3.501) 3.718 3.856 ( 1.613 0.000 3.355) 3.723 3.963 ( -0.693 -0.000 -0.195) 0.720 4.313 ( -5.447 -0.000 11.053) 12.322 4.333 ( 2.666 0.000 -0.784) 2.778 4.555 ( 9.475 0.000 1.013) 9.529 4.593 ( 7.416 0.000 -3.060) 8.022 4.735 ( 5.703 0.000 -5.748) 8.097 4.817 ( 3.578 0.000 0.062) 3.578 4.895 ( 8.638 0.000 -4.757) 9.861 4.959 ( -1.171 -0.000 1.072) 1.587 5.057 ( -2.218 -0.000 4.209) 4.758 5.083 ( 1.380 0.000 -1.480) 2.024 5.152 ( 5.938 0.000 -3.785) 7.042 5.260 ( 1.909 0.000 1.741) 2.584 5.380 ( 8.097 0.000 -1.216) 8.188 5.380 ( 7.708 0.000 -2.379) 8.066 5.616 ( -4.659 -0.000 12.131) 12.995 5.856 ( 5.810 0.000 -7.328) 9.352 5.863 ( -1.696 -0.000 0.306) 1.724 6.197 ( -1.404 -0.000 -0.099) 1.408 6.339 ( 3.165 0.000 0.115) 3.167 6.490 ( 2.709 0.000 -5.424) 6.063 6.713 ( -4.551 -0.000 2.488) 5.187 6.821 ( -10.324 -0.000 -1.480) 10.430 6.964 ( -8.187 -0.000 -0.282) 8.192 7.140 ( -4.960 -0.000 1.360) 5.143 7.561 ( -14.455 -0.000 6.396) 15.807 7.684 ( -1.456 -0.000 -15.460) 15.528 7.921 ( -4.491 -0.000 -4.027) 6.032 7.997 ( -3.347 -0.000 -5.299) 6.267 8.292 ( 2.970 0.000 3.727) 4.766 8.425 ( -1.882 -0.000 10.793) 10.956 8.566 ( 11.674 0.000 -2.342) 11.907 8.938 ( -2.423 -0.000 -1.162) 2.687 8.954 ( -2.158 -0.000 9.710) 9.947 9.009 ( 0.248 0.000 -1.379) 1.401 9.527 ( -12.214 -0.000 8.960) 15.148 9.613 ( -6.986 -0.000 -7.491) 10.243 9.893 ( 6.060 0.000 -14.219) 15.457 10.253 ( 6.654 0.000 4.610) 8.095 10.309 ( 2.722 0.000 -11.165) 11.492 10.488 ( 14.754 0.000 4.032) 15.295 10.566 ( 5.607 0.000 -0.848) 5.671 10.771 ( 0.837 0.000 -1.529) 1.743 11.069 ( -6.450 -0.000 0.406) 6.463 11.085 ( -3.610 -0.000 -2.229) 4.243 11.162 ( -4.941 -0.000 -5.290) 7.239 11.457 ( -5.491 -0.000 1.705) 5.750 11.695 ( -10.023 -0.000 -4.069) 10.818 11.749 ( 10.031 0.000 13.088) 16.490 12.188 ( 2.346 0.000 1.892) 3.014 12.285 ( 7.158 0.000 -1.608) 7.337 12.815 ( -8.554 -0.000 2.586) 8.936 12.941 ( -0.270 -0.000 -1.987) 2.005 13.124 ( -5.563 -0.000 2.883) 6.265 13.210 ( -15.113 -0.000 -9.172) 17.679 13.896 ( 4.348 0.000 0.434) 4.370 13.903 ( 3.706 0.000 -0.575) 3.750 16.020 ( 4.193 0.000 -9.031) 9.957 16.601 ( 26.816 0.000 10.619) 28.842 17.434 ( -6.010 -0.000 2.731) 6.601 17.568 ( -7.101 -0.000 -5.246) 8.829 18.095 ( -9.356 -0.000 2.527) 9.692 18.303 ( -10.655 -0.000 -15.783) 19.043 18.987 ( 10.550 0.000 