----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 04:37:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.664687250020258 0.000000000000000 0.000000000000000 b 0.000000000000000 7.069840710000000 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): *1 O 0.34330419752753 0.23303122474513 0.81997956616298 15.999 2 O 0.65669580247246 0.73303122474513 0.68002043383702 15.999 3 O 0.65669580247246 0.76696877525487 0.18002043383702 15.999 4 O 0.34330419752753 0.26696877525487 0.31997956616298 15.999 *5 O 0.84803080566060 0.17539850911741 0.85970366193829 15.999 6 O 0.15196919433940 0.67539850911741 0.64029633806171 15.999 7 O 0.15196919433940 0.82460149088259 0.14029633806171 15.999 8 O 0.84803080566060 0.32460149088259 0.35970366193829 15.999 *9 O 0.75338161467818 0.18044655062794 0.07193341167970 15.999 10 O 0.24661838532182 0.68044655062794 0.42806658832030 15.999 11 O 0.24661838532182 0.81955344937206 0.92806658832030 15.999 12 O 0.75338161467818 0.31955344937206 0.57193341167970 15.999 *13 O 0.71233778371308 0.99378691401500 0.43111496324945 15.999 14 O 0.28766221628692 0.49378691401501 0.06888503675055 15.999 15 O 0.28766221628692 0.00621308598500 0.56888503675055 15.999 16 O 0.71233778371308 0.50621308598500 0.93111496324945 15.999 *17 Si 0.66007671204610 0.27919806902183 0.91879075626108 28.085 18 Si 0.33992328795390 0.77919806902183 0.58120924373892 28.085 19 Si 0.33992328795390 0.72080193097817 0.08120924373892 28.085 20 Si 0.66007671204610 0.22080193097817 0.41879075626108 28.085 *21 Sr 0.97223048122467 0.49998084962803 0.19744124444260 87.620 22 Sr 0.02776951877533 0.99998084962803 0.30255875555740 87.620 23 Sr 0.02776951877533 0.50001915037197 0.80255875555740 87.620 24 Sr 0.97223048122467 0.00001915037197 0.69744124444260 87.620 *25 Sr 0.68860900060329 0.84295813735071 0.92426934752114 87.620 26 Sr 0.31139099939671 0.34295813735071 0.57573065247886 87.620 27 Sr 0.31139099939671 0.15704186264929 0.07573065247886 87.620 28 Sr 0.68860900060329 0.65704186264929 0.42426934752114 87.620 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.664687250020258 0.000000000000000 0.000000000000000 b 0.000000000000000 7.069840710000000 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): *1 O 0.34330419752753 0.23303122474513 0.81997956616298 15.999 > 1 2 O 0.65669580247246 0.73303122474513 0.68002043383702 15.999 > 2 3 O 0.65669580247246 0.76696877525487 0.18002043383702 15.999 > 3 4 O 0.34330419752753 0.26696877525487 0.31997956616298 15.999 > 4 *5 O 0.84803080566060 0.17539850911741 0.85970366193829 15.999 > 5 6 O 0.15196919433940 0.67539850911741 0.64029633806171 15.999 > 6 7 O 0.15196919433940 0.82460149088259 0.14029633806171 15.999 > 7 8 O 0.84803080566060 0.32460149088259 0.35970366193829 15.999 > 8 *9 O 0.75338161467818 0.18044655062794 0.07193341167970 15.999 > 9 10 O 0.24661838532182 0.68044655062794 0.42806658832030 15.999 > 10 11 O 0.24661838532182 0.81955344937206 0.92806658832030 15.999 > 11 12 O 0.75338161467818 0.31955344937206 0.57193341167970 15.999 > 12 *13 O 0.71233778371308 0.99378691401500 0.43111496324945 15.999 > 13 14 O 0.28766221628692 0.49378691401501 0.06888503675055 15.999 > 14 15 O 0.28766221628692 0.00621308598500 0.56888503675055 15.999 > 15 16 O 0.71233778371308 0.50621308598500 0.93111496324945 15.999 > 16 *17 Si 0.66007671204610 0.27919806902183 0.91879075626108 28.085 > 17 18 Si 0.33992328795390 0.77919806902183 0.58120924373892 28.085 > 18 19 Si 0.33992328795390 0.72080193097817 0.08120924373892 28.085 > 19 20 Si 0.66007671204610 0.22080193097817 0.41879075626108 28.085 > 20 *21 Sr 0.97223048122467 0.49998084962803 0.19744124444260 87.620 > 21 22 Sr 0.02776951877533 0.99998084962803 0.30255875555740 87.620 > 22 23 Sr 0.02776951877533 0.50001915037197 0.80255875555740 87.620 > 23 24 Sr 0.97223048122467 0.00001915037197 0.69744124444260 87.620 > 24 *25 Sr 0.68860900060329 0.84295813735071 0.92426934752114 87.620 > 25 26 Sr 0.31139099939671 0.34295813735071 0.57573065247886 87.620 > 26 27 Sr 0.31139099939671 0.15704186264929 0.07573065247886 87.620 > 27 28 Sr 0.68860900060329 0.65704186264929 0.42426934752114 87.620 > 28 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.329374500040515 0.000000000000000 0.000000000000000 b 0.000000000000000 14.139681420000001 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): *1 O 0.17165209876377 0.11651561237257 0.81997956616298 15.999 > 1 2 O 0.67165209876377 0.11651561237257 0.81997956616298 15.999 > 1 3 O 0.17165209876377 0.61651561237257 0.81997956616298 15.999 > 1 4 O 0.67165209876377 0.61651561237257 0.81997956616298 15.999 > 1 5 O 0.32834790123623 0.36651561237257 0.68002043383702 15.999 > 2 6 O 0.82834790123623 0.36651561237257 0.68002043383702 15.999 > 2 7 O 0.32834790123623 0.86651561237257 0.68002043383702 15.999 > 2 8 O 0.82834790123623 0.86651561237257 0.68002043383702 15.999 > 2 9 O 0.32834790123623 0.38348438762743 0.18002043383702 15.999 > 3 10 O 0.82834790123623 0.38348438762743 0.18002043383702 15.999 > 3 11 O 0.32834790123623 0.88348438762743 0.18002043383702 15.999 > 3 12 O 0.82834790123623 0.88348438762743 0.18002043383702 15.999 > 3 13 O 0.17165209876377 0.13348438762743 0.31997956616298 15.999 > 4 14 O 0.67165209876377 0.13348438762743 0.31997956616298 15.999 > 4 15 O 0.17165209876377 0.63348438762743 0.31997956616298 15.999 > 4 16 O 0.67165209876377 0.63348438762743 0.31997956616298 15.999 > 4 *17 O 0.42401540283030 0.08769925455871 0.85970366193829 15.999 > 5 18 O 0.92401540283030 0.08769925455871 0.85970366193829 15.999 > 5 19 O 0.42401540283030 0.58769925455871 0.85970366193829 15.999 > 5 20 O 0.92401540283030 0.58769925455871 0.85970366193829 15.999 > 5 21 O 0.07598459716970 0.33769925455871 0.64029633806171 15.999 > 6 22 O 0.57598459716970 0.33769925455871 0.64029633806171 15.999 > 6 23 O 0.07598459716970 0.83769925455871 0.64029633806171 15.999 > 6 24 O 0.57598459716970 0.83769925455871 0.64029633806171 15.999 > 6 25 O 0.07598459716970 0.41230074544129 0.14029633806171 15.999 > 7 26 O 0.57598459716970 0.41230074544129 0.14029633806171 15.999 > 7 27 O 0.07598459716970 0.91230074544129 0.14029633806171 15.999 > 7 28 O 0.57598459716970 0.91230074544129 0.14029633806171 15.999 > 7 29 O 0.42401540283030 0.16230074544129 0.35970366193829 15.999 > 8 30 O 0.92401540283030 0.16230074544129 0.35970366193829 15.999 > 8 31 O 0.42401540283030 0.66230074544129 0.35970366193829 15.999 > 8 32 O 0.92401540283030 0.66230074544129 0.35970366193829 15.999 > 8 *33 O 0.37669080733909 0.09022327531397 0.07193341167970 15.999 > 9 34 O 0.87669080733909 0.09022327531397 0.07193341167970 15.999 > 9 35 O 0.37669080733909 0.59022327531397 0.07193341167970 15.999 > 9 36 O 0.87669080733909 0.59022327531397 0.07193341167970 15.999 > 9 37 O 0.12330919266091 0.34022327531397 0.42806658832030 15.999 > 10 38 O 0.62330919266091 0.34022327531397 0.42806658832030 15.999 > 10 39 O 0.12330919266091 0.84022327531397 0.42806658832030 15.999 > 10 40 O 0.62330919266091 0.84022327531397 0.42806658832030 15.999 > 10 41 O 0.12330919266091 0.40977672468603 0.92806658832030 15.999 > 11 42 O 0.62330919266091 0.40977672468603 0.92806658832030 15.999 > 11 43 O 0.12330919266091 0.90977672468603 0.92806658832030 15.999 > 11 44 O 0.62330919266091 0.90977672468603 0.92806658832030 15.999 > 11 45 O 0.37669080733909 0.15977672468603 0.57193341167970 15.999 > 12 46 O 0.87669080733909 0.15977672468603 0.57193341167970 15.999 > 12 47 O 0.37669080733909 0.65977672468603 0.57193341167970 15.999 > 12 48 O 0.87669080733909 0.65977672468603 0.57193341167970 15.999 > 12 *49 O 0.35616889185654 0.49689345700750 0.43111496324945 15.999 > 13 50 O 0.85616889185654 0.49689345700750 0.43111496324945 15.999 > 13 51 O 0.35616889185654 0.99689345700750 0.43111496324945 15.999 > 13 52 O 0.85616889185654 0.99689345700750 0.43111496324945 15.999 > 13 53 O 0.14383110814346 0.24689345700750 0.06888503675055 15.999 > 14 54 O 0.64383110814346 0.24689345700750 0.06888503675055 15.999 > 14 55 O 0.14383110814346 0.74689345700750 0.06888503675055 15.999 > 14 56 O 0.64383110814346 0.74689345700750 0.06888503675055 15.999 > 14 57 O 0.14383110814346 0.00310654299250 0.56888503675055 15.999 > 15 58 O 0.64383110814346 0.00310654299250 0.56888503675055 15.999 > 15 59 O 0.14383110814346 0.50310654299250 0.56888503675055 15.999 > 15 60 O 0.64383110814346 0.50310654299250 0.56888503675055 15.999 > 15 61 O 0.35616889185654 0.25310654299250 0.93111496324945 15.999 > 16 62 O 0.85616889185654 0.25310654299250 0.93111496324945 15.999 > 16 63 O 0.35616889185654 0.75310654299250 0.93111496324945 15.999 > 16 64 O 0.85616889185654 0.75310654299250 0.93111496324945 15.999 > 16 *65 Si 0.33003835602305 0.13959903451091 0.91879075626108 28.085 > 17 66 Si 0.83003835602305 0.13959903451091 0.91879075626108 28.085 > 17 67 Si 0.33003835602305 0.63959903451091 0.91879075626108 28.085 > 17 68 Si 0.83003835602305 0.63959903451091 0.91879075626108 28.085 > 17 69 Si 0.16996164397695 0.38959903451091 0.58120924373892 28.085 > 18 70 Si 0.66996164397695 0.38959903451091 0.58120924373892 28.085 > 18 71 Si 0.16996164397695 0.88959903451091 0.58120924373892 28.085 > 18 72 Si 0.66996164397695 0.88959903451091 0.58120924373892 28.085 > 18 73 Si 0.16996164397695 0.36040096548909 0.08120924373892 28.085 > 19 74 Si 0.66996164397695 0.36040096548909 0.08120924373892 28.085 > 19 75 Si 0.16996164397695 0.86040096548909 0.08120924373892 28.085 > 19 76 Si 0.66996164397695 0.86040096548909 0.08120924373892 28.085 > 19 77 Si 0.33003835602305 0.11040096548909 0.41879075626108 28.085 > 20 78 Si 0.83003835602305 0.11040096548909 0.41879075626108 28.085 > 20 79 Si 0.33003835602305 0.61040096548909 0.41879075626108 28.085 > 20 80 Si 0.83003835602305 0.61040096548909 0.41879075626108 28.085 > 20 *81 Sr 0.48611524061234 0.24999042481402 0.19744124444260 87.620 > 21 82 Sr 0.98611524061234 0.24999042481402 0.19744124444260 87.620 > 21 83 Sr 0.48611524061234 0.74999042481402 0.19744124444260 87.620 > 21 84 Sr 0.98611524061234 0.74999042481402 0.19744124444260 87.620 > 21 85 Sr 0.01388475938766 0.49999042481402 0.30255875555740 87.620 > 22 86 Sr 0.51388475938766 0.49999042481402 0.30255875555740 87.620 > 22 87 Sr 0.01388475938766 0.99999042481402 0.30255875555740 87.620 > 22 88 Sr 0.51388475938766 0.99999042481402 0.30255875555740 87.620 > 22 89 Sr 0.01388475938766 0.25000957518598 0.80255875555740 87.620 > 23 90 Sr 0.51388475938766 0.25000957518598 0.80255875555740 87.620 > 23 91 Sr 0.01388475938766 0.75000957518598 0.80255875555740 87.620 > 23 92 Sr 0.51388475938766 0.75000957518598 0.80255875555740 87.620 > 23 93 Sr 0.48611524061234 0.00000957518598 0.69744124444260 87.620 > 24 94 Sr 0.98611524061234 0.00000957518598 0.69744124444260 87.620 > 24 95 Sr 0.48611524061234 0.50000957518598 0.69744124444260 87.620 > 24 96 Sr 0.98611524061234 0.50000957518598 0.69744124444260 87.620 > 24 *97 Sr 0.34430450030164 0.42147906867535 0.92426934752114 87.620 > 25 98 Sr 0.84430450030164 0.42147906867535 0.92426934752114 87.620 > 25 99 Sr 0.34430450030164 0.92147906867535 0.92426934752114 87.620 > 25 100 Sr 0.84430450030164 0.92147906867535 0.92426934752114 87.620 > 25 101 Sr 0.15569549969836 0.17147906867535 0.57573065247886 87.620 > 26 102 Sr 0.65569549969836 0.17147906867535 0.57573065247886 87.620 > 26 103 Sr 0.15569549969836 0.67147906867535 0.57573065247886 87.620 > 26 104 Sr 0.65569549969836 0.67147906867535 0.57573065247886 87.620 > 26 105 Sr 0.15569549969836 0.07852093132465 0.07573065247886 87.620 > 27 106 Sr 0.65569549969836 0.07852093132465 0.07573065247886 87.620 > 27 107 Sr 0.15569549969836 0.57852093132465 0.07573065247886 87.620 > 27 108 Sr 0.65569549969836 0.57852093132465 0.07573065247886 87.620 > 27 109 Sr 0.34430450030164 0.32852093132465 0.42426934752114 87.620 > 28 110 Sr 0.84430450030164 0.32852093132465 0.42426934752114 87.620 > 28 111 Sr 0.34430450030164 0.82852093132465 0.42426934752114 87.620 > 28 112 Sr 0.84430450030164 0.82852093132465 0.42426934752114 87.620 > 28 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3049229 0.0000000 0.0102065 0.0000000 3.3855046 0.0000000 0.0102062 0.0000000 3.2736386 -------------------------- Born effective charges -------------------------- 1 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 2 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 3 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 4 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 5 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 6 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 7 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 8 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 9 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 10 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 11 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 12 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 13 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 14 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 15 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 16 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 17 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 18 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 19 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 20 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 21 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 22 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 23 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 24 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 25 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 26 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 27 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 28 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (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: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 880 - Time: 3.038 Solver_block: 200 / 880 - Time: 2.069 Solver_block: 300 / 880 - Time: 1.949 Solver_block: 400 / 880 - Time: 2.085 Solver_block: 500 / 880 - Time: 2.675 Solver_block: 600 / 880 - Time: 0.894 Solver_block: 700 / 880 - Time: 0.906 Solver_block: 800 / 880 - Time: 0.894 Solver_block: 880 / 880 - Time: 0.750 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 15.752 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 336/336 Permutation basis: 14448/14448 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3654 Number of blocks in projector: 3654 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: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (2) Block: 250 / 500 (2) 236 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 486 eigenvectors found. (1) Block: 784 / 784 (1) 270 eigenvectors found. (1) Complementary block size: 28 (1) Compute compressed projector. (1) Use standard solver. (1) 14 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 784 Use submatrix version of eigh solver. (1) Block: 500 / 784 (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: 784 / 784 (1) 275 eigenvectors found. (1) Complementary block size: 22 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 434 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 434 Use standard eigh solver. Tree of FC basis block matrices: - (3654, 3592), data: False |-- (434, 427), data: True |-- (434, 427), data: True |-- (434, 427), data: True |-- (784, 771), data: False |-- (784, 9), data: (784, 22) @ (22, 9) |-- (284, 275), data: True |-- (500, 487), data: False |-- (500, 11), data: (500, 24) @ (24, 11) |-- (250, 239), data: True |-- (250, 237), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True |-- (784, 770), data: False |-- (784, 14), data: (784, 28) @ (28, 14) |-- (284, 270), data: True |-- (500, 486), data: False |-- (500, 12), data: (500, 26) @ (26, 12) |-- (250, 238), data: True |-- (250, 236), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 04:39:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:39:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.664687250020258 0.000000000000000 0.000000000000000 b 0.000000000000000 7.069840710000000 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): 1 O 0.34330419752753 0.23303122474513 0.81997956616298 15.999 2 O 0.65669580247246 0.73303122474513 0.68002043383702 15.999 3 O 0.65669580247246 0.76696877525487 0.18002043383702 15.999 4 O 0.34330419752753 0.26696877525487 0.31997956616298 15.999 5 O 0.84803080566060 0.17539850911741 0.85970366193829 15.999 6 O 0.15196919433940 0.67539850911741 0.64029633806171 15.999 7 O 0.15196919433940 0.82460149088259 0.14029633806171 15.999 8 O 0.84803080566060 0.32460149088259 0.35970366193829 15.999 9 O 0.75338161467818 0.18044655062794 0.07193341167970 15.999 10 O 0.24661838532182 0.68044655062794 0.42806658832030 15.999 11 O 0.24661838532182 0.81955344937206 0.92806658832030 15.999 12 O 0.75338161467818 0.31955344937206 0.57193341167970 15.999 13 O 0.71233778371308 0.99378691401500 0.43111496324945 15.999 14 O 0.28766221628692 0.49378691401501 0.06888503675055 15.999 15 O 0.28766221628692 0.00621308598500 0.56888503675055 15.999 16 O 0.71233778371308 0.50621308598500 0.93111496324945 15.999 17 Si 0.66007671204610 0.27919806902183 0.91879075626108 28.085 18 Si 0.33992328795390 0.77919806902183 0.58120924373892 28.085 19 Si 0.33992328795390 0.72080193097817 0.08120924373892 28.085 20 Si 0.66007671204610 0.22080193097817 0.41879075626108 28.085 21 Sr 0.97223048122467 0.49998084962803 0.19744124444260 87.620 22 Sr 0.02776951877533 0.99998084962803 0.30255875555740 87.620 23 Sr 0.02776951877533 0.50001915037197 0.80255875555740 87.620 24 Sr 0.97223048122467 0.00001915037197 0.69744124444260 87.620 25 Sr 0.68860900060329 0.84295813735071 0.92426934752114 87.620 26 Sr 0.31139099939671 0.34295813735071 0.57573065247886 87.620 27 Sr 0.31139099939671 0.15704186264929 0.07573065247886 87.620 28 Sr 0.68860900060329 0.65704186264929 0.42426934752114 87.620 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.329374500040515 0.000000000000000 0.000000000000000 b 0.000000000000000 14.139681420000001 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): 1 O 0.17165209876377 0.11651561237257 0.81997956616298 15.999 > 1 2 O 0.67165209876377 0.11651561237257 0.81997956616298 15.999 > 1 3 O 0.17165209876377 0.61651561237257 0.81997956616298 15.999 > 1 4 O 0.67165209876377 0.61651561237257 0.81997956616298 15.999 > 1 5 O 0.32834790123623 0.36651561237257 0.68002043383702 15.999 > 5 6 O 0.82834790123623 0.36651561237257 0.68002043383702 15.999 > 5 7 O 0.32834790123623 0.86651561237257 0.68002043383702 15.999 > 5 8 O 0.82834790123623 0.86651561237257 0.68002043383702 15.999 > 5 9 O 0.32834790123623 0.38348438762743 0.18002043383702 15.999 > 9 10 O 0.82834790123623 0.38348438762743 0.18002043383702 15.999 > 9 11 O 0.32834790123623 0.88348438762743 0.18002043383702 15.999 > 9 12 O 0.82834790123623 0.88348438762743 0.18002043383702 15.999 > 9 13 O 0.17165209876377 0.13348438762743 0.31997956616298 15.999 > 13 14 O 0.67165209876377 0.13348438762743 0.31997956616298 15.999 > 13 15 O 0.17165209876377 0.63348438762743 0.31997956616298 15.999 > 13 16 O 0.67165209876377 0.63348438762743 0.31997956616298 15.999 > 13 17 O 0.42401540283030 0.08769925455871 0.85970366193829 15.999 > 17 18 O 0.92401540283030 0.08769925455871 0.85970366193829 15.999 > 17 19 O 0.42401540283030 0.58769925455871 0.85970366193829 15.999 > 17 20 O 0.92401540283030 0.58769925455871 0.85970366193829 15.999 > 17 21 O 0.07598459716970 0.33769925455871 0.64029633806171 15.999 > 21 22 O 0.57598459716970 0.33769925455871 0.64029633806171 15.999 > 21 23 O 0.07598459716970 0.83769925455871 0.64029633806171 15.999 > 21 24 O 0.57598459716970 0.83769925455871 0.64029633806171 15.999 > 21 25 O 0.07598459716970 0.41230074544129 0.14029633806171 15.999 > 25 26 O 0.57598459716970 0.41230074544129 0.14029633806171 15.999 > 25 27 O 0.07598459716970 0.91230074544129 0.14029633806171 15.999 > 25 28 O 0.57598459716970 0.91230074544129 0.14029633806171 15.999 > 25 29 O 0.42401540283030 0.16230074544129 0.35970366193829 15.999 > 29 30 O 0.92401540283030 0.16230074544129 0.35970366193829 15.999 > 29 31 O 0.42401540283030 0.66230074544129 0.35970366193829 15.999 > 29 32 O 0.92401540283030 0.66230074544129 0.35970366193829 15.999 > 29 33 O 0.37669080733909 0.09022327531397 0.07193341167970 15.999 > 33 34 O 0.87669080733909 0.09022327531397 0.07193341167970 15.999 > 33 35 O 0.37669080733909 0.59022327531397 0.07193341167970 15.999 > 33 36 O 0.87669080733909 0.59022327531397 0.07193341167970 15.999 > 33 37 O 0.12330919266091 0.34022327531397 0.42806658832030 15.999 > 37 38 O 0.62330919266091 0.34022327531397 0.42806658832030 15.999 > 37 39 O 0.12330919266091 0.84022327531397 0.42806658832030 15.999 > 37 40 O 0.62330919266091 0.84022327531397 0.42806658832030 15.999 > 37 41 O 0.12330919266091 0.40977672468603 0.92806658832030 15.999 > 41 42 O 0.62330919266091 0.40977672468603 0.92806658832030 15.999 > 41 43 O 0.12330919266091 0.90977672468603 0.92806658832030 15.999 > 41 44 O 0.62330919266091 0.90977672468603 0.92806658832030 15.999 > 41 45 O 0.37669080733909 0.15977672468603 0.57193341167970 15.999 > 45 46 O 0.87669080733909 0.15977672468603 0.57193341167970 15.999 > 45 47 O 0.37669080733909 0.65977672468603 0.57193341167970 15.999 > 45 48 O 0.87669080733909 0.65977672468603 0.57193341167970 15.999 > 45 49 O 0.35616889185654 0.49689345700750 0.43111496324945 15.999 > 49 50 O 0.85616889185654 0.49689345700750 0.43111496324945 15.999 > 49 51 O 0.35616889185654 0.99689345700750 0.43111496324945 15.999 > 49 52 O 0.85616889185654 0.99689345700750 0.43111496324945 15.999 > 49 53 O 0.14383110814346 0.24689345700750 0.06888503675055 15.999 > 53 54 O 0.64383110814346 0.24689345700750 0.06888503675055 15.999 > 53 55 O 0.14383110814346 0.74689345700750 0.06888503675055 15.999 > 53 56 O 0.64383110814346 0.74689345700750 0.06888503675055 15.999 > 53 57 O 0.14383110814346 0.00310654299250 0.56888503675055 15.999 > 57 58 O 0.64383110814346 0.00310654299250 0.56888503675055 15.999 > 57 59 O 0.14383110814346 0.50310654299250 0.56888503675055 15.999 > 57 60 O 0.64383110814346 0.50310654299250 0.56888503675055 15.999 > 57 61 O 0.35616889185654 0.25310654299250 0.93111496324945 15.999 > 61 62 O 0.85616889185654 0.25310654299250 0.93111496324945 15.999 > 61 63 O 0.35616889185654 0.75310654299250 0.93111496324945 15.999 > 61 64 O 0.85616889185654 0.75310654299250 0.93111496324945 15.999 > 61 65 Si 0.33003835602305 0.13959903451091 0.91879075626108 28.085 > 65 66 Si 0.83003835602305 0.13959903451091 0.91879075626108 28.085 > 65 67 Si 0.33003835602305 0.63959903451091 0.91879075626108 28.085 > 65 68 Si 0.83003835602305 0.63959903451091 0.91879075626108 28.085 > 65 69 Si 0.16996164397695 0.38959903451091 0.58120924373892 28.085 > 69 70 Si 0.66996164397695 0.38959903451091 0.58120924373892 28.085 > 69 71 Si 0.16996164397695 0.88959903451091 0.58120924373892 28.085 > 69 72 Si 0.66996164397695 0.88959903451091 0.58120924373892 28.085 > 69 73 Si 0.16996164397695 0.36040096548909 0.08120924373892 28.085 > 73 74 Si 0.66996164397695 0.36040096548909 0.08120924373892 28.085 > 73 75 Si 0.16996164397695 0.86040096548909 0.08120924373892 28.085 > 73 76 Si 0.66996164397695 0.86040096548909 0.08120924373892 28.085 > 73 77 Si 0.33003835602305 0.11040096548909 0.41879075626108 28.085 > 77 78 Si 0.83003835602305 0.11040096548909 0.41879075626108 28.085 > 77 79 Si 0.33003835602305 0.61040096548909 0.41879075626108 28.085 > 77 80 Si 0.83003835602305 0.61040096548909 0.41879075626108 28.085 > 77 81 Sr 0.48611524061234 0.24999042481402 