4.232) 11.367 19.162 ( 14.508 0.000 -0.260) 14.511 19.796 ( -5.261 -0.000 -4.134) 6.691 19.972 ( -4.632 -0.000 7.994) 9.239 20.250 ( -7.195 -0.000 0.771) 7.236 20.597 ( 1.673 0.000 -5.973) 6.203 20.769 ( -11.069 -0.000 3.855) 11.721 21.031 ( -11.949 -0.000 -28.163) 30.593 21.911 ( -3.158 -0.000 2.465) 4.006 21.955 ( -4.042 -0.000 -2.082) 4.547 22.362 ( -2.242 -0.000 7.815) 8.131 22.407 ( 0.799 0.000 -1.465) 1.669 22.561 ( 11.074 0.000 21.908) 24.547 22.653 ( 11.134 0.000 -6.634) 12.960 23.001 ( 3.674 0.000 -0.118) 3.676 23.006 ( 5.311 0.000 -0.793) 5.370 ======================= Grid point 242 (101/102) ======================= q-point: (-0.09 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 182 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( -20.063 -4.624 10.123) 22.943 0.870 ( -21.529 -11.340 9.114) 25.983 1.051 ( -4.360 1.248 -14.896) 15.571 1.396 ( -6.752 -13.330 -4.704) 15.665 1.471 ( -29.310 -18.138 9.425) 35.734 1.640 ( -21.833 -7.617 -9.617) 25.043 1.896 ( -7.351 -3.084 2.181) 8.265 2.327 ( -5.465 1.334 -2.222) 6.049 2.556 ( -8.616 -5.519 2.324) 10.492 2.580 ( -5.951 -5.853 -4.064) 9.284 2.698 ( 2.983 7.584 7.441) 11.035 2.841 ( 1.433 5.723 -1.679) 6.134 2.937 ( -0.082 -1.625 1.244) 2.048 3.032 ( 2.074 -2.412 -0.678) 3.253 3.274 ( 10.623 -1.071 -3.042) 11.101 3.307 ( -0.611 3.959 -1.111) 4.158 3.391 ( 0.396 -0.881 3.309) 3.447 3.492 ( 0.285 -1.137 -1.856) 2.196 3.507 ( -2.346 -2.760 0.521) 3.659 3.738 ( -0.357 0.723 -3.492) 3.584 3.805 ( 3.644 1.343 -2.426) 4.579 3.813 ( 0.654 2.257 -1.087) 2.589 3.887 ( 3.437 -3.115 0.674) 4.687 3.971 ( 3.455 -0.271 -0.319) 3.480 4.213 ( -2.606 6.483 6.348) 9.440 4.335 ( 0.052 2.157 0.654) 2.255 4.595 ( 2.508 3.600 1.447) 4.619 4.634 ( 7.804 1.653 -2.393) 8.329 4.743 ( 4.983 1.469 -2.310) 5.685 4.788 ( 4.660 2.790 0.840) 5.495 4.865 ( -7.165 5.842 0.985) 9.297 4.941 ( -0.038 1.051 -5.670) 5.767 5.031 ( 1.684 0.640 0.999) 2.059 5.156 ( 4.627 -4.080 0.173) 6.171 5.267 ( 4.890 -5.399 -0.513) 7.302 5.326 ( 4.306 -3.287 -0.712) 5.464 5.419 ( 11.275 1.243 -1.612) 11.457 5.474 ( 7.879 -2.542 -4.006) 9.197 5.593 ( -7.813 -1.360 10.367) 13.053 5.839 ( 2.933 3.238 -1.794) 4.723 5.930 ( 1.756 -4.491 -3.475) 5.944 6.140 ( -5.671 2.824 -2.751) 6.906 6.305 ( -4.793 4.190 4.222) 7.639 6.445 ( -5.141 2.024 -3.406) 6.490 6.595 ( -4.882 