0.19744124444260 87.620 > 81 82 Sr 0.98611524061234 0.24999042481402 0.19744124444260 87.620 > 81 83 Sr 0.48611524061234 0.74999042481402 0.19744124444260 87.620 > 81 84 Sr 0.98611524061234 0.74999042481402 0.19744124444260 87.620 > 81 85 Sr 0.01388475938766 0.49999042481402 0.30255875555740 87.620 > 85 86 Sr 0.51388475938766 0.49999042481402 0.30255875555740 87.620 > 85 87 Sr 0.01388475938766 0.99999042481402 0.30255875555740 87.620 > 85 88 Sr 0.51388475938766 0.99999042481402 0.30255875555740 87.620 > 85 89 Sr 0.01388475938766 0.25000957518598 0.80255875555740 87.620 > 89 90 Sr 0.51388475938766 0.25000957518598 0.80255875555740 87.620 > 89 91 Sr 0.01388475938766 0.75000957518598 0.80255875555740 87.620 > 89 92 Sr 0.51388475938766 0.75000957518598 0.80255875555740 87.620 > 89 93 Sr 0.48611524061234 0.00000957518598 0.69744124444260 87.620 > 93 94 Sr 0.98611524061234 0.00000957518598 0.69744124444260 87.620 > 93 95 Sr 0.48611524061234 0.50000957518598 0.69744124444260 87.620 > 93 96 Sr 0.98611524061234 0.50000957518598 0.69744124444260 87.620 > 93 97 Sr 0.34430450030164 0.42147906867535 0.92426934752114 87.620 > 97 98 Sr 0.84430450030164 0.42147906867535 0.92426934752114 87.620 > 97 99 Sr 0.34430450030164 0.92147906867535 0.92426934752114 87.620 > 97 100 Sr 0.84430450030164 0.92147906867535 0.92426934752114 87.620 > 97 101 Sr 0.15569549969836 0.17147906867535 0.57573065247886 87.620 > 101 102 Sr 0.65569549969836 0.17147906867535 0.57573065247886 87.620 > 101 103 Sr 0.15569549969836 0.67147906867535 0.57573065247886 87.620 > 101 104 Sr 0.65569549969836 0.67147906867535 0.57573065247886 87.620 > 101 105 Sr 0.15569549969836 0.07852093132465 0.07573065247886 87.620 > 105 106 Sr 0.65569549969836 0.07852093132465 0.07573065247886 87.620 > 105 107 Sr 0.15569549969836 0.57852093132465 0.07573065247886 87.620 > 105 108 Sr 0.65569549969836 0.57852093132465 0.07573065247886 87.620 > 105 109 Sr 0.34430450030164 0.32852093132465 0.42426934752114 87.620 > 109 110 Sr 0.84430450030164 0.32852093132465 0.42426934752114 87.620 > 109 111 Sr 0.34430450030164 0.82852093132465 0.42426934752114 87.620 > 109 112 Sr 0.84430450030164 0.82852093132465 0.42426934752114 87.620 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3049229 0.0000000 0.0102065 0.0000000 3.3855046 0.0000000 0.0102062 0.0000000 3.2736386 -------------------------- Born effective charges -------------------------- 1 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 2 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 3 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 4 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 5 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 6 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 7 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 8 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 9 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 10 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 11 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 12 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 13 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 14 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 15 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 16 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 17 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 18 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 19 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 20 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 21 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 22 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 23 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 24 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 25 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 26 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 27 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 28 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 ---------------------------------------------------------------------------- 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] Computing fc3[ 97, 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] [-0.0046 0.0000 0.0089] [ 0.0046 0.0000 -0.0089] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000001 (zx) -0.00000001 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:39:38]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 04:39:39]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.664687250020258 0.000000000000000 0.000000000000000 b 0.000000000000000 7.069840710000000 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): 1 O 0.34330419752753 0.23303122474513 0.81997956616298 15.999 2 O 0.65669580247246 0.73303122474513 0.68002043383702 15.999 3 O 0.65669580247246 0.76696877525487 0.18002043383702 15.999 4 O 0.34330419752753 0.26696877525487 0.31997956616298 15.999 5 O 0.84803080566060 0.17539850911741 0.85970366193829 15.999 6 O 0.15196919433940 0.67539850911741 0.64029633806171 15.999 7 O 0.15196919433940 0.82460149088259 0.14029633806171 15.999 8 O 0.84803080566060 0.32460149088259 0.35970366193829 15.999 9 O 0.75338161467818 0.18044655062794 0.07193341167970 15.999 10 O 0.24661838532182 0.68044655062794 0.42806658832030 15.999 11 O 0.24661838532182 0.81955344937206 0.92806658832030 15.999 12 O 0.75338161467818 0.31955344937206 0.57193341167970 15.999 13 O 0.71233778371308 0.99378691401500 0.43111496324945 15.999 14 O 0.28766221628692 0.49378691401501 0.06888503675055 15.999 15 O 0.28766221628692 0.00621308598500 0.56888503675055 15.999 16 O 0.71233778371308 0.50621308598500 0.93111496324945 15.999 17 Si 0.66007671204610 0.27919806902183 0.91879075626108 28.085 18 Si 0.33992328795390 0.77919806902183 0.58120924373892 28.085 19 Si 0.33992328795390 0.72080193097817 0.08120924373892 28.085 20 Si 0.66007671204610 0.22080193097817 0.41879075626108 28.085 21 Sr 0.97223048122467 0.49998084962803 0.19744124444260 87.620 22 Sr 0.02776951877533 0.99998084962803 0.30255875555740 87.620 23 Sr 0.02776951877533 0.50001915037197 0.80255875555740 87.620 24 Sr 0.97223048122467 0.00001915037197 0.69744124444260 87.620 25 Sr 0.68860900060329 0.84295813735071 0.92426934752114 87.620 26 Sr 0.31139099939671 0.34295813735071 0.57573065247886 87.620 27 Sr 0.31139099939671 0.15704186264929 0.07573065247886 87.620 28 Sr 0.68860900060329 0.65704186264929 0.42426934752114 87.620 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.329374500040515 0.000000000000000 0.000000000000000 b 0.000000000000000 14.139681420000001 0.000000000000000 c -5.082406607273762 0.000000000000000 9.698114917323082 Atomic positions (fractional): 1 O 0.17165209876377 0.11651561237257 0.81997956616298 15.999 > 1 2 O 0.67165209876377 0.11651561237257 0.81997956616298 15.999 > 1 3 O 0.17165209876377 0.61651561237257 0.81997956616298 15.999 > 1 4 O 0.67165209876377 0.61651561237257 0.81997956616298 15.999 > 1 5 O 0.32834790123623 0.36651561237257 0.68002043383702 15.999 > 5 6 O 0.82834790123623 0.36651561237257 0.68002043383702 15.999 > 5 7 O 0.32834790123623 0.86651561237257 0.68002043383702 15.999 > 5 8 O 0.82834790123623 0.86651561237257 0.68002043383702 15.999 > 5 9 O 0.32834790123623 0.38348438762743 0.18002043383702 15.999 > 9 10 O 0.82834790123623 0.38348438762743 0.18002043383702 15.999 > 9 11 O 0.32834790123623 0.88348438762743 0.18002043383702 15.999 > 9 12 O 0.82834790123623 0.88348438762743 0.18002043383702 15.999 > 9 13 O 0.17165209876377 0.13348438762743 0.31997956616298 15.999 > 13 14 O 0.67165209876377 0.13348438762743 0.31997956616298 15.999 > 13 15 O 0.17165209876377 0.63348438762743 0.31997956616298 15.999 > 13 16 O 0.67165209876377 0.63348438762743 0.31997956616298 15.999 > 13 17 O 0.42401540283030 0.08769925455871 0.85970366193829 15.999 > 17 18 O 0.92401540283030 0.08769925455871 0.85970366193829 15.999 > 17 19 O 0.42401540283030 0.58769925455871 0.85970366193829 15.999 > 17 20 O 0.92401540283030 0.58769925455871 0.85970366193829 15.999 > 17 21 O 0.07598459716970 0.33769925455871 0.64029633806171 15.999 > 21 22 O 0.57598459716970 0.33769925455871 0.64029633806171 15.999 > 21 23 O 0.07598459716970 0.83769925455871 0.64029633806171 15.999 > 21 24 O 0.57598459716970 0.83769925455871 0.64029633806171 15.999 > 21 25 O 0.07598459716970 0.41230074544129 0.14029633806171 15.999 > 25 26 O 0.57598459716970 0.41230074544129 0.14029633806171 15.999 > 25 27 O 0.07598459716970 0.91230074544129 0.14029633806171 15.999 > 25 28 O 0.57598459716970 0.91230074544129 0.14029633806171 15.999 > 25 29 O 0.42401540283030 0.16230074544129 0.35970366193829 15.999 > 29 30 O 0.92401540283030 0.16230074544129 0.35970366193829 15.999 > 29 31 O 0.42401540283030 0.66230074544129 0.35970366193829 15.999 > 29 32 O 0.92401540283030 0.66230074544129 0.35970366193829 15.999 > 29 33 O 0.37669080733909 0.09022327531397 0.07193341167970 15.999 > 33 34 O 0.87669080733909 0.09022327531397 0.07193341167970 15.999 > 33 35 O 0.37669080733909 0.59022327531397 0.07193341167970 15.999 > 33 36 O 0.87669080733909 0.59022327531397 0.07193341167970 15.999 > 33 37 O 0.12330919266091 0.34022327531397 0.42806658832030 15.999 > 37 38 O 0.62330919266091 0.34022327531397 0.42806658832030 15.999 > 37 39 O 0.12330919266091 0.84022327531397 0.42806658832030 15.999 > 37 40 O 0.62330919266091 0.84022327531397 0.42806658832030 15.999 > 37 41 O 0.12330919266091 0.40977672468603 0.92806658832030 15.999 > 41 42 O 0.62330919266091 0.40977672468603 0.92806658832030 15.999 > 41 43 O 0.12330919266091 0.90977672468603 0.92806658832030 15.999 > 41 44 O 0.62330919266091 0.90977672468603 0.92806658832030 15.999 > 41 45 O 0.37669080733909 0.15977672468603 0.57193341167970 15.999 > 45 46 O 0.87669080733909 0.15977672468603 0.57193341167970 15.999 > 45 47 O 0.37669080733909 0.65977672468603 0.57193341167970 15.999 > 45 48 O 0.87669080733909 0.65977672468603 0.57193341167970 15.999 > 45 49 O 0.35616889185654 0.49689345700750 0.43111496324945 15.999 > 49 50 O 0.85616889185654 0.49689345700750 0.43111496324945 15.999 > 49 51 O 0.35616889185654 0.99689345700750 0.43111496324945 15.999 > 49 52 O 0.85616889185654 0.99689345700750 0.43111496324945 15.999 > 49 53 O 0.14383110814346 0.24689345700750 0.06888503675055 15.999 > 53 54 O 0.64383110814346 0.24689345700750 0.06888503675055 15.999 > 53 55 O 0.14383110814346 0.74689345700750 0.06888503675055 15.999 > 53 56 O 0.64383110814346 0.74689345700750 0.06888503675055 15.999 > 53 57 O 0.14383110814346 0.00310654299250 0.56888503675055 15.999 > 57 58 O 0.64383110814346 0.00310654299250 0.56888503675055 15.999 > 57 59 O 0.14383110814346 0.50310654299250 0.56888503675055 15.999 > 57 60 O 0.64383110814346 0.50310654299250 0.56888503675055 15.999 > 57 61 O 0.35616889185654 0.25310654299250 0.93111496324945 15.999 > 61 62 O 0.85616889185654 0.25310654299250 0.93111496324945 15.999 > 61 63 O 0.35616889185654 0.75310654299250 0.93111496324945 15.999 > 61 64 O 0.85616889185654 0.75310654299250 0.93111496324945 15.999 > 61 65 Si 0.33003835602305 0.13959903451091 0.91879075626108 28.085 > 65 66 Si 0.83003835602305 0.13959903451091 0.91879075626108 28.085 > 65 67 Si 0.33003835602305 0.63959903451091 0.91879075626108 28.085 > 65 68 Si 0.83003835602305 0.63959903451091 0.91879075626108 28.085 > 65 69 Si 0.16996164397695 0.38959903451091 0.58120924373892 28.085 > 69 70 Si 0.66996164397695 0.38959903451091 0.58120924373892 28.085 > 69 71 Si 0.16996164397695 0.88959903451091 0.58120924373892 28.085 > 69 72 Si 0.66996164397695 0.88959903451091 0.58120924373892 28.085 > 69 73 Si 0.16996164397695 0.36040096548909 0.08120924373892 28.085 > 73 74 Si 0.66996164397695 0.36040096548909 0.08120924373892 28.085 > 73 75 Si 0.16996164397695 0.86040096548909 0.08120924373892 28.085 > 73 76 Si 0.66996164397695 0.86040096548909 0.08120924373892 28.085 > 73 77 Si 0.33003835602305 0.11040096548909 0.41879075626108 28.085 > 77 78 Si 0.83003835602305 0.11040096548909 0.41879075626108 28.085 > 77 79 Si 0.33003835602305 0.61040096548909 0.41879075626108 28.085 > 77 80 Si 0.83003835602305 0.61040096548909 0.41879075626108 28.085 > 77 81 Sr 0.48611524061234 0.24999042481402 0.19744124444260 87.620 > 81 82 Sr 0.98611524061234 0.24999042481402 0.19744124444260 87.620 > 81 83 Sr 0.48611524061234 0.74999042481402 0.19744124444260 87.620 > 81 84 Sr 0.98611524061234 0.74999042481402 0.19744124444260 87.620 > 81 85 Sr 0.01388475938766 0.49999042481402 0.30255875555740 87.620 > 85 86 Sr 0.51388475938766 0.49999042481402 0.30255875555740 87.620 > 85 87 Sr 0.01388475938766 0.99999042481402 0.30255875555740 87.620 > 85 88 Sr 0.51388475938766 0.99999042481402 0.30255875555740 87.620 > 85 89 Sr 0.01388475938766 0.25000957518598 0.80255875555740 87.620 > 89 90 Sr 0.51388475938766 0.25000957518598 0.80255875555740 87.620 > 89 91 Sr 0.01388475938766 0.75000957518598 0.80255875555740 87.620 > 89 92 Sr 0.51388475938766 0.75000957518598 0.80255875555740 87.620 > 89 93 Sr 0.48611524061234 0.00000957518598 0.69744124444260 87.620 > 93 94 Sr 0.98611524061234 0.00000957518598 0.69744124444260 87.620 > 93 95 Sr 0.48611524061234 0.50000957518598 0.69744124444260 87.620 > 93 96 Sr 0.98611524061234 0.50000957518598 0.69744124444260 87.620 > 93 97 Sr 0.34430450030164 0.42147906867535 0.92426934752114 87.620 > 97 98 Sr 0.84430450030164 0.42147906867535 0.92426934752114 87.620 > 97 99 Sr 0.34430450030164 0.92147906867535 0.92426934752114 87.620 > 97 100 Sr 0.84430450030164 0.92147906867535 0.92426934752114 87.620 > 97 101 Sr 0.15569549969836 0.17147906867535 0.57573065247886 87.620 > 101 102 Sr 0.65569549969836 0.17147906867535 0.57573065247886 87.620 > 101 103 Sr 0.15569549969836 0.67147906867535 0.57573065247886 87.620 > 101 104 Sr 0.65569549969836 0.67147906867535 0.57573065247886 87.620 > 101 105 Sr 0.15569549969836 0.07852093132465 0.07573065247886 87.620 > 105 106 Sr 0.65569549969836 0.07852093132465 0.07573065247886 87.620 > 105 107 Sr 0.15569549969836 0.57852093132465 0.07573065247886 87.620 > 105 108 Sr 0.65569549969836 0.57852093132465 0.07573065247886 87.620 > 105 109 Sr 0.34430450030164 0.32852093132465 0.42426934752114 87.620 > 109 110 Sr 0.84430450030164 0.32852093132465 0.42426934752114 87.620 > 109 111 Sr 0.34430450030164 0.82852093132465 0.42426934752114 87.620 > 109 112 Sr 0.84430450030164 0.82852093132465 0.42426934752114 87.620 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.3049229 0.0000000 0.0102065 0.0000000 3.3855046 0.0000000 0.0102062 0.0000000 3.2736386 -------------------------- Born effective charges -------------------------- 1 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 2 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 3 O -2.2186616 -0.1367584 -0.3965257 -0.1007707 -1.6961001 -0.1145666 -0.4474178 -0.0754503 -1.9842661 4 O -2.2186616 0.1367584 -0.3965257 0.1007707 -1.6961001 0.1145666 -0.4474178 0.0754503 -1.9842661 5 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 6 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 7 O -2.2626784 0.2694152 0.2504566 0.2478038 -1.9245139 -0.1269100 0.2656389 -0.1303824 -1.7238915 8 O -2.2626784 -0.2694152 0.2504566 -0.2478038 -1.9245139 0.1269100 0.2656389 0.1303824 -1.7238915 9 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 10 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 11 O -1.8064755 -0.1034323 0.0991680 -0.1019049 -1.8655400 0.2753087 0.0458197 0.2560207 -2.2791157 12 O -1.8064755 0.1034323 0.0991680 0.1019049 -1.8655400 -0.2753087 0.0458197 -0.2560207 -2.2791157 13 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 14 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 15 O -1.5552566 0.1197472 0.0407680 0.1024344 -2.6795010 0.0881969 0.0467009 0.0841380 -1.6212187 16 O -1.5552566 -0.1197472 0.0407680 -0.1024344 -2.6795010 -0.0881969 0.0467009 -0.0841380 -1.6212187 17 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 18 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 19 Si 2.9116054 -0.0040825 0.0460808 0.0020885 2.9044609 0.0002873 0.0988705 0.0236142 2.6148866 20 Si 2.9116054 0.0040825 0.0460808 -0.0020885 2.9044609 -0.0002873 0.0988705 -0.0236142 2.6148866 21 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 22 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 23 Sr 2.4488900 -0.0210114 -0.0596736 0.0216683 2.4750446 -0.0480612 -0.0195243 -0.0888019 2.6420141 24 Sr 2.4488900 0.0210114 -0.0596736 -0.0216683 2.4750446 0.0480612 -0.0195243 0.0888019 2.6420141 25 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 26 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 27 Sr 2.4825768 0.0448956 0.0197257 0.0218820 2.7861494 0.0128947 0.0099122 0.0435962 2.3515913 28 Sr 2.4825768 -0.0448956 0.0197257 -0.0218820 2.7861494 -0.0128947 0.0099122 -0.0435962 2.3515913 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (yyy) 0.00000001 (yyy) 0.00000001 (yyy) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 7 5 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.57, Number of G-points: 303, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/104) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.071 ( 0.000 0.000 0.000) 0.000 2.216 ( 0.000 0.000 0.000) 0.000 2.403 ( 0.000 0.000 0.000) 0.000 2.538 ( 0.000 0.000 0.000) 0.000 2.884 ( 0.000 0.000 0.000) 0.000 3.074 ( 0.000 0.000 0.000) 0.000 3.080 ( 0.000 0.000 0.000) 0.000 3.181 ( 0.000 0.000 0.000) 0.000 3.390 ( 0.000 0.000 0.000) 0.000 3.514 ( 0.000 0.000 0.000) 0.000 3.638 ( 0.000 0.000 0.000) 0.000 3.659 ( 0.000 0.000 0.000) 0.000 3.878 ( 0.000 0.000 0.000) 0.000 3.894 ( 0.000 0.000 0.000) 0.000 4.000 ( 0.000 0.000 0.000) 0.000 4.101 ( 0.000 0.000 0.000) 0.000 4.183 ( 0.000 0.000 0.000) 0.000 4.283 ( 0.000 0.000 0.000) 0.000 4.308 ( 0.000 0.000 0.000) 0.000 4.386 ( 0.000 0.000 0.000) 0.000 4.742 ( 0.000 0.000 0.000) 0.000 4.777 ( 0.000 0.000 0.000) 0.000 4.987 ( 0.000 0.000 0.000) 0.000 5.008 ( 0.000 0.000 0.000) 0.000 5.119 ( 0.000 0.000 0.000) 0.000 5.240 ( 0.000 0.000 0.000) 0.000 5.519 ( 0.000 0.000 0.000) 0.000 5.575 ( 0.000 0.000 0.000) 0.000 5.579 ( 0.000 0.000 0.000) 0.000 5.787 ( 0.000 0.000 0.000) 0.000 6.041 ( 0.000 0.000 0.000) 0.000 6.065 ( 0.000 0.000 0.000) 0.000 6.139 ( 0.000 0.000 0.000) 0.000 6.140 ( 0.000 0.000 0.000) 0.000 6.198 ( 0.000 0.000 0.000) 0.000 6.310 ( 0.000 0.000 0.000) 0.000 6.548 ( 0.000 0.000 0.000) 0.000 6.690 ( 0.000 0.000 0.000) 0.000 6.850 ( 0.000 0.000 0.000) 0.000 6.887 ( 0.000 0.000 0.000) 0.000 6.961 ( 0.000 0.000 0.000) 0.000 7.217 ( 0.000 0.000 0.000) 0.000 7.401 ( 0.000 0.000 0.000) 0.000 7.553 ( 0.000 0.000 0.000) 0.000 7.620 ( 0.000 0.000 0.000) 0.000 10.136 ( 0.000 0.000 0.000) 0.000 10.338 ( 0.000 0.000 0.000) 0.000 10.423 ( 0.000 0.000 0.000) 0.000 10.675 ( 0.000 0.000 0.000) 0.000 10.899 ( 0.000 0.000 0.000) 0.000 11.273 ( 0.000 0.000 0.000) 0.000 11.348 ( 0.000 0.000 0.000) 0.000 11.718 ( 0.000 0.000 0.000) 0.000 13.986 ( 0.000 0.000 0.000) 0.000 14.004 ( 0.000 0.000 0.000) 0.000 14.280 ( 0.000 0.000 0.000) 0.000 14.298 ( 0.000 0.000 0.000) 0.000 14.431 ( 0.000 0.000 0.000) 0.000 14.466 ( 0.000 0.000 0.000) 0.000 14.687 ( 0.000 0.000 0.000) 0.000 14.709 ( 0.000 0.000 0.000) 0.000 14.854 ( 0.000 0.000 0.000) 0.000 14.966 ( 0.000 0.000 0.000) 0.000 15.277 ( 0.000 0.000 0.000) 0.000 15.587 ( 0.000 0.000 0.000) 0.000 24.379 ( 0.000 0.000 0.000) 0.000 24.392 ( 0.000 0.000 0.000) 0.000 24.438 ( 0.000 0.000 0.000) 0.000 24.573 ( 0.000 0.000 0.000) 0.000 25.197 ( 0.000 0.000 0.000) 0.000 25.490 ( 0.000 0.000 0.000) 0.000 25.619 ( 0.000 0.000 0.000) 0.000 26.129 ( 0.000 0.000 0.000) 0.000 26.474 ( 0.000 0.000 0.000) 0.000 26.514 ( 0.000 0.000 0.000) 0.000 26.651 ( 0.000 0.000 0.000) 0.000 27.599 ( 0.000 0.000 0.000) 0.000 27.894 ( 0.000 0.000 0.000) 0.000 27.949 ( 0.000 0.000 0.000) 0.000 28.310 ( 0.000 0.000 0.000) 0.000 28.437 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/104) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.615 ( 25.656 0.000 14.809) 29.623 0.650 ( 29.267 0.000 12.728) 31.915 1.003 ( 40.925 0.000 22.200) 46.559 2.024 ( 6.924 0.000 -9.046) 11.392 2.379 ( 5.032 0.000 -11.113) 12.199 2.433 ( 6.877 0.000 11.985) 13.818 2.643 ( -0.131 0.000 11.790) 11.791 2.767 ( -13.516 0.000 9.634) 16.599 3.009 ( -7.364 0.000 1.665) 7.550 3.156 ( 8.584 0.000 -6.413) 10.715 3.227 ( 4.267 0.000 2.034) 4.727 3.435 ( 2.174 0.000 3.623) 4.225 3.468 ( -4.954 0.000 -0.928) 5.040 3.611 ( -3.047 0.000 -1.158) 3.260 3.690 ( 2.610 0.000 0.410) 2.642 3.789 ( -8.836 0.000 -2.535) 9.192 3.859 ( -1.294 0.000 -1.545) 2.016 3.959 ( -9.138 0.000 -0.378) 9.146 4.005 ( -1.943 0.000 1.771) 2.629 4.237 ( 0.962 0.000 1.239) 1.569 4.325 ( 2.020 0.000 -2.761) 3.421 4.354 ( 5.182 0.000 0.224) 5.187 4.516 ( -7.804 0.000 -5.513) 9.555 4.800 ( 9.496 0.000 -6.685) 11.613 4.930 ( -2.137 0.000 -0.782) 2.276 4.977 ( 8.856 0.000 -3.753) 9.618 4.999 ( -2.846 0.000 -1.698) 3.315 5.248 ( 14.586 0.000 -1.369) 14.651 5.284 ( -0.887 0.000 4.700) 4.783 5.567 ( 0.617 0.000 -1.573) 1.690 5.567 ( 3.497 0.000 3.197) 4.738 5.846 ( 7.320 0.000 -3.647) 8.178 5.951 ( 2.102 0.000 -5.513) 5.900 5.960 ( -6.366 0.000 -4.709) 7.919 6.100 ( 0.121 0.000 -3.278) 3.281 6.154 ( 8.034 0.000 -5.056) 9.493 6.233 ( 3.713 0.000 -2.864) 4.690 6.246 ( 4.838 0.000 9.068) 10.278 6.577 ( 0.923 0.000 3.237) 3.366 6.769 ( 8.151 0.000 -2.248) 8.456 6.825 ( 1.694 0.000 -0.478) 1.760 6.838 ( -3.084 0.000 -1.808) 3.575 6.970 ( -0.786 0.000 3.625) 3.709 7.204 ( -0.995 0.000 -1.507) 1.806 7.409 ( 0.832 0.000 -0.377) 0.913 7.422 ( -10.638 0.000 -4.052) 11.383 7.631 ( -6.180 0.000 12.393) 13.849 8.890 ( -11.933 0.000 2.681) 12.231 10.130 ( -0.594 0.000 -0.014) 0.595 10.396 ( 2.561 0.000 0.893) 2.712 10.423 ( -3.136 0.000 0.554) 3.185 10.672 ( 3.473 0.000 -3.058) 4.628 10.925 ( -0.524 0.000 5.470) 5.495 11.167 ( -8.080 0.000 -4.567) 9.281 11.362 ( 2.452 0.000 -0.719) 2.555 11.779 ( 4.690 0.000 1.088) 4.815 13.940 ( -2.233 0.000 -8.412) 8.703 13.982 ( -2.979 0.000 2.166) 3.683 14.358 ( 5.056 0.000 3.701) 6.266 14.455 ( -0.310 0.000 1.587) 1.617 14.524 ( 8.875 0.000 -2.474) 9.214 14.666 ( -2.037 0.000 1.254) 2.392 14.708 ( 0.344 0.000 -0.843) 0.911 14.883 ( 3.217 0.000 -1.546) 3.569 14.955 ( -5.220 0.000 4.560) 6.931 15.005 ( 6.569 0.000 -5.348) 8.471 15.301 ( -0.560 0.000 5.311) 5.341 15.562 ( -2.640 0.000 -0.376) 2.667 24.376 ( -1.240 0.000 0.991) 1.588 24.390 ( -0.023 0.000 -0.341) 0.342 24.438 ( -0.196 0.000 0.375) 0.424 24.566 ( -0.883 0.000 0.237) 0.914 25.184 ( -1.926 0.000 1.169) 2.253 25.509 ( 4.159 0.000 -5.990) 7.292 25.619 ( -0.048 0.000 -0.200) 0.205 26.184 ( 2.887 0.000 4.410) 5.272 26.551 ( 3.919 0.000 0.247) 3.927 26.624 ( -1.827 0.000 -1.271) 2.226 27.596 ( 0.988 0.000 -2.088) 2.310 27.890 ( -0.277 0.000 0.041) 0.280 27.909 ( -1.179 0.000 -2.190) 2.487 27.952 ( -0.368 0.000 -0.177) 0.409 28.409 ( -1.702 0.000 -2.651) 3.151 29.137 ( -0.239 0.000 0.965) 0.994 ======================= Grid point 2 (3/104) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( 21.281 0.000 10.110) 23.560 1.246 ( 25.138 0.000 10.537) 27.257 1.773 ( 24.466 0.000 15.755) 29.100 2.125 ( 8.156 0.000 -2.575) 8.553 2.414 ( 10.086 0.000 -9.178) 13.637 2.550 ( -2.750 0.000 3.757) 4.656 2.623 ( -11.836 0.000 8.560) 14.607 2.735 ( -0.651 0.000 7.740) 7.767 2.926 ( -4.383 0.000 4.474) 6.264 3.208 ( -1.956 0.000 -1.078) 2.233 3.321 ( -7.300 0.000 -2.671) 7.773 3.333 ( 3.087 0.000 2.955) 4.274 3.437 ( -11.318 0.000 -5.296) 12.496 3.491 ( -1.133 0.000 2.634) 2.868 3.669 ( -0.370 0.000 3.268) 3.289 3.720 ( -0.495 0.000 -1.156) 1.258 3.801 ( -4.201 0.000 -6.867) 8.050 3.889 ( -1.095 0.000 4.735) 4.860 3.972 ( -0.036 0.000 1.375) 1.376 4.223 ( -4.214 0.000 0.614) 4.258 4.297 ( 3.505 0.000 -8.389) 9.091 4.434 ( 2.075 0.000 -5.717) 6.083 4.443 ( 6.385 0.000 -1.606) 6.584 4.887 ( -1.385 0.000 0.662) 1.536 4.897 ( 6.040 0.000 -3.575) 7.018 4.974 ( -0.125 0.000 1.139) 1.145 5.130 ( 14.194 0.000 -6.506) 15.614 5.236 ( -6.667 0.000 1.367) 6.806 5.489 ( 10.320 0.000 -3.949) 11.050 5.591 ( 2.627 0.000 1.845) 3.210 5.677 ( 5.101 0.000 -2.887) 5.862 5.806 ( -3.411 0.000 -3.445) 4.848 5.907 ( 7.913 0.000 -0.375) 7.922 6.123 ( 14.951 0.000 1.397) 15.016 6.133 ( 9.027 0.000 -3.534) 9.694 6.262 ( 3.206 0.000 -3.525) 4.765 6.275 ( 8.082 0.000 -0.352) 8.090 6.426 ( 7.793 0.000 5.686) 9.647 6.617 ( -1.721 0.000 6.267) 6.499 6.722 ( -5.464 0.000 -3.606) 6.546 6.845 ( 0.792 0.000 -0.684) 1.046 6.920 ( 9.048 0.000 -5.490) 10.584 7.007 ( 0.213 0.000 5.584) 5.589 7.118 ( -7.789 0.000 -4.338) 8.916 7.211 ( -4.484 0.000 -3.092) 5.446 7.409 ( -0.653 0.000 -0.841) 1.065 7.638 ( -8.819 0.000 18.915) 20.870 8.632 ( -16.051 0.000 -3.845) 16.505 10.121 ( -0.522 0.000 0.550) 0.758 10.293 ( -8.039 0.000 -4.269) 9.103 10.459 ( 2.430 0.000 1.946) 3.113 10.739 ( 5.477 0.000 -3.399) 6.446 10.949 ( -5.686 0.000 9.739) 11.277 10.955 ( -9.178 0.000 -6.044) 10.990 11.454 ( 9.251 0.000 -0.525) 9.266 11.867 ( 4.432 0.000 -0.365) 4.447 13.823 ( -3.646 0.000 -4.627) 5.891 13.959 ( -2.085 0.000 3.354) 3.949 14.456 ( -1.281 0.000 1.617) 2.063 14.485 ( 4.188 0.000 4.920) 6.461 14.611 ( 0.017 0.000 0.873) 0.873 14.710 ( 1.910 0.000 -2.479) 3.129 14.735 ( 10.455 0.000 -0.364) 10.461 14.897 ( -2.867 0.000 -0.775) 2.970 14.914 ( 2.554 0.000 -3.524) 4.352 15.096 ( 6.970 0.000 -1.731) 7.182 15.339 ( -1.400 0.000 6.002) 6.163 15.492 ( -4.481 0.000 -0.703) 4.536 24.360 ( -1.111 0.000 0.071) 1.113 24.384 ( -0.097 0.000 -0.711) 0.718 24.437 ( -0.415 0.000 0.377) 0.561 24.551 ( -1.149 0.000 0.661) 1.326 25.159 ( -2.249 0.000 1.847) 2.910 25.526 ( 2.175 0.000 -2.700) 3.467 25.611 ( -0.496 0.000 -0.636) 0.806 26.231 ( -5.420 0.000 5.420) 7.665 26.617 ( 4.664 0.000 -2.052) 5.096 26.650 ( 6.670 0.000 0.406) 6.682 27.613 ( 3.741 0.000 -1.998) 4.241 27.863 ( -1.991 0.000 -1.436) 2.455 27.890 ( -0.415 0.000 1.412) 1.471 27.927 ( -2.004 0.000 -0.533) 2.073 28.337 ( -2.080 0.000 -4.973) 5.390 29.144 ( 0.011 0.000 0.855) 0.855 ======================= Grid point 3 (4/104) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( 12.941 0.000 1.639) 13.044 1.666 ( 11.227 0.000 3.322) 11.708 2.159 ( 9.152 0.000 6.768) 11.383 2.217 ( -1.528 0.000 4.105) 4.380 2.353 ( -6.107 0.000 -8.225) 10.244 2.553 ( 9.454 0.000 -1.133) 9.522 2.596 ( -6.725 0.000 8.940) 11.187 2.748 ( -0.786 0.000 1.862) 2.021 2.914 ( -1.865 0.000 2.003) 2.737 3.041 ( -8.106 0.000 -3.008) 8.646 3.161 ( -8.445 0.000 -6.810) 10.849 3.202 ( -10.746 0.000 8.065) 13.436 3.449 ( 5.720 0.000 -2.199) 6.128 3.455 ( -3.160 0.000 2.588) 4.084 3.616 ( -8.259 0.000 -3.763) 9.076 3.715 ( 0.652 0.000 1.121) 1.297 3.771 ( 5.030 0.000 4.430) 6.703 3.965 ( 0.384 0.000 3.425) 3.446 4.006 ( 1.609 0.000 -0.766) 1.783 4.129 ( -4.013 0.000 0.327) 4.027 4.293 ( 2.179 0.000 -8.139) 8.425 4.441 ( 5.650 0.000 -6.330) 8.485 4.548 ( 5.778 0.000 -0.374) 5.790 4.861 ( -0.921 0.000 -3.692) 3.805 4.941 ( 1.358 0.000 -1.490) 2.016 4.981 ( -0.393 0.000 1.070) 1.140 5.151 ( -2.471 0.000 1.090) 2.701 5.357 ( 16.399 0.000 -3.641) 16.799 5.521 ( 1.043 0.000 -4.827) 4.938 5.641 ( 0.023 0.000 3.711) 3.711 5.676 ( 3.478 0.000 -8.441) 9.129 5.826 ( 4.560 0.000 -0.096) 4.561 6.141 ( 10.511 0.000 8.433) 13.475 6.286 ( 3.245 0.000 -4.607) 5.635 6.380 ( 17.869 0.000 0.112) 17.870 6.390 ( 13.219 0.000 -2.240) 13.407 6.430 ( 9.612 0.000 2.146) 9.848 6.533 ( -9.761 0.000 -1.903) 9.945 6.634 ( 10.288 0.000 3.528) 10.876 6.663 ( 0.541 0.000 5.657) 5.683 6.848 ( 0.782 0.000 0.868) 1.168 6.931 ( -3.947 0.000 -9.183) 9.995 6.989 ( 1.888 0.000 1.245) 2.262 7.069 ( 0.903 0.000 4.468) 4.558 7.186 ( 1.791 0.000 -1.589) 2.394 7.358 ( -4.143 0.000 -1.322) 4.349 7.670 ( -7.313 0.000 16.568) 18.110 8.276 ( -18.294 0.000 -6.091) 19.282 10.109 ( -6.665 0.000 -5.520) 8.654 10.127 ( 0.276 0.000 1.358) 1.386 10.472 ( -3.704 0.000 0.213) 3.710 10.773 ( 2.319 0.000 -3.919) 4.554 10.787 ( -2.803 0.000 -3.781) 4.706 10.896 ( -8.597 0.000 7.082) 11.139 11.657 ( 11.604 0.000 1.837) 11.748 11.923 ( 2.990 0.000 -1.537) 3.362 13.734 ( -2.667 0.000 -2.499) 3.655 13.978 ( 0.278 0.000 4.331) 4.340 14.435 ( -2.586 0.000 0.952) 2.756 14.572 ( 0.711 0.000 3.583) 3.653 14.623 ( 0.204 0.000 2.216) 2.226 14.743 ( 4.630 0.000 -3.532) 5.823 14.855 ( -1.058 0.000 0.531) 1.184 14.899 ( 0.640 0.000 -4.897) 4.939 14.923 ( 9.582 0.000 -0.493) 9.595 15.200 ( 5.523 0.000 -0.750) 5.574 15.357 ( -1.996 0.000 4.576) 4.993 15.401 ( -4.694 0.000 -0.810) 4.763 24.341 ( -0.930 0.000 -0.103) 0.935 24.375 ( -0.122 0.000 -0.797) 0.807 24.430 ( -0.560 0.000 0.180) 0.589 24.540 ( -0.836 0.000 0.901) 1.229 25.143 ( -1.521 0.000 1.857) 2.401 25.533 ( 0.739 0.000 -1.428) 1.608 25.589 ( -0.924 0.000 -1.173) 1.493 26.099 ( -10.924 0.000 1.486) 11.025 26.727 ( 7.338 0.000 -1.016) 7.408 26.781 ( 7.293 0.000 0.485) 7.309 27.697 ( 5.814 0.000 0.954) 5.892 27.816 ( -1.971 0.000 -0.755) 2.111 27.874 ( -2.996 0.000 -1.069) 3.181 27.905 ( -0.394 0.000 3.694) 3.715 28.254 ( -0.961 0.000 -6.715) 6.784 29.152 ( 0.099 0.000 0.742) 0.749 ======================= Grid point 4 (5/104) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -12.630 0.000 -9.903) 16.049 1.628 ( 2.182 0.000 -4.040) 4.591 2.005 ( -13.435 0.000 -1.834) 13.560 2.265 ( 2.619 0.000 -2.592) 3.685 2.467 ( 14.531 0.000 -3.385) 14.920 2.576 ( -4.646 0.000 11.974) 12.844 2.681 ( 0.942 0.000 10.723) 10.764 2.817 ( 0.729 0.000 1.841) 1.980 2.892 ( -3.621 0.000 -8.543) 9.279 2.910 ( 8.218 0.000 -5.415) 9.841 3.045 ( -1.114 0.000 2.088) 2.366 3.167 ( -7.295 0.000 11.314) 13.462 3.427 ( -8.520 0.000 -3.734) 9.302 3.446 ( 2.658 0.000 2.356) 3.552 3.563 ( 7.869 0.000 -0.556) 7.889 3.741 ( -0.701 0.000 2.166) 2.277 3.846 ( -5.925 0.000 -4.239) 7.285 3.888 ( 0.252 0.000 3.767) 3.776 4.012 ( 0.267 0.000 -0.694) 0.744 4.088 ( -5.597 0.000 -0.507) 5.620 4.232 ( -0.613 0.000 -4.869) 4.908 4.490 ( 4.410 0.000 -4.393) 6.225 4.615 ( 1.901 0.000 -0.451) 1.954 4.811 ( -0.818 0.000 -1.758) 1.939 4.940 ( 0.045 0.000 0.899) 0.900 5.006 ( 1.728 0.000 0.879) 1.938 5.158 ( 0.847 0.000 1.130) 1.412 5.462 ( -0.630 0.000 -4.067) 4.116 5.605 ( 11.844 0.000 -4.289) 12.597 5.672 ( 0.223 0.000 2.561) 2.571 5.689 ( 4.702 0.000 -4.619) 6.591 5.889 ( 1.478 0.000 1.133) 1.863 6.240 ( -5.276 0.000 0.277) 5.284 6.352 ( 5.649 0.000 4.727) 7.366 6.391 ( 0.055 0.000 -5.205) 5.205 6.548 ( 6.410 0.000 0.460) 6.426 6.626 ( 3.617 0.000 3.520) 5.048 6.635 ( 9.610 0.000 1.088) 9.671 6.761 ( 3.425 0.000 1.039) 3.579 6.774 ( -0.482 0.000 -5.363) 5.385 6.882 ( 14.720 0.000 2.151) 14.877 6.979 ( 11.368 0.000 0.538) 11.381 7.078 ( 4.084 0.000 6.042) 7.293 7.100 ( -1.583 0.000 3.013) 3.404 7.200 ( 0.854 0.000 -1.324) 1.575 7.243 ( -7.200 0.000 -0.920) 7.259 7.632 ( -10.510 0.000 7.355) 12.828 7.913 ( -15.342 0.000 -5.132) 16.178 9.981 ( -2.808 0.000 -3.462) 4.458 10.157 ( 1.418 0.000 2.033) 2.479 10.349 ( -6.817 0.000 -2.626) 7.306 10.761 ( 0.195 0.000 -2.560) 2.567 10.776 ( 1.576 0.000 -0.344) 1.613 10.805 ( -6.189 0.000 3.079) 6.912 11.849 ( 7.267 0.000 1.840) 7.496 11.949 ( 1.539 0.000 -1.339) 2.040 13.683 ( -1.334 0.000 -1.043) 1.693 14.047 ( 2.485 0.000 4.467) 5.112 14.380 ( -3.562 0.000 -0.866) 3.665 14.590 ( -0.488 0.000 1.270) 1.361 14.658 ( 0.893 0.000 2.790) 2.930 14.762 ( 1.086 0.000 -2.885) 3.083 14.841 ( -0.774 0.000 -5.697) 5.749 14.896 ( 3.142 0.000 2.177) 3.823 15.061 ( 5.313 0.000 0.721) 5.362 15.255 ( 1.169 0.000 -0.626) 1.326 15.323 ( -3.061 0.000 -0.712) 3.143 15.366 ( -0.367 0.000 2.416) 2.443 24.327 ( -0.529 0.000 -0.071) 0.534 24.367 ( -0.033 0.000 -0.467) 0.468 24.422 ( -0.423 0.000 0.033) 0.424 24.537 ( -0.401 0.000 0.616) 0.735 25.138 ( -0.648 0.000 1.173) 1.340 25.529 ( 0.023 0.000 -0.662) 0.662 25.563 ( -0.658 0.000 -1.065) 1.252 25.934 ( -7.306 0.000 -0.249) 7.310 26.820 ( 3.952 0.000 -0.889) 4.051 26.899 ( 5.058 0.000 0.394) 5.073 27.783 ( -1.403 0.000 0.179) 1.415 27.794 ( 2.798 0.000 1.195) 3.043 27.812 ( -2.338 0.000 -1.391) 2.720 27.956 ( 0.928 0.000 6.467) 6.533 28.183 ( 0.231 0.000 -7.129) 7.133 29.160 ( 0.082 0.000 0.442) 0.450 ======================= Grid point 5 (6/104) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 52 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( 0.000 0.000 0.000) 0.000 1.610 ( 0.000 0.000 0.000) 0.000 1.861 ( 0.000 0.000 0.000) 0.000 2.270 ( 0.000 0.000 0.000) 0.000 2.582 ( 0.000 0.000 -0.000) 0.000 2.629 ( 0.000 0.000 0.000) 0.000 2.757 ( 0.000 0.000 0.000) 0.000 2.805 ( 0.000 0.000 -0.000) 0.000 2.813 ( 0.000 0.000 0.000) 0.000 3.015 ( 0.000 0.000 0.000) 0.000 3.064 ( 0.000 0.000 0.000) 0.000 3.119 ( 0.000 0.000 -0.000) 0.000 3.309 ( 0.000 0.000 -0.000) 0.000 3.535 ( -0.000 0.000 -0.000) 0.000 3.687 ( 0.000 0.000 0.000) 0.000 3.703 ( -0.000 0.000 -0.000) 0.000 3.739 ( 0.000 0.000 -0.000) 0.000 3.930 ( 0.000 0.000 0.000) 0.000 3.970 ( 0.000 0.000 0.000) 0.000 4.010 ( 0.000 0.000 0.000) 0.000 4.204 ( 0.000 0.000 0.000) 0.000 4.506 ( 0.000 0.000 0.000) 0.000 4.624 ( 0.000 0.000 0.000) 0.000 4.801 ( 0.000 0.000 0.000) 0.000 4.947 ( 0.000 0.000 0.000) 0.000 5.031 ( 0.000 0.000 0.000) 0.000 5.174 ( 0.000 0.000 0.000) 0.000 5.432 ( 0.000 0.000 0.000) 0.000 5.668 ( -0.000 0.000 0.000) 0.000 5.704 ( 0.000 0.000 -0.000) 0.000 5.719 ( 0.000 0.000 0.000) 0.000 5.904 ( 0.000 0.000 -0.000) 0.000 6.199 ( 0.000 0.000 0.000) 0.000 6.365 ( 0.000 0.000 0.000) 0.000 6.425 ( 0.000 0.000 0.000) 0.000 6.600 ( 0.000 0.000 0.000) 0.000 6.679 ( 0.000 0.000 -0.000) 0.000 6.716 ( 0.000 0.000 0.000) 0.000 6.724 ( -0.000 0.000 0.000) 0.000 6.854 ( 0.000 0.000 0.000) 0.000 7.069 ( 0.000 0.000 0.000) 0.000 7.079 ( -0.000 0.000 0.000) 0.000 7.084 ( 0.000 0.000 -0.000) 0.000 7.169 ( 0.000 0.000 0.000) 0.000 7.196 ( -0.000 0.000 0.000) 0.000 7.217 ( 0.000 0.000 -0.000) 0.000 7.500 ( 0.000 0.000 0.000) 0.000 7.727 ( 0.000 0.000 0.000) 0.000 9.943 ( 0.000 0.000 -0.000) 0.000 10.210 ( -0.000 0.000 -0.000) 0.000 10.240 ( 0.000 0.000 0.000) 0.000 10.746 ( 0.000 0.000 0.000) 0.000 10.763 ( 0.000 0.000 0.000) 0.000 10.792 ( 0.000 0.000 -0.000) 0.000 11.925 ( 0.000 0.000 0.000) 0.000 11.956 ( 0.000 0.000 0.000) 0.000 13.666 ( 0.000 0.000 0.000) 0.000 14.107 ( 0.000 0.000 0.000) 0.000 14.328 ( 0.000 0.000 0.000) 0.000 14.591 ( 0.000 0.000 0.000) 0.000 14.687 ( 0.000 0.000 -0.000) 0.000 14.756 ( 0.000 0.000 0.000) 0.000 14.797 ( 0.000 0.000 0.000) 0.000 14.943 ( 0.000 0.000 0.000) 0.000 15.114 ( 0.000 0.000 0.000) 0.000 15.254 ( 0.000 0.000 0.000) 0.000 15.290 ( 0.000 0.000 0.000) 0.000 15.378 ( 0.000 0.000 0.000) 0.000 24.322 ( 0.000 0.000 0.000) 0.000 24.365 ( 0.000 0.000 0.000) 0.000 24.418 ( 0.000 0.000 0.000) 0.000 24.536 ( 0.000 0.000 0.000) 0.000 25.138 ( 0.000 0.000 0.000) 0.000 25.525 ( 0.000 0.000 0.000) 0.000 25.551 ( 0.000 0.000 0.000) 0.000 25.864 ( 0.000 0.000 0.000) 0.000 26.850 ( 0.000 0.000 -0.000) 0.000 26.948 ( 0.000 0.000 0.000) 0.000 27.773 ( 0.000 0.000 0.000) 0.000 27.781 ( 0.000 0.000 0.000) 0.000 27.819 ( 0.000 0.000 0.000) 0.000 28.012 ( 0.000 0.000 0.000) 0.000 28.143 ( 0.000 0.000 0.000) 0.000 29.163 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/104) ======================= q-point: ( 0.00 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.628 ( 0.000 31.075 0.000) 31.075 0.697 ( 0.000 33.766 0.000) 33.766 1.278 ( 0.000 60.829 0.000) 60.829 2.090 ( 0.000 1.917 0.000) 1.917 2.152 ( 0.000 -3.818 0.000) 3.818 2.526 ( 0.000 8.922 0.000) 8.922 2.793 ( 0.000 21.830 0.000) 21.830 2.879 ( 0.000 -1.283 0.000) 1.283 3.037 ( 0.000 -4.143 0.000) 4.143 3.071 ( 0.000 0.196 0.000) 0.196 3.183 ( 0.000 0.866 0.000) 0.866 3.406 ( 0.000 1.336 0.000) 1.336 3.510 ( 0.000 -0.145 0.000) 0.145 3.707 ( 0.000 0.926 0.000) 0.926 3.762 ( 0.000 6.560 0.000) 6.560 3.787 ( 0.000 -2.992 0.000) 2.992 3.994 ( 0.000 10.333 0.000) 10.333 3.999 ( 0.000 -8.354 0.000) 8.354 4.123 ( 0.000 3.349 0.000) 3.349 4.196 ( 0.000 9.022 0.000) 9.022 4.296 ( 0.000 12.174 0.000) 12.174 4.316 ( 0.000 -7.559 0.000) 7.559 4.608 ( 0.000 -9.328 0.000) 9.328 4.631 ( 0.000 16.909 0.000) 16.909 4.769 ( 0.000 2.463 0.000) 2.463 5.009 ( 0.000 1.409 0.000) 1.409 5.144 ( 0.000 6.760 0.000) 6.760 5.218 ( 0.000 3.289 0.000) 3.289 5.297 ( 0.000 5.429 0.000) 5.429 5.361 ( 0.000 -5.468 0.000) 5.468 5.534 ( 0.000 -3.956 0.000) 3.956 5.768 ( 0.000 8.787 0.000) 8.787 5.802 ( 0.000 1.416 0.000) 1.416 5.987 ( 0.000 -5.710 0.000) 5.710 6.001 ( 0.000 -6.866 0.000) 6.866 6.104 ( 0.000 -4.507 0.000) 4.507 6.129 ( 0.000 -0.194 0.000) 0.194 6.282 ( 0.000 -5.439 0.000) 5.439 6.285 ( 0.000 -0.566 0.000) 0.566 6.570 ( 0.000 -8.871 0.000) 8.871 6.650 ( 0.000 -7.654 0.000) 7.654 6.922 ( 0.000 -3.523 0.000) 3.523 7.121 ( 0.000 10.702 0.000) 10.702 7.241 ( 0.000 1.980 0.000) 1.980 7.427 ( 0.000 2.137 0.000) 2.137 7.606 ( 0.000 5.815 0.000) 5.815 7.611 ( 0.000 -0.195 0.000) 0.195 9.509 ( 0.000 -11.241 0.000) 11.241 10.157 ( 0.000 1.588 0.000) 1.588 10.366 ( 0.000 2.545 0.000) 2.545 10.587 ( 0.000 1.642 0.000) 1.642 10.756 ( 0.000 7.584 0.000) 7.584 10.860 ( 0.000 -3.579 0.000) 3.579 11.263 ( 0.000 -0.664 0.000) 0.664 11.267 ( 0.000 -6.919 0.000) 6.919 11.754 ( 0.000 2.396 0.000) 2.396 13.969 ( 0.000 -1.555 0.000) 1.555 14.022 ( 0.000 0.878 0.000) 0.878 14.282 ( 0.000 0.218 0.000) 0.218 14.314 ( 0.000 1.366 0.000) 1.366 14.384 ( 0.000 -4.105 0.000) 4.105 14.641 ( 0.000 -5.124 0.000) 5.124 14.676 ( 0.000 -0.986 0.000) 0.986 14.708 ( 0.000 -0.785 0.000) 0.785 14.979 ( 0.000 1.282 0.000) 1.282 15.101 ( 0.000 -9.870 0.000) 9.870 15.411 ( 0.000 2.271 0.000) 2.271 15.498 ( 0.000 -8.232 0.000) 8.232 24.387 ( 0.000 0.716 0.000) 0.716 24.436 ( 0.000 0.002 0.000) 0.002 24.495 ( 0.000 2.072 0.000) 2.072 24.582 ( 0.000 0.769 0.000) 0.769 25.203 ( 0.000 0.624 0.000) 0.624 25.434 ( 0.000 -3.891 0.000) 3.891 25.698 ( 0.000 6.026 0.000) 6.026 26.136 ( 0.000 -0.766 0.000) 0.766 26.477 ( 0.000 0.390 0.000) 0.390 26.516 ( 0.000 0.142 0.000) 0.142 26.651 ( 0.000 0.140 0.000) 0.140 27.497 ( 0.000 -13.231 0.000) 13.231 28.077 ( 0.000 8.637 0.000) 8.637 28.359 ( 0.000 2.502 0.000) 2.502 28.543 ( 0.000 11.909 0.000) 11.909 29.982 ( 0.000 -4.373 0.000) 4.373 ======================= Grid point 12 (8/104) ======================= q-point: ( 0.10 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.889 ( 15.557 20.152 16.618) 30.403 0.908 ( 18.244 24.229 4.349) 30.640 1.626 ( 26.330 47.651 11.688) 55.682 2.045 ( 6.056 2.194 -5.738) 8.626 2.342 ( 7.152 -1.689 3.847) 8.294 2.564 ( 3.335 8.603 1.961) 9.433 2.771 ( -8.084 5.482 6.141) 11.538 2.823 ( -1.058 10.657 1.652) 10.836 2.968 ( -6.834 -3.613 1.818) 7.941 3.155 ( 7.487 0.045 -3.921) 8.452 3.248 ( 4.335 2.932 4.430) 6.856 3.404 ( -4.404 -1.708 -1.116) 4.854 3.468 ( 0.146 1.303 1.473) 1.972 3.705 ( -0.264 -0.260 -1.225) 1.280 3.726 ( -5.117 6.637 -1.126) 8.456 3.786 ( -0.262 -0.768 1.560) 1.759 3.952 ( -5.782 3.274 -2.264) 7.020 3.973 ( -3.475 4.481 1.144) 5.785 4.049 ( 1.097 -0.908 -2.131) 2.564 4.135 ( -5.103 4.419 0.062) 6.751 4.334 ( 1.526 8.571 -0.844) 8.747 4.488 ( 4.803 -7.767 1.038) 9.191 4.597 ( 6.170 7.741 -1.503) 10.012 4.702 ( 2.791 6.585 -6.498) 9.664 4.798 ( 4.526 -8.289 1.808) 9.616 4.998 ( -2.343 3.700 1.021) 4.497 5.096 ( -0.108 5.796 -4.178) 7.146 5.264 ( 8.234 0.288 -4.376) 9.329 5.323 ( 1.369 2.077 4.832) 5.435 5.474 ( 6.564 -0.966 5.515) 8.628 5.662 ( 3.959 -5.897 -3.965) 8.134 5.789 ( 4.726 4.077 -0.361) 6.253 5.872 ( 7.004 -0.340 2.495) 7.443 5.915 ( -4.416 -5.032 -5.210) 8.483 6.022 ( 4.608 -7.780 -2.533) 9.390 6.113 ( 2.133 -0.767 -1.824) 2.910 6.225 ( 7.142 -0.425 0.836) 7.203 6.225 ( 3.017 -4.119 -0.633) 5.145 6.437 ( 5.818 -5.373 5.673) 9.742 6.568 ( -0.162 -10.961 -0.720) 10.986 6.725 ( 7.563 -5.204 0.087) 9.181 6.928 ( 0.682 -2.597 -1.240) 2.958 7.080 ( -2.099 9.806 -1.227) 10.103 7.233 ( -0.936 1.571 -0.008) 1.829 7.372 ( -6.611 -0.029 -3.191) 7.341 7.534 ( -2.898 7.448 -2.003) 8.239 7.624 ( -6.993 0.239 13.697) 15.380 9.169 ( -21.850 4.535 -10.181) 24.529 10.109 ( -2.849 1.099 1.806) 3.548 10.407 ( 3.344 1.396 -0.486) 3.657 10.543 ( -3.619 7.574 1.928) 8.612 10.714 ( 0.695 3.889 -2.898) 4.900 10.894 ( -0.656 -3.263 3.064) 4.524 11.192 ( -5.360 2.226 -3.768) 6.920 11.364 ( 5.206 -2.587 2.615) 6.374 11.782 ( 2.277 -0.020 0.806) 2.415 13.919 ( -2.018 -1.455 -6.054) 6.545 14.014 ( -2.045 2.299 2.216) 3.792 14.296 ( 4.379 -5.611 -1.916) 7.371 14.372 ( 1.194 -2.357 6.130) 6.675 14.427 ( 3.242 -5.268 -0.472) 6.203 14.632 ( 0.474 -2.855 0.774) 2.996 14.708 ( 3.269 -2.016 -0.883) 3.940 14.731 ( 1.419 -2.666 -0.358) 3.041 14.993 ( 2.771 0.678 -2.995) 4.136 15.137 ( 0.401 -8.459 5.338) 10.010 15.276 ( -5.399 6.986 -4.218) 9.785 15.474 ( -2.641 -8.105 -0.205) 8.527 24.378 ( -0.729 0.573 -0.348) 0.991 24.412 ( -1.313 0.871 -0.483) 1.648 24.466 ( -1.201 2.454 0.047) 2.733 24.574 ( -0.881 0.746 0.222) 1.175 25.189 ( -1.633 0.632 0.830) 1.938 25.442 ( 1.752 -4.398 -2.036) 5.154 25.698 ( 0.127 5.869 -0.477) 5.889 26.166 ( 1.433 -1.714 3.869) 4.468 26.543 ( 2.611 -0.472 0.191) 2.661 26.641 ( 0.801 1.644 -1.323) 2.257 26.995 ( 25.713 -23.168 14.414) 37.492 27.514 ( 4.980 -12.064 -5.309) 14.090 28.048 ( -3.500 8.409 0.641) 9.131 28.326 ( -3.529 4.507 0.017) 5.724 28.508 ( -2.453 12.697 -2.393) 13.151 29.579 ( -20.962 16.012 -10.715) 28.471 ======================= Grid point 13 (9/104) ======================= q-point: ( 0.20 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( 18.753 13.557 4.554) 23.584 1.351 ( 17.604 9.988 16.085) 25.852 2.148 ( 6.926 3.665 -1.031) 7.904 2.172 ( 18.783 31.963 9.177) 38.192 2.442 ( 4.472 0.087 0.056) 4.473 2.587 ( -5.360 3.623 0.388) 6.481 2.686 ( -5.765 5.906 5.792) 10.083 2.852 ( 2.747 9.590 -1.951) 10.165 2.896 ( -3.293 -2.052 4.458) 5.910 3.202 ( -2.362 0.097 -2.750) 3.627 3.277 ( -5.827 -0.929 3.455) 6.838 3.377 ( 4.429 3.571 3.618) 6.743 3.498 ( -13.811 3.236 -4.504) 14.883 3.505 ( -0.990 1.694 0.926) 2.169 3.691 ( -0.341 1.315 1.415) 1.962 3.782 ( -1.626 3.757 0.335) 4.108 3.885 ( -2.013 4.963 -3.861) 6.602 3.926 ( -1.524 5.933 3.383) 6.998 4.075 ( 1.148 4.426 -0.470) 4.597 4.121 ( 7.937 -2.397 -1.581) 8.441 4.306 ( -3.603 10.136 -1.774) 10.903 4.495 ( 0.341 3.739 -4.377) 5.767 4.656 ( 4.461 11.115 -5.374) 13.127 4.747 ( 5.932 -10.570 0.300) 12.125 4.905 ( 4.806 -4.903 -0.041) 6.866 4.964 ( -1.341 4.159 0.623) 4.414 5.099 ( 3.767 4.383 -5.526) 7.997 5.363 ( 2.224 2.336 0.268) 3.237 5.396 ( 5.989 -3.582 -1.165) 7.075 5.588 ( 1.304 1.230 -3.532) 3.961 5.688 ( 7.048 -0.542 -2.012) 7.349 5.775 ( -3.560 -3.679 -2.555) 5.722 5.896 ( 6.772 -0.906 2.605) 7.312 6.083 ( 12.621 -5.303 -1.005) 13.726 6.098 ( 7.949 -6.401 -1.636) 10.336 6.180 ( 8.061 1.594 -2.094) 8.480 6.306 ( 6.091 -1.411 -0.539) 6.275 6.396 ( 8.107 -2.329 4.967) 9.788 6.554 ( -0.355 -5.208 2.898) 5.971 6.560 ( 2.307 -7.055 1.508) 7.574 6.860 ( 8.169 -4.672 -3.577) 10.067 6.909 ( -0.136 0.717 -3.124) 3.208 7.076 ( -0.525 4.782 2.276) 5.322 7.117 ( -9.325 0.608 -3.823) 10.097 7.260 ( -0.940 3.278 -0.589) 3.461 7.485 ( -2.006 6.656 -1.443) 7.100 7.625 ( -9.409 -0.469 19.385) 21.553 8.717 ( -19.866 2.933 -8.626) 21.856 10.091 ( -0.940 -0.119 0.476) 1.060 10.396 ( -6.598 5.839 -3.257) 9.393 10.485 ( -0.131 4.090 2.652) 4.876 10.783 ( 6.427 3.663 -1.787) 7.611 10.874 ( -4.932 -3.508 3.224) 6.858 11.033 ( -8.681 3.869 -1.776) 9.668 11.496 ( 9.084 2.552 0.494) 9.449 11.833 ( 2.981 -3.275 -0.523) 4.459 13.823 ( -2.863 0.285 -4.253) 5.135 14.001 ( -1.797 3.405 3.277) 5.056 14.373 ( 4.308 -10.354 0.234) 11.217 14.434 ( -0.172 -5.629 0.996) 5.719 14.467 ( 1.796 -4.124 4.309) 6.229 14.682 ( 2.575 -2.783 1.424) 4.050 14.738 ( -0.026 -4.492 -0.216) 4.498 14.781 ( 7.525 -1.021 -3.211) 8.245 14.999 ( 1.496 1.265 -4.202) 4.636 15.183 ( 2.333 0.891 -0.080) 2.499 15.233 ( -0.620 -4.040 3.931) 5.671 15.407 ( -4.221 -7.818 -0.666) 8.910 24.359 ( -1.030 0.202 -0.257) 1.081 24.396 ( -0.157 0.735 -0.625) 0.978 24.448 ( -1.079 1.267 0.130) 1.669 24.559 ( -1.085 0.702 0.545) 1.403 25.168 ( -2.037 0.864 1.764) 2.829 25.454 ( 1.278 -4.728 -1.347) 5.079 25.688 ( -0.739 5.323 -0.741) 5.425 26.185 ( -5.627 -3.955 4.716) 8.339 26.613 ( 6.476 0.341 -0.566) 6.509 26.683 ( 5.393 2.614 -1.411) 6.157 27.409 ( 11.944 -15.713 7.518) 21.120 27.579 ( 8.034 -10.222 -6.710) 14.631 27.978 ( -4.936 7.987 1.444) 9.499 28.248 ( -5.163 7.386 0.337) 9.018 28.423 ( -3.324 12.584 -4.340) 13.720 29.267 ( -8.308 8.661 -3.525) 12.508 ======================= Grid point 14 (10/104) ======================= q-point: ( 0.30 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 11.178 7.224 -0.806) 13.334 1.749 ( 10.684 6.737 11.097) 16.813 2.226 ( 0.659 2.799 0.537) 2.925 2.306 ( -10.957 6.167 -2.860) 12.895 2.428 ( 2.145 7.251 -3.166) 8.198 2.545 ( -0.247 -0.614 5.341) 5.382 2.709 ( 1.879 10.828 6.524) 12.780 2.856 ( 0.166 7.365 -6.184) 9.618 2.913 ( -0.550 2.331 2.717) 3.622 3.055 ( -5.601 3.686 -1.983) 6.992 3.182 ( -7.634 2.968 -0.891) 8.239 3.267 ( -7.818 3.454 4.221) 9.533 3.470 ( 4.560 2.744 -0.871) 5.393 3.503 ( -3.042 3.413 3.161) 5.558 3.679 ( -5.872 5.590 -4.595) 9.320 3.716 ( 1.342 1.100 1.897) 2.571 3.865 ( -0.263 5.260 2.463) 5.814 3.989 ( 3.712 6.826 4.010) 8.744 4.145 ( -0.110 3.071 -1.166) 3.287 4.202 ( -0.400 15.038 -1.351) 15.104 4.248 ( 6.756 -2.051 -2.315) 7.430 4.449 ( -0.616 3.999 -4.338) 5.932 4.720 ( 6.436 10.647 -4.507) 13.233 4.813 ( 0.565 -4.236 -2.081) 4.754 4.935 ( 2.535 -2.118 -2.549) 4.172 4.998 ( 1.887 -3.359 2.252) 4.463 5.077 ( -0.659 3.131 -2.423) 4.014 5.391 ( 2.524 -1.975 -0.596) 3.260 5.472 ( 4.707 -6.598 -1.372) 8.220 5.569 ( 3.324 3.399 -8.361) 9.618 5.733 ( 1.868 1.021 1.164) 2.426 5.830 ( 6.127 0.151 0.116) 6.130 6.096 ( 9.092 -3.809 4.990) 11.049 6.165 ( 5.049 -10.634 -2.989) 12.145 6.259 ( 3.721 -5.336 -1.611) 6.702 6.374 ( 13.732 -0.386 -1.343) 13.803 6.440 ( 9.141 -0.872 2.183) 9.438 6.572 ( 3.249 -0.783 -1.176) 3.543 6.601 ( 6.272 -4.344 7.701) 10.840 6.650 ( 7.633 -0.894 2.556) 8.099 6.877 ( -0.935 2.957 -1.035) 3.270 6.887 ( -0.976 -1.871 -7.636) 7.922 6.986 ( 1.968 -0.744 1.047) 2.350 7.110 ( -0.516 2.911 2.919) 4.154 7.248 ( 0.177 3.996 -1.243) 4.189 7.425 ( -4.132 5.993 -0.016) 7.280 7.662 ( -6.447 -0.331 16.990) 18.176 8.292 ( -19.398 -0.135 -8.165) 21.047 10.071 ( -1.357 0.203 -1.748) 2.222 10.242 ( -5.759 6.922 -1.610) 9.147 10.488 ( -3.757 1.690 1.154) 4.279 10.804 ( -1.902 1.777 -1.855) 3.197 10.832 ( 0.744 3.461 -3.839) 5.222 10.897 ( -6.630 1.865 4.254) 8.095 11.690 ( 10.806 2.474 1.686) 11.213 11.871 ( 2.493 -4.783 -1.611) 5.630 13.748 ( -2.121 1.552 -2.303) 3.494 14.022 ( 0.427 3.753 4.224) 5.666 14.400 ( -2.270 -3.335 0.850) 4.123 14.461 ( 3.286 -13.061 0.744) 13.488 14.537 ( 1.296 -3.348 3.207) 4.814 14.707 ( -0.020 -6.391 -1.370) 6.536 14.756 ( 2.345 -1.516 0.490) 2.835 14.881 ( 4.798 -2.903 -2.417) 6.106 14.993 ( 2.716 2.135 -2.450) 4.235 15.233 ( 3.165 0.938 -1.312) 3.553 15.259 ( -1.210 -6.994 3.920) 8.109 15.328 ( -3.222 -6.399 -0.517) 7.183 24.339 ( -0.923 0.053 -0.255) 0.959 24.390 ( 0.221 0.976 -0.791) 1.276 24.430 ( -1.173 0.317 0.254) 1.241 24.549 ( -0.772 0.624 0.702) 1.216 25.153 ( -1.476 1.019 1.809) 2.547 25.460 ( 0.601 -4.613 -0.869) 4.733 25.658 ( -1.557 4.326 -1.183) 4.747 26.064 ( -9.775 -3.156 1.466) 10.376 26.733 ( 6.454 0.962 -2.203) 6.887 26.800 ( 8.101 1.763 1.401) 8.409 27.627 ( 5.771 -6.959 -6.206) 10.966 27.655 ( 7.601 -8.223 6.539) 12.967 27.917 ( -3.574 8.105 2.241) 9.137 28.162 ( -4.916 8.181 0.924) 9.589 28.321 ( -2.711 10.571 -5.742) 12.331 29.160 ( -2.872 0.616 -0.511) 2.981 ======================= Grid point 15 (11/104) ======================= q-point: ( 0.40 