5.513 0.418) 7.376 6.849 ( -2.955 -5.307 0.715) 6.116 6.917 ( -4.609 -0.508 -1.783) 4.968 7.144 ( -6.286 -3.866 0.310) 7.386 7.439 ( -16.032 1.255 4.617) 16.731 7.610 ( -4.055 2.044 -14.807) 15.488 7.898 ( -6.355 -0.813 -0.850) 6.463 7.958 ( -4.903 -1.778 -6.859) 8.617 8.289 ( 3.110 4.669 3.406) 6.563 8.370 ( -3.873 5.768 7.101) 9.935 8.659 ( 11.209 -0.678 -3.582) 11.787 8.828 ( 2.403 7.984 2.773) 8.787 8.938 ( -4.531 -3.474 6.885) 8.944 9.095 ( 1.236 -2.520 -1.790) 3.329 9.445 ( -7.826 1.160 4.612) 9.157 9.569 ( -4.740 -1.324 -4.096) 6.403 9.887 ( 1.255 1.527 -7.981) 8.222 10.085 ( -1.420 20.771 -1.767) 20.895 10.321 ( 8.202 2.704 -3.531) 9.330 10.541 ( 5.300 6.329 2.481) 8.620 10.624 ( 8.309 0.169 1.161) 8.391 10.763 ( -0.825 1.104 0.361) 1.424 10.899 ( -1.413 3.495 -0.147) 3.772 11.089 ( -2.823 0.494 -2.813) 4.016 11.204 ( -5.674 -6.632 0.296) 8.733 11.415 ( -5.716 0.588 0.225) 5.751 11.591 ( -10.036 1.425 -4.260) 10.995 11.789 ( 3.506 7.301 10.817) 13.513 12.218 ( 3.659 -0.637 0.113) 3.715 12.336 ( 6.243 -0.433 -1.248) 6.382 12.656 ( -14.468 9.222 0.687) 17.171 12.749 ( -20.634 11.392 -3.939) 23.897 13.053 ( 0.305 0.615 -0.905) 1.136 13.074 ( -1.039 2.036 1.382) 2.671 13.908 ( 3.694 1.668 -0.175) 4.057 13.947 ( 4.467 0.268 -1.293) 4.658 16.019 ( 3.480 0.907 -8.321) 9.065 16.517 ( -1.404 26.006 9.521) 27.730 17.329 ( -1.217 -1.065 -0.567) 1.714 17.592 ( -1.855 -6.368 -3.772) 7.630 17.707 ( -8.360 6.334 0.808) 10.519 18.542 ( -13.547 -9.571 -9.553) 19.141 19.047 ( 10.371 2.898 3.893) 11.450 19.451 ( 13.457 -9.746 -2.310) 16.775 19.640 ( -9.264 12.374 -2.399) 15.642 19.771 ( -14.688 17.574 3.087) 23.111 19.927 ( 4.841 7.758 2.568) 9.498 20.469 ( 2.576 12.679 -0.073) 12.939 20.807 ( -9.771 -8.125 -0.490) 12.717 21.006 ( -15.079 -10.729 -13.551) 22.937 21.781 ( -2.750 3.552 7.968) 9.147 21.940 ( -3.206 -2.584 0.838) 4.202 22.386 ( -0.113 1.528 -0.124) 1.538 22.394 ( -0.164 -1.705 -1.225) 2.106 22.741 ( 7.965 -3.551 2.045) 8.957 22.971 ( 9.652 -6.745 -4.476) 12.597 23.079 ( 5.357 -4.405 0.114) 6.936 23.129 ( 15.096 -15.225 2.084) 21.541 ======================= Grid point 253 (102/102) ======================= q-point: (-0.09 -0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 5.20e-05 5.20e-05 5.20e-05 5.20e-05 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 