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( 0.949 5.351 -3.469) 6.447 1.782 ( -8.656 14.635 -6.382) 18.161 2.034 ( -12.136 3.153 -1.978) 12.694 2.183 ( -1.823 -3.255 -4.129) 5.565 2.524 ( 7.656 0.479 4.315) 8.801 2.599 ( -0.292 2.463 6.823) 7.260 2.771 ( -0.936 -1.237 1.572) 2.209 2.797 ( 1.189 0.726 -2.810) 3.137 2.926 ( -1.276 10.623 5.260) 11.923 3.052 ( 1.469 6.645 -5.343) 8.652 3.093 ( 4.088 8.567 2.286) 9.764 3.289 ( 0.332 7.991 6.030) 10.017 3.432 ( -6.051 5.098 -0.991) 7.974 3.505 ( -2.745 3.053 0.928) 4.209 3.592 ( 4.529 1.862 -1.419) 5.098 3.755 ( 0.743 2.098 -0.188) 2.234 3.866 ( -4.164 0.533 4.151) 5.904 3.989 ( -3.720 11.622 -4.409) 12.975 4.103 ( 1.962 7.304 0.716) 7.596 4.203 ( -2.031 10.742 -2.115) 11.135 4.298 ( -1.571 6.613 -2.042) 7.097 4.435 ( 3.335 -0.970 -0.813) 3.567 4.748 ( 0.099 7.626 -1.592) 7.791 4.779 ( 0.841 -1.205 -4.370) 4.611 4.956 ( 1.163 0.538 -0.935) 1.587 5.025 ( -0.325 -0.115 2.706) 2.728 5.089 ( 1.701 -2.393 -0.315) 2.953 5.463 ( 5.085 -11.374 -0.270) 12.462 5.515 ( 0.432 1.337 -0.946) 1.694 5.591 ( 6.820 -0.782 -4.690) 8.313 5.786 ( 3.201 3.096 -0.388) 4.470 5.907 ( 0.856 1.651 1.824) 2.605 6.100 ( -3.371 -5.793 -3.170) 7.414 6.253 ( 5.730 -7.114 -2.596) 9.496 6.406 ( 7.261 -2.481 6.966) 10.364 6.543 ( 4.042 -3.075 1.177) 5.214 6.591 ( 5.466 -4.205 1.579) 7.074 6.630 ( 4.319 0.583 -3.018) 5.301 6.695 ( -2.884 -5.069 -4.735) 7.512 6.783 ( 9.928 -3.234 4.716) 11.457 6.875 ( 2.090 0.798 1.353) 2.615 6.978 ( 10.135 3.042 0.409) 10.589 7.051 ( 2.523 -0.742 1.222) 2.900 7.161 ( 4.237 1.412 2.790) 5.266 7.242 ( 1.501 4.057 -1.579) 4.605 7.351 ( -4.298 8.484 2.104) 9.741 7.649 ( -9.695 1.424 7.878) 12.573 7.906 ( -15.497 -1.120 -5.737) 16.563 10.008 ( -2.048 2.666 -2.938) 4.465 10.197 ( -0.139 3.679 1.674) 4.044 10.376 ( -6.706 2.492 -1.916) 7.406 10.758 ( -5.013 -3.574 1.309) 6.295 10.801 ( 1.357 2.722 -0.195) 3.048 10.865 ( -0.250 8.654 -1.542) 8.794 11.868 ( 6.430 -0.088 0.733) 6.472 11.895 ( 1.939 -3.508 -0.434) 4.032 13.706 ( -1.048 2.356 -0.913) 2.736 14.093 ( 2.767 3.903 4.403) 6.502 14.348 ( -3.558 -3.029 -0.745) 4.732 14.519 ( 1.708 -9.713 1.141) 9.928 14.578 ( 1.510 -4.696 1.742) 5.231 14.683 ( -1.593 -7.429 -0.614) 7.623 14.777 ( 1.397 -1.602 -4.703) 5.161 14.915 ( 1.392 -1.838 1.647) 2.833 15.054 ( 3.725 -1.137 0.031) 3.894 15.234 ( -1.794 -6.969 -0.612) 7.222 15.245 ( -1.179 -2.316 -0.040) 2.599 15.328 ( 1.652 -2.675 0.791) 3.242 24.324 ( -0.524 0.001 -0.137) 0.541 24.388 ( 0.300 1.538 -0.635) 1.691 24.414 ( -0.850 -0.471 0.296) 1.016 24.544 ( -0.371 0.520 0.480) 0.799 25.148 ( -0.675 0.990 1.126) 1.644 25.460 ( 0.176 -4.278 -0.515) 4.312 25.620 ( -1.300 3.267 -0.997) 3.655 25.917 ( -6.459 -1.521 -0.146) 6.637 26.797 ( 3.172 -0.660 -1.720) 3.668 26.953 ( 6.361 4.132 1.702) 7.774 27.611 ( -0.473 -9.488 -3.305) 10.059 27.849 ( 6.248 2.746 0.371) 6.835 27.907 ( -0.195 5.414 6.917) 8.786 28.101 ( -3.245 7.007 1.985) 7.973 28.221 ( -2.055 8.221 -6.953) 10.961 29.130 ( -0.870 -2.760 0.215) 2.902 ======================= Grid point 16 (12/104) ======================= q-point: (-0.50 0.14 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( 0.000 20.316 -0.000) 20.316 1.658 ( 0.000 4.146 0.000) 4.146 1.901 ( 0.000 4.274 0.000) 4.274 2.147 ( -0.000 -7.059 0.000) 7.059 2.618 ( 0.000 0.196 -0.000) 0.196 2.644 ( 0.000 1.462 -0.000) 1.462 2.786 ( -0.000 -2.203 0.000) 2.203 2.797 ( 0.000 -0.874 -0.000) 0.874 2.917 ( 0.000 8.474 0.000) 8.474 3.117 ( 0.000 12.478 -0.000) 12.478 3.144 ( -0.000 8.272 0.000) 8.272 3.297 ( -0.000 2.215 0.000) 2.215 3.319 ( -0.000 12.276 0.000) 12.276 3.529 ( 0.000 1.033 0.000) 1.033 3.679 ( -0.000 -4.196 -0.000) 4.196 3.731 ( 0.000 3.110 0.000) 3.110 3.814 ( -0.000 7.331 -0.000) 7.331 3.955 ( 0.000 6.762 0.000) 6.762 4.080 ( 0.000 9.176 0.000) 9.176 4.179 ( 0.000 13.353 -0.000) 13.353 4.262 ( 0.000 5.865 0.000) 5.865 4.469 ( 0.000 -0.109 0.000) 0.109 4.736 ( 0.000 5.409 0.000) 5.409 4.769 ( 0.000 -0.598 -0.000) 0.598 4.961 ( 0.000 1.246 0.000) 1.246 5.041 ( 0.000 1.821 0.000) 1.821 5.096 ( 0.000 -6.048 0.000) 6.048 5.504 ( 0.000 3.976 -0.000) 3.976 5.521 ( -0.000 -8.798 0.000) 8.798 5.646 ( 0.000 -6.022 0.000) 6.022 5.816 ( 0.000 4.253 0.000) 4.253 5.915 ( 0.000 1.522 0.000) 1.522 6.049 ( 0.000 -3.892 0.000) 3.892 6.298 ( 0.000 -5.992 0.000) 5.992 6.524 ( 0.000 1.681 0.000) 1.681 6.573 ( -0.000 -8.043 -0.000) 8.043 6.607 ( 0.000 -4.414 0.000) 4.414 6.650 ( 0.000 -0.670 0.000) 0.670 6.672 ( 0.000 -2.840 0.000) 2.840 6.901 ( 0.000 -9.405 0.000) 9.405 6.941 ( 0.000 5.743 0.000) 5.743 7.052 ( -0.000 -1.637 0.000) 1.637 7.077 ( 0.000 -0.863 -0.000) 0.863 7.214 ( 0.000 0.395 0.000) 0.395 7.305 ( -0.000 8.159 0.000) 8.159 7.353 ( 0.000 7.253 -0.000) 7.253 7.528 ( 0.000 3.713 0.000) 3.713 7.719 ( 0.000 -0.804 0.000) 0.804 9.975 ( 0.000 3.098 0.000) 3.098 10.230 ( 0.000 2.023 0.000) 2.023 10.278 ( 0.000 3.373 0.000) 3.373 10.715 ( 0.000 -4.537 0.000) 4.537 10.817 ( 0.000 2.762 0.000) 2.762 10.853 ( 0.000 9.803 -0.000) 9.803 11.896 ( 0.000 -5.601 0.000) 5.601 11.945 ( 0.000 1.654 0.000) 1.654 13.693 ( 0.000 2.645 0.000) 2.645 14.161 ( -0.000 5.022 -0.000) 5.022 14.291 ( 0.000 -3.795 0.000) 3.795 14.537 ( -0.000 -6.843 -0.000) 6.843 14.626 ( 0.000 -5.343 -0.000) 5.343 14.643 ( 0.000 -9.650 0.000) 9.650 14.757 ( 0.000 -0.894 0.000) 0.894 14.944 ( 0.000 -2.513 0.000) 2.513 15.091 ( 0.000 -2.076 0.000) 2.076 15.211 ( 0.000 -6.954 0.000) 6.954 15.230 ( 0.000 -1.993 0.000) 1.993 15.350 ( 0.000 -2.429 0.000) 2.429 24.319 ( 0.000 -0.009 0.000) 0.009 24.388 ( -0.000 1.947 0.000) 1.947 24.407 ( 0.000 -0.925 -0.000) 0.925 24.543 ( 0.000 0.477 0.000) 0.477 25.148 ( 0.000 0.945 0.000) 0.945 25.459 ( 0.000 -4.119 0.000) 4.119 25.602 ( 0.000 2.789 0.000) 2.789 25.857 ( 0.000 -0.790 0.000) 0.790 26.817 ( 0.000 -1.211 0.000) 1.211 27.023 ( 0.000 5.746 0.000) 5.746 27.585 ( 0.000 -10.619 0.000) 10.619 27.870 ( -0.000 8.937 0.000) 8.937 27.993 ( 0.000 5.130 -0.000) 5.130 28.097 ( 0.000 -1.433 0.000) 1.433 28.138 ( 0.000 11.376 -0.000) 11.376 29.124 ( 0.000 -3.585 0.000) 3.585 ======================= Grid point 22 (13/104) ======================= q-point: ( 0.00 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 0.000 29.711 0.000) 29.711 1.351 ( 0.000 30.626 0.000) 30.626 2.087 ( 0.000 -1.343 0.000) 1.343 2.138 ( 0.000 2.514 0.000) 2.514 2.383 ( 0.000 40.375 0.000) 40.375 2.638 ( 0.000 -2.244 0.000) 2.244 2.805 ( 0.000 -2.163 0.000) 2.163 2.961 ( 0.000 0.054 0.000) 0.054 3.048 ( 0.000 0.740 0.000) 0.740 3.239 ( 0.000 4.655 0.000) 4.655 3.297 ( 0.000 20.851 0.000) 20.851 3.431 ( 0.000 0.928 0.000) 0.928 3.561 ( 0.000 5.674 0.000) 5.674 3.672 ( 0.000 -3.261 0.000) 3.261 3.687 ( 0.000 -5.658 0.000) 5.658 3.868 ( 0.000 3.033 0.000) 3.033 3.939 ( 0.000 4.310 0.000) 4.310 4.058 ( 0.000 -4.805 0.000) 4.805 4.106 ( 0.000 -8.439 0.000) 8.439 4.355 ( 0.000 10.335 0.000) 10.335 4.384 ( 0.000 7.348 0.000) 7.348 4.511 ( 0.000 1.769 0.000) 1.769 4.613 ( 0.000 13.088 0.000) 13.088 4.854 ( 0.000 9.214 0.000) 9.214 4.940 ( 0.000 11.669 0.000) 11.669 4.961 ( 0.000 -7.395 0.000) 7.395 5.207 ( 0.000 -0.460 0.000) 0.460 5.321 ( 0.000 5.408 0.000) 5.408 5.367 ( 0.000 4.207 0.000) 4.207 5.438 ( 0.000 -4.918 0.000) 4.918 5.483 ( 0.000 14.158 0.000) 14.158 5.776 ( 0.000 -9.372 0.000) 9.372 5.788 ( 0.000 -9.616 0.000) 9.616 5.869 ( 0.000 1.344 0.000) 1.344 5.870 ( 0.000 -0.478 0.000) 0.478 6.020 ( 0.000 -2.073 0.000) 2.073 6.160 ( 0.000 -5.716 0.000) 5.716 6.167 ( 0.000 2.654 0.000) 2.654 6.281 ( 0.000 -0.519 0.000) 0.519 6.426 ( 0.000 -4.762 0.000) 4.762 6.586 ( 0.000 1.185 0.000) 1.185 6.829 ( 0.000 -5.497 0.000) 5.497 7.261 ( 0.000 3.932 0.000) 3.932 7.290 ( 0.000 2.237 0.000) 2.237 7.460 ( 0.000 0.343 0.000) 0.343 7.550 ( 0.000 -5.646 0.000) 5.646 7.805 ( 0.000 13.894 0.000) 13.894 9.174 ( 0.000 -21.652 0.000) 21.652 10.203 ( 0.000 3.360 0.000) 3.360 10.417 ( 0.000 1.571 0.000) 1.571 10.644 ( 0.000 4.093 0.000) 4.093 10.781 ( 0.000 -3.086 0.000) 3.086 10.903 ( 0.000 3.974 0.000) 3.974 11.106 ( 0.000 -8.556 0.000) 8.556 11.294 ( 0.000 5.605 0.000) 5.605 11.772 ( 0.000 -1.346 0.000) 1.346 13.933 ( 0.000 -1.561 0.000) 1.561 14.033 ( 0.000 -0.321 0.000) 0.321 14.277 ( 0.000 -4.293 0.000) 4.293 14.287 ( 0.000 -0.118 0.000) 0.118 14.367 ( 0.000 2.508 0.000) 2.508 14.499 ( 0.000 -7.537 0.000) 7.537 14.651 ( 0.000 -1.495 0.000) 1.495 14.679 ( 0.000 -2.008 0.000) 2.008 14.948 ( 0.000 -4.664 0.000) 4.664 15.014 ( 0.000 1.589 0.000) 1.589 15.303 ( 0.000 -9.225 0.000) 9.225 15.400 ( 0.000 -2.981 0.000) 2.981 24.406 ( 0.000 1.097 0.000) 1.097 24.439 ( 0.000 0.182 0.000) 0.182 24.542 ( 0.000 2.388 0.000) 2.388 24.598 ( 0.000 0.656 0.000) 0.656 25.222 ( 0.000 1.183 0.000) 1.183 25.359 ( 0.000 -3.431 0.000) 3.431 25.832 ( 0.000 6.912 0.000) 6.912 26.111 ( 0.000 -1.823 0.000) 1.823 26.491 ( 0.000 0.890 0.000) 0.890 26.518 ( 0.000 0.076 0.000) 0.076 26.669 ( 0.000 2.074 0.000) 2.074 27.211 ( 0.000 -14.390 0.000) 14.390 28.237 ( 0.000 6.833 0.000) 6.833 28.391 ( 0.000 0.877 0.000) 0.877 28.880 ( 0.000 19.540 0.000) 19.540 29.846 ( 0.000 -9.100 0.000) 9.100 ======================= Grid point 23 (14/104) ======================= q-point: ( 0.10 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( 7.909 25.193 7.942) 27.574 1.443 ( 8.505 26.917 2.309) 28.323 2.102 ( 6.019 3.787 0.002) 7.112 2.322 ( 8.454 -0.851 5.268) 9.997 2.521 ( 8.785 21.776 3.439) 23.732 2.658 ( 2.704 -0.862 0.671) 2.916 2.775 ( -4.167 7.568 5.715) 10.359 2.936 ( -1.747 4.896 2.668) 5.843 3.041 ( 1.269 3.497 -6.744) 7.702 3.213 ( 2.212 6.365 0.483) 6.755 3.387 ( 3.669 10.459 3.211) 11.540 3.457 ( -6.816 7.378 -2.128) 10.267 3.497 ( 3.106 1.272 1.767) 3.793 3.666 ( 0.328 -2.817 -3.416) 4.440 3.731 ( 2.937 -4.994 3.978) 7.028 3.830 ( -3.822 2.874 0.204) 4.786 3.913 ( -1.793 3.474 -3.639) 5.341 3.985 ( -4.967 0.709 -0.838) 5.086 4.193 ( 0.743 -3.328 -3.279) 4.730 4.214 ( 1.899 -2.791 3.725) 5.028 4.410 ( -2.230 13.289 -1.628) 13.572 4.561 ( 1.850 -3.809 1.375) 4.452 4.707 ( 1.577 14.773 0.901) 14.884 4.760 ( 2.297 8.525 -4.518) 9.918 4.943 ( -1.099 8.907 0.704) 9.002 5.047 ( 2.541 0.149 2.499) 3.567 5.215 ( 3.872 0.346 -1.994) 4.368 5.292 ( -0.311 1.605 -3.405) 3.777 5.343 ( 0.541 4.428 -1.851) 4.830 5.503 ( 3.500 3.900 6.483) 8.336 5.562 ( 6.095 -2.032 0.535) 6.447 5.760 ( -1.992 -6.482 -3.563) 7.660 5.816 ( 1.589 -10.627 -2.035) 10.936 5.828 ( 2.062 -2.331 2.506) 3.996 5.952 ( 5.793 4.835 -2.801) 8.049 6.106 ( 7.214 0.099 1.143) 7.305 6.129 ( 2.959 -2.160 -3.272) 4.912 6.235 ( 6.834 0.562 -2.042) 7.155 6.343 ( 3.699 -5.087 2.441) 6.746 6.434 ( 1.958 -3.158 0.253) 3.725 6.657 ( 5.926 -0.068 1.694) 6.164 6.856 ( 3.150 -4.143 -0.859) 5.275 7.213 ( -2.619 3.422 -2.708) 5.090 7.259 ( -2.881 1.822 0.919) 3.531 7.391 ( -7.197 0.927 -3.346) 7.991 7.567 ( -4.866 -4.764 13.267) 14.913 7.753 ( -3.978 12.776 -1.744) 13.494 9.000 ( -13.452 -17.738 -8.558) 23.851 10.174 ( -3.180 4.604 1.699) 5.848 10.432 ( 1.847 0.303 -1.018) 2.131 10.692 ( 3.551 7.056 3.322) 8.569 10.758 ( -2.243 -0.668 -0.148) 2.345 10.875 ( -2.302 2.146 -0.348) 3.166 11.216 ( 1.708 -4.592 2.352) 5.434 11.288 ( 5.735 1.884 -0.799) 6.089 11.752 ( -1.874 -3.459 0.170) 3.938 13.897 ( -1.836 -0.454 -2.628) 3.238 14.043 ( -0.324 -0.270 1.742) 1.792 14.241 ( -1.207 -1.012 -2.513) 2.966 14.324 ( 2.470 -3.824 -0.823) 4.626 14.355 ( -1.147 0.374 2.612) 2.877 14.524 ( 1.712 -6.990 0.429) 7.210 14.656 ( 0.549 -2.296 0.967) 2.551 14.698 ( 2.487 -1.771 -1.193) 3.278 14.950 ( 0.757 -4.706 -0.890) 4.849 15.040 ( 1.521 0.149 2.366) 2.817 15.275 ( -2.182 -8.487 -1.916) 8.970 15.345 ( -2.920 -1.032 -2.586) 4.035 24.396 ( -0.833 1.046 -0.632) 1.479 24.424 ( -0.951 0.397 -0.547) 1.167 24.519 ( -1.694 2.587 -0.452) 3.125 24.589 ( -0.978 0.503 0.087) 1.104 25.210 ( -1.410 1.349 0.753) 2.092 25.359 ( 0.044 -3.694 0.097) 3.696 25.827 ( -0.974 6.543 0.412) 6.628 26.118 ( -1.015 -2.884 2.992) 4.278 26.544 ( 2.816 0.769 0.513) 2.964 26.688 ( 3.524 2.139 -1.908) 4.543 26.741 ( 17.955 -5.140 9.230) 20.833 27.254 ( 7.675 -13.187 -5.183) 16.114 28.207 ( -3.817 6.914 1.135) 7.978 28.366 ( -2.389 0.878 -0.575) 2.609 28.848 ( -3.318 18.992 -0.310) 19.282 29.677 ( -13.144 -3.072 -6.052) 14.793 ======================= Grid point 24 (15/104) ======================= q-point: ( 0.20 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( 10.727 16.535 5.424) 20.442 1.656 ( 9.686 18.693 8.335) 22.643 2.229 ( 4.851 4.974 3.136) 7.623 2.433 ( 0.429 -0.609 1.859) 2.003 2.547 ( -3.325 -5.001 -1.866) 6.289 2.707 ( 0.863 -3.685 0.723) 3.853 2.760 ( -7.566 9.844 3.613) 12.931 2.988 ( 2.686 6.047 -5.472) 8.586 3.096 ( 9.351 21.914 5.803) 24.523 3.266 ( -0.890 7.078 -5.009) 8.716 3.306 ( -5.265 3.743 6.423) 9.110 3.464 ( -3.498 0.325 2.067) 4.076 3.501 ( -0.297 2.495 -0.225) 2.523 3.594 ( -4.027 6.678 -3.397) 8.506 3.771 ( -2.003 6.411 5.733) 8.831 3.837 ( -1.737 -0.557 -3.222) 3.703 3.884 ( 8.780 -5.261 0.701) 10.260 3.979 ( 2.948 7.523 -0.080) 8.080 4.111 ( 1.021 4.848 -2.670) 5.628 4.406 ( 4.700 7.966 0.892) 9.292 4.430 ( 9.794 -13.913 2.973) 17.272 4.490 ( -4.273 6.948 -2.364) 8.492 4.653 ( -3.366 15.638 -1.854) 16.103 4.862 ( 3.051 7.748 -0.174) 8.329 4.915 ( 1.270 4.319 -1.400) 4.715 5.073 ( -2.149 3.955 -1.137) 4.643 5.224 ( 1.878 3.542 -10.471) 11.212 5.288 ( 5.423 -1.100 -0.737) 5.582 5.394 ( 2.224 -0.590 0.459) 2.346 5.626 ( 5.304 0.262 3.027) 6.113 5.648 ( -3.571 -6.520 0.807) 7.478 5.725 ( 9.370 5.294 -1.513) 10.868 5.846 ( 2.579 -6.182 0.677) 6.732 5.927 ( 6.784 -4.120 -1.739) 8.126 6.040 ( 9.072 -0.424 -2.220) 9.349 6.192 ( 8.682 -2.935 -3.750) 9.903 6.262 ( 6.152 -0.319 2.009) 6.480 6.357 ( 6.128 -2.050 0.914) 6.526 6.422 ( 5.059 -4.639 0.676) 6.897 6.520 ( 5.396 -1.876 2.083) 6.080 6.781 ( 6.402 -0.828 -0.416) 6.469 6.906 ( 3.870 -0.445 -1.896) 4.333 7.118 ( -8.802 2.696 -3.052) 9.698 7.186 ( -2.919 3.154 0.649) 4.347 7.289 ( -1.293 0.043 2.851) 3.131 7.594 ( -7.110 -3.793 15.728) 17.672 7.659 ( -4.721 9.923 -1.569) 11.101 8.620 ( -17.809 -12.504 -10.784) 24.285 10.142 ( -2.170 4.616 1.449) 5.302 10.432 ( -1.792 -1.035 -0.705) 2.186 10.657 ( -5.681 9.985 0.159) 11.489 10.821 ( -2.886 -0.700 5.003) 5.818 10.873 ( 8.272 4.607 -0.801) 9.502 11.107 ( -7.977 3.463 -4.340) 9.719 11.495 ( 11.286 -2.802 2.378) 11.870 11.733 ( 0.490 -6.801 -0.709) 6.856 13.841 ( -1.629 1.451 -2.449) 3.279 14.052 ( -0.573 -0.059 2.416) 2.484 14.214 ( 1.226 -2.298 -2.248) 3.440 14.332 ( -0.504 -4.092 0.152) 4.126 14.397 ( 1.551 -3.306 3.532) 5.080 14.554 ( 0.613 -7.862 0.903) 7.937 14.679 ( 0.238 -2.799 2.223) 3.582 14.750 ( 5.035 -2.427 -2.433) 6.096 14.955 ( 0.618 -4.793 -0.941) 4.924 15.098 ( 2.357 -2.307 2.081) 3.899 15.205 ( -2.834 -6.337 -2.289) 7.310 15.293 ( -0.392 -0.267 -2.167) 2.218 24.370 ( -1.193 0.835 -0.593) 1.572 24.406 ( -0.476 0.195 -0.662) 0.838 24.486 ( -1.652 2.242 -0.265) 2.798 24.570 ( -1.142 0.190 0.240) 1.183 25.193 ( -1.640 1.627 1.632) 2.828 25.363 ( 0.307 -4.122 0.007) 4.133 25.800 ( -2.421 5.543 0.125) 6.050 26.094 ( -5.849 -4.682 3.548) 8.289 26.642 ( 8.182 2.618 0.026) 8.590 26.744 ( 5.313 3.091 -3.148) 6.906 27.153 ( 17.143 -9.099 9.146) 21.455 27.372 ( 10.993 -10.500 -6.925) 16.705 28.139 ( -5.096 7.246 2.349) 9.165 28.304 ( -3.540 1.088 -0.940) 3.821 28.761 ( -5.849 17.775 -0.776) 18.729 29.379 ( -12.750 1.344 -5.159) 13.820 ======================= Grid point 25 (16/104) ======================= q-point: ( 0.30 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( 5.720 9.834 -1.879) 11.530 1.919 ( 6.582 9.418 12.143) 16.718 2.290 ( -5.098 2.735 2.270) 6.214 2.371 ( -0.240 1.030 -2.799) 2.992 2.528 ( -9.038 5.212 -4.262) 11.270 2.558 ( -0.334 1.203 4.515) 4.684 2.768 ( 0.600 -4.175 2.364) 4.835 2.884 ( -7.518 -1.749 -6.871) 10.334 3.159 ( -3.756 6.377 -6.383) 9.774 3.180 ( -7.533 4.272 5.168) 10.085 3.291 ( -1.152 10.055 -2.495) 10.424 3.382 ( 2.937 10.779 4.698) 12.120 3.542 ( 0.423 4.629 0.774) 4.712 3.592 ( 0.515 6.731 2.399) 7.164 3.742 ( 0.160 0.091 -5.193) 5.196 3.823 ( -0.510 7.605 4.696) 8.952 3.936 ( -2.670 2.642 -0.726) 3.826 4.142 ( 10.817 5.983 2.406) 12.594 4.175 ( 5.676 1.664 -1.000) 5.999 4.393 ( -3.102 7.992 0.179) 8.575 4.526 ( -0.249 8.187 -4.503) 9.347 4.552 ( 3.747 13.366 3.659) 14.356 4.674 ( 8.362 -2.884 0.236) 8.849 4.872 ( 1.849 1.990 -2.541) 3.720 4.918 ( -2.515 2.831 0.481) 3.817 5.013 ( -0.704 3.528 -2.294) 4.267 5.150 ( 1.554 -0.943 -7.543) 7.759 5.361 ( 2.458 -4.560 -2.533) 5.767 5.384 ( -1.336 8.446 -2.244) 8.841 5.649 ( 2.407 -0.429 1.925) 3.112 5.762 ( 6.562 3.718 0.313) 7.549 5.830 ( 6.776 0.980 -1.483) 7.005 5.998 ( 8.572 -5.345 2.917) 10.514 6.025 ( 6.488 -1.672 -1.097) 6.790 6.158 ( 4.820 -4.916 -2.361) 7.278 6.341 ( 12.473 -3.536 -2.819) 13.268 6.401 ( 6.948 -2.225 2.295) 7.648 6.484 ( 4.813 -5.616 5.957) 9.497 6.510 ( 4.984 -4.456 -1.320) 6.814 6.618 ( 3.392 -3.385 -0.494) 4.817 6.840 ( 2.366 -0.014 -2.999) 3.820 6.972 ( 1.018 -0.290 0.324) 1.107 7.009 ( 4.080 7.510 0.393) 8.556 7.151 ( -2.778 1.609 2.280) 3.937 7.310 ( -0.284 2.386 2.295) 3.323 7.561 ( -5.041 6.685 -0.641) 8.397 7.636 ( -4.178 -3.377 14.670) 15.623 8.207 ( -17.597 -8.881 -9.855) 22.038 10.120 ( -1.282 4.298 -0.089) 4.486 10.353 ( -5.407 2.513 -0.675) 6.001 10.556 ( -6.662 5.420 1.151) 8.665 10.790 ( -5.508 -2.274 2.058) 6.305 10.921 ( -3.760 6.152 -5.021) 8.787 11.013 ( 5.131 7.415 0.397) 9.026 11.688 ( 7.689 -4.487 -0.381) 8.911 11.768 ( 4.860 -4.168 0.588) 6.429 13.799 ( -1.090 3.281 -1.340) 3.708 14.076 ( 0.700 -0.903 2.764) 2.991 14.241 ( 3.012 -5.279 -0.790) 6.129 14.325 ( -1.127 -2.783 1.675) 3.438 14.450 ( 1.297 -4.848 1.965) 5.390 14.557 ( -0.517 -7.822 -0.018) 7.839 14.705 ( 0.363 -4.003 1.560) 4.312 14.802 ( 1.648 -5.537 -0.265) 5.783 14.965 ( 2.024 -3.415 -0.663) 4.025 15.131 ( -1.676 -8.313 -0.780) 8.516 15.166 ( 1.781 -0.217 0.119) 1.798 15.283 ( 1.139 -0.333 -2.214) 2.512 24.346 ( -0.949 0.662 -0.387) 1.220 24.395 ( -0.134 -0.403 -0.582) 0.720 24.457 ( -1.356 2.141 -0.054) 2.535 24.555 ( -0.812 -0.132 0.318) 0.881 25.183 ( -1.262 1.876 1.623) 2.783 25.369 ( 0.348 -4.279 -0.065) 4.293 25.745 ( -3.243 4.276 -0.664) 5.408 25.989 ( -7.779 -3.972 1.341) 8.837 26.778 ( 6.166 3.517 -3.764) 8.035 26.850 ( 9.339 3.047 1.960) 10.017 27.460 ( 5.012 -8.017 -4.876) 10.638 27.506 ( 14.395 -7.860 5.119) 17.181 28.091 ( -2.957 8.108 3.172) 9.194 28.236 ( -2.710 2.119 -1.091) 3.609 28.634 ( -7.022 16.386 -1.556) 17.895 29.163 ( -7.740 -0.869 -2.143) 8.078 ======================= Grid point 26 (17/104) ======================= q-point: ( 0.40 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( -1.066 5.740 -2.703) 6.433 1.985 ( -3.942 1.560 -0.115) 4.241 2.143 ( -8.610 6.969 -1.180) 11.139 2.255 ( -7.801 11.574 -8.362) 16.271 2.527 ( 6.572 0.923 8.416) 10.717 2.647 ( 1.879 2.016 4.925) 5.643 2.714 ( -1.389 -2.381 0.569) 2.815 2.791 ( -2.439 -0.281 -0.698) 2.553 3.015 ( -4.438 -1.129 -3.321) 5.656 3.122 ( -1.814 -2.755 4.584) 5.647 3.336 ( 8.662 12.397 -4.587) 15.803 3.480 ( -4.073 2.833 -3.038) 5.817 3.549 ( 3.819 4.363 4.827) 7.544 3.589 ( -0.304 10.916 0.201) 10.922 3.688 ( -2.885 6.649 -0.720) 7.284 3.821 ( -2.145 4.574 -2.342) 5.569 3.922 ( 0.309 4.720 4.894) 6.806 4.214 ( -0.407 -2.469 -2.768) 3.731 4.224 ( -0.095 11.568 -3.639) 12.127 4.396 ( 0.137 8.577 2.432) 8.916 4.528 ( 2.170 9.213 1.248) 9.547 4.554 ( -0.606 16.550 -1.218) 16.605 4.767 ( 1.964 3.113 -2.331) 4.357 4.824 ( -4.396 -4.120 -1.918) 6.323 4.931 ( 3.638 -0.901 1.414) 4.006 5.006 ( 1.413 2.922 -1.314) 3.502 5.182 ( 2.135 3.234 -0.194) 3.880 5.333 ( 1.404 4.479 -3.998) 6.166 5.385 ( 2.028 -6.184 0.172) 6.511 5.702 ( 1.699 6.427 1.185) 6.752 5.849 ( 2.973 2.368 -1.484) 4.080 5.927 ( 3.613 -0.795 0.108) 3.701 6.090 ( 2.650 3.181 0.112) 4.141 6.114 ( 4.194 -4.253 -1.122) 6.077 6.279 ( 7.817 -7.844 0.946) 11.115 6.496 ( 4.242 -5.508 -2.005) 7.235 6.514 ( 1.245 -1.753 3.046) 3.728 6.528 ( 3.914 -4.648 -3.667) 7.097 6.648 ( 4.431 -7.387 4.329) 9.640 6.654 ( 4.145 -2.495 -0.582) 4.873 6.898 ( 6.315 0.500 0.494) 6.354 6.989 ( 0.962 -2.219 1.063) 2.642 7.110 ( 2.726 4.107 1.728) 5.223 7.160 ( 1.556 1.047 -0.311) 1.901 7.340 ( 1.526 4.626 1.863) 5.215 7.500 ( -0.078 5.596 1.595) 5.819 7.651 ( -7.723 -2.260 5.921) 9.990 7.852 ( -12.514 -4.326 -4.901) 14.119 10.087 ( -1.291 5.086 -1.715) 5.520 10.280 ( -2.160 3.560 1.058) 4.296 10.437 ( -6.758 3.252 -0.499) 7.516 10.657 ( -7.168 -5.648 0.366) 9.133 10.901 ( 1.928 7.117 -1.299) 7.487 11.075 ( 2.370 10.582 -0.943) 10.885 11.747 ( 2.207 -7.028 -1.518) 7.521 11.900 ( 5.905 -0.727 1.620) 6.166 13.777 ( -0.492 4.481 -0.420) 4.527 14.126 ( 2.101 -4.030 2.268) 5.079 14.285 ( 1.462 -2.965 -0.132) 3.309 14.322 ( -0.546 -3.251 1.615) 3.671 14.480 ( 1.073 -5.400 0.403) 5.520 14.539 ( -1.494 -6.569 0.018) 6.737 14.699 ( -0.709 -6.677 -2.061) 7.024 14.819 ( -0.478 -7.269 2.926) 7.850 15.015 ( 3.199 -1.982 0.133) 3.766 15.091 ( -1.433 -5.366 -0.588) 5.585 15.195 ( 0.968 -1.504 -0.817) 1.966 15.287 ( 1.104 -1.946 -1.274) 2.575 24.331 ( -0.511 0.638 -0.173) 0.835 24.389 ( -0.096 -0.943 -0.358) 1.014 24.439 ( -0.665 2.317 0.046) 2.411 24.547 ( -0.398 -0.379 0.230) 0.596 25.178 ( -0.629 1.958 0.957) 2.268 25.373 ( 0.185 -4.227 -0.111) 4.233 25.686 ( -2.367 3.293 -0.771) 4.129 25.876 ( -4.958 -2.486 0.016) 5.546 26.824 ( 2.916 3.489 -2.497) 5.187 27.047 ( 8.818 4.566 3.294) 10.462 27.432 ( -1.577 -7.550 -5.252) 9.331 27.767 ( 9.153 -8.748 3.940) 13.259 28.085 ( -1.356 9.582 2.664) 10.038 28.203 ( 0.330 4.960 -0.710) 5.022 28.496 ( -6.248 14.980 -2.051) 16.360 29.058 ( -3.305 -4.283 -0.282) 5.417 ======================= Grid point 27 (18/104) ======================= q-point: (-0.50 0.29 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( 0.000 4.064 -0.000) 4.064 1.944 ( 0.000 2.782 -0.000) 2.782 2.038 ( 0.000 8.882 0.000) 8.882 2.122 ( 0.000 11.605 0.000) 11.605 2.644 ( -0.000 2.590 -0.000) 2.590 2.682 ( 0.000 2.039 0.000) 2.039 2.729 ( 0.000 -1.903 0.000) 1.903 2.778 ( 0.000 -0.790 0.000) 0.790 2.967 ( 0.000 -1.318 0.000) 1.318 3.148 ( 0.000 -4.130 0.000) 4.130 3.383 ( 0.000 -1.503 0.000) 1.503 3.475 ( 0.000 16.473 -0.000) 16.473 3.485 ( -0.000 8.611 0.000) 8.611 3.594 ( 0.000 -2.512 0.000) 2.512 3.721 ( 0.000 12.497 -0.000) 12.497 3.794 ( 0.000 3.566 0.000) 3.566 3.942 ( -0.000 5.261 -0.000) 5.261 4.177 ( 0.000 -2.277 -0.000) 2.277 4.187 ( 0.000 14.578 0.000) 14.578 4.404 ( 0.000 7.997 0.000) 7.997 4.542 ( 0.000 3.624 0.000) 3.624 4.559 ( 0.000 21.943 -0.000) 21.943 4.760 ( -0.000 1.907 0.000) 1.907 4.784 ( 0.000 -1.721 0.000) 1.721 4.970 ( 0.000 -0.210 0.000) 0.210 5.064 ( -0.000 3.751 -0.000) 3.751 5.120 ( 0.000 3.474 0.000) 3.474 5.387 ( 0.000 -3.557 -0.000) 3.557 5.392 ( -0.000 -2.125 0.000) 2.125 5.726 ( 0.000 8.196 0.000) 8.196 5.854 ( 0.000 -0.065 0.000) 0.065 5.966 ( 0.000 0.760 0.000) 0.760 6.108 ( 0.000 6.911 0.000) 6.911 6.154 ( 0.000 -5.922 -0.000) 5.922 6.389 ( 0.000 -8.682 -0.000) 8.682 6.425 ( 0.000 -6.800 0.000) 6.800 6.568 ( -0.000 -2.903 0.000) 2.903 6.578 ( 0.000 -1.964 -0.000) 1.964 6.686 ( 0.000 -0.462 0.000) 0.462 6.712 ( 0.000 -7.665 -0.000) 7.665 6.988 ( 0.000 -1.612 0.000) 1.612 7.015 ( -0.000 -2.827 0.000) 2.827 7.127 ( 0.000 4.720 0.000) 4.720 7.182 ( 0.000 -1.780 0.000) 1.780 7.414 ( -0.000 2.290 -0.000) 2.290 7.429 ( 0.000 0.281 0.000) 0.281 7.634 ( 0.000 4.905 0.000) 4.905 7.701 ( 0.000 -0.778 0.000) 0.778 10.063 ( 0.000 5.522 0.000) 5.522 10.283 ( 0.000 2.672 0.000) 2.672 10.353 ( 0.000 3.553 0.000) 3.553 10.594 ( 0.000 -6.923 0.000) 6.923 10.916 ( 0.000 7.054 0.000) 7.054 11.090 ( 0.000 11.845 0.000) 11.845 11.759 ( 0.000 -6.634 0.000) 6.634 11.963 ( 0.000 -0.834 0.000) 0.834 13.771 ( 0.000 4.897 0.000) 4.897 14.165 ( -0.000 -8.506 -0.000) 8.506 14.283 ( 0.000 6.133 0.000) 6.133 14.335 ( 0.000 -8.415 -0.000) 8.415 14.501 ( 0.000 -5.816 0.000) 5.816 14.512 ( -0.000 -5.251 -0.000) 5.251 14.676 ( 0.000 -7.825 0.000) 7.825 14.832 ( 0.000 -7.668 0.000) 7.668 15.051 ( 0.000 -1.559 0.000) 1.559 15.075 ( 0.000 -4.708 0.000) 4.708 15.194 ( 0.000 -1.195 0.000) 1.195 15.293 ( 0.000 -3.077 0.000) 3.077 24.325 ( -0.000 0.645 0.000) 0.645 24.386 ( 0.000 -1.129 0.000) 1.129 24.434 ( 0.000 2.403 0.000) 2.403 24.545 ( 0.000 -0.471 0.000) 0.471 25.177 ( 0.000 1.958 0.000) 1.958 25.374 ( 0.000 -4.180 0.000) 4.180 25.659 ( 0.000 2.944 0.000) 2.944 25.830 ( 0.000 -1.843 0.000) 1.843 26.838 ( 0.000 3.519 0.000) 3.519 27.167 ( 0.000 8.572 0.000) 8.572 27.366 ( 0.000 -11.024 0.000) 11.024 27.871 ( 0.000 -11.063 0.000) 11.063 28.084 ( 0.000 10.854 -0.000) 10.854 28.218 ( 0.000 7.122 0.000) 7.122 28.415 ( 0.000 14.649 0.000) 14.649 29.029 ( 0.000 -5.654 0.000) 5.654 ======================= Grid point 33 (19/104) ======================= q-point: ( 0.00 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 0.000 23.011 0.000) 23.011 1.921 ( 0.000 25.503 0.000) 25.503 2.050 ( 0.000 -3.420 0.000) 3.420 2.195 ( 0.000 4.402 0.000) 4.402 2.379 ( 0.000 -19.550 0.000) 19.550 2.416 ( 0.000 -15.314 0.000) 15.314 3.013 ( 0.000 3.938 0.000) 3.938 3.052 ( 0.000 -0.397 0.000) 0.397 3.289 ( 0.000 21.455 0.000) 21.455 3.372 ( 0.000 10.812 0.000) 10.812 3.427 ( 0.000 -1.289 0.000) 1.289 3.531 ( 0.000 -0.589 0.000) 0.589 3.560 ( 0.000 -2.412 0.000) 2.412 3.622 ( 0.000 -1.745 0.000) 1.745 3.728 ( 0.000 5.804 0.000) 5.804 3.862 ( 0.000 -9.071 0.000) 9.071 3.970 ( 0.000 5.819 0.000) 5.819 4.042 ( 0.000 -2.089 0.000) 2.089 4.138 ( 0.000 16.938 0.000) 16.938 4.379 ( 0.000 -2.334 0.000) 2.334 4.456 ( 0.000 0.920 0.000) 0.920 4.634 ( 0.000 -5.256 0.000) 5.256 4.691 ( 0.000 -9.046 0.000) 9.046 4.720 ( 0.000 0.210 0.000) 0.210 5.092 ( 0.000 8.054 0.000) 8.054 5.145 ( 0.000 11.373 0.000) 11.373 5.179 ( 0.000 -1.716 0.000) 1.716 5.329 ( 0.000 -6.063 0.000) 6.063 5.383 ( 0.000 0.756 0.000) 0.756 5.403 ( 0.000 -1.597 0.000) 1.597 5.625 ( 0.000 -1.806 0.000) 1.806 5.654 ( 0.000 -3.484 0.000) 3.484 5.806 ( 0.000 11.130 0.000) 11.130 5.873 ( 0.000 0.755 0.000) 0.755 5.938 ( 0.000 4.567 0.000) 4.567 6.003 ( 0.000 -0.782 0.000) 0.782 6.090 ( 0.000 -0.116 0.000) 0.116 6.150 ( 0.000 -3.685 0.000) 3.685 6.307 ( 0.000 2.580 0.000) 2.580 6.358 ( 0.000 -2.604 0.000) 2.604 6.646 ( 0.000 3.299 0.000) 3.299 6.718 ( 0.000 -4.710 0.000) 4.710 7.299 ( 0.000 1.381 0.000) 1.381 7.361 ( 0.000 4.909 0.000) 4.909 7.388 ( 0.000 -6.838 0.000) 6.838 7.450 ( 0.000 -3.527 0.000) 3.527 8.168 ( 0.000 22.008 0.000) 22.008 8.672 ( 0.000 -26.554 0.000) 26.554 10.293 ( 0.000 5.204 0.000) 5.204 10.393 ( 0.000 -3.913 0.000) 3.913 10.750 ( 0.000 5.860 0.000) 5.860 10.777 ( 0.000 2.364 0.000) 2.364 10.891 ( 0.000 -3.094 0.000) 3.094 10.935 ( 0.000 -7.704 0.000) 7.704 11.486 ( 0.000 11.264 0.000) 11.264 11.684 ( 0.000 -7.464 0.000) 7.464 13.930 ( 0.000 1.674 0.000) 1.674 13.992 ( 0.000 -3.511 0.000) 3.511 14.223 ( 0.000 -0.733 0.000) 0.733 14.248 ( 0.000 -2.906 0.000) 2.906 14.415 ( 0.000 1.543 0.000) 1.543 14.422 ( 0.000 -0.178 0.000) 0.178 14.623 ( 0.000 -0.766 0.000) 0.766 14.636 ( 0.000 -1.841 0.000) 1.841 14.914 ( 0.000 1.244 0.000) 1.244 14.985 ( 0.000 -4.552 0.000) 4.552 15.223 ( 0.000 2.089 0.000) 2.089 15.311 ( 0.000 -5.201 0.000) 5.201 24.427 ( 0.000 0.875 0.000) 0.875 24.439 ( 0.000 -0.250 0.000) 0.250 24.583 ( 0.000 1.570 0.000) 1.570 24.602 ( 0.000 -0.302 0.000) 0.302 25.252 ( 0.000 1.841 0.000) 1.841 25.297 ( 0.000 -2.648 0.000) 2.648 25.964 ( 0.000 5.779 0.000) 5.779 26.058 ( 0.000 -3.556 0.000) 3.556 26.508 ( 0.000 0.704 0.000) 0.704 26.517 ( 0.000 -0.212 0.000) 0.212 26.753 ( 0.000 6.628 0.000) 6.628 26.941 ( 0.000 -11.756 0.000) 11.756 28.346 ( 0.000 3.812 0.000) 3.812 28.392 ( 0.000 -0.927 0.000) 0.927 29.275 ( 0.000 18.690 0.000) 18.690 29.611 ( 0.000 -14.226 0.000) 14.226 ======================= Grid point 34 (20/104) ======================= q-point: ( 0.10 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 3.512 21.985 4.124) 22.643 1.955 ( 2.574 22.589 0.968) 22.756 2.158 ( 7.062 -1.619 4.703) 8.638 2.294 ( 7.230 -0.384 3.533) 8.056 2.385 ( -0.458 -15.608 -0.818) 15.636 2.438 ( 3.731 -13.506 0.192) 14.014 2.993 ( -3.107 4.594 2.874) 6.247 3.045 ( -0.541 -0.914 -0.365) 1.122 3.316 ( 0.859 9.255 -1.292) 9.384 3.390 ( 5.946 12.149 -2.393) 13.736 3.471 ( 0.339 0.546 3.312) 3.374 3.532 ( -1.821 0.749 2.034) 2.830 3.605 ( 3.870 -0.567 -2.097) 4.438 3.635 ( 2.347 6.788 -2.877) 7.737 3.720 ( -0.276 3.909 5.032) 6.377 3.890 ( -2.926 0.125 -4.318) 5.218 3.912 ( -3.456 -5.570 -0.673) 6.589 3.970 ( 1.050 -4.832 3.085) 5.828 4.149 ( 1.874 12.401 -2.000) 12.700 4.336 ( -2.144 -3.769 -2.425) 4.968 4.351 ( -4.147 6.201 -2.238) 7.788 4.635 ( 1.575 -5.767 -0.716) 6.021 4.841 ( 11.522 1.804 0.315) 11.667 4.887 ( 9.265 -3.143 4.031) 10.581 5.059 ( -3.635 7.197 0.271) 8.067 5.105 ( -7.508 3.808 4.897) 9.739 5.168 ( 2.750 1.813 -2.379) 4.063 5.256 ( -3.169 -2.240 -2.229) 4.475 5.441 ( 2.503 -0.862 1.008) 2.833 5.475 ( 4.545 -4.681 4.529) 7.942 5.610 ( -2.476 2.593 -0.838) 3.682 5.684 ( 2.563 -4.248 -0.221) 4.967 5.760 ( 1.495 7.769 -5.123) 9.425 5.833 ( -0.058 2.910 0.104) 2.912 6.012 ( 5.405 2.147 -1.570) 6.024 6.087 ( 6.057 -3.584 -0.935) 7.100 6.143 ( 5.000 2.019 -2.614) 5.993 6.188 ( 6.939 -3.460 -1.046) 7.824 6.321 ( 2.307 2.444 -0.706) 3.434 6.376 ( 2.694 -2.808 -0.730) 3.959 6.708 ( 6.021 3.523 1.221) 7.082 6.774 ( 6.147 -3.552 -0.467) 7.115 7.269 ( -2.518 3.718 1.761) 4.823 7.317 ( -4.387 3.204 -0.164) 5.435 7.377 ( -7.532 -2.513 0.915) 7.992 7.430 ( -2.990 -7.211 9.650) 12.412 8.084 ( -6.421 20.233 -4.188) 21.637 8.552 ( -9.408 -24.622 -6.256) 27.090 10.282 ( -1.901 5.726 1.297) 6.171 10.390 ( -0.678 -4.387 0.367) 4.454 10.768 ( 1.797 3.117 -0.182) 3.603 10.823 ( 4.333 1.492 -0.104) 4.584 10.899 ( 1.488 3.620 1.619) 4.235 11.053 ( 7.374 -8.888 5.110) 12.629 11.441 ( -2.611 10.106 -2.722) 10.787 11.634 ( -4.149 -8.106 -1.330) 9.202 13.914 ( -1.263 2.500 -0.327) 2.820 13.991 ( -0.554 -4.234 0.584) 4.310 14.229 ( 0.180 0.132 0.885) 0.913 14.259 ( 0.964 -2.870 0.311) 3.044 14.391 ( -1.628 2.470 -0.675) 3.034 14.429 ( -0.054 -1.948 0.269) 1.967 14.624 ( 0.351 -0.401 -0.043) 0.535 14.651 ( 2.081 -2.590 -1.331) 3.579 14.911 ( -0.445 1.058 0.360) 1.203 14.985 ( -0.197 -5.352 0.311) 5.364 15.211 ( -0.225 2.422 -1.551) 2.885 15.289 ( -0.689 -4.089 -2.315) 4.749 24.416 ( -0.864 0.852 -0.671) 1.387 24.427 ( -0.853 -0.200 -0.628) 1.078 24.565 ( -1.573 1.809 -0.454) 2.439 24.589 ( -1.260 -0.566 -0.188) 1.394 25.244 ( -1.154 2.046 0.863) 2.503 25.293 ( -0.742 -2.853 0.762) 3.045 25.951 ( -2.190 5.603 1.329) 6.161 26.049 ( -2.425 -4.057 2.204) 5.215 26.575 ( 5.178 2.222 1.711) 5.888 26.632 ( 8.812 -3.437 3.793) 10.191 26.812 ( 8.782 7.322 -1.693) 11.559 27.002 ( 9.025 -11.293 -3.892) 14.971 28.318 ( -3.269 3.951 0.614) 5.165 28.367 ( -2.686 -1.004 -0.085) 2.869 29.224 ( -5.149 17.299 -0.801) 18.067 29.521 ( -8.021 -11.655 -2.707) 14.405 ======================= Grid point 35 (21/104) ======================= q-point: ( 0.20 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 1.503 15.184 3.277) 15.606 2.011 ( 1.446 13.527 4.029) 14.188 2.308 ( 3.842 -0.925 5.544) 6.808 2.345 ( -1.804 -7.005 -0.537) 7.253 2.445 ( 5.918 -1.154 1.854) 6.308 2.531 ( 4.776 -8.845 2.286) 10.309 2.923 ( -8.333 5.891 -1.973) 10.394 3.002 ( -4.179 -2.043 -4.161) 6.242 3.309 ( -3.145 3.092 2.927) 5.294 3.378 ( -6.198 -3.359 -1.203) 7.152 3.444 ( -1.057 5.646 -5.427) 7.902 3.479 ( 2.632 4.724 -4.916) 7.308 3.658 ( -0.310 7.295 6.383) 9.698 3.712 ( 1.530 3.971 1.941) 4.677 3.778 ( -1.165 -2.572 -3.211) 4.276 3.839 ( 3.613 -0.254 5.078) 6.238 3.897 ( 2.431 5.874 3.642) 7.327 4.058 ( 3.443 -9.746 -2.751) 10.696 4.182 ( 5.029 6.834 0.876) 8.530 4.312 ( 5.100 -5.606 -0.205) 7.582 4.404 ( 9.196 15.761 -0.555) 18.256 4.694 ( 6.674 -1.880 -1.411) 7.076 4.908 ( -7.865 4.894 1.028) 9.321 4.955 ( -2.889 0.701 1.581) 3.367 5.010 ( 0.273 5.440 -2.231) 5.886 5.069 ( 1.487 -0.192 -4.308) 4.561 5.217 ( 2.391 0.381 -1.412) 2.803 5.261 ( 5.479 -2.687 -1.153) 6.210 5.429 ( -0.661 3.014 -0.528) 3.130 5.543 ( -2.012 -6.022 4.606) 7.844 5.670 ( 7.091 1.054 4.470) 8.448 5.727 ( 6.862 -1.807 0.763) 7.137 5.834 ( 8.817 5.162 -2.390) 10.493 5.909 ( 6.594 2.316 -1.079) 7.072 6.084 ( 5.133 1.353 -5.002) 7.294 6.133 ( 5.945 -3.274 -3.031) 7.433 6.226 ( 4.763 -0.198 -2.338) 5.309 6.295 ( 6.384 -3.889 -3.209) 8.135 6.395 ( 5.023 1.221 1.130) 5.291 6.447 ( 5.499 -4.021 -0.269) 6.818 6.839 ( 5.181 4.226 1.351) 6.821 6.895 ( 6.897 -1.144 -0.502) 7.010 7.195 ( -7.080 4.057 -0.658) 8.187 7.262 ( -6.395 0.490 3.298) 7.212 7.280 ( -0.502 4.312 6.690) 7.975 7.455 ( -4.860 -9.215 11.713) 15.676 7.902 ( -8.226 15.126 -5.490) 18.073 8.271 ( -13.081 -19.907 -9.032) 25.475 10.255 ( -2.648 6.100 1.874) 6.909 10.370 ( -2.442 -4.846 1.288) 5.578 10.792 ( -0.199 3.368 -0.556) 3.419 10.829 ( -2.859 -0.066 -1.090) 3.061 11.008 ( 6.344 8.816 3.370) 11.372 11.142 ( -2.885 -2.102 -0.864) 3.673 11.449 ( 7.704 1.157 0.244) 7.794 11.568 ( 0.050 -8.630 -1.479) 8.756 13.890 ( -1.170 3.667 0.019) 3.849 13.985 ( -0.653 -5.142 0.717) 5.233 14.243 ( 0.900 2.533 -0.497) 2.733 14.282 ( 1.480 -1.659 -0.026) 2.224 14.362 ( -1.293 0.984 1.199) 2.019 14.423 ( -0.752 -4.487 0.233) 4.556 14.632 ( -0.633 -0.851 1.791) 2.082 14.673 ( 1.147 -4.442 -0.958) 4.687 14.912 ( 0.539 1.076 0.176) 1.217 14.986 ( 0.329 -5.932 -0.030) 5.942 15.199 ( 0.910 3.057 -2.077) 3.806 15.264 ( 0.590 -2.760 -2.672) 3.887 24.389 ( -1.231 0.911 -0.763) 1.711 24.403 ( -0.963 -0.436 -0.766) 1.305 24.531 ( -1.664 2.025 -0.344) 2.644 24.562 ( -1.415 -1.012 -0.121) 1.744 25.233 ( -1.168 2.351 1.409) 2.979 25.289 ( -0.543 -3.193 0.910) 3.364 25.906 ( -4.308 4.947 1.295) 6.686 26.001 ( -5.526 -4.548 2.467) 7.570 26.714 ( 9.352 4.155 -0.098) 10.234 26.778 ( 7.486 -0.885 -2.567) 7.963 27.059 ( 15.498 0.749 4.312) 16.104 27.170 ( 12.587 -8.811 -3.321) 15.719 28.256 ( -4.133 4.203 1.384) 6.054 28.308 ( -3.536 -0.959 0.027) 3.664 29.093 ( -8.302 14.292 -1.128) 16.566 29.316 ( -11.071 -7.382 -3.207) 13.688 ======================= Grid point 36 (22/104) ======================= q-point: ( 0.30 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -1.436 7.545 -0.836) 7.726 2.043 ( -3.719 0.440 3.567) 5.171 2.347 ( 0.994 4.416 3.161) 5.521 2.401 ( 0.547 0.653 5.281) 5.350 2.554 ( 4.652 1.213 2.607) 5.469 2.644 ( 3.935 -6.842 1.560) 8.045 2.683 ( -10.181 7.526 -4.462) 13.424 2.815 ( -8.435 -5.138 -3.559) 10.498 3.199 ( -9.917 0.765 -1.225) 10.021 3.212 ( -10.803 0.159 -4.279) 11.620 3.440 ( 2.427 4.633 -2.526) 5.809 3.481 ( 2.891 0.535 -2.226) 3.688 3.649 ( -1.587 2.896 -2.698) 4.264 3.703 ( 2.470 -1.853 -1.527) 3.445 3.812 ( -0.408 9.627 5.536) 11.113 3.917 ( 0.427 -0.558 5.744) 5.787 3.989 ( 2.120 3.552 -0.558) 4.174 4.079 ( 3.199 -6.160 -3.487) 7.768 4.327 ( 8.169 7.405 2.509) 11.307 4.444 ( 4.770 -2.849 2.505) 6.095 4.586 ( 6.934 9.221 0.832) 11.567 4.771 ( -4.105 4.209 -1.283) 6.017 4.815 ( 1.740 -3.910 -1.044) 4.405 4.888 ( 1.585 -1.273 -1.614) 2.596 4.960 ( -1.862 12.333 -1.877) 12.613 5.074 ( 1.987 1.751 -1.639) 3.114 5.192 ( 1.274 3.835 -5.490) 6.817 5.280 ( -0.305 -3.253 -1.462) 3.580 5.527 ( 5.481 1.631 3.343) 6.624 5.594 ( 2.742 -4.534 5.963) 7.977 5.845 ( 6.534 4.497 -0.011) 7.932 5.858 ( 5.061 1.340 -1.666) 5.494 5.992 ( 7.869 3.583 -2.060) 8.889 5.999 ( 10.059 -1.796 0.224) 10.220 6.125 ( 5.203 3.194 -4.739) 7.728 6.252 ( 9.980 -6.241 -4.175) 12.489 6.327 ( 6.970 -1.843 2.421) 7.605 6.378 ( 6.678 -5.397 -0.693) 8.614 6.471 ( 2.008 0.990 1.520) 2.706 6.526 ( 2.990 -4.388 -0.136) 5.311 6.880 ( 0.763 3.277 -0.931) 3.491 6.946 ( -0.486 -2.658 -0.655) 2.780 7.159 ( 0.648 6.168 2.467) 6.674 7.205 ( -2.786 2.341 2.819) 4.604 7.360 ( 1.343 4.101 7.485) 8.640 7.508 ( -1.115 -8.562 11.539) 14.412 7.711 ( -7.484 9.375 -5.000) 12.996 7.959 ( -12.145 -14.079 -8.669) 20.515 10.227 ( -2.090 5.831 1.251) 6.320 10.332 ( -3.103 -3.877 1.455) 5.175 10.674 ( -9.814 4.975 -0.824) 11.033 10.744 ( -8.696 -2.376 -0.243) 9.018 11.063 ( 0.210 6.963 -3.815) 7.942 11.129 ( 5.554 2.112 -0.461) 5.960 11.593 ( 6.269 -1.616 -0.483) 6.492 11.662 ( 9.063 -6.375 2.208) 11.299 13.877 ( -0.476 4.575 0.352) 4.613 13.985 ( -0.055 -5.825 0.718) 5.869 14.246 ( 1.454 3.904 -2.640) 4.932 14.322 ( 1.982 0.276 1.891) 2.753 14.363 ( -0.431 -2.537 0.907) 2.729 14.416 ( -0.188 -5.691 0.498) 5.716 14.625 ( -2.707 -2.171 2.418) 4.230 14.667 ( -2.096 -5.877 2.504) 6.723 14.942 ( 2.887 1.190 -0.274) 3.135 15.000 ( 1.644 -4.511 -0.746) 4.858 15.201 ( 1.224 2.658 -2.119) 3.613 15.254 ( 0.812 -2.327 -2.559) 3.553 24.363 ( -0.949 0.948 -0.478) 1.424 24.382 ( -0.737 -0.822 -0.524) 1.222 24.503 ( -1.169 2.191 -0.175) 2.489 24.540 ( -0.998 -1.374 -0.022) 1.698 25.228 ( -0.805 2.656 1.249) 3.043 25.290 ( -0.201 -3.477 0.678) 3.548 25.829 ( -4.870 4.012 0.173) 6.312 25.909 ( -6.220 -3.912 0.932) 7.407 26.863 ( 7.487 4.178 -4.036) 9.476 26.901 ( 9.700 1.022 -0.199) 9.756 27.333 ( 7.581 -3.374 -2.013) 8.538 27.359 ( 12.714 -5.524 4.104) 14.457 28.219 ( -1.510 4.263 2.115) 4.992 28.261 ( -1.401 -0.061 0.362) 1.448 28.925 ( -9.017 11.856 -1.202) 14.944 29.102 ( -9.733 -5.629 -2.042) 11.428 ======================= Grid point 37 (23/104) ======================= q-point: ( 0.40 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -4.387 4.031 -2.255) 6.370 1.954 ( -5.214 -2.823 -1.702) 6.169 2.294 ( -6.753 7.151 -0.902) 9.877 2.390 ( -4.844 -1.042 -2.215) 5.427 2.622 ( 2.901 6.449 7.136) 10.046 2.664 ( 5.066 -0.225 2.180) 5.520 2.704 ( 1.630 2.201 4.012) 4.858 2.776 ( -1.000 -2.042 2.732) 3.555 2.989 ( -5.906 0.108 -5.438) 8.029 3.041 ( -3.788 -4.258 -0.829) 5.759 3.446 ( -0.916 1.823 -3.752) 4.271 3.493 ( 0.592 -2.442 -3.980) 4.707 3.617 ( 1.410 6.464 -1.264) 6.735 3.712 ( 0.930 -1.519 -1.091) 2.089 3.871 ( 2.177 8.737 4.489) 10.061 3.924 ( -2.896 4.333 -3.709) 6.397 4.008 ( 0.589 2.020 4.960) 5.388 4.080 ( -0.317 -6.847 -3.093) 7.520 4.438 ( 1.030 6.063 0.386) 6.162 4.450 ( -2.897 0.343 1.010) 3.087 4.629 ( -4.681 0.067 0.733) 4.738 4.698 ( 1.420 -4.145 -1.732) 4.711 4.828 ( 3.055 6.354 -1.160) 7.145 4.930 ( 2.973 -2.150 -1.575) 3.992 4.968 ( 1.347 15.061 0.393) 15.126 5.085 ( 2.358 3.126 -3.455) 5.222 5.220 ( 2.299 3.652 0.863) 4.401 5.322 ( 3.630 -2.677 2.638) 5.225 5.555 ( -1.117 10.244 -1.879) 10.475 5.727 ( 4.920 -6.035 3.945) 8.729 5.851 ( -0.963 0.473 -2.405) 2.634 5.884 ( -0.045 -1.351 -0.768) 1.554 6.133 ( 6.837 3.440 -2.744) 8.131 6.172 ( 8.664 -0.771 -2.979) 9.194 6.199 ( 5.189 5.543 1.669) 7.775 6.345 ( 3.172 -8.050 -3.313) 9.265 6.468 ( 6.300 -0.854 0.083) 6.358 6.503 ( 2.153 -1.387 2.777) 3.778 6.535 ( 5.651 -2.287 3.406) 6.983 6.575 ( 3.208 -4.150 1.468) 5.447 6.906 ( 3.484 0.806 -0.753) 3.655 6.940 ( 0.863 -2.341 -0.125) 2.498 7.159 ( -1.194 2.635 1.741) 3.376 7.199 ( -1.522 -0.011 0.427) 1.581 7.430 ( -2.549 4.910 3.053) 6.318 7.548 ( -7.034 -5.780 4.417) 10.119 7.606 ( 2.438 4.813 -1.227) 5.533 7.736 ( -4.446 -6.849 -2.349) 8.496 10.204 ( -1.090 6.005 -0.223) 6.107 10.299 ( -1.487 -2.328 0.952) 2.922 10.499 ( -8.165 2.799 -0.361) 8.639 10.558 ( -9.159 -3.638 -0.816) 9.889 11.072 ( 2.425 8.923 -1.946) 9.449 11.198 ( 3.221 -0.943 -1.309) 3.603 11.685 ( 4.031 3.121 -0.061) 5.098 11.820 ( 5.865 -7.041 1.399) 9.270 13.877 ( -0.012 5.288 0.355) 5.300 13.994 ( 0.333 -6.505 0.495) 6.532 14.254 ( 1.622 2.633 -1.560) 3.464 14.349 ( -1.323 -0.898 0.841) 1.807 14.382 ( 2.988 -3.109 0.044) 4.313 14.423 ( 0.297 -4.919 0.249) 4.935 14.579 ( -4.208 -0.897 2.038) 4.761 14.665 ( -1.516 -7.015 3.572) 8.017 14.998 ( 3.148 0.316 -0.128) 3.167 15.022 ( 1.389 -2.055 -0.645) 2.563 15.198 ( 0.451 1.485 -1.733) 2.326 15.241 ( 0.058 -2.461 -1.828) 3.066 24.348 ( -0.490 0.969 -0.196) 1.104 24.368 ( -0.412 -1.038 -0.238) 1.142 24.487 ( -0.539 2.278 -0.063) 2.342 24.527 ( -0.486 -1.592 0.020) 1.665 25.227 ( -0.391 2.857 0.672) 2.961 25.293 ( -0.056 -3.643 0.307) 3.656 25.753 ( -3.195 3.361 -0.352) 4.650 25.819 ( -3.901 -3.097 -0.026) 4.981 26.932 ( 3.989 6.855 -2.526) 8.324 27.065 ( 7.774 -4.431 0.308) 8.954 27.384 ( 0.806 4.654 -1.748) 5.036 27.559 ( 6.085 -10.714 2.383) 12.549 28.239 ( 1.153 4.991 1.664) 5.386 28.275 ( 2.098 1.328 0.747) 2.593 28.767 ( -7.063 11.343 -1.102) 13.407 28.949 ( -5.849 -6.830 -0.697) 9.019 ======================= Grid point 38 (24/104) ======================= q-point: (-0.50 0.43 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 91 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 0.000 3.441 -0.000) 3.441 1.892 ( -0.000 -3.689 0.000) 3.689 2.224 ( 0.000 8.383 0.000) 8.383 2.314 ( 0.000 1.619 0.000) 1.619 2.715 ( -0.000 3.547 -0.000) 3.547 2.721 ( 0.000 1.727 0.000) 1.727 2.735 ( 0.000 1.368 0.000) 1.368 2.762 ( 0.000 -1.091 0.000) 1.091 2.939 ( 0.000 1.220 0.000) 1.220 3.039 ( 0.000 -6.335 0.000) 6.335 3.379 ( 0.000 1.935 0.000) 1.935 3.457 ( 0.000 -4.996 -0.000) 4.996 3.675 ( -0.000 4.660 -0.000) 4.660 3.703 ( 0.000 3.973 0.000) 3.973 3.850 ( 0.000 6.906 0.000) 6.906 3.956 ( 0.000 7.996 -0.000) 7.996 4.000 ( 0.000 -2.585 0.000) 2.585 4.062 ( 0.000 -5.271 -0.000) 5.271 4.417 ( 0.000 1.333 0.000) 1.333 4.463 ( 0.000 -6.557 0.000) 6.557 4.532 ( 0.000 11.046 -0.000) 11.046 4.736 ( 0.000 -6.049 0.000) 6.049 4.849 ( 0.000 5.830 0.000) 5.830 4.936 ( 0.000 1.818 0.000) 1.818 5.001 ( 0.000 11.418 0.000) 11.418 5.136 ( 0.000 0.504 0.000) 0.504 5.200 ( 0.000 9.378 0.000) 9.378 5.381 ( 0.000 -3.556 0.000) 3.556 5.531 ( 0.000 12.736 0.000) 12.736 5.793 ( 0.000 -10.803 0.000) 10.803 5.842 ( 0.000 2.334 0.000) 2.334 5.858 ( -0.000 -2.624 -0.000) 2.624 6.173 ( 0.000 5.117 0.000) 5.117 6.232 ( 0.000 2.714 0.000) 2.714 6.290 ( 0.000 -1.004 0.000) 1.004 6.315 ( 0.000 -3.989 0.000) 3.989 6.523 ( 0.000 -0.459 0.000) 0.459 6.541 ( -0.000 -0.243 0.000) 0.243 6.618 ( 0.000 -2.488 0.000) 2.488 6.635 ( 0.000 -3.935 -0.000) 3.935 6.949 ( 0.000 -1.551 0.000) 1.551 6.951 ( -0.000 -2.160 -0.000) 2.160 7.171 ( 0.000 0.234 0.000) 0.234 7.177 ( 0.000 0.210 0.000) 0.210 7.413 ( -0.000 -0.536 -0.000) 0.536 7.420 ( 0.000 -0.794 0.000) 0.794 7.687 ( 0.000 0.618 0.000) 0.618 7.690 ( -0.000 -0.250 0.000) 0.250 10.190 ( 0.000 6.671 0.000) 6.671 10.297 ( 0.000 -2.485 0.000) 2.485 10.413 ( 0.000 2.330 0.000) 2.330 10.469 ( 0.000 -4.378 0.000) 4.378 11.087 ( 0.000 9.060 0.000) 9.060 11.220 ( 0.000 -1.474 0.000) 1.474 11.721 ( 0.000 4.959 0.000) 4.959 11.880 ( 0.000 -7.464 0.000) 7.464 13.879 ( 0.000 5.583 0.000) 5.583 14.001 ( 0.000 -6.875 0.000) 6.875 14.264 ( 0.000 1.535 0.000) 1.535 14.337 ( 0.000 -1.803 0.000) 1.803 14.416 ( 0.000 -3.528 0.000) 3.528 14.426 ( 0.000 -4.794 0.000) 4.794 14.543 ( 0.000 1.768 0.000) 1.768 14.670 ( 0.000 -7.864 0.000) 7.864 15.031 ( 0.000 -0.423 -0.000) 0.423 15.031 ( -0.000 -0.538 0.000) 0.538 15.191 ( 0.000 0.996 0.000) 0.996 15.231 ( 0.000 -2.782 0.000) 2.782 24.342 ( -0.000 0.973 0.000) 0.973 24.363 ( 0.000 -1.083 -0.000) 1.083 24.482 ( 0.000 2.289 0.000) 2.289 24.523 ( 0.000 -1.661 0.000) 1.661 25.227 ( 0.000 2.915 0.000) 2.915 25.294 ( 0.000 -3.687 -0.000) 3.687 25.722 ( 0.000 3.160 0.000) 3.160 25.783 ( 0.000 -2.784 0.000) 2.784 26.956 ( 0.000 7.942 0.000) 7.942 27.146 ( 0.000 -10.493 0.000) 10.493 27.370 ( 0.000 11.511 0.000) 11.511 27.621 ( 0.000 -12.929 0.000) 12.929 28.262 ( 0.000 5.975 0.000) 5.975 28.309 ( 0.000 1.361 0.000) 1.361 28.690 ( 0.000 12.029 0.000) 12.029 28.893 ( 0.000 -8.130 0.000) 8.130 ======================= Grid point 77 (25/104) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( -9.008 0.000 25.890) 27.412 0.660 ( -1.612 0.000 31.245) 31.286 1.181 ( 0.758 0.000 54.418) 54.423 1.820 ( -1.356 0.000 -14.952) 15.014 2.195 ( 0.070 0.000 -14.220) 14.220 2.483 ( 5.081 0.000 15.500) 16.311 2.709 ( -1.533 0.000 4.942) 5.175 2.755 ( 15.014 0.000 -7.854) 16.945 3.092 ( -0.564 0.000 1.207) 1.332 3.153 ( -10.630 0.000 2.912) 11.022 3.244 ( 2.289 0.000 7.527) 7.867 3.527 ( -1.444 0.000 2.206) 2.637 3.641 ( -1.206 0.000 -0.010) 1.206 3.680 ( 1.372 0.000 1.180) 1.809 3.881 ( -3.019 0.000 -1.755) 3.492 3.884 ( -3.759 0.000 -0.873) 3.859 3.993 ( 4.747 0.000 -0.386) 4.763 4.000 ( -23.954 0.000 -4.651) 24.402 4.036 ( -5.294 0.000 -3.066) 6.117 4.214 ( -1.312 0.000 1.528) 2.014 4.230 ( 1.909 0.000 -7.171) 7.421 4.280 ( 3.915 0.000 -0.184) 3.919 4.514 ( 7.905 0.000 6.533) 10.256 4.611 ( -13.403 0.000 -13.571) 19.074 4.734 ( 10.186 0.000 -4.655) 11.200 4.930 ( 1.670 0.000 -6.102) 6.327 5.086 ( -4.984 0.000 4.823) 6.935 5.117 ( -2.687 0.000 3.281) 4.241 5.380 ( 5.693 0.000 8.309) 10.072 5.558 ( 1.902 0.000 1.185) 2.241 5.564 ( -2.396 0.000 -1.892) 3.053 5.672 ( 2.364 0.000 3.208) 3.985 5.820 ( 3.753 0.000 3.242) 4.960 5.918 ( 2.934 0.000 -8.932) 9.402 6.012 ( -0.215 0.000 -1.229) 1.247 6.092 ( 0.677 0.000 -3.463) 3.529 6.154 ( -3.686 0.000 -4.484) 5.805 6.357 ( -3.561 0.000 5.882) 6.876 6.584 ( 0.736 0.000 -2.383) 2.494 6.609 ( 2.553 0.000 -4.815) 5.450 6.813 ( 1.109 0.000 -4.297) 4.438 6.820 ( -1.067 0.000 -1.254) 1.647 7.015 ( 1.119 0.000 4.578) 4.713 7.200 ( -0.788 0.000 -1.026) 1.294 7.369 ( 2.002 0.000 -2.842) 3.477 7.488 ( -3.372 0.000 -5.670) 6.597 7.861 ( 2.773 0.000 19.588) 19.783 9.007 ( -1.230 0.000 -9.818) 9.894 10.175 ( 3.205 0.000 3.646) 4.854 10.369 ( -1.221 0.000 2.679) 2.945 10.443 ( 1.854 0.000 0.887) 2.055 10.617 ( -2.407 0.000 -4.991) 5.541 10.932 ( 4.630 0.000 3.539) 5.827 11.250 ( -5.178 0.000 -2.370) 5.694 11.396 ( -3.197 0.000 4.193) 5.273 11.697 ( 3.863 0.000 -2.911) 4.837 13.990 ( 3.496 0.000 -1.001) 3.637 14.065 ( -13.383 0.000 -2.447) 13.605 14.294 ( 0.035 0.000 1.320) 1.321 14.409 ( -0.188 0.000 -1.363) 1.376 14.514 ( -2.319 0.000 3.725) 4.388 14.697 ( 0.927 0.000 0.869) 1.271 14.705 ( 1.395 0.000 -0.085) 1.398 14.769 ( 9.943 0.000 1.891) 10.122 14.849 ( -1.624 0.000 -0.497) 1.699 14.973 ( 0.377 0.000 -9.238) 9.246 15.385 ( 0.251 0.000 6.496) 6.501 15.583 ( -0.270 0.000 -0.517) 0.583 24.395 ( -0.519 0.000 0.250) 0.576 24.415 ( -0.197 0.000 -0.947) 0.967 24.474 ( -0.881 0.000 1.474) 1.717 24.560 ( 0.869 0.000 -1.158) 1.448 25.239 ( -1.616 0.000 3.900) 4.221 25.580 ( 1.764 0.000 -3.720) 4.117 26.085 ( -50.735 0.000 0.925) 50.743 26.129 ( 5.526 0.000 0.004) 5.526 26.518 ( 0.429 0.000 0.408) 0.592 26.626 ( 0.144 0.000 -2.176) 2.180 27.611 ( -3.413 0.000 1.076) 3.578 27.715 ( 23.688 0.000 -1.461) 23.734 27.912 ( -1.043 0.000 1.606) 1.915 27.957 ( -1.204 0.000 0.597) 1.344 28.440 ( -3.571 0.000 0.280) 3.582 28.497 ( 33.849 0.000 -0.908) 33.862 ======================= Grid point 78 (26/104) ======================= q-point: ( 0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( 18.244 0.000 17.223) 25.089 1.076 ( 14.937 0.000 24.565) 28.750 1.758 ( 11.358 0.000 33.913) 35.765 1.834 ( 14.061 0.000 -10.484) 17.539 2.119 ( 6.577 0.000 -11.304) 13.078 2.631 ( -0.322 0.000 6.060) 6.069 2.765 ( 4.268 0.000 2.911) 5.167 2.865 ( -2.595 0.000 -0.044) 2.596 3.050 ( -4.604 0.000 1.883) 4.974 3.130 ( 6.894 0.000 3.113) 7.564 3.375 ( 1.692 0.000 10.788) 10.920 3.438 ( -8.951 0.000 -1.329) 9.049 3.547 ( -7.033 0.000 -3.308) 7.772 3.663 ( -12.038 0.000 8.661) 14.830 3.703 ( -0.689 0.000 0.965) 1.186 3.754 ( -6.187 0.000 -0.464) 6.204 3.815 ( -2.452 0.000 -3.088) 3.943 3.966 ( -2.567 0.000 0.943) 2.734 4.040 ( 0.260 0.000 0.391) 0.470 4.133 ( -4.269 0.000 -15.135) 15.725 4.297 ( 0.644 0.000 0.763) 0.999 4.339 ( -0.745 0.000 -8.973) 9.004 4.352 ( 3.456 0.000 5.066) 6.133 4.713 ( 10.451 0.000 -2.459) 10.737 4.773 ( 8.796 0.000 -13.016) 15.710 4.998 ( -2.672 0.000 5.689) 6.286 5.067 ( -4.129 0.000 8.525) 9.472 5.169 ( 14.524 0.000 -5.561) 15.552 5.402 ( -5.628 0.000 4.883) 7.451 5.523 ( 1.328 0.000 -3.471) 3.716 5.624 ( -2.348 0.000 -5.243) 5.745 5.746 ( 10.748 0.000 5.585) 12.112 5.862 ( -2.984 0.000 -2.251) 