2.84e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 102 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.558 ( -21.929 -0.000 12.163) 25.076 0.601 ( -21.932 -0.000 15.056) 26.603 0.971 ( -11.901 -0.000 -6.558) 13.588 1.043 ( -30.360 -0.000 16.563) 34.585 1.264 ( -1.286 -0.000 -12.381) 12.448 1.389 ( -12.711 -0.000 -21.349) 24.846 1.840 ( -0.789 -0.000 5.229) 5.288 2.325 ( -0.557 -0.000 -5.044) 5.074 2.403 ( -12.163 -0.000 4.401) 12.935 2.483 ( -3.789 -0.000 -4.778) 6.098 2.780 ( -4.583 -0.000 9.570) 10.611 2.911 ( -2.654 -0.000 3.487) 4.383 2.965 ( 4.680 0.000 1.681) 4.973 3.062 ( 12.139 0.000 -4.506) 12.948 3.327 ( -0.772 -0.000 2.725) 2.832 3.328 ( 8.436 0.000 -3.292) 9.056 3.433 ( 2.014 0.000 1.955) 2.807 3.436 ( 1.768 0.000 -8.127) 8.317 3.470 ( -6.452 -0.000 1.756) 6.687 3.673 ( -2.739 -0.000 -7.083) 7.594 3.834 ( 3.818 0.000 -4.974) 6.270 3.859 ( -0.406 -0.000 5.053) 5.069 3.895 ( 3.108 0.000 0.568) 3.159 3.974 ( 1.688 0.000 -1.580) 2.312 4.244 ( -7.423 -0.000 8.017) 10.926 4.370 ( 3.065 0.000 -5.647) 6.425 4.677 ( 4.393 0.000 4.332) 6.170 4.705 ( 8.376 0.000 -2.749) 8.816 4.787 ( 4.641 0.000 -4.891) 6.743 4.826 ( -2.163 -0.000 1.331) 2.540 4.894 ( -5.124 -0.000 -3.518) 6.215 4.926 ( -5.887 -0.000 1.152) 5.998 5.081 ( 6.588 0.000 -1.953) 6.871 5.133 ( 2.997 0.000 2.817) 4.113 5.282 ( 14.517 0.000 -7.828) 16.493 5.307 ( 5.046 0.000 0.454) 5.066 5.497 ( 7.836 0.000 -0.042) 7.836 5.517 ( 11.821 0.000 -3.450) 12.314 5.535 ( -10.043 -0.000 8.725) 13.304 5.875 ( -1.525 -0.000 -6.223) 6.408 5.905 ( 4.720 0.000 1.213) 4.873 6.117 ( -10.460 -0.000 -6.741) 12.444 6.355 ( -4.282 -0.000 -2.170) 4.800 6.377 ( -13.692 -0.000 -0.761) 13.713 6.688 ( -4.444 -0.000 -0.431) 4.464 6.728 ( 3.928 0.000 3.121) 5.017 6.887 ( -1.458 -0.000 -4.365) 4.602 7.026 ( -9.075 -0.000 -2.190) 9.335 7.323 ( -19.101 -0.000 8.931) 21.086 7.540 ( -9.709 -0.000 -15.712) 18.470 7.859 ( -12.107 -0.000 0.964) 12.145 7.880 ( 1.990 0.000 -7.704) 7.957 8.382 ( 7.167 0.000 1.849) 7.402 8.423 ( -3.231 -0.000 7.748) 8.395 8.745 ( 14.249 0.000 -8.046) 16.364 8.817 ( -13.599 -0.000 10.364) 17.098 8.909 ( -0.566 -0.000 3.794) 3.836 9.120 ( 6.146 0.000 -1.397) 6.303 9.410 ( -8.607 -0.000 8.760) 12.281 9.509 ( -1.057 -0.000 -9.077) 9.139 9.911 ( 1.633 0.000 -1.279) 2.075 10.277 ( 0.322 0.000 -11.939) 11.943 10.440 ( 19.211 0.000 -3.518) 19.531 10.675 ( 8.632 0.000 -1.935) 8.846 10.712 ( 10.371 0.000 2.740) 10.727 10.772 ( 0.492 0.000 -0.111) 0.504 10.984 ( -4.863 -0.000 -0.016) 4.863 11.018 ( -4.897 -0.000 -0.995) 4.997 11.104 ( 0.614 0.000 -5.171) 5.207 11.382 ( -4.053 -0.000 -0.273) 4.062 11.520 ( -10.100 -0.000 -3.296) 10.624 11.959 ( 3.689 0.000 -5.921) 6.976 12.267 ( 8.785 0.000 6.433) 10.888 12.366 ( 3.923 0.000 -1.591) 4.233 12.654 ( -35.490 -0.000 -16.105) 38.973 12.680 ( -10.576 -0.000 5.033) 11.713 13.055 ( -0.199 -0.000 -1.239) 1.254 13.085 ( -1.691 -0.000 0.948) 1.939 13.944 ( 2.022 0.000 -0.229) 2.035 13.950 ( 2.567 0.000 -0.045) 2.567 16.044 ( 6.475 0.000 -8.756) 10.890 17.036 ( 18.767 0.000 -12.050) 22.302 17.346 ( -19.621 -0.000 -14.729) 24.534 17.399 ( -0.976 -0.000 2.837) 3.001 17.897 ( -30.446 -0.000 -10.211) 32.112 17.962 ( -9.289 -0.000 1.136) 9.358 19.201 ( 16.572 0.000 9.556) 19.130 19.385 ( 15.001 0.000 1.195) 15.049 19.714 ( -3.236 -0.000 -0.254) 3.246 19.850 ( -15.619 -0.000 6.482) 16.911 20.158 ( -4.638 -0.000 -1.466) 4.864 20.516 ( -16.265 -0.000 -19.556) 25.435 20.661 ( -4.679 -0.000 1.454) 4.899 20.694 ( -10.745 -0.000 -7.634) 13.181 21.884 ( -1.412 -0.000 0.756) 1.602 21.902 ( -2.245 -0.000 -0.811) 2.387 22.357 ( -1.213 -0.000 3.306) 3.522 22.407 ( 0.396 0.000 -1.942) 1.982 22.805 ( 11.094 0.000 -2.797) 11.441 22.886 ( 17.607 0.000 11.612) 21.091 23.048 ( 2.773 0.000 1.143) 2.999 23.066 ( 3.210 0.000 -0.982) 3.357 =================== 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 3/37026 10.0 219.560 133.271 72.507 -0.000 -28.146 0.000 3/37026 20.0 71.861 47.877 22.099 -0.000 -10.306 0.000 3/37026 30.0 35.102 23.854 11.159 -0.000 -5.072 0.000 3/37026 40.0 21.668 14.780 7.099 -0.000 -3.157 0.000 3/37026 50.0 15.300 10.417 5.129 -0.000 -2.256 0.000 3/37026 60.0 11.737 7.960 4.004 -0.000 -1.750 0.000 3/37026 70.0 9.503 6.416 3.287 -0.000 -1.429 0.000 3/37026 80.0 7.985 5.368 2.792 -0.000 -1.210 0.000 3/37026 90.0 6.889 4.614 2.432 -0.000 -1.050 0.000 3/37026 100.0 6.064 4.048 2.157 -0.000 -0.928 0.000 3/37026 110.0 5.419 3.608 1.941 -0.000 -0.833 0.000 3/37026 120.0 4.903 3.258 1.766 -0.000 -0.755 0.000 3/37026 130.0 4.480 2.972 1.621 -0.000 -0.692 0.000 3/37026 140.0 4.127 2.735 1.499 -0.000 -0.638 0.000 3/37026 150.0 3.829 2.535 1.396 -0.000 -0.592 