3.738 5.969 ( 6.303 0.000 4.991) 8.039 6.014 ( -0.161 0.000 -5.567) 5.569 6.131 ( 10.155 0.000 3.452) 10.726 6.144 ( 4.649 0.000 -5.837) 7.462 6.393 ( 1.969 0.000 4.675) 5.073 6.596 ( 7.091 0.000 -9.924) 12.198 6.645 ( 3.420 0.000 -2.324) 4.135 6.792 ( 0.081 0.000 -0.764) 0.769 6.814 ( 1.139 0.000 -0.404) 1.209 7.074 ( -0.103 0.000 5.752) 5.753 7.167 ( -1.787 0.000 -1.334) 2.230 7.292 ( -9.957 0.000 -7.175) 12.273 7.386 ( 1.794 0.000 -1.784) 2.530 8.026 ( -6.432 0.000 22.205) 23.118 8.762 ( -10.893 0.000 -13.564) 17.396 10.184 ( -3.939 0.000 5.182) 6.509 10.378 ( -7.374 0.000 -5.542) 9.224 10.436 ( 4.020 0.000 3.119) 5.088 10.604 ( 5.060 0.000 -2.783) 5.775 11.068 ( -10.290 0.000 -5.392) 11.617 11.090 ( 5.034 0.000 10.165) 11.343 11.369 ( -1.878 0.000 0.961) 2.110 11.762 ( 5.588 0.000 -2.637) 6.179 13.885 ( -6.910 0.000 -0.653) 6.941 14.015 ( -0.505 0.000 1.271) 1.367 14.407 ( 7.780 0.000 1.619) 7.947 14.473 ( 8.672 0.000 -1.903) 8.879 14.522 ( -1.524 0.000 4.545) 4.794 14.689 ( -1.030 0.000 -1.288) 1.649 14.704 ( -0.859 0.000 2.141) 2.307 14.839 ( 1.441 0.000 -2.737) 3.093 14.886 ( 0.286 0.000 -5.938) 5.945 14.932 ( 7.639 0.000 -2.034) 7.905 15.433 ( -1.199 0.000 5.782) 5.905 15.547 ( -2.802 0.000 -1.159) 3.032 24.386 ( -0.601 0.000 -0.136) 0.616 24.392 ( -1.581 0.000 0.443) 1.642 24.467 ( -1.300 0.000 1.390) 1.903 24.559 ( 0.139 0.000 -0.750) 0.763 25.244 ( -2.255 0.000 4.299) 4.854 25.574 ( 1.528 0.000 -3.979) 4.262 25.641 ( -14.121 0.000 10.274) 17.463 26.273 ( 6.890 0.000 4.313) 8.129 26.560 ( 3.845 0.000 0.627) 3.896 26.584 ( -2.415 0.000 -2.399) 3.404 27.554 ( -1.257 0.000 -1.804) 2.199 27.849 ( 1.772 0.000 -3.540) 3.959 27.918 ( -0.231 0.000 2.376) 2.387 27.947 ( -0.661 0.000 0.233) 0.701 28.355 ( -4.526 0.000 -2.650) 5.245 28.914 ( 18.418 0.000 -11.946) 21.953 ======================= Grid point 79 (27/104) ======================= q-point: ( 0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( 13.630 0.000 9.540) 16.637 1.543 ( 14.013 0.000 16.435) 21.598 1.989 ( 12.856 0.000 -12.094) 17.650 2.106 ( 14.213 0.000 -1.190) 14.263 2.224 ( 7.256 0.000 -0.063) 7.257 2.593 ( -11.181 0.000 2.574) 11.473 2.780 ( -4.859 0.000 4.680) 6.746 2.842 ( 0.504 0.000 -0.474) 0.692 3.022 ( -5.706 0.000 10.345) 11.814 3.151 ( -7.792 0.000 -7.749) 10.989 3.240 ( -9.082 0.000 -3.755) 9.828 3.408 ( -2.674 0.000 1.722) 3.180 3.443 ( -2.766 0.000 5.968) 6.577 3.610 ( -7.425 0.000 7.724) 10.714 3.667 ( -3.126 0.000 -2.983) 4.321 3.741 ( -0.964 0.000 1.654) 1.915 3.743 ( 3.099 0.000 4.788) 5.704 3.980 ( 2.106 0.000 3.476) 4.064 3.986 ( 1.179 0.000 -4.424) 4.578 4.052 ( 5.506 0.000 -9.468) 10.952 4.257 ( -5.856 0.000 3.133) 6.641 4.292 ( 2.117 0.000 -7.788) 8.071 4.482 ( 4.477 0.000 7.234) 8.508 4.839 ( 6.672 0.000 -2.463) 7.112 4.852 ( 4.274 0.000 -4.263) 6.037 5.021 ( 8.605 0.000 -0.288) 8.609 5.087 ( -3.176 0.000 8.853) 9.406 5.295 ( -8.906 0.000 2.797) 9.334 5.361 ( 10.161 0.000 -8.938) 13.533 5.556 ( -0.148 0.000 -5.092) 5.094 5.567 ( 7.505 0.000 -3.743) 8.387 5.802 ( -2.325 0.000 1.621) 2.834 6.014 ( 12.844 0.000 6.089) 14.214 6.081 ( 11.830 0.000 -2.305) 12.053 6.172 ( 5.232 0.000 -4.488) 6.893 6.180 ( 10.741 0.000 6.695) 12.657 6.322 ( 6.821 0.000 3.794) 7.805 6.512 ( 7.791 0.000 3.082) 8.379 6.596 ( 1.217 0.000 -9.282) 9.361 6.663 ( 2.372 0.000 -4.059) 4.701 6.819 ( 2.706 0.000 -0.631) 2.779 6.836 ( 1.221 0.000 -0.211) 1.239 7.055 ( -8.166 0.000 -2.207) 8.459 7.116 ( -0.438 0.000 4.652) 4.673 7.148 ( 0.070 0.000 -1.159) 1.161 7.382 ( -0.922 0.000 -1.585) 1.834 8.058 ( -11.449 0.000 19.800) 22.872 8.410 ( -12.439 0.000 -16.817) 20.917 10.167 ( -8.164 0.000 -7.419) 11.031 10.172 ( -2.395 0.000 4.759) 5.328 10.527 ( 1.047 0.000 4.016) 4.150 10.666 ( 4.611 0.000 -3.480) 5.777 10.838 ( -8.435 0.000 -5.060) 9.836 11.148 ( -9.723 0.000 7.988) 12.584 11.470 ( 12.204 0.000 2.768) 12.514 11.824 ( 4.725 0.000 -3.780) 6.051 13.780 ( -4.513 0.000 -0.533) 4.545 14.020 ( -0.416 0.000 2.685) 2.717 14.516 ( -3.358 0.000 3.945) 5.180 14.545 ( 5.556 0.000 0.775) 5.610 14.611 ( 4.831 0.000 -0.553) 4.862 14.662 ( 0.287 0.000 -2.253) 2.271 14.766 ( 6.585 0.000 2.511) 7.048 14.829 ( 1.336 0.000 -4.225) 4.431 14.847 ( 0.834 0.000 -2.533) 2.667 15.061 ( 8.092 0.000 -1.562) 8.241 15.447 ( -2.389 0.000 3.974) 4.636 15.469 ( -4.314 0.000 -1.629) 4.611 24.371 ( -1.622 0.000 1.066) 1.941 24.373 ( -0.505 0.000 -0.388) 0.636 24.454 ( -1.267 0.000 0.825) 1.512 24.554 ( -0.195 0.000 -0.357) 0.407 25.236 ( -3.511 0.000 5.082) 6.177 25.556 ( 0.827 0.000 -4.518) 4.593 25.575 ( -4.241 0.000 6.091) 7.422 26.306 ( -9.448 0.000 1.491) 9.565 26.587 ( 6.785 0.000 -0.448) 6.800 26.659 ( 6.592 0.000 0.510) 6.611 27.587 ( 6.451 0.000 0.077) 6.452 27.821 ( -0.805 0.000 -2.805) 2.919 27.922 ( -2.499 0.000 0.305) 2.517 27.948 ( 0.431 0.000 3.728) 3.753 28.243 ( -4.225 0.000 -4.126) 5.905 29.036 ( 8.218 0.000 -8.784) 12.029 ======================= Grid point 80 (28/104) ======================= q-point: ( 0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 5.622 0.000 3.022) 6.383 1.698 ( -7.337 0.000 -3.370) 8.074 2.118 ( 13.322 0.000 -8.333) 15.714 2.254 ( -1.794 0.000 0.139) 1.799 2.332 ( -16.931 0.000 3.718) 17.335 2.370 ( 20.676 0.000 -10.610) 23.240 2.763 ( -3.606 0.000 7.154) 8.011 2.804 ( -0.423 0.000 -6.303) 6.317 2.867 ( -7.297 0.000 -12.114) 14.142 3.013 ( -5.281 0.000 11.175) 12.360 3.122 ( -3.855 0.000 3.115) 4.956 3.440 ( 0.892 0.000 5.231) 5.307 3.484 ( -8.452 0.000 10.053) 13.134 3.526 ( -0.745 0.000 6.104) 6.149 3.532 ( -7.252 0.000 -3.699) 8.141 3.788 ( -0.588 0.000 3.328) 3.379 3.846 ( 1.930 0.000 3.197) 3.734 3.992 ( 1.099 0.000 -2.116) 2.384 4.013 ( -4.859 0.000 2.920) 5.669 4.093 ( 9.151 0.000 -9.622) 13.279 4.211 ( -4.477 0.000 7.306) 8.569 4.273 ( 5.821 0.000 -9.555) 11.188 4.627 ( 2.762 0.000 8.768) 9.192 4.840 ( -2.382 0.000 3.015) 3.843 4.914 ( 3.051 0.000 -0.130) 3.054 5.096 ( -4.313 0.000 8.005) 9.093 5.218 ( -3.040 0.000 4.722) 5.616 5.259 ( 15.528 0.000 -5.893) 16.609 5.394 ( 5.491 0.000 -5.990) 8.126 5.527 ( 3.504 0.000 -5.266) 6.325 5.650 ( 4.553 0.000 -2.808) 5.349 5.822 ( 2.963 0.000 -0.921) 3.103 6.168 ( 5.783 0.000 -6.379) 8.610 6.268 ( 9.976 0.000 2.471) 10.278 6.423 ( 8.801 0.000 1.287) 8.895 6.430 ( 10.507 0.000 3.190) 10.980 6.470 ( 7.585 0.000 5.386) 9.303 6.476 ( 2.816 0.000 -1.792) 3.337 6.675 ( 4.214 0.000 -5.931) 7.276 6.703 ( 8.521 0.000 3.327) 9.147 6.813 ( -2.319 0.000 -0.049) 2.319 6.847 ( 1.436 0.000 -1.355) 1.974 6.992 ( 3.607 0.000 -4.205) 5.540 7.146 ( -0.252 0.000 2.891) 2.902 7.199 ( 2.663 0.000 6.116) 6.671 7.319 ( -4.075 0.000 -2.418) 4.738 7.980 ( -14.976 0.000 12.233) 19.337 8.035 ( -11.750 0.000 -16.595) 20.334 9.994 ( -4.190 0.000 -4.867) 6.422 10.187 ( -1.001 0.000 4.873) 4.975 10.463 ( -8.452 0.000 -2.127) 8.716 10.701 ( 2.973 0.000 -3.180) 4.353 10.766 ( 0.970 0.000 2.201) 2.405 10.997 ( -11.291 0.000 2.518) 11.568 11.724 ( 10.732 0.000 4.532) 11.650 11.865 ( 4.241 0.000 -4.029) 5.849 13.715 ( -2.797 0.000 0.211) 2.805 14.059 ( 1.363 0.000 3.585) 3.835 14.458 ( -5.572 0.000 0.266) 5.578 14.589 ( 0.684 0.000 -1.891) 2.011 14.660 ( 1.690 0.000 0.726) 1.839 14.671 ( 2.967 0.000 -3.037) 4.245 14.785 ( 0.421 0.000 -3.971) 3.993 14.884 ( 3.151 0.000 2.390) 3.955 14.956 ( 8.368 0.000 2.741) 8.805 15.173 ( 5.847 0.000 -1.845) 6.132 15.377 ( -4.131 0.000 -1.569) 4.419 15.425 ( -2.945 0.000 1.891) 3.500 24.354 ( -1.556 0.000 1.473) 2.142 24.363 ( -0.157 0.000 -0.331) 0.366 24.439 ( -1.067 0.000 0.299) 1.108 24.546 ( -0.310 0.000 -0.327) 0.451 25.219 ( -3.744 0.000 5.195) 6.404 25.524 ( 0.768 0.000 -4.868) 4.929 25.568 ( -2.513 0.000 4.527) 5.178 26.088 ( -11.566 0.000 -2.550) 11.844 26.719 ( 6.690 0.000 0.230) 6.694 26.790 ( 7.292 0.000 0.353) 7.301 27.737 ( 6.398 0.000 3.004) 7.068 27.780 ( -0.756 0.000 -2.690) 2.795 27.870 ( -3.575 0.000 0.657) 3.635 28.001 ( 0.970 0.000 3.735) 3.859 28.150 ( -2.043 0.000 -1.548) 2.563 29.075 ( 5.048 0.000 -7.424) 8.978 ======================= Grid point 81 (29/104) ======================= q-point: ( 0.40 0.00 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( -9.365 0.000 -2.813) 9.779 1.622 ( 1.807 0.000 3.694) 4.112 2.008 ( -11.895 0.000 2.717) 12.201 2.225 ( 1.066 0.000 -1.215) 1.617 2.324 ( 8.353 0.000 -9.238) 12.454 2.607 ( 11.074 0.000 -8.476) 13.945 2.734 ( 5.450 0.000 -10.975) 12.254 2.761 ( 2.803 0.000 -2.664) 3.867 2.820 ( -1.962 0.000 10.536) 10.717 3.001 ( -6.923 0.000 6.123) 9.242 3.090 ( -2.668 0.000 1.045) 2.865 3.330 ( -9.770 0.000 1.214) 9.845 3.377 ( -6.489 0.000 -0.909) 6.553 3.556 ( 1.978 0.000 9.735) 9.934 3.666 ( 4.305 0.000 9.060) 10.031 3.758 ( -2.613 0.000 -0.971) 2.788 3.805 ( -7.054 0.000 -0.892) 7.110 3.962 ( -3.123 0.000 4.470) 5.453 3.984 ( 1.220 0.000 -3.227) 3.450 4.143 ( -10.748 0.000 8.117) 13.469 4.166 ( 3.836 0.000 -0.216) 3.842 4.350 ( 12.235 0.000 -8.820) 15.082 4.712 ( -2.897 0.000 9.398) 9.835 4.828 ( -2.534 0.000 2.188) 3.348 4.948 ( 0.746 0.000 0.773) 1.074 5.103 ( -3.421 0.000 6.993) 7.785 5.221 ( -2.547 0.000 4.878) 5.503 5.341 ( 5.939 0.000 -7.512) 9.576 5.531 ( 8.600 0.000 -1.038) 8.663 5.611 ( 9.075 0.000 -2.742) 9.480 5.707 ( 4.569 0.000 -1.463) 4.798 5.846 ( 1.839 0.000 -2.659) 3.233 6.243 ( 2.122 0.000 -0.789) 2.264 6.283 ( -0.695 0.000 -5.129) 5.176 6.391 ( 3.298 0.000 0.068) 3.298 6.624 ( 7.521 0.000 0.310) 7.527 6.655 ( 6.752 0.000 5.783) 8.890 6.666 ( 0.854 0.000 -3.355) 3.462 6.722 ( 2.128 0.000 4.760) 5.214 6.774 ( 0.217 0.000 0.363) 0.423 6.899 ( 13.765 0.000 -0.662) 13.781 6.930 ( 8.076 0.000 -4.401) 9.197 7.025 ( 5.204 0.000 -7.499) 9.128 7.167 ( 0.177 0.000 2.885) 2.890 7.197 ( -6.170 0.000 -3.902) 7.300 7.320 ( 2.312 0.000 8.919) 9.214 7.732 ( -6.074 0.000 -11.509) 13.013 7.736 ( -19.934 0.000 2.302) 20.067 9.937 ( 0.103 0.000 -0.443) 0.455 10.225 ( -0.019 0.000 4.932) 4.932 10.292 ( -6.488 0.000 -3.159) 7.216 10.722 ( 2.267 0.000 -1.882) 2.946 10.814 ( 0.173 0.000 3.644) 3.648 10.832 ( -7.918 0.000 0.240) 7.921 11.897 ( 4.669 0.000 2.553) 5.321 11.905 ( 3.836 0.000 -2.721) 4.703 13.684 ( -1.311 0.000 1.069) 1.692 14.110 ( 0.282 0.000 1.136) 1.171 14.351 ( -3.591 0.000 -2.024) 4.122 14.572 ( 0.315 0.000 -2.925) 2.942 14.675 ( 0.008 0.000 -1.553) 1.553 14.697 ( 3.095 0.000 -2.666) 4.085 14.793 ( 1.940 0.000 2.343) 3.042 14.966 ( 1.741 0.000 3.852) 4.227 15.088 ( 3.846 0.000 1.502) 4.129 15.221 ( 1.963 0.000 -2.620) 3.274 15.307 ( -2.160 0.000 -0.732) 2.281 15.392 ( -1.592 0.000 0.090) 1.595 24.343 ( -1.328 0.000 1.647) 2.115 24.362 ( 0.206 0.000 -0.114) 0.235 24.425 ( -0.568 0.000 0.155) 0.589 24.536 ( -0.312 0.000 -0.670) 0.739 25.200 ( -3.598 0.000 4.579) 5.823 25.503 ( 1.969 0.000 -4.532) 4.941 25.566 ( -2.133 0.000 4.120) 4.639 25.906 ( -5.712 0.000 -2.368) 6.183 26.817 ( 3.983 0.000 0.600) 4.028 26.904 ( 4.857 0.000 0.125) 4.859 27.748 ( -0.124 0.000 -2.442) 2.445 27.819 ( 0.977 0.000 1.254) 1.590 27.823 ( -2.417 0.000 1.284) 2.737 27.986 ( -1.399 0.000 -4.979) 5.172 28.200 ( 1.316 0.000 10.063) 10.149 29.085 ( 3.897 0.000 -7.343) 8.313 ======================= Grid point 82 (30/104) ======================= q-point: (-0.50 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 10.565 0.000 12.381) 16.276 1.707 ( 1.042 0.000 7.535) 7.606 1.940 ( -1.217 0.000 6.509) 6.622 2.286 ( 5.069 0.000 1.432) 5.268 2.344 ( 5.828 0.000 -10.847) 12.314 2.515 ( -2.044 0.000 -13.304) 13.461 2.709 ( -9.937 0.000 -1.418) 10.038 2.803 ( -0.210 0.000 -10.372) 10.374 2.894 ( 3.817 0.000 4.066) 5.577 2.920 ( 2.131 0.000 -1.238) 2.464 3.050 ( -2.763 0.000 0.331) 2.783 3.190 ( -7.277 0.000 1.675) 7.467 3.366 ( 3.695 0.000 5.559) 6.675 3.545 ( -10.149 0.000 1.788) 10.306 3.715 ( -3.339 0.000 2.817) 4.369 3.717 ( -0.351 0.000 -1.738) 1.773 3.798 ( 2.897 0.000 2.914) 4.109 3.943 ( -4.266 0.000 6.096) 7.441 3.987 ( 2.430 0.000 -2.805) 3.711 4.095 ( -3.074 0.000 10.539) 10.978 4.242 ( 3.165 0.000 4.344) 5.375 4.495 ( 7.677 0.000 -1.183) 7.768 4.719 ( -4.516 0.000 6.748) 8.119 4.797 ( 0.035 0.000 -1.201) 1.202 4.940 ( -1.950 0.000 0.005) 1.950 5.106 ( -3.582 0.000 7.916) 8.689 5.209 ( -3.353 0.000 3.027) 4.517 5.392 ( 6.161 0.000 -5.339) 8.152 5.624 ( 3.479 0.000 -2.194) 4.113 5.731 ( 4.342 0.000 1.364) 4.551 5.766 ( 3.439 0.000 -1.608) 3.796 5.839 ( -3.011 0.000 -0.694) 3.090 6.149 ( 0.243 0.000 -2.464) 2.476 6.386 ( -3.151 0.000 -2.797) 4.213 6.420 ( 6.361 0.000 4.219) 7.633 6.631 ( -1.081 0.000 -1.453) 1.811 6.652 ( -2.404 0.000 3.426) 4.185 6.720 ( -3.426 0.000 -0.101) 3.428 6.797 ( 2.413 0.000 3.736) 4.448 6.824 ( -2.443 0.000 -2.485) 3.485 6.978 ( 7.600 0.000 -5.321) 9.278 6.999 ( 0.269 0.000 -6.496) 6.501 7.033 ( -0.459 0.000 -6.459) 6.475 7.087 ( 0.438 0.000 -6.748) 6.762 7.181 ( -3.402 0.000 4.104) 5.331 7.356 ( -15.596 0.000 4.970) 16.368 7.464 ( 2.904 0.000 -2.529) 3.850 7.681 ( 9.643 0.000 -4.047) 10.458 9.970 ( 2.239 0.000 2.446) 3.317 10.170 ( -3.194 0.000 -2.653) 4.152 10.305 ( 2.910 0.000 5.019) 5.802 10.712 ( 0.023 0.000 -4.684) 4.684 10.782 ( 0.632 0.000 3.143) 3.206 10.828 ( -1.917 0.000 2.911) 3.485 11.928 ( -2.523 0.000 0.201) 2.531 11.945 ( 2.308 0.000 -0.898) 2.476 13.689 ( 0.176 0.000 2.308) 2.315 14.045 ( -3.753 0.000 -5.631) 6.767 14.348 ( 1.982 0.000 1.797) 2.675 14.552 ( 0.716 0.000 -3.500) 3.573 14.646 ( -1.125 0.000 -1.595) 1.952 14.733 ( 3.253 0.000 -1.641) 3.643 14.876 ( 2.577 0.000 5.428) 6.008 14.980 ( -4.005 0.000 2.620) 4.786 15.114 ( -1.161 0.000 -0.186) 1.176 15.223 ( 2.070 0.000 -2.948) 3.602 15.296 ( 0.773 0.000 0.676) 1.027 15.364 ( -1.430 0.000 -1.115) 1.814 24.338 ( -0.836 0.000 1.426) 1.653 24.368 ( 0.421 0.000 0.228) 0.479 24.423 ( -0.057 0.000 0.540) 0.543 24.523 ( -0.118 0.000 -1.242) 1.247 25.177 ( -3.245 0.000 3.609) 4.854 25.512 ( 3.281 0.000 -3.676) 4.927 25.572 ( -1.569 0.000 4.234) 4.516 25.850 ( 1.295 0.000 -1.556) 2.024 26.866 ( 0.368 0.000 1.426) 1.473 26.945 ( -0.398 0.000 -0.383) 0.552 27.741 ( 1.503 0.000 -1.231) 1.943 27.815 ( -0.001 0.000 1.516) 1.516 27.819 ( -1.286 0.000 -0.219) 1.305 27.904 ( -1.468 0.000 -5.853) 6.035 28.305 ( -1.201 0.000 11.326) 11.390 29.079 ( 3.432 0.000 -7.920) 8.631 ======================= Grid point 83 (31/104) ======================= q-point: (-0.40 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( -9.298 0.000 -2.201) 9.555 1.810 ( 1.571 0.000 11.363) 11.471 2.028 ( 6.611 0.000 -1.127) 6.706 2.332 ( -7.673 0.000 3.082) 8.269 2.363 ( 7.479 0.000 -7.326) 10.469 2.438 ( 5.457 0.000 -5.535) 7.773 2.502 ( -9.387 0.000 0.615) 9.407 2.682 ( 6.134 0.000 -11.170) 12.744 2.924 ( -1.485 0.000 -5.538) 5.733 2.959 ( 4.076 0.000 0.395) 4.095 3.094 ( 5.171 0.000 3.809) 6.423 3.120 ( -4.181 0.000 6.695) 7.893 3.422 ( -3.072 0.000 0.654) 3.141 3.532 ( 6.787 0.000 6.463) 9.372 3.627 ( -8.144 0.000 2.880) 8.638 3.710 ( 0.628 0.000 -0.001) 0.628 3.791 ( -2.533 0.000 -4.768) 5.399 3.968 ( -2.040 0.000 5.808) 6.156 4.010 ( 1.921 0.000 -1.509) 2.443 4.145 ( -1.577 0.000 6.537) 6.725 4.353 ( 2.864 0.000 5.958) 6.610 4.557 ( -0.743 0.000 3.153) 3.239 4.650 ( -5.632 0.000 -1.283) 5.776 4.855 ( 5.741 0.000 0.542) 5.767 4.940 ( -0.273 0.000 6.029) 6.035 5.110 ( -5.356 0.000 8.164) 9.764 5.172 ( -2.538 0.000 3.056) 3.973 5.436 ( 4.545 0.000 -7.151) 8.473 5.626 ( -3.953 0.000 0.908) 4.056 5.651 ( -8.828 0.000 -5.015) 10.153 5.801 ( 0.244 0.000 6.169) 6.173 5.814 ( 3.422 0.000 -4.856) 5.941 6.227 ( -9.344 0.000 -6.122) 11.171 6.274 ( 9.510 0.000 4.235) 10.411 6.489 ( -3.678 0.000 3.812) 5.297 6.577 ( -10.019 0.000 -4.305) 10.904 6.600 ( -3.635 0.000 0.850) 3.733 6.607 ( -7.862 0.000 3.613) 8.653 6.731 ( -0.809 0.000 -1.496) 1.701 6.736 ( -13.584 0.000 -4.710) 14.377 6.906 ( 1.353 0.000 -2.363) 2.723 6.926 ( -11.601 0.000 -3.389) 12.086 6.969 ( 4.005 0.000 0.769) 4.078 7.030 ( 0.817 0.000 -3.943) 4.027 7.233 ( -2.933 0.000 1.460) 3.276 7.260 ( 7.669 0.000 1.297) 7.778 7.475 ( 0.145 0.000 -6.988) 6.989 7.941 ( 20.311 0.000 -1.867) 20.397 10.061 ( 4.803 0.000 3.924) 6.202 10.114 ( -0.689 0.000 -2.675) 2.763 10.423 ( 4.432 0.000 4.804) 6.536 10.699 ( 4.430 0.000 -6.965) 8.254 10.817 ( -1.352 0.000 2.859) 3.163 10.833 ( 0.555 0.000 4.003) 4.041 11.823 ( -8.483 0.000 -0.743) 8.515 11.962 ( -0.203 0.000 0.091) 0.223 13.737 ( 1.766 0.000 4.449) 4.787 13.936 ( -1.692 0.000 -6.000) 6.234 14.399 ( 1.757 0.000 1.170) 2.111 14.525 ( 0.208 0.000 -4.641) 4.646 14.613 ( -1.224 0.000 -0.965) 1.559 14.779 ( 3.357 0.000 -1.258) 3.585 14.898 ( -6.443 0.000 1.634) 6.647 14.959 ( 0.442 0.000 5.254) 5.273 15.062 ( -4.640 0.000 0.610) 4.680 15.232 ( 1.526 0.000 -3.336) 3.669 15.315 ( -2.512 0.000 -1.534) 2.943 15.336 ( 3.033 0.000 0.654) 3.103 24.341 ( -0.150 0.000 0.997) 1.008 24.380 ( 0.460 0.000 0.746) 0.877 24.432 ( 0.082 0.000 1.148) 1.151 24.511 ( 0.457 0.000 -1.837) 1.893 25.156 ( -2.334 0.000 2.911) 3.731 25.542 ( 3.366 0.000 -2.999) 4.508 25.590 ( -1.108 0.000 4.993) 5.115 25.911 ( 7.186 0.000 -2.647) 7.658 26.849 ( -4.186 0.000 1.692) 4.515 26.887 ( -5.100 0.000 -0.753) 5.155 27.759 ( -3.568 0.000 -2.513) 4.364 27.776 ( 2.755 0.000 0.202) 2.762 27.846 ( 1.855 0.000 1.268) 2.247 27.859 ( 0.695 0.000 -2.116) 2.227 28.370 ( -2.654 0.000 10.591) 10.918 29.058 ( 3.230 0.000 -9.307) 9.852 ======================= Grid point 84 (32/104) ======================= q-point: (-0.30 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( -18.013 0.000 -10.751) 20.978 1.640 ( -22.859 0.000 1.699) 22.922 2.099 ( 6.033 0.000 -7.200) 9.394 2.115 ( -15.629 0.000 0.772) 15.648 2.427 ( 2.952 0.000 -3.337) 4.455 2.468 ( 2.790 0.000 -0.192) 2.797 2.507 ( 0.794 0.000 1.103) 1.359 2.740 ( 2.874 0.000 -3.661) 4.654 2.811 ( -3.143 0.000 -5.860) 6.650 3.125 ( 9.086 0.000 4.375) 10.085 3.220 ( 6.291 0.000 0.840) 6.347 3.227 ( 8.284 0.000 6.731) 10.674 3.406 ( 0.595 0.000 -0.029) 0.596 3.537 ( -4.044 0.000 3.655) 5.451 3.674 ( -5.344 0.000 -3.113) 6.184 3.683 ( 4.221 0.000 3.310) 5.364 3.773 ( 5.354 0.000 4.343) 6.894 3.874 ( -5.872 0.000 -4.246) 7.246 4.013 ( -0.903 0.000 -0.766) 1.184 4.206 ( 0.971 0.000 6.920) 6.988 4.400 ( -1.462 0.000 0.882) 1.707 4.548 ( -4.559 0.000 -1.466) 4.789 4.566 ( -4.233 0.000 6.463) 7.725 4.902 ( -1.395 0.000 -0.677) 1.550 4.995 ( -1.445 0.000 6.099) 6.267 5.079 ( -5.504 0.000 7.360) 9.191 5.197 ( 0.408 0.000 6.382) 6.395 5.356 ( -10.147 0.000 -3.852) 10.853 5.476 ( 4.289 0.000 -7.975) 9.055 5.656 ( 0.217 0.000 4.655) 4.660 5.794 ( 0.160 0.000 -5.639) 5.641 5.831 ( -6.122 0.000 4.185) 7.415 6.015 ( -5.755 0.000 -0.885) 5.823 6.315 ( -7.775 0.000 -1.280) 7.880 6.331 ( -11.273 0.000 -7.394) 13.482 6.459 ( 3.982 0.000 -5.672) 6.930 6.477 ( -13.920 0.000 6.998) 15.580 6.490 ( -9.638 0.000 4.249) 10.533 6.552 ( -16.054 0.000 -3.168) 16.364 6.651 ( 6.215 0.000 5.240) 8.129 6.832 ( 2.264 0.000 -0.504) 2.319 6.955 ( 5.282 0.000 -1.134) 5.402 6.969 ( -2.199 0.000 -4.988) 5.451 7.121 ( 7.230 0.000 5.598) 9.144 7.191 ( -4.313 0.000 0.073) 4.314 7.369 ( 0.206 0.000 -10.459) 10.461 7.384 ( 3.971 0.000 1.865) 4.387 8.297 ( 21.250 0.000 -2.911) 21.449 10.089 ( 0.842 0.000 -3.178) 3.288 10.205 ( 6.944 0.000 3.826) 7.928 10.498 ( -0.963 0.000 2.829) 2.988 10.722 ( 6.177 0.000 -9.265) 11.136 10.857 ( -2.075 0.000 3.690) 4.234 10.885 ( 5.853 0.000 4.913) 7.642 11.644 ( -10.720 0.000 0.487) 10.731 11.932 ( -3.061 0.000 -0.499) 3.101 13.839 ( 3.416 0.000 8.002) 8.700 13.882 ( 1.175 0.000 -4.763) 4.906 14.431 ( 1.083 0.000 0.592) 1.234 14.462 ( -1.632 0.000 -6.349) 6.555 14.589 ( -0.458 0.000 -0.747) 0.876 14.807 ( -5.006 0.000 2.339) 5.525 14.825 ( 3.270 0.000 -2.964) 4.414 14.929 ( -8.091 0.000 1.203) 8.180 15.007 ( -3.153 0.000 4.042) 5.126 15.190 ( -3.124 0.000 -3.072) 4.381 15.271 ( -0.261 0.000 -1.640) 1.661 15.414 ( 4.834 0.000 0.557) 4.866 24.351 ( 0.425 0.000 0.605) 0.739 24.395 ( 0.084 0.000 1.076) 1.080 24.445 ( -0.161 0.000 1.691) 1.698 24.509 ( 1.506 0.000 -2.049) 2.543 25.154 ( -0.916 0.000 3.030) 3.166 25.569 ( 2.716 0.000 -2.993) 4.042 25.628 ( -0.895 0.000 7.575) 7.627 26.025 ( 9.055 0.000 -5.661) 10.679 26.756 ( -7.370 0.000 1.588) 7.539 26.769 ( -7.042 0.000 -0.656) 7.072 27.683 ( -2.809 0.000 -0.551) 2.863 27.834 ( 2.844 0.000 1.378) 3.161 27.870 ( 1.224 0.000 0.162) 1.235 27.893 ( 2.241 0.000 0.273) 2.258 28.416 ( -2.322 0.000 9.157) 9.447 29.013 ( 2.914 0.000 -13.015) 13.337 ======================= Grid point 85 (33/104) ======================= q-point: (-0.20 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.906 ( -23.919 0.000 -5.053) 24.447 1.173 ( -30.833 0.000 4.203) 31.119 1.746 ( -34.235 0.000 9.980) 35.660 2.144 ( 3.948 0.000 -1.872) 4.369 2.433 ( -4.434 0.000 -6.522) 7.887 2.451 ( 5.098 0.000 -5.627) 7.593 2.453 ( -3.617 0.000 -5.368) 6.473 2.691 ( -5.756 0.000 5.969) 8.292 2.811 ( 9.146 0.000 -5.226) 10.534 3.246 ( 3.754 0.000 2.544) 4.535 3.262 ( -2.572 0.000 -4.511) 5.193 3.377 ( 7.011 0.000 2.753) 7.532 3.541 ( 2.230 0.000 5.334) 5.782 3.596 ( -0.939 0.000 2.453) 2.627 3.646 ( 13.305 0.000 7.648) 15.347 3.731 ( -0.249 0.000 -0.156) 0.294 3.814 ( 2.981 0.000 -1.657) 3.411 3.922 ( 5.304 0.000 1.904) 5.635 3.939 ( -6.538 0.000 -0.021) 6.538 4.263 ( -0.189 0.000 2.600) 2.607 4.350 ( -1.962 0.000 -3.096) 3.666 4.450 ( -6.314 0.000 1.366) 6.460 4.517 ( -3.214 0.000 2.263) 3.931 4.907 ( 2.506 0.000 2.445) 3.501 4.980 ( -5.027 0.000 3.469) 6.108 5.067 ( -4.189 0.000 9.035) 9.959 5.140 ( -9.340 0.000 -3.591) 10.007 5.276 ( 0.459 0.000 4.842) 4.864 5.422 ( -5.324 0.000 -9.254) 10.676 5.644 ( -5.018 0.000 3.680) 6.223 5.654 ( -9.231 0.000 -1.301) 9.322 5.825 ( 8.506 0.000 -4.452) 9.601 6.027 ( -5.957 0.000 -5.200) 7.907 6.060 ( -8.473 0.000 5.647) 10.182 6.186 ( -4.888 0.000 -0.918) 4.974 6.255 ( -11.412 0.000 -4.779) 12.372 6.351 ( -8.128 0.000 1.223) 8.220 6.358 ( -7.123 0.000 5.841) 9.212 6.506 ( 5.765 0.000 -2.724) 6.376 6.759 ( 1.297 0.000 0.525) 1.399 6.859 ( -1.383 0.000 -0.197) 1.397 6.908 ( 2.044 0.000 -2.594) 3.302 6.944 ( -8.220 0.000 -3.265) 8.845 7.176 ( 5.137 0.000 1.485) 5.348 7.261 ( 6.698 0.000 0.912) 6.760 7.416 ( 9.865 0.000 0.294) 9.869 7.429 ( -0.224 0.000 0.925) 0.952 8.608 ( 17.002 0.000 -3.381) 17.335 10.081 ( 2.047 0.000 -4.456) 4.904 10.347 ( 5.376 0.000 1.536) 5.591 10.463 ( -4.376 0.000 1.974) 4.800 10.727 ( 2.168 0.000 -6.301) 6.664 10.840 ( -0.980 0.000 0.374) 1.048 11.082 ( 9.233 0.000 5.998) 11.010 11.488 ( -8.144 0.000 3.042) 8.693 11.842 ( -5.295 0.000 -2.782) 5.982 13.884 ( 3.380 0.000 -3.691) 5.005 14.013 ( 5.437 0.000 13.395) 14.456 14.358 ( -2.909 0.000 -6.565) 7.181 14.449 ( 0.109 0.000 0.810) 0.817 14.589 ( 1.262 0.000 -0.720) 1.453 14.746 ( -2.811 0.000 -0.295) 2.826 14.767 ( -10.859 0.000 2.023) 11.046 14.840 ( 1.068 0.000 -4.548) 4.672 14.971 ( -4.247 0.000 2.105) 4.740 15.086 ( -3.820 0.000 -4.592) 5.973 15.272 ( 0.414 0.000 1.492) 1.548 15.503 ( 4.365 0.000 0.431) 4.386 24.367 ( 0.815 0.000 0.564) 0.992 24.401 ( -0.361 0.000 0.853) 0.927 24.456 ( -0.527 0.000 2.126) 2.191 24.526 ( 2.190 0.000 -1.696) 2.770 25.181 ( 0.251 0.000 3.920) 3.928 25.582 ( 2.039 0.000 -3.293) 3.873 25.728 ( 1.485 0.000 16.440) 16.507 26.093 ( 5.207 0.000 -7.745) 9.333 26.642 ( -6.416 0.000 -0.324) 6.424 26.657 ( -4.437 0.000 1.520) 4.690 27.651 ( -1.712 0.000 1.633) 2.366 27.897 ( 0.592 0.000 1.662) 1.765 27.898 ( 2.410 0.000 2.381) 3.387 27.918 ( 1.189 0.000 -2.215) 2.514 28.456 ( -1.753 0.000 6.829) 7.050 28.885 ( -0.082 0.000 -24.126) 24.126 ======================= Grid point 86 (34/104) ======================= q-point: (-0.10 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.575 ( -17.445 0.000 22.896) 28.785 0.714 ( -28.692 0.000 17.406) 33.559 1.170 ( -44.089 0.000 28.650) 52.580 2.099 ( -9.683 0.000 -12.539) 15.843 2.290 ( -0.035 0.000 8.275) 8.275 2.321 ( -1.992 0.000 -10.003) 10.199 2.567 ( 13.622 0.000 -7.424) 15.513 2.689 ( -4.032 0.000 10.431) 11.184 2.998 ( 10.940 0.000 