0.000 3/37026 160.0 3.573 2.364 1.306 -0.000 -0.553 0.000 3/37026 170.0 3.350 2.217 1.228 -0.000 -0.519 0.000 3/37026 180.0 3.155 2.088 1.160 -0.000 -0.489 0.000 3/37026 190.0 2.983 1.974 1.099 -0.000 -0.462 0.000 3/37026 200.0 2.830 1.873 1.045 -0.000 -0.438 0.000 3/37026 210.0 2.693 1.783 0.996 -0.000 -0.417 0.000 3/37026 220.0 2.569 1.702 0.951 -0.000 -0.398 0.000 3/37026 230.0 2.456 1.629 0.911 -0.000 -0.380 0.000 3/37026 240.0 2.354 1.562 0.875 -0.000 -0.364 0.000 3/37026 250.0 2.260 1.500 0.841 -0.000 -0.349 0.000 3/37026 260.0 2.174 1.444 0.810 -0.000 -0.336 0.000 3/37026 270.0 2.094 1.392 0.781 -0.000 -0.323 0.000 3/37026 280.0 2.020 1.344 0.755 -0.000 -0.312 0.000 3/37026 290.0 1.952 1.299 0.730 -0.000 -0.301 0.000 3/37026 300.0 1.888 1.258 0.707 -0.000 -0.291 0.000 3/37026 310.0 1.828 1.219 0.685 -0.000 -0.282 0.000 3/37026 320.0 1.772 1.182 0.665 -0.000 -0.273 0.000 3/37026 330.0 1.720 1.148 0.646 -0.000 -0.265 0.000 3/37026 340.0 1.670 1.116 0.628 -0.000 -0.257 0.000 3/37026 350.0 1.624 1.085 0.611 -0.000 -0.250 0.000 3/37026 360.0 1.580 1.057 0.595 -0.000 -0.243 0.000 3/37026 370.0 1.538 1.029 0.580 -0.000 -0.237 0.000 3/37026 380.0 1.498 1.003 0.565 -0.000 -0.231 0.000 3/37026 390.0 1.461 0.979 0.551 -0.000 -0.225 0.000 3/37026 400.0 1.425 0.955 0.538 -0.000 -0.219 0.000 3/37026 410.0 1.391 0.933 0.526 -0.000 -0.214 0.000 3/37026 420.0 1.359 0.912 0.514 -0.000 -0.209 0.000 3/37026 430.0 1.328 0.892 0.503 -0.000 -0.204 0.000 3/37026 440.0 1.299 0.872 0.492 -0.000 -0.200 0.000 3/37026 450.0 1.271 0.854 0.481 -0.000 -0.195 0.000 3/37026 460.0 1.244 0.836 0.471 -0.000 -0.191 0.000 3/37026 470.0 1.218 0.819 0.462 -0.000 -0.187 0.000 3/37026 480.0 1.193 0.803 0.453 -0.000 -0.183 0.000 3/37026 490.0 1.169 0.787 0.444 -0.000 -0.180 0.000 3/37026 500.0 1.146 0.772 0.435 -0.000 -0.176 0.000 3/37026 510.0 1.124 0.757 0.427 -0.000 -0.173 0.000 3/37026 520.0 1.103 0.743 0.419 -0.000 -0.170 0.000 3/37026 530.0 1.083 0.730 0.412 -0.000 -0.166 0.000 3/37026 540.0 1.063 0.717 0.404 -0.000 -0.163 0.000 3/37026 550.0 1.044 0.704 0.397 -0.000 -0.160 0.000 3/37026 560.0 1.026 0.692 0.391 -0.000 -0.158 0.000 3/37026 570.0 1.008 0.680 0.384 -0.000 -0.155 0.000 3/37026 580.0 0.991 0.669 0.378 -0.000 -0.152 0.000 3/37026 590.0 0.975 0.658 0.371 -0.000 -0.150 0.000 3/37026 600.0 0.959 0.647 0.365 -0.000 -0.147 0.000 3/37026 610.0 0.944 0.637 0.360 -0.000 -0.145 0.000 3/37026 620.0 0.929 0.627 0.354 -0.000 -0.143 0.000 3/37026 630.0 0.914 0.617 0.349 -0.000 -0.140 0.000 3/37026 640.0 0.900 0.608 0.343 -0.000 -0.138 0.000 3/37026 650.0 0.886 0.599 0.338 -0.000 -0.136 0.000 3/37026 660.0 0.873 0.590 0.333 -0.000 -0.134 0.000 3/37026 670.0 0.860 0.582 0.329 -0.000 -0.132 0.000 3/37026 680.0 0.848 0.573 0.324 -0.000 -0.130 0.000 3/37026 690.0 0.836 0.565 0.319 -0.000 -0.128 0.000 3/37026 700.0 0.824 0.557 0.315 -0.000 -0.127 0.000 3/37026 710.0 0.813 0.550 0.311 -0.000 -0.125 0.000 3/37026 720.0 0.802 0.542 0.306 -0.000 -0.123 0.000 3/37026 730.0 0.791 0.535 0.302 -0.000 -0.121 0.000 3/37026 740.0 0.780 0.528 0.298 -0.000 -0.120 0.000 3/37026 750.0 0.770 0.521 0.294 -0.000 -0.118 0.000 3/37026 760.0 0.760 0.514 0.291 -0.000 -0.117 0.000 3/37026 770.0 0.750 0.508 0.287 -0.000 -0.115 0.000 3/37026 780.0 0.741 0.501 0.283 -0.000 -0.114 0.000 3/37026 790.0 0.732 0.495 0.280 -0.000 -0.112 0.000 3/37026 800.0 0.722 0.489 0.277 -0.000 -0.111 0.000 3/37026 810.0 0.714 0.483 0.273 -0.000 -0.110 0.000 3/37026 820.0 0.705 0.478 0.270 -0.000 -0.108 0.000 3/37026 830.0 0.697 0.472 0.267 -0.000 -0.107 0.000 3/37026 840.0 0.689 0.466 0.264 -0.000 -0.106 0.000 3/37026 850.0 0.680 0.461 0.261 -0.000 -0.104 0.000 3/37026 860.0 0.673 0.456 0.258 -0.000 -0.103 0.000 3/37026 870.0 0.665 0.451 0.255 -0.000 -0.102 0.000 3/37026 880.0 0.658 0.446 0.252 -0.000 -0.101 0.000 3/37026 890.0 0.650 0.441 0.249 -0.000 -0.100 0.000 3/37026 900.0 0.643 0.436 0.246 -0.000 -0.099 0.000 3/37026 910.0 0.636 0.431 0.244 -0.000 -0.098 0.000 3/37026 920.0 0.629 0.427 0.241 -0.000 -0.097 0.000 3/37026 930.0 0.623 0.422 0.239 -0.000 -0.096 0.000 3/37026 940.0 0.616 0.418 0.236 -0.000 -0.095 0.000 3/37026 950.0 0.610 0.413 0.234 -0.000 -0.094 0.000 3/37026 960.0 0.603 0.409 0.231 -0.000 -0.093 0.000 3/37026 970.0 0.597 0.405 0.229 -0.000 -0.092 0.000 3/37026 980.0 0.591 0.401 0.227 -0.000 -0.091 0.000 3/37026 990.0 0.585 0.397 0.224 -0.000 -0.090 0.000 3/37026 1000.0 0.579 0.393 0.222 -0.000 -0.089 0.000 3/37026 Thermal conductivity related properties were written into "kappa-m11113.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 10:05:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|