0.679) 10.961 3.188 ( -1.665 0.000 0.419) 1.717 3.296 ( -5.805 0.000 4.772) 7.514 3.473 ( 4.185 0.000 0.509) 4.216 3.629 ( 1.571 0.000 0.952) 1.837 3.687 ( -3.046 0.000 -0.051) 3.046 3.737 ( 15.749 0.000 10.794) 19.093 3.860 ( 4.565 0.000 5.270) 6.972 3.887 ( 1.560 0.000 0.984) 1.845 3.963 ( 0.383 0.000 -2.434) 2.464 3.980 ( 11.666 0.000 1.760) 11.798 4.242 ( -2.084 0.000 -1.322) 2.468 4.282 ( -0.661 0.000 -6.238) 6.273 4.367 ( -6.265 0.000 6.005) 8.678 4.564 ( 6.819 0.000 0.948) 6.885 4.876 ( -12.331 0.000 -5.640) 13.560 4.921 ( -6.235 0.000 -8.107) 10.228 5.002 ( -2.462 0.000 1.971) 3.154 5.088 ( -1.971 0.000 9.345) 9.551 5.182 ( -8.550 0.000 -5.405) 10.115 5.241 ( -3.331 0.000 -3.363) 4.734 5.581 ( -1.903 0.000 6.158) 6.446 5.610 ( -2.316 0.000 1.378) 2.695 5.751 ( -12.294 0.000 -10.565) 16.210 5.905 ( -12.325 0.000 -0.970) 12.363 5.911 ( 7.338 0.000 -8.752) 11.421 6.091 ( -5.851 0.000 -2.700) 6.444 6.117 ( -1.235 0.000 -2.867) 3.121 6.275 ( -6.465 0.000 0.915) 6.529 6.338 ( 1.069 0.000 6.264) 6.354 6.569 ( 1.398 0.000 0.745) 1.584 6.700 ( -4.096 0.000 -7.358) 8.421 6.821 ( 0.487 0.000 -2.548) 2.594 6.834 ( 0.422 0.000 -0.505) 0.658 6.955 ( 2.194 0.000 2.039) 2.995 7.214 ( 0.033 0.000 -0.231) 0.233 7.400 ( -1.671 0.000 -2.925) 3.368 7.460 ( 8.997 0.000 1.844) 9.185 7.618 ( 7.928 0.000 8.766) 11.819 8.860 ( 14.092 0.000 2.382) 14.292 10.079 ( 2.966 0.000 -3.490) 4.580 10.407 ( -3.940 0.000 2.266) 4.545 10.407 ( 1.677 0.000 -0.366) 1.716 10.691 ( -2.103 0.000 -1.416) 2.535 10.854 ( 3.539 0.000 -1.842) 3.990 11.268 ( 4.195 0.000 4.040) 5.824 11.416 ( -4.422 0.000 4.669) 6.431 11.715 ( -3.242 0.000 -5.008) 5.966 13.928 ( 4.780 0.000 -2.735) 5.507 14.218 ( 0.987 0.000 -3.781) 3.908 14.331 ( 6.312 0.000 14.415) 15.736 14.446 ( -1.463 0.000 0.410) 1.519 14.567 ( -6.068 0.000 1.314) 6.209 14.648 ( -7.612 0.000 -10.472) 12.946 14.663 ( 0.178 0.000 1.225) 1.238 14.750 ( -4.257 0.000 -0.438) 4.280 14.905 ( -4.325 0.000 0.708) 4.382 15.015 ( 1.752 0.000 -6.081) 6.328 15.314 ( 0.712 0.000 5.362) 5.409 15.566 ( 2.365 0.000 0.046) 2.365 24.395 ( 1.879 0.000 0.573) 1.965 24.400 ( -0.460 0.000 0.546) 0.714 24.466 ( -0.617 0.000 2.341) 2.420 24.548 ( 1.786 0.000 -1.386) 2.261 25.222 ( -0.277 0.000 4.020) 4.029 25.583 ( 1.721 0.000 -3.543) 3.939 26.088 ( 2.373 0.000 -4.947) 5.487 26.151 ( 25.539 0.000 35.177) 43.470 26.548 ( -3.842 0.000 -0.310) 3.854 26.631 ( 0.229 0.000 -0.586) 0.630 27.640 ( -1.995 0.000 2.371) 3.098 27.812 ( -12.114 0.000 -19.599) 23.040 27.914 ( -0.658 0.000 1.907) 2.017 27.955 ( 0.915 0.000 2.287) 2.463 28.441 ( -17.778 0.000 -31.072) 35.799 28.472 ( -2.227 0.000 3.720) 4.335 ======================= Grid point 87 (35/104) ======================= q-point: ( 0.00 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.871 ( -3.633 25.771 16.140) 30.624 0.998 ( 0.237 21.609 24.535) 32.696 1.670 ( -1.613 42.065 31.703) 52.698 1.895 ( -1.599 7.378 -10.213) 12.700 2.247 ( 3.906 2.082 -2.500) 5.084 2.563 ( 2.053 6.690 6.701) 9.689 2.786 ( 4.758 2.172 -3.323) 6.196 2.810 ( 5.713 11.144 -4.208) 13.211 3.028 ( -0.586 -4.887 0.606) 4.959 3.113 ( -7.000 -3.368 0.957) 7.827 3.278 ( 3.509 3.800 8.930) 10.320 3.539 ( -4.468 0.244 2.486) 5.118 3.633 ( -8.055 -10.741 5.749) 14.606 3.725 ( -2.789 -3.275 1.554) 4.573 3.773 ( 1.884 -0.221 -0.056) 1.898 3.829 ( -2.314 5.953 4.647) 7.899 3.985 ( 0.693 -7.492 -0.942) 7.583 4.011 ( -2.944 3.193 -1.888) 4.736 4.072 ( -1.678 10.185 -0.313) 10.327 4.208 ( -1.058 9.749 0.213) 9.809 4.246 ( 3.753 2.374 -1.259) 4.616 4.430 ( 2.782 1.913 2.787) 4.379 4.499 ( -1.488 0.826 -0.993) 1.971 4.634 ( -4.612 7.070 -11.181) 14.010 4.713 ( 3.468 0.617 -2.768) 4.480 4.973 ( 1.482 2.105 -5.331) 5.921 5.108 ( 1.518 2.914 0.736) 3.367 5.201 ( -5.963 5.356 3.538) 8.762 5.411 ( 10.476 1.250 4.393) 11.428 5.422 ( -5.558 -1.990 5.452) 8.036 5.576 ( -0.157 -4.693 2.881) 5.509 5.756 ( -1.921 7.539 -0.631) 7.806 5.831 ( 1.447 1.167 1.135) 2.178 5.895 ( 0.154 -3.593 -5.476) 6.551 5.947 ( -0.037 -5.848 -1.116) 5.954 6.083 ( 1.238 -1.018 -2.432) 2.913 6.124 ( -1.844 -0.893 -3.204) 3.803 6.275 ( -2.898 -7.325 4.923) 9.289 6.436 ( 0.918 -7.321 5.139) 8.992 6.526 ( 0.371 -6.562 -3.918) 7.652 6.628 ( 2.889 -7.848 -1.333) 8.469 6.858 ( 1.250 -2.939 -6.509) 7.250 7.080 ( 1.710 5.761 0.489) 6.029 7.241 ( -0.056 3.284 0.466) 3.317 7.401 ( -1.321 1.964 -2.913) 3.754 7.539 ( -2.279 5.555 -5.924) 8.434 7.859 ( 3.301 -0.574 19.402) 19.689 9.162 ( -0.587 0.313 -22.230) 22.240 10.200 ( 1.799 2.058 3.936) 4.792 10.371 ( -1.858 1.723 0.414) 2.568 10.574 ( 1.583 6.011 0.607) 6.245 10.706 ( -2.773 8.300 -4.244) 9.725 10.901 ( 3.749 -2.846 3.817) 6.060 11.235 ( -4.648 -1.181 -2.650) 5.479 11.370 ( 0.119 -4.336 6.416) 7.745 11.720 ( 3.565 2.133 -3.270) 5.287 13.980 ( -1.596 -1.886 0.026) 2.471 14.037 ( -4.878 -1.165 0.272) 5.022 14.221 ( 2.087 -1.709 -1.038) 2.890 14.353 ( 0.075 -4.594 -1.414) 4.807 14.441 ( -0.518 -2.509 5.318) 5.903 14.651 ( -0.787 -6.242 0.020) 6.291 14.687 ( 0.061 -1.141 0.996) 1.516 14.720 ( -0.218 -1.255 1.275) 1.802 14.888 ( 2.737 2.607 -3.710) 5.297 15.172 ( 0.551 4.801 -8.592) 9.858 15.261 ( 0.242 -6.173 3.710) 7.206 15.496 ( -0.221 -7.949 -0.823) 7.994 24.395 ( -0.799 0.320 0.484) 0.988 24.423 ( -0.122 0.630 -0.852) 1.066 24.488 ( -0.522 1.333 0.454) 1.502 24.568 ( 0.897 0.682 -1.278) 1.704 25.248 ( -1.854 0.920 4.153) 4.640 25.567 ( -1.399 -2.526 -1.135) 3.103 25.907 ( -26.799 -9.088 13.680) 31.431 26.129 ( 3.623 -0.795 -0.650) 3.766 26.519 ( 1.024 0.156 0.532) 1.164 26.627 ( -0.611 0.114 -1.800) 1.904 26.719 ( 24.978 -17.464 20.104) 36.511 27.459 ( -4.903 -14.812 -3.749) 16.047 28.111 ( -0.904 8.931 3.301) 9.565 28.403 ( -2.732 2.341 3.776) 5.216 28.500 ( -0.407 14.550 -3.719) 15.023 29.329 ( 12.082 31.895 -37.068) 50.372 ======================= Grid point 88 (36/104) ======================= q-point: ( 0.10 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( 11.858 18.936 14.806) 26.804 1.322 ( 10.180 16.403 21.662) 29.016 1.905 ( 12.684 7.128 -7.981) 16.595 2.075 ( 10.504 29.215 18.925) 36.359 2.273 ( 5.879 11.560 -4.609) 13.764 2.649 ( -0.406 2.069 3.809) 4.354 2.793 ( 3.203 1.351 -0.237) 3.484 2.866 ( -4.101 1.918 1.693) 4.834 3.015 ( -3.732 -2.763 2.385) 5.220 3.113 ( 8.715 -0.961 0.682) 8.795 3.405 ( -4.720 -0.102 4.686) 6.651 3.447 ( -1.944 4.737 6.794) 8.508 3.538 ( -5.103 -1.527 0.218) 5.331 3.669 ( -5.867 -1.522 1.943) 6.365 3.761 ( -6.221 5.812 2.716) 8.936 3.814 ( -0.589 3.276 1.205) 3.540 3.899 ( -3.210 2.879 -2.727) 5.102 3.968 ( 1.373 -6.779 -5.262) 8.691 4.047 ( -3.092 11.833 3.604) 12.750 4.132 ( -6.192 4.170 -0.500) 7.482 4.311 ( 2.440 6.710 -1.269) 7.252 4.435 ( -0.067 6.366 -9.052) 11.066 4.526 ( 2.294 10.822 -2.672) 11.380 4.616 ( 10.590 -5.819 1.760) 12.211 4.720 ( 6.264 -4.119 -9.335) 11.973 5.001 ( 1.969 1.007 -0.071) 2.213 5.109 ( -7.248 3.918 4.707) 9.490 5.196 ( 7.389 2.082 -1.008) 7.742 5.430 ( -0.379 0.439 3.997) 4.039 5.523 ( -0.117 1.182 -5.338) 5.469 5.583 ( 1.318 -1.727 0.051) 2.173 5.794 ( 6.741 3.351 3.729) 8.402 5.825 ( -1.928 -3.644 -1.404) 4.355 5.934 ( 5.720 -2.084 2.248) 6.490 5.986 ( 2.037 -6.364 0.221) 6.685 6.057 ( 3.618 -0.986 -3.476) 5.114 6.181 ( 7.548 0.240 -0.514) 7.569 6.330 ( 4.112 -5.508 4.073) 7.990 6.515 ( 3.834 -6.398 -5.328) 9.166 6.526 ( 3.663 -7.910 1.479) 8.842 6.691 ( 5.013 -4.884 -1.041) 7.076 6.827 ( 2.452 -1.779 -6.707) 7.359 7.127 ( 0.127 4.931 5.093) 7.090 7.226 ( -4.120 1.971 -0.414) 4.586 7.277 ( -5.753 1.133 -5.445) 8.002 7.464 ( 0.573 6.818 -3.669) 7.764 8.021 ( -6.576 -0.978 21.607) 22.607 8.830 ( -11.999 0.838 -19.798) 23.165 10.183 ( -5.691 1.563 4.668) 7.525 10.403 ( 2.408 0.949 -0.169) 2.593 10.561 ( -5.401 10.077 -1.057) 11.482 10.652 ( 4.407 4.381 -1.948) 6.513 11.003 ( -3.678 -3.949 3.406) 6.381 11.130 ( -0.501 1.847 1.191) 2.254 11.395 ( 0.216 0.658 0.758) 1.027 11.756 ( 3.544 -0.670 -3.260) 4.861 13.877 ( -5.995 -0.481 0.013) 6.014 14.045 ( 0.364 2.254 1.032) 2.505 14.279 ( 5.153 -9.160 0.288) 10.514 14.403 ( 5.702 -5.376 -1.615) 8.002 14.484 ( 0.123 -3.165 4.802) 5.752 14.651 ( 2.150 -3.921 -0.496) 4.499 14.700 ( -0.224 -1.065 1.000) 1.478 14.727 ( 0.350 -2.629 -0.254) 2.664 14.914 ( 2.866 1.570 -2.738) 4.263 15.101 ( 1.996 7.047 -7.169) 10.249 15.310 ( -0.785 -9.518 6.202) 11.388 15.458 ( -2.680 -8.180 -1.467) 8.732 24.381 ( -1.168 0.094 0.340) 1.220 24.406 ( -1.016 0.836 0.004) 1.315 24.476 ( -1.244 0.974 0.672) 1.717 24.567 ( 0.130 0.572 -0.895) 1.071 25.250 ( -2.449 0.699 4.552) 5.216 25.512 ( -4.413 -3.957 2.725) 6.524 25.715 ( -5.872 5.195 3.214) 8.474 26.242 ( 5.152 -2.793 3.635) 6.896 26.542 ( 1.129 -0.751 -0.478) 1.438 26.609 ( 1.176 1.831 -1.245) 2.507 27.264 ( 15.834 -21.794 10.255) 28.825 27.375 ( 3.873 -14.949 -7.523) 17.177 28.097 ( -4.447 10.458 4.274) 12.141 28.350 ( -5.174 1.840 0.901) 5.565 28.433 ( -3.165 19.847 -3.497) 20.399 29.182 ( 3.710 17.641 -20.087) 26.990 ======================= Grid point 89 (37/104) ======================= q-point: ( 0.20 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 10.056 11.534 10.075) 18.321 1.704 ( 11.938 10.960 16.259) 22.956 2.035 ( 10.266 6.387 -11.006) 16.350 2.291 ( 13.042 11.116 -10.881) 20.299 2.384 ( 2.612 15.237 3.421) 15.833 2.602 ( -10.011 1.087 1.132) 10.133 2.789 ( -2.383 1.617 1.948) 3.477 2.836 ( -1.200 -0.287 0.328) 1.277 3.019 ( -3.327 2.006 10.594) 11.284 3.144 ( -5.699 -0.264 -4.063) 7.004 3.289 ( -8.226 4.730 -4.703) 10.591 3.442 ( -3.479 1.717 1.886) 4.314 3.477 ( -2.098 3.800 6.495) 7.812 3.632 ( -2.163 0.918 6.516) 6.927 3.708 ( -5.386 4.101 1.364) 6.906 3.773 ( -3.205 2.381 0.871) 4.086 3.877 ( 2.336 9.332 2.611) 9.968 4.003 ( 8.358 -3.210 -3.579) 9.642 4.024 ( -1.432 4.293 2.389) 5.118 4.131 ( 4.503 11.745 1.780) 12.704 4.267 ( -4.992 9.110 -3.133) 10.851 4.384 ( 1.442 3.886 -5.621) 6.984 4.557 ( 3.686 6.605 0.241) 7.568 4.787 ( 6.502 -5.233 2.303) 8.658 4.845 ( 12.461 -4.091 -3.985) 13.707 4.954 ( -5.112 1.615 -1.135) 5.479 5.093 ( -0.746 0.196 4.539) 4.604 5.311 ( 7.295 -4.599 -4.882) 9.910 5.411 ( -2.950 8.800 0.514) 9.296 5.456 ( -0.590 -4.051 -4.477) 6.066 5.636 ( 6.495 2.123 -3.515) 7.684 5.792 ( -1.598 -1.538 2.293) 3.190 5.980 ( 8.721 -2.736 3.462) 9.774 6.050 ( 6.589 -6.149 -2.417) 9.331 6.111 ( 9.127 -4.107 1.644) 10.142 6.167 ( 10.349 -0.438 3.285) 10.867 6.302 ( 6.867 -1.235 -0.245) 6.982 6.479 ( 7.291 -3.682 1.594) 8.322 6.531 ( 3.574 -3.646 -0.022) 5.106 6.606 ( 5.858 -4.098 -3.734) 8.066 6.771 ( 4.125 -3.364 -0.975) 5.412 6.827 ( 3.232 -0.630 -3.969) 5.157 7.038 ( -7.776 -1.033 -3.314) 8.515 7.156 ( -1.238 3.418 3.158) 4.815 7.246 ( -0.601 5.984 0.756) 6.061 7.449 ( -0.367 5.986 -1.752) 6.248 8.049 ( -11.315 -1.262 20.077) 23.080 8.420 ( -13.510 -1.091 -19.133) 23.448 10.121 ( -4.858 1.262 1.245) 5.172 10.330 ( -6.300 7.951 -2.019) 10.344 10.553 ( 0.756 3.289 3.621) 4.950 10.718 ( 4.458 4.555 -2.920) 7.010 10.847 ( -7.289 1.065 -4.693) 8.734 11.138 ( -9.404 -1.038 8.546) 12.749 11.501 ( 11.683 2.129 0.654) 11.893 11.784 ( 3.627 -3.827 -4.178) 6.727 13.789 ( -3.973 1.098 -0.005) 4.122 14.058 ( -0.079 3.087 2.395) 3.908 14.387 ( 5.535 -13.339 0.690) 14.458 14.448 ( -0.226 -5.805 0.475) 5.829 14.540 ( 1.461 -3.326 2.849) 4.617 14.693 ( -0.592 -3.071 -0.576) 3.180 14.702 ( 3.268 -3.135 -4.133) 6.131 14.770 ( 5.538 0.066 2.810) 6.211 14.927 ( 1.702 2.645 -2.244) 3.864 15.127 ( 5.520 3.831 -3.246) 7.462 15.333 ( -2.131 -9.107 3.600) 10.022 15.385 ( -3.644 -8.084 -1.184) 8.946 24.362 ( -1.295 -0.068 0.459) 1.376 24.392 ( -0.778 0.992 0.299) 1.296 24.459 ( -1.400 0.525 0.565) 1.598 24.559 ( -0.179 0.424 -0.520) 0.695 25.243 ( -3.386 0.729 5.036) 6.112 25.479 ( -1.906 -3.890 1.729) 4.664 25.666 ( -2.152 5.327 -0.235) 5.749 26.249 ( -8.628 -4.955 1.121) 10.013 26.594 ( 6.687 0.764 -0.738) 6.770 26.675 ( 6.562 1.390 0.378) 6.718 27.396 ( 9.965 -11.462 -7.599) 16.983 27.584 ( 9.378 -14.106 6.175) 18.029 28.046 ( -5.831 11.252 5.225) 13.708 28.257 ( -4.896 2.124 -1.106) 5.450 28.335 ( -4.496 20.606 -2.459) 21.234 29.102 ( 2.807 5.544 -10.372) 12.091 ======================= Grid point 90 (38/104) ======================= q-point: ( 0.30 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 3.484 7.402 3.987) 9.101 1.877 ( -6.020 14.547 -3.775) 16.190 2.104 ( 8.011 1.129 -4.046) 9.045 2.298 ( -11.553 0.083 -1.291) 11.625 2.412 ( -0.762 6.793 -0.101) 6.836 2.460 ( 10.179 7.094 -8.880) 15.258 2.777 ( 0.410 -0.595 -4.891) 4.944 2.821 ( -1.762 2.882 4.429) 5.570 2.938 ( -4.070 6.986 -2.771) 8.547 3.089 ( -6.384 6.752 1.825) 9.470 3.125 ( -0.003 2.947 4.496) 5.376 3.421 ( -4.069 -1.774 4.017) 5.987 3.546 ( -4.256 2.816 0.681) 5.148 3.567 ( -2.974 5.306 10.219) 11.893 3.625 ( -4.424 7.299 1.896) 8.744 3.780 ( -1.214 0.689 2.648) 2.993 3.958 ( 0.394 7.615 5.087) 9.166 4.043 ( 2.978 5.791 -0.344) 6.521 4.103 ( -8.693 1.711 1.164) 8.936 4.172 ( 6.056 8.227 -5.116) 11.425 4.206 ( 6.251 9.523 -1.242) 11.459 4.384 ( 1.336 7.778 -2.339) 8.231 4.656 ( 4.440 1.721 3.351) 5.823 4.819 ( -3.808 -0.435 2.677) 4.675 4.922 ( 2.814 0.730 -0.037) 2.907 5.042 ( 7.093 -9.113 3.648) 12.110 5.113 ( -1.449 1.688 4.036) 4.608 5.362 ( 5.144 -7.592 -7.336) 11.744 5.394 ( 1.552 -0.370 1.386) 2.114 5.437 ( 4.758 5.716 -4.683) 8.789 5.712 ( 4.889 3.257 -3.148) 6.665 5.834 ( 4.405 0.224 -0.361) 4.425 6.094 ( 2.562 -8.684 -1.444) 9.168 6.122 ( 3.856 -4.669 -3.668) 7.080 6.314 ( 12.055 -6.836 4.144) 14.464 6.395 ( 10.449 -3.081 1.764) 11.036 6.463 ( 9.160 -2.462 1.669) 9.631 6.549 ( 4.358 -0.527 -1.157) 4.540 6.664 ( 4.535 -0.632 -1.304) 4.761 6.723 ( 10.856 -0.354 2.981) 11.264 6.772 ( -0.791 -1.752 -1.326) 2.335 6.860 ( 1.896 2.781 -0.294) 3.379 6.979 ( 3.807 -1.168 -3.109) 5.052 7.160 ( -0.150 0.730 1.880) 2.022 7.243 ( -1.145 4.730 2.512) 5.477 7.408 ( -2.260 6.382 -1.432) 6.920 7.978 ( -14.727 -1.184 3.351) 15.150 8.030 ( -11.265 -0.770 -7.579) 13.599 10.029 ( -3.959 3.433 -2.345) 5.741 10.253 ( -3.036 5.553 3.237) 7.109 10.502 ( -8.461 3.729 -0.859) 9.286 10.744 ( 3.039 3.409 -3.820) 5.955 10.785 ( 1.242 1.986 1.397) 2.727 11.000 ( -10.994 0.779 3.821) 11.665 11.728 ( 10.512 -0.482 1.737) 10.666 11.817 ( 4.465 -3.935 -3.135) 6.727 13.735 ( -2.477 2.150 0.597) 3.333 14.097 ( 1.611 3.121 3.229) 4.771 14.409 ( -3.330 -5.207 -1.081) 6.275 14.483 ( 3.679 -11.549 1.379) 12.199 14.564 ( 0.139 -2.976 -0.434) 3.011 14.671 ( 0.097 -6.859 -3.348) 7.633 14.708 ( 1.519 -0.159 -2.077) 2.578 14.907 ( 4.362 -0.441 3.548) 5.640 14.967 ( 4.779 0.813 -0.093) 4.848 15.199 ( 4.260 1.312 -1.693) 4.768 15.284 ( -3.443 -7.637 -1.265) 8.472 15.342 ( -1.874 -7.573 1.576) 7.959 24.346 ( -1.192 -0.138 0.847) 1.469 24.384 ( -0.414 1.145 0.237) 1.240 24.439 ( -1.264 0.236 0.410) 1.350 24.551 ( -0.250 0.334 -0.454) 0.616 25.227 ( -3.671 0.756 4.994) 6.244 25.466 ( -0.591 -3.645 -0.062) 3.693 25.627 ( -1.863 3.812 -0.374) 4.259 26.052 ( -10.225 -3.175 -2.573) 11.012 26.700 ( 5.710 -0.559 -0.805) 5.793 26.835 ( 8.927 3.362 1.882) 9.723 27.501 ( 7.314 -11.146 -5.585) 14.454 27.767 ( 5.861 -6.349 3.823) 9.449 28.012 ( -3.314 10.640 6.187) 12.747 28.168 ( -3.506 2.320 -1.628) 4.508 28.239 ( -4.632 17.390 0.012) 17.996 29.073 ( 2.725 -0.100 -7.202) 7.701 ======================= Grid point 91 (39/104) ======================= q-point: ( 0.40 0.14 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -5.485 13.845 -4.784) 15.641 1.696 ( -0.438 9.792 4.962) 10.986 2.039 ( -11.692 3.073 3.121) 12.485 2.137 ( -0.345 -3.822 -0.947) 3.953 2.460 ( 3.888 6.884 -7.867) 11.154 2.595 ( 9.119 0.691 -3.864) 9.928 2.720 ( 3.000 -0.678 -8.817) 9.338 2.861 ( -2.282 2.232 6.470) 7.214 2.930 ( 3.190 9.591 -2.634) 10.445 3.014 ( -3.579 3.935 2.239) 5.771 3.196 ( 2.059 10.382 3.849) 11.262 3.347 ( -5.372 -1.061 0.915) 5.552 3.432 ( -6.608 6.359 -0.446) 9.182 3.588 ( -3.214 3.175 5.617) 7.208 3.697 ( 2.802 2.205 9.776) 10.406 3.748 ( -2.108 0.642 0.112) 2.206 3.904 ( -7.293 7.802 -2.406) 10.948 4.018 ( -4.031 6.324 7.262) 10.439 4.089 ( 2.741 6.517 -0.973) 7.137 4.168 ( -1.161 7.939 -0.084) 8.024 4.294 ( -2.928 9.144 3.019) 10.064 4.403 ( 8.807 5.980 -4.341) 11.496 4.741 ( 0.962 -1.040 4.097) 4.335 4.793 ( -3.179 1.140 3.649) 4.972 4.965 ( 0.930 1.900 0.893) 2.296 5.097 ( -3.357 -0.497 2.044) 3.962 5.127 ( -0.685 -6.480 6.270) 9.043 5.412 ( 5.207 -0.583 -4.015) 6.601 5.488 ( 5.432 1.084 -2.836) 6.223 5.528 ( 9.587 -5.721 -0.000) 11.165 5.769 ( 4.284 2.980 -2.006) 5.591 5.870 ( 1.340 1.073 -3.980) 4.334 6.065 ( -1.737 -6.105 -0.586) 6.375 6.213 ( 7.943 -4.779 -1.048) 9.328 6.493 ( 3.564 -0.729 0.147) 3.641 6.525 ( 6.134 -6.452 -4.645) 10.041 6.603 ( 3.217 -5.965 2.482) 7.217 6.617 ( 1.700 -5.312 -0.126) 5.579 6.689 ( 0.019 1.061 5.649) 5.747 6.833 ( 7.907 -0.218 0.211) 7.913 6.876 ( 3.874 0.487 -1.048) 4.043 6.957 ( 8.021 3.266 -1.538) 8.796 7.012 ( 3.214 -1.035 -5.189) 6.191 7.220 ( 3.910 0.947 1.562) 4.316 7.248 ( -0.405 5.330 1.938) 5.686 7.367 ( -0.558 5.128 0.346) 5.169 7.653 ( -10.045 -3.854 -11.207) 15.535 7.827 ( -14.888 4.109 2.120) 15.589 9.977 ( -0.444 3.763 0.122) 3.791 10.257 ( -1.236 2.831 4.218) 5.228 10.337 ( -6.619 4.169 -2.073) 8.092 10.738 ( -1.269 -0.953 -2.502) 2.962 10.832 ( 0.341 2.051 3.336) 3.931 10.876 ( -3.861 6.479 1.540) 7.697 11.840 ( 4.383 -5.501 -2.440) 7.445 11.910 ( 4.639 0.421 1.058) 4.777 13.711 ( -1.242 2.682 1.294) 3.227 14.157 ( 1.160 4.047 1.499) 4.469 14.313 ( -3.703 -3.733 -2.834) 5.973 14.536 ( -0.003 -5.737 -0.196) 5.741 14.569 ( 3.856 -7.769 -2.077) 8.918 14.632 ( -1.021 -6.503 -3.119) 7.285 14.742 ( 2.616 -2.010 1.801) 3.759 14.976 ( 0.007 -1.283 3.425) 3.657 15.054 ( 3.562 -2.632 -0.253) 4.436 15.218 ( -0.419 -2.254 -2.238) 3.204 15.233 ( -0.827 -4.978 0.764) 5.104 15.339 ( 0.583 -4.280 0.002) 4.320 24.337 ( -0.995 -0.141 1.227) 1.586 24.381 ( 0.055 1.132 -0.014) 1.134 24.424 ( -0.861 0.158 0.579) 1.049 24.542 ( -0.204 0.364 -0.730) 0.841 25.207 ( -3.499 0.707 4.345) 5.624 25.458 ( 0.474 -3.274 -1.066) 3.476 25.600 ( -1.101 2.404 0.562) 2.703 25.890 ( -4.908 -1.538 -2.462) 5.703 26.783 ( 3.870 -1.169 0.411) 4.063 26.980 ( 5.171 5.713 0.844) 7.752 27.547 ( 3.076 -11.177 -2.550) 11.870 27.841 ( 1.433 1.632 -0.350) 2.200 28.028 ( -0.270 9.263 1.229) 9.348 28.084 ( -4.467 7.392 -3.094) 9.175 28.222 ( -1.058 5.593 9.116) 10.747 29.058 ( 2.814 -2.442 -6.819) 7.770 ======================= Grid point 92 (40/104) ======================= q-point: (-0.50 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 7.526 12.250 7.410) 16.174 1.783 ( 1.691 8.959 8.689) 12.595 1.979 ( -0.810 3.839 6.667) 7.736 2.169 ( 3.553 -4.891 1.720) 6.285 2.445 ( 2.727 4.552 -6.704) 8.550 2.534 ( -2.055 1.150 -11.748) 11.982 2.752 ( 0.866 -3.157 -8.601) 9.203 2.787 ( -5.393 0.799 -1.887) 5.769 2.906 ( -0.461 6.647 0.810) 6.712 3.052 ( 3.065 8.260 -0.195) 8.812 3.203 ( -5.622 14.630 -0.924) 15.701 3.316 ( -3.039 7.987 -0.950) 8.598 3.366 ( 3.690 2.141 5.990) 7.354 3.537 ( -5.278 -0.949 1.193) 5.493 3.712 ( -4.975 1.376 3.550) 6.265 3.797 ( 0.988 1.866 1.492) 2.585 3.831 ( -2.184 6.748 4.969) 8.659 4.011 ( 0.020 9.348 2.678) 9.724 4.144 ( -1.972 10.559 0.356) 10.748 4.152 ( 2.602 7.266 5.500) 9.477 4.302 ( 0.605 5.099 4.224) 6.649 4.504 ( 1.645 2.573 2.248) 3.792 4.769 ( -0.281 -2.029 0.318) 2.073 4.788 ( 1.300 4.998 2.645) 5.802 4.963 ( -0.732 1.884 -0.283) 2.041 5.076 ( -2.727 -3.674 5.242) 6.958 5.162 ( -2.599 -1.345 6.011) 6.686 5.427 ( 2.563 0.020 -6.903) 7.364 5.553 ( 2.256 -2.051 2.117) 3.712 5.653 ( 3.065 -9.654 -0.283) 10.133 5.807 ( -1.348 2.339 -4.610) 5.342 5.827 ( 3.030 0.766 -3.896) 4.995 6.082 ( 2.631 -0.897 3.813) 4.719 6.326 ( 2.216 -6.908 2.626) 7.715 6.450 ( -5.110 0.258 -5.018) 7.166 6.555 ( 1.497 -3.456 0.659) 3.824 6.615 ( -0.195 -6.165 -3.344) 7.017 6.678 ( 3.541 -6.171 2.334) 7.488 6.732 ( -2.138 0.885 4.262) 4.850 6.869 ( -3.132 -5.727 -2.810) 7.106 6.901 ( -3.568 2.775 -2.149) 5.005 7.005 ( 0.459 0.016 -5.092) 5.113 7.041 ( 5.583 1.167 -1.652) 5.938 7.197 ( 0.424 4.576 -4.796) 6.643 7.266 ( -2.507 5.725 0.075) 6.250 7.394 ( -8.816 2.325 3.304) 9.698 7.480 ( 1.538 3.429 -4.425) 5.806 7.676 ( 7.264 -0.433 -3.869) 8.241 10.007 ( 1.932 3.442 2.836) 4.860 10.204 ( -3.248 2.992 -2.037) 4.863 10.334 ( 2.309 2.659 4.681) 5.858 10.681 ( -0.457 -2.909 -3.233) 4.373 10.844 ( -1.368 3.800 2.479) 4.739 10.888 ( 0.749 7.882 2.729) 8.375 11.886 ( 2.408 -5.368 -0.713) 5.926 11.936 ( -1.935 0.387 -0.950) 2.190 13.717 ( -0.014 2.687 2.432) 3.624 14.093 ( -3.937 4.241 -6.079) 8.392 14.312 ( 2.288 -3.538 1.817) 4.589 14.518 ( -0.106 -4.112 -2.429) 4.777 14.581 ( -1.992 -6.823 -1.870) 7.350 14.627 ( 3.712 -8.033 -1.080) 8.915 14.825 ( 2.795 -3.428 4.531) 6.332 14.958 ( -4.027 -3.941 0.930) 5.711 15.076 ( 0.237 -2.972 -0.976) 3.137 15.201 ( 0.960 -3.677 -2.046) 4.316 15.244 ( 0.122 -2.888 2.061) 3.550 15.341 ( -0.327 -1.913 -0.675) 2.055 24.334 ( -0.625 -0.084 1.296) 1.441 24.386 ( 0.614 1.103 -0.193) 1.277 24.420 ( -0.571 0.033 1.131) 1.268 24.531 ( 0.030 0.536 -1.195) 1.310 25.184 ( -3.079 0.769 3.418) 4.664 25.465 ( 1.163 -3.459 -0.619) 3.701 25.602 ( 0.408 1.988 1.074) 2.296 25.840 ( 1.300 -1.058 -1.791) 2.453 26.839 ( 0.987 -0.759 2.105) 2.446 27.009 ( -1.739 4.914 -1.403) 5.398 27.595 ( 3.444 -8.953 1.200) 9.667 27.839 ( 0.050 1.905 -3.809) 4.259 27.961 ( -6.279 8.568 -1.066) 10.675 28.032 ( 1.756 9.720 -1.722) 10.026 28.314 ( -0.630 2.307 11.037) 11.293 29.045 ( 3.309 -3.074 -7.422) 8.688 ======================= Grid point 93 (41/104) ======================= q-point: (-0.40 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -8.072 6.361 -1.739) 10.423 1.884 ( -3.708 5.523 8.206) 10.564 2.069 ( 5.630 3.860 -0.213) 6.830 2.303 ( 7.926 1.036 5.241) 9.558 2.400 ( -1.431 -0.125 -4.430) 4.657 2.437 ( 0.850 3.624 -6.765) 7.721 2.692 ( 6.948 -0.333 -7.577) 10.286 2.733 ( 0.771 14.456 -1.768) 14.584 2.907 ( 0.905 -0.536 1.019) 1.464 3.054 ( -3.158 10.739 -5.435) 12.443 3.133 ( 2.883 3.173 4.083) 5.920 3.253 ( -5.455 9.640 3.283) 11.553 3.449 ( 0.937 3.923 1.227) 4.216 3.540 ( 1.066 1.434 2.540) 3.105 3.678 ( -1.207 3.620 4.043) 5.560 3.767 ( -4.406 3.710 1.337) 5.914 3.840 ( 0.197 5.284 1.571) 5.517 4.037 ( -4.621 8.924 0.398) 10.058 4.137 ( 3.409 8.274 3.666) 9.671 4.221 ( -0.770 10.102 0.881) 10.169 4.356 ( -1.047 -0.902 2.370) 2.744 4.509 ( -1.847 1.239 6.804) 7.158 4.771 ( -0.360 4.956 -0.753) 5.026 4.859 ( 3.634 2.869 0.695) 4.682 4.982 ( 1.231 0.932 3.654) 3.967 5.070 ( -4.866 -5.673 6.354) 9.810 5.145 ( -3.704 1.801 5.004) 6.481 5.387 ( 0.523 -4.596 -6.000) 7.576 5.554 ( -6.032 -5.257 1.548) 8.150 5.661 ( 1.087 -2.225 0.945) 2.650 5.744 ( 1.165 0.995 -6.368) 6.550 5.848 ( 0.915 1.139 -1.190) 1.885 6.179 ( -2.576 -3.229 1.367) 4.351 6.275 ( -2.961 -3.769 -1.445) 5.006 6.319 ( -5.760 -6.582 2.453) 9.084 6.520 ( -5.450 -5.182 -5.510) 9.323 6.578 ( -3.309 -2.155 4.490) 5.979 6.648 ( -9.129 -2.014 -3.369) 9.937 6.714 ( -8.683 3.161 1.869) 9.427 6.756 ( -1.588 -8.148 -0.630) 8.325 6.843 ( 2.641 2.553 -0.974) 3.800 6.935 ( -3.283 2.794 -3.462) 5.529 7.035 ( -1.939 1.406 0.346) 2.420 7.099 ( -7.871 2.744 -2.481) 8.697 7.260 ( 1.812 5.449 -2.334) 6.198 7.302 ( 3.348 0.600 -0.291) 3.414 7.485 ( 0.770 2.459 -6.434) 6.931 7.952 ( 21.953 0.231 -0.933) 21.974 10.080 ( 1.600 1.968 3.135) 4.033 10.170 ( 2.441 4.818 -1.027) 5.498 10.434 ( 3.476 1.177 3.860) 5.326 10.687 ( 5.194 -1.133 -4.759) 7.136 10.837 ( -1.320 3.386 2.856) 4.622 10.925 ( -0.201 7.309 3.037) 7.918 11.833 ( -7.569 0.656 -2.106) 7.884 11.906 ( -0.116 -5.215 0.356) 5.228 13.760 ( 1.319 2.246 4.593) 5.280 13.981 ( -1.688 3.932 -6.209) 7.541 14.364 ( 1.814 -3.461 1.136) 4.069 14.484 ( -0.965 -5.800 -3.195) 6.691 14.528 ( -2.307 -6.430 -1.586) 7.013 14.677 ( 2.989 -7.207 -0.876) 7.851 14.836 ( -5.537 -4.497 0.850) 7.184 14.944 ( 1.303 -4.176 3.642) 5.692 15.060 ( -1.756 -0.565 0.776) 2.001 15.199 ( 1.074 -4.070 -3.596) 5.537 15.263 ( 0.148 -3.823 1.567) 4.135 15.317 ( -1.364 -0.740 -0.467) 1.620 24.339 ( -0.031 0.030 1.061) 1.062 24.400 ( 0.859 1.486 0.215) 1.730 24.423 ( -0.389 -0.540 1.432) 1.579 24.523 ( 0.550 0.836 -1.566) 1.858 25.165 ( -2.179 0.903 2.750) 3.623 25.483 ( 0.753 -4.104 0.508) 4.203 25.632 ( 1.685 2.482 1.157) 3.215 25.892 ( 6.484 -1.774 -2.756) 7.266 26.851 ( -2.817 0.857 3.310) 4.430 26.911 ( -6.512 2.235 -2.296) 7.257 27.671 ( 0.933 -6.868 1.260) 7.045 27.734 ( -4.088 -2.152 -5.178) 6.940 27.899 ( -1.814 8.006 1.986) 8.446 28.072 ( 4.152 11.208 -0.804) 11.979 28.390 ( -1.289 3.150 9.209) 9.817 29.042 ( 4.697 -1.479 -8.159) 9.529 ======================= Grid point 94 (42/104) ======================= q-point: (-0.30 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -15.604 9.569 -9.511) 20.628 1.703 ( -20.844 6.401 5.131) 22.400 2.111 ( 3.922 2.683 -8.310) 9.573 2.348 ( -3.425 10.969 0.092) 11.491 2.435 ( 5.725 2.180 -3.685) 7.149 2.454 ( 2.557 4.043 -1.175) 4.926 2.677 ( -6.064 13.954 5.698) 16.247 2.762 ( 4.966 1.199 -9.250) 10.567 2.962 ( -3.224 12.259 -1.856) 12.811 3.090 ( 11.553 -2.369 1.923) 11.949 3.223 ( 0.869 3.529 8.402) 9.155 3.295 ( 6.650 3.485 0.993) 7.573 3.442 ( 0.104 3.899 0.775) 3.976 3.535 ( -2.139 0.935 2.822) 3.663 3.670 ( -1.502 -1.242 -2.596) 3.246 3.778 ( 0.211 7.725 4.427) 8.906 3.865 ( 0.242 8.043 -0.133) 8.048 3.922 ( -1.810 5.403 -0.484) 5.719 4.145 ( -5.218 9.972 -0.798) 11.282 4.258 ( 3.970 6.006 3.099) 7.838 4.298 ( -5.982 -3.561 2.286) 7.327 4.575 ( -1.324 2.970 7.237) 7.934 4.732 ( -2.179 9.598 -2.708) 10.208 4.870 ( -4.838 -3.142 2.281) 6.204 4.978 ( -3.619 -3.778 0.951) 5.318 5.011 ( -5.772 -6.359 3.342) 9.216 5.187 ( 0.295 6.565 6.714) 9.395 5.390 ( 2.493 -1.117 -0.934) 2.887 5.460 ( -2.819 -0.732 -0.062) 2.913 5.665 ( -4.328 1.961 -1.390) 4.950 5.725 ( 2.607 -6.258 -2.038) 7.079 5.820 ( -3.075 -0.956 0.382) 3.243 5.987 ( -7.670 -2.483 -3.616) 8.836 6.217 ( -6.397 -6.214 0.113) 8.919 6.316 ( -5.457 -8.422 2.470) 10.335 6.354 ( -7.214 -0.330 -4.425) 8.469 6.440 ( -6.506 -2.934 -4.365) 8.366 6.501 ( -12.745 -1.840 8.086) 15.205 6.577 ( -8.593 3.825 -1.533) 9.530 6.613 ( -5.532 -4.637 0.678) 7.250 6.882 ( 3.071 3.580 -0.234) 4.722 6.946 ( 1.464 0.072 -2.771) 3.135 7.031 ( 2.682 -0.692 3.596) 4.539 7.084 ( 1.967 0.409 3.309) 3.871 7.249 ( -0.238 2.846 -0.813) 2.970 7.289 ( 2.188 -1.826 -13.634) 13.929 7.471 ( 2.541 5.440 -0.046) 6.004 8.359 ( 24.071 3.168 -0.703) 24.289 10.089 ( -0.252 0.758 -0.752) 1.097 10.289 ( 7.962 6.774 2.766) 10.814 10.486 ( -0.336 -0.196 0.808) 0.896 10.731 ( 3.743 0.571 -5.403) 6.597 10.903 ( 2.507 4.546 3.093) 6.043 10.934 ( 1.531 3.967 3.787) 5.694 11.655 ( -9.832 0.596 -1.657) 9.988 11.883 ( -2.625 -4.688 -0.290) 5.380 13.852 ( 2.519 1.271 7.989) 8.472 13.925 ( 1.187 3.690 -4.899) 6.247 14.398 ( 0.649 -3.204 0.559) 3.316 14.424 ( -1.054 -6.452 -4.751) 8.081 14.465 ( -3.365 -7.346 -1.114) 8.157 14.716 ( 2.130 -6.275 -0.758) 6.669 14.742 ( -4.784 -4.805 0.119) 6.782 14.945 ( -5.492 -3.531 2.520) 6.999 15.055 ( -0.677 3.763 2.706) 4.684 15.162 ( -0.376 -6.786 -4.227) 8.004 15.247 ( -2.713 2.335 -0.226) 3.587 15.338 ( 3.744 -6.685 0.478) 7.677 24.352 ( 0.523 0.207 0.730) 0.922 24.412 ( -0.302 1.427 1.093) 1.823 24.437 ( 0.749 -0.386 1.139) 1.417 24.523 ( 1.255 1.041 -1.629) 2.305 25.163 ( -0.856 0.939 2.877) 3.145 25.502 ( 0.361 -4.781 1.637) 5.067 25.676 ( 1.569 3.045 2.033) 3.984 25.993 ( 8.357 -2.854 -5.307) 10.303 26.750 ( -8.299 0.624 -1.152) 8.402 26.811 ( -5.743 3.121 2.824) 7.120 27.513 ( -8.971 -10.707 -6.409) 15.369 27.752 ( -2.067 -5.642 5.069) 7.861 27.908 ( 1.828 6.561 0.950) 6.877 28.158 ( 5.414 12.352 0.748) 13.507 28.445 ( -0.332 4.433 6.154) 7.592 29.069 ( 7.864 4.456 -9.443) 13.072 ======================= Grid point 95 (43/104) ======================= q-point: (-0.20 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.088 ( -18.829 16.556 -2.762) 25.224 1.336 ( -24.825 14.320 6.106) 29.303 2.076 ( -7.844 13.746 -3.151) 16.138 2.185 ( -15.079 18.492 6.082) 24.623 2.401 ( -4.470 0.309 -1.810) 4.833 2.478 ( 5.099 3.005 -9.326) 11.046 2.635 ( -3.221 10.803 0.790) 11.301 2.786 ( 8.514 -1.975 -4.929) 10.034 2.891 ( -3.977 16.693 1.788) 17.253 3.204 ( 2.434 -4.060 0.222) 4.739 3.280 ( -2.211 1.945 -5.341) 6.099 3.349 ( 4.467 0.057 6.734) 8.081 3.550 ( -1.013 0.128 4.332) 4.451 3.633 ( 4.538 1.451 2.280) 5.281 3.663 ( 10.414 1.050 3.786) 11.130 3.762 ( -0.231 2.297 -0.421) 2.347 3.899 ( 2.371 10.401 0.378) 10.674 3.972 ( 0.578 1.851 2.352) 3.048 4.058 ( -2.569 10.370 -0.868) 10.719 4.176 ( -6.852 -7.299 2.307) 10.273 4.347 ( 1.126 10.388 2.438) 10.730 4.554 ( -3.771 0.731 0.784) 3.921 4.656 ( -3.134 9.282 -2.460) 10.101 4.842 ( -1.777 -9.896 7.203) 12.368 4.905 ( -7.618 -2.986 0.268) 8.187 4.946 ( -1.213 -1.404 -1.174) 2.195 5.197 ( -3.898 5.546 3.518) 7.637 5.344 ( -5.145 3.685 -2.186) 6.695 5.443 ( -4.572 -0.083 2.367) 5.149 5.522 ( -6.414 -2.791 -4.515) 8.326 5.737 ( 2.765 -1.754 -2.919) 4.386 5.821 ( -0.977 -6.572 0.838) 6.697 5.892 ( -1.712 -0.825 0.164) 1.907 6.046 ( -11.924 -0.346 -2.565) 12.202 6.162 ( -9.254 -7.803 1.361) 12.181 6.205 ( -5.105 -0.004 -1.308) 5.269 6.304 ( -6.882 -2.420 0.451) 7.309 6.380 ( -7.509 0.499 3.058) 8.123 6.465 ( -1.961 -1.881 -1.422) 3.067 6.583 ( -2.829 -10.199 2.745) 10.934 6.869 ( -8.390 -5.474 -2.333) 10.286 6.904 ( 1.279 -0.782 -3.173) 3.510 7.046 ( -0.154 9.252 -2.978) 9.721 7.210 ( 3.980 0.248 3.070) 5.033 7.252 ( 7.261 -0.026 1.434) 7.402 7.357 ( 11.275 -1.263 -2.419) 11.601 7.509 ( 1.551 6.305 -0.481) 6.511 8.773 ( 24.174 7.246 -2.215) 25.334 10.078 ( 0.469 0.848 -1.811) 2.054 10.440 ( 3.880 7.687 -0.703) 8.639 10.468 ( -0.057 1.327 2.886) 3.177 10.732 ( 1.772 0.129 -3.419) 3.853 10.874 ( -2.455 1.920 0.589) 3.172 11.118 ( 8.703 3.842 4.952) 10.725 11.477 ( -8.850 -1.732 -0.487) 9.031 11.810 ( -3.841 -3.187 -2.684) 5.667 13.921 ( 3.057 3.205 -3.607) 5.712 14.000 ( 3.058 -1.870 11.866) 12.396 14.327 ( -2.177 -3.029 -6.558) 7.545 14.392 ( -3.936 -6.638 1.296) 7.825 14.440 ( 1.103 -5.791 0.245) 5.900 14.671 ( -3.299 -3.408 0.279) 4.751 14.736 ( 0.484 -6.458 -0.728) 6.517 14.838 ( -7.695 -0.662 2.087) 8.000 15.015 ( -3.112 2.329 -4.594) 6.018 15.156 ( -0.026 -8.799 2.950) 9.281 15.204 ( 0.489 7.418 -2.383) 7.807 15.417 ( 4.100 -7.912 0.442) 8.922 24.371 ( 0.996 0.479 0.629) 1.272 24.413 ( -0.471 0.969 0.884) 1.393 24.463 ( 0.521 0.769 1.503) 1.767 24.537 ( 1.894 0.889 -1.566) 2.613 25.189 ( 0.220 0.827 3.826) 3.921 25.531 ( 0.934 -4.902 2.479) 5.572 25.736 ( 1.065 1.636 7.651) 7.896 26.063 ( 5.651 -2.684 -6.981) 9.374 26.613 ( -5.804 -0.621 -0.395) 5.851 26.724 ( -6.107 4.367 1.871) 7.737 27.245 ( -16.206 -20.470 -7.241) 27.094 27.701 ( -7.798 -9.406 4.266) 12.941 27.982 ( 4.355 6.365 1.703) 7.898 28.268 ( 5.105 11.650 2.449) 12.954 28.491 ( 1.098 6.194 2.152) 6.648 29.158 ( 15.067 17.027 -14.363) 26.893 ======================= Grid point 96 (44/104) ======================= q-point: (-0.10 0.14 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( -11.841 22.797 15.194) 29.846 1.007 ( -20.150 23.041 12.886) 33.210 1.706 ( -27.855 42.879 17.705) 54.110 2.145 ( -7.159 3.648 -5.047) 9.489 2.180 ( -4.256 -2.470 -2.225) 5.401 2.519 ( 2.468 5.941 -1.398) 6.584 2.638 ( 8.219 9.136 -4.347) 13.036 2.848 ( -2.167 14.986 1.016) 15.176 2.958 ( 8.397 -2.879 1.066) 8.941 3.190 ( -2.448 -0.406 1.802) 3.066 3.226 ( -3.118 -4.661 0.901) 5.679 3.492 ( 4.848 2.451 4.143) 6.832 3.603 ( 1.508 -7.476 8.684) 11.558 3.714 ( 2.871 -0.003 1.591) 3.283 3.747 ( 1.175 -1.701 -0.808) 2.219 3.801 ( -1.332 6.646 3.639) 7.693 3.974 ( -0.117 3.207 0.720) 3.289 3.997 ( 5.361 -0.459 1.541) 5.597 4.061 ( 2.304 8.597 -0.854) 8.941 4.152 ( 2.471 1.419 1.889) 3.419 4.324 ( -4.527 9.075 -2.127) 10.363 4.492 ( -5.230 -10.133 2.902) 11.767 4.612 ( -0.057 12.609 -1.937) 12.757 4.670 ( -14.318 -1.687 -3.249) 14.779 4.831 ( -5.175 -4.747 -0.681) 7.056 4.982 ( 3.139 -0.715 0.344) 3.238 5.153 ( -2.935 4.736 -2.933) 6.297 5.245 ( 0.491 4.177 0.534) 4.240 5.295 ( -7.244 2.571 -4.010) 8.670 5.464 ( -3.579 -3.438 7.779) 9.227 5.658 ( -10.794 -5.582 -2.292) 12.366 5.776 ( 0.390 3.453 -0.677) 3.540 5.875 ( -5.618 1.152 1.301) 5.880 5.910 ( 2.396 1.051 -4.215) 4.961 6.024 ( -5.490 -6.278 -3.199) 8.932 6.117 ( -2.919 -0.701 -1.482) 3.348 6.203 ( -5.869 -3.265 1.254) 6.832 6.309 ( -2.929 -2.421 1.440) 4.064 6.430 ( -5.011 -8.029 5.258) 10.827 6.559 ( -0.400 -9.059 -0.864) 9.109 6.670 ( -6.846 -6.096 -3.999) 10.001 6.891 ( 0.927 -3.047 -4.237) 5.301 7.057 ( 3.177 7.676 -3.949) 9.199 7.229 ( 0.745 1.902 0.282) 2.062 7.419 ( 1.917 1.445 0.827) 2.539 7.539 ( 5.738 6.562 0.688) 8.744 7.589 ( 9.375 -0.922 8.379) 12.608 9.138 ( 21.145 5.193 -11.517) 24.632 10.097 ( 3.677 2.928 0.695) 4.752 10.416 ( -2.259 2.100 0.215) 3.092 10.527 ( 2.227 6.871 0.769) 7.264 10.746 ( 0.428 5.064 -0.487) 5.105 10.864 ( 1.707 -1.242 -1.543) 2.615 11.267 ( 2.204 1.052 3.649) 4.391 11.346 ( -6.045 -6.166 3.290) 9.241 11.724 ( -0.645 0.317 -4.768) 4.822 13.953 ( 3.873 2.080 -3.160) 5.414 14.127 ( -3.761 -11.971 9.846) 15.949 14.236 ( -0.745 1.054 -5.759) 5.902 14.364 ( -1.431 -2.480 4.116) 5.014 14.433 ( -2.420 -4.021 0.720) 4.748 14.643 ( -0.349 -2.456 1.386) 2.841 14.715 ( -2.311 -4.807 0.018) 5.334 14.741 ( -4.012 -0.838 0.160) 4.102 14.914 ( -1.157 2.995 -5.960) 6.770 15.173 ( -0.632 -5.361 3.794) 6.598 15.239 ( 5.381 5.524 -5.449) 9.443 15.479 ( 2.422 -7.957 0.076) 8.317 24.395 ( 0.534 0.398 0.683) 0.954 24.417 ( 0.707 1.049 -0.061) 1.267 24.482 ( 0.149 1.427 1.323) 1.951 24.557 ( 1.782 0.722 -1.439) 2.401 25.230 ( -0.283 0.781 4.188) 4.269 25.570 ( 1.669 -2.721 -0.466) 3.225 25.928 ( 3.521 -12.296 26.902) 29.788 26.084 ( 4.328 -1.465 -3.198) 5.577 26.541 ( -2.518 -0.522 -0.117) 2.574 26.638 ( -6.463 -0.656 -3.105) 7.200 26.748 ( -27.556 -14.519 -5.758) 31.674 27.585 ( -7.787 -12.944 1.344) 15.166 28.068 ( 2.663 7.359 2.500) 8.216 28.369 ( 2.184 6.946 4.208) 8.410 28.516 ( 1.321 9.185 -1.768) 9.446 29.319 ( 24.082 31.492 -30.125) 49.792 ======================= Grid point 97 (45/104) ======================= q-point: ( 0.00 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -0.504 25.583 11.964) 28.247 1.483 ( -2.377 26.074 12.999) 29.232 2.021 ( -1.245 6.582 -3.604) 7.607 2.239 ( 7.006 0.704 4.325) 8.263 2.557 ( -1.802 21.025 11.712) 24.135 2.640 ( 0.943 0.835 -0.040) 1.261 2.784 ( 2.750 7.177 0.895) 7.737 2.931 ( 1.275 -1.570 0.117) 2.026 3.051 ( 1.279 -0.342 -2.446) 2.781 3.128 ( -2.089 13.316 -4.844) 14.323 3.401 ( 1.173 7.070 6.524) 9.692 3.478 ( -0.642 0.796 3.364) 3.516 3.592 ( -0.188 -4.734 0.374) 4.753 3.649 ( -5.472 3.889 3.276) 7.470 3.777 ( -2.411 -2.175 4.026) 5.172 3.872 ( -0.113 0.043 -3.107) 3.109 3.925 ( -1.104 3.317 2.414) 4.248 4.036 ( 1.706 -0.456 -1.811) 2.529 4.137 ( -0.456 -9.619 2.789) 10.026 4.315 ( -5.747 8.141 -1.070) 10.022 4.451 ( 4.102 -1.453 -2.109) 4.835 4.492 ( -1.090 16.093 3.830) 16.579 4.636 ( 1.360 9.086 0.459) 9.199 4.756 ( -4.436 7.570 -8.211) 12.017 4.907 ( 3.246 11.067 -3.780) 12.137 4.959 ( 5.313 -2.215 -1.028) 5.847 5.179 ( -1.316 4.415 -3.326) 5.682 5.284 ( -2.236 3.921 0.235) 4.520 5.430 ( 2.011 -0.798 0.034) 2.164 5.472 ( -1.315 4.268 6.757) 8.100 5.557 ( -1.033 5.145 5.454) 7.569 5.728 ( 1.063 -7.367 -1.221) 7.543 5.768 ( -1.705 -8.300 -2.789) 8.920 5.892 ( 1.971 3.309 1.481) 4.127 5.899 ( -4.771 1.258 3.010) 5.780 6.032 ( 1.200 -4.083 0.555) 4.291 6.108 ( -2.144 -1.683 -3.890) 4.750 6.156 ( -2.346 -1.855 0.543) 3.040 6.313 ( 1.383 -4.846 1.571) 5.279 6.408 ( -0.854 -4.523 -1.605) 4.875 6.556 ( 4.569 0.299 -2.729) 5.330 6.765 ( 2.194 -5.551 -6.458) 8.794 7.179 ( 3.102 4.152 -2.481) 5.747 7.305 ( -0.591 2.959 1.910) 3.571 7.440 ( -2.723 1.519 -2.523) 4.011 7.690 ( 0.067 5.557 -2.222) 5.985 7.821 ( 2.744 0.095 12.617) 12.912 8.972 ( -0.691 -17.079 -16.706) 23.901 10.252 ( 0.129 3.269 4.163) 5.295 10.419 ( -2.021 2.186 -0.152) 2.981 10.674 ( 1.686 4.930 2.546) 5.799 10.791 ( -1.083 -2.272 0.213) 2.526 10.896 ( 1.382 2.979 1.026) 3.440 11.191 ( 1.834 -6.179 2.573) 6.940 11.291 ( -3.608 2.320 3.070) 5.275 11.735 ( 2.380 -1.584 -3.657) 4.642 13.936 ( -3.029 -1.454 0.560) 3.406 14.034 ( 1.629 -0.295 -0.192) 1.666 14.237 ( 0.373 1.605 -3.013) 3.435 14.255 ( 0.510 -4.022 -1.910) 4.481 14.415 ( -1.913 -0.166 2.921) 3.495 14.503 ( 0.763 -7.234 0.155) 7.275 14.652 ( 0.377 -2.318 0.310) 2.369 14.684 ( -0.753 -2.447 0.415) 2.594 14.928 ( 0.129 0.882 -0.356) 0.959 15.078 ( -0.321 -4.436 4.487) 6.318 15.245 ( 0.255 -4.083 -6.649) 7.807 15.331 ( -0.043 -5.475 -3.666) 6.589 24.409 ( -0.807 0.955 0.300) 1.286 24.435 ( -0.432 0.468 -0.252) 0.685 24.523 ( 0.031 1.935 -1.018) 2.187 24.581 ( 0.908 0.418 -1.553) 1.847 25.276 ( -2.153 1.805 4.868) 5.621 25.474 ( -4.700 -5.126 6.273) 9.365 25.871 ( -4.248 3.172 4.384) 6.880 26.100 ( 4.008 -2.008 -1.045) 4.603 26.524 ( 2.683 0.370 1.026) 2.896 26.571 ( 9.687 -2.285 7.333) 12.362 26.649 ( -1.464 1.992 -1.779) 3.045 27.159 ( -4.538 -14.274 -4.959) 15.778 28.265 ( 0.025 6.384 2.719) 6.939 28.422 ( -2.370 0.450 2.240) 3.292 28.870 ( 0.210 19.688 -0.095) 19.690 29.604 ( 3.814 1.518 -19.609) 20.034 ======================= Grid point 98 (46/104) ======================= q-point: ( 0.10 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 5.245 22.872 10.574) 25.738 1.663 ( 5.696 18.227 15.586) 24.649 2.089 ( 9.612 10.034 -2.695) 14.154 2.381 ( 6.330 3.613 -2.529) 7.715 2.583 ( -1.993 -1.379 -0.646) 2.508 2.666 ( 1.651 -5.217 -0.695) 5.516 2.843 ( -0.458 8.395 -0.614) 8.430 2.972 ( -3.770 5.676 2.146) 7.144 3.027 ( 5.958 11.643 6.878) 14.777 3.183 ( 6.485 9.855 -1.058) 11.844 3.423 ( -1.735 3.937 4.824) 6.464 3.536 ( -3.824 2.078 4.056) 5.950 3.575 ( 0.339 1.408 0.050) 1.449 3.615 ( -1.208 0.279 5.420) 5.560 3.779 ( 0.946 -3.892 0.324) 4.018 3.840 ( -0.335 2.721 -1.143) 2.970 3.909 ( -4.203 4.645 3.718) 7.284 3.986 ( -2.722 2.013 0.539) 3.428 4.128 ( -4.841 -1.369 -1.873) 5.368 4.336 ( 7.886 -5.347 6.801) 11.706 4.374 ( -2.451 5.188 -1.813) 6.017 4.523 ( -4.088 5.166 -7.503) 9.985 4.686 ( 8.168 9.745 0.349) 12.720 4.714 ( 1.965 15.070 0.237) 15.200 4.868 ( -0.545 15.447 -9.353) 18.066 5.006 ( 4.153 -0.357 -5.913) 7.235 5.203 ( -2.106 1.392 2.749) 3.732 5.222 ( -1.275 3.106 0.428) 3.384 5.398 ( -1.884 -2.744 0.787) 3.420 5.566 ( 2.823 1.708 -2.238) 3.987 5.586 ( 3.404 1.111 1.321) 3.816 5.728 ( -0.953 -3.389 4.955) 6.079 5.809 ( 3.114 -7.737 2.132) 8.609 5.875 ( 0.376 3.048 -2.070) 3.703 5.907 ( 2.108 -1.007 2.594) 3.491 6.052 ( 1.955 -1.318 -3.505) 4.224 6.141 ( 8.032 -1.983 1.199) 8.360 6.240 ( 7.505 -3.983 1.913) 8.709 6.367 ( 2.762 -5.923 1.093) 6.626 6.418 ( 5.053 -4.212 -2.565) 7.060 6.646 ( 7.435 0.798 -2.237) 7.805 6.769 ( 5.338 -3.316 -6.991) 9.400 7.233 ( 1.149 4.773 3.250) 5.888 7.248 ( -7.854 2.571 -1.301) 8.366 7.330 ( -3.580 2.793 -1.555) 4.799 7.634 ( -0.308 9.313 -5.404) 10.772 7.950 ( -5.730 -6.399 18.425) 20.328 8.694 ( -10.517 -13.772 -18.898) 25.640 10.245 ( -4.662 4.194 4.363) 7.639 10.424 ( 1.971 0.931 0.228) 2.192 10.734 ( -1.879 6.019 0.326) 6.314 10.756 ( 2.402 4.408 -0.839) 5.089 10.937 ( -1.790 -1.730 5.232) 5.795 11.188 ( -1.873 5.199 -1.685) 5.777 11.338 ( 4.996 -6.179 3.297) 8.603 11.711 ( -0.447 -4.556 -4.213) 6.222 13.880 ( -3.659 1.093 0.843) 3.910 14.059 ( 1.526 -1.612 -0.033) 2.220 14.185 ( -1.017 0.311 -1.980) 2.248 14.298 ( 3.649 -4.114 -1.494) 5.698 14.420 ( -0.270 -2.596 2.746) 3.788 14.542 ( 2.612 -6.080 0.812) 6.667 14.656 ( 0.465 -2.874 -0.900) 3.048 14.696 ( 1.387 -1.819 1.193) 2.580 14.938 ( 0.684 0.343 0.477) 0.902 15.113 ( 0.039 -4.704 3.009) 5.584 15.185 ( 0.286 -3.044 -5.115) 5.959 15.282 ( -1.775 -6.514 -2.939) 7.364 24.391 ( -1.380 0.831 0.231) 1.627 24.420 ( -1.067 0.439 0.176) 1.167 24.505 ( -1.000 1.781 -0.619) 2.134 24.576 ( 0.038 0.160 -1.225) 1.236 25.275 ( -2.934 1.682 4.966) 6.008 25.436 ( -4.757 -3.500 4.858) 7.647 25.832 ( -2.400 6.250 0.232) 6.699 26.170 ( 1.969 -4.171 1.954) 5.009 26.545 ( 1.533 1.133 -0.689) 2.026 26.651 ( 2.427 2.123 -1.286) 3.471 26.944 ( 17.358 -10.645 9.068) 22.290 27.107 ( 7.551 -11.621 -8.202) 16.104 28.264 ( -3.717 6.206 4.395) 8.464 28.374 ( -4.205 1.168 0.502) 4.393 28.841 ( -3.835 19.419 0.585) 19.803 29.413 ( -4.341 4.714 -16.362) 17.572 ======================= Grid point 99 (47/104) ======================= q-point: ( 0.20 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 3.357 15.911 8.319) 18.265 1.930 ( 8.902 12.089 13.330) 20.077 2.219 ( 7.915 10.540 -5.123) 14.141 2.401 ( -0.541 1.062 -6.286) 6.398 2.541 ( -0.002 -1.719 0.006) 1.719 2.668 ( -1.577 -0.890 -2.964) 3.473 2.753 ( -5.299 -0.353 -4.242) 6.797 2.890 ( -3.436 1.540 -1.647) 4.110 3.173 ( -1.326 4.209 -1.495) 4.660 3.220 ( 1.411 12.577 1.274) 12.720 3.394 ( -7.431 2.752 -0.086) 7.925 3.471 ( -5.090 3.208 2.537) 6.530 3.625 ( -0.400 11.008 9.878) 14.796 3.636 ( 0.337 2.577 5.788) 6.344 3.744 ( -6.031 -1.813 -2.852) 6.914 3.870 ( 0.967 6.275 4.636) 7.861 3.974 ( 9.975 3.330 3.505) 11.085 3.992 ( 0.133 1.724 2.757) 3.254 4.088 ( 2.341 1.607 0.124) 2.842 4.357 ( 4.053 -4.832 -4.153) 7.551 4.458 ( 2.971 13.544 1.558) 13.954 4.566 ( 1.014 3.458 4.139) 5.488 4.634 ( -0.465 15.167 0.737) 15.192 4.804 ( 2.893 10.638 -5.071) 12.135 4.871 ( 8.045 5.200 -1.763) 9.740 5.001 ( 0.816 -0.835 -5.113) 5.245 5.084 ( -6.051 0.125 -1.110) 6.154 5.254 ( 2.424 -0.220 -1.947) 3.117 5.393 ( -0.176 -0.108 -1.253) 1.270 5.593 ( 0.221 1.257 0.266) 1.304 5.642 ( 7.295 4.097 -5.142) 9.821 5.761 ( 0.247 0.013 3.759) 3.767 5.905 ( 5.932 -4.916 3.366) 8.408 5.923 ( 4.440 -3.415 0.666) 5.640 6.024 ( 7.599 -5.081 1.005) 9.196 6.131 ( 8.505 -2.745 -0.995) 8.992 6.279 ( 7.296 -2.197 -1.034) 7.689 6.362 ( 6.218 -7.093 -0.693) 9.458 6.479 ( 6.269 -2.354 5.060) 8.393 6.523 ( 7.800 -3.999 -1.290) 8.859 6.747 ( 5.126 1.842 -2.639) 6.052 6.829 ( 8.256 0.976 -4.826) 9.613 7.054 ( -7.051 3.436 -3.168) 8.459 7.232 ( -4.495 4.207 1.682) 6.382 7.338 ( 0.928 3.657 3.677) 5.269 7.580 ( -1.363 6.106 -4.010) 7.431 7.973 ( -9.804 -6.946 18.158) 21.774 8.304 ( -12.930 -10.754 -18.758) 25.193 10.193 ( -4.762 5.184 2.598) 7.503 10.431 ( -2.862 1.808 0.589) 3.436 10.674 ( -3.158 7.547 1.637) 8.344 10.809 ( 2.500 2.909 -1.405) 4.085 10.904 ( -2.681 5.623 -3.561) 7.175 11.117 ( -8.654 -0.402 7.596) 11.522 11.501 ( 11.363 -2.804 -1.297) 11.775 11.679 ( 2.551 -6.562 -4.433) 8.320 13.831 ( -2.739 3.060 0.966) 4.219 14.086 ( 0.862 -3.058 1.128) 3.372 14.183 ( 2.087 -3.128 -0.628) 3.813 14.338 ( 1.790 -4.167 -0.174) 4.538 14.449 ( 0.714 -4.879 1.714) 5.221 14.569 ( -0.569 -6.737 0.208) 6.764 14.672 ( 2.549 -1.994 -2.236) 3.934 14.761 ( 4.134 -1.440 2.944) 5.276 14.950 ( -0.216 -0.740 0.679) 1.027 15.137 ( 1.698 -2.950 -0.426) 3.430 15.164 ( -1.193 -7.842 0.447) 7.945 15.229 ( -0.138 -3.260 -3.497) 4.783 24.369 ( -1.430 0.663 0.453) 1.640 24.405 ( -0.980 0.227 0.568) 1.155 24.480 ( -1.305 1.613 -0.217) 2.087 24.563 ( -0.281 -0.161 -0.810) 0.872 25.265 ( -3.305 1.451 4.866) 6.058 25.407 ( -2.738 -3.246 3.165) 5.296 25.780 ( -2.817 5.831 -1.728) 6.703 26.134 ( -7.204 -5.918 -0.039) 9.323 26.622 ( 7.259 2.042 -1.517) 7.692 26.708 ( 6.996 1.653 -0.498) 7.205 27.197 ( 13.352 -7.835 -7.667) 17.276 27.340 ( 14.167 -10.241 6.739) 18.735 28.224 ( -5.446 6.404 5.331) 9.954 28.298 ( -4.340 2.107 0.118) 4.826 28.746 ( -7.070 18.618 -0.025) 19.915 29.206 ( -4.590 3.442 -10.031) 11.556 ======================= Grid point 100 (48/104) ======================= q-point: ( 0.30 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -0.756 9.929 3.684) 10.618 2.125 ( -3.930 4.438 5.468) 8.064 2.219 ( 0.311 11.674 -11.227) 16.200 2.314 ( -6.635 3.690 2.442) 7.975 2.494 ( 0.967 3.700 -2.429) 4.530 2.575 ( 0.412 2.402 -2.377) 3.404 2.732 ( 2.611 -3.494 -3.571) 5.638 2.844 ( -2.112 -0.694 3.243) 3.932 3.078 ( -4.721 0.777 -0.579) 4.820 3.176 ( -2.193 10.138 -5.311) 11.654 3.269 ( -5.391 -1.394 2.122) 5.959 3.488 ( 2.685 9.864 3.008) 10.656 3.587 ( -6.725 1.027 1.428) 6.951 3.651 ( -2.423 2.356 3.278) 4.708 3.722 ( -0.151 5.998 3.651) 7.023 3.903 ( -4.205 8.428 2.762) 9.815 4.020 ( -0.908 0.961 9.631) 9.721 4.139 ( 4.289 4.689 -3.290) 7.156 4.182 ( 4.700 1.249 0.699) 4.913 4.394 ( 2.524 8.727 -0.107) 9.086 4.488 ( 0.324 14.055 0.243) 14.061 4.584 ( 1.733 14.242 -0.588) 14.359 4.668 ( 1.183 1.595 -1.247) 2.344 4.869 ( 3.577 4.838 2.773) 6.625 4.932 ( 1.799 0.812 -2.326) 3.051 5.002 ( -1.408 3.809 6.554) 7.709 5.075 ( 6.544 -7.676 0.919) 10.129 5.276 ( 1.372 5.583 -6.450) 8.640 5.333 ( -0.423 -2.262 -1.130) 2.564 5.619 ( 4.153 8.421 -2.865) 9.817 5.766 ( 9.492 -1.319 -4.786) 10.712 5.800 ( 1.820 0.456 1.788) 2.592 6.016 ( 6.097 -1.756 -0.090) 6.346 6.034 ( 2.759 -2.027 -0.719) 3.498 6.155 ( 8.766 -8.910 2.924) 12.836 6.320 ( 11.659 -3.965 0.521) 12.325 6.374 ( 6.346 -5.079 -4.333) 9.211 6.493 ( 7.154 -3.640 -0.061) 8.027 6.608 ( 1.858 -5.139 4.994) 7.403 6.647 ( 4.575 -4.407 3.858) 7.433 6.784 ( 4.356 1.904 -2.081) 5.190 6.944 ( 6.002 -0.437 -3.433) 6.928 7.005 ( 4.658 8.224 -1.338) 9.546 7.175 ( -2.313 1.377 0.667) 2.773 7.364 ( -0.991 6.663 3.486) 7.585 7.504 ( -2.594 2.625 -4.240) 5.621 7.895 ( -12.763 -7.276 -10.255) 17.916 7.972 ( -8.939 -5.920 6.732) 12.659 10.126 ( -3.983 5.952 0.118) 7.163 10.361 ( -4.785 3.827 1.923) 6.423 10.598 ( -9.040 5.210 1.916) 10.608 10.790 ( -5.042 0.153 -2.248) 5.522 10.851 ( 2.713 5.172 -0.198) 5.843 11.061 ( -2.952 5.283 3.544) 7.013 11.639 ( 6.261 -7.042 -3.803) 10.161 11.766 ( 9.305 -2.298 -0.676) 9.608 13.802 ( -1.773 4.231 1.172) 4.735 14.115 ( 1.352 -4.334 1.204) 4.697 14.231 ( 3.250 -5.869 -0.239) 6.713 14.359 ( 0.111 -2.184 0.838) 2.342 14.464 ( 0.117 -6.130 -0.283) 6.137 14.547 ( -0.980 -6.014 -1.244) 6.219 14.677 ( 0.410 -2.321 -2.397) 3.362 14.865 ( 2.107 -4.192 4.212) 6.305 14.954 ( 1.590 -1.826 -0.276) 2.437 15.130 ( -2.032 -5.768 0.710) 6.157 15.168 ( 0.885 -5.347 -0.076) 5.420 15.228 ( 2.895 -0.966 -2.262) 3.799 24.351 ( -1.207 0.597 0.818) 1.576 24.395 ( -0.760 -0.106 0.505) 0.919 24.458 ( -1.102 1.657 0.138) 1.995 24.552 ( -0.276 -0.399 -0.623) 0.790 25.249 ( -3.417 1.414 4.460) 5.794 25.394 ( -1.395 -3.361 1.765) 4.044 25.709 ( -2.772 4.239 -2.261) 5.546 25.975 ( -7.688 -4.237 -2.759) 9.201 26.719 ( 5.849 2.523 -1.641) 6.578 26.902 ( 11.459 2.592 3.082) 12.146 27.317 ( 7.187 -6.429 -7.038) 11.938 27.618 ( 11.243 -8.622 3.901) 14.696 28.189 ( -2.479 6.694 3.058) 7.765 28.234 ( -4.580 3.881 3.434) 6.916 28.604 ( -7.997 17.004 -1.111) 18.824 29.071 ( -2.513 -0.393 -6.016) 6.532 ======================= Grid point 101 (49/104) ======================= q-point: ( 0.40 0.29 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -1.860 6.643 2.820) 7.453 2.001 ( -5.772 6.089 2.130) 8.656 2.125 ( -2.100 8.925 -2.554) 9.518 2.144 ( -8.868 6.854 1.591) 11.320 2.563 ( 2.616 3.696 -6.898) 8.251 2.625 ( 4.020 1.499 -2.783) 5.114 2.725 ( 1.090 2.284 -1.716) 3.058 2.852 ( -3.558 -2.185 4.868) 6.413 2.977 ( -2.580 -1.626 -0.245) 3.060 3.198 ( 1.231 1.842 1.941) 2.945 3.265 ( 5.719 5.233 1.266) 7.854 3.427 ( -5.592 1.115 -1.826) 5.987 3.594 ( 0.195 11.106 -0.836) 11.139 3.632 ( -3.424 -0.151 1.432) 3.715 3.753 ( 1.109 6.351 5.179) 8.269 3.842 ( -3.357 5.484 5.462) 8.436 4.031 ( -6.193 4.262 2.065) 7.796 4.165 ( 0.610 0.904 -0.769) 1.334 4.204 ( 1.428 10.221 4.111) 11.109 4.412 ( -0.860 6.583 0.661) 6.671 4.482 ( -1.923 12.563 -4.010) 13.327 4.620 ( 4.656 14.676 2.235) 15.558 4.727 ( 3.807 2.948 0.849) 4.889 4.827 ( -6.462 -0.854 1.828) 6.770 5.008 ( 0.809 0.941 3.586) 3.795 5.043 ( 0.456 0.084 7.629) 7.643 5.170 ( -2.909 7.851 -3.404) 9.038 5.277 ( 10.186 -5.133 1.652) 11.525 5.393 ( 3.073 -3.009 0.114) 4.303 5.654 ( 3.638 9.113 -5.494) 11.246 5.815 ( 2.562 1.486 -2.903) 4.147 5.861 ( 3.959 -2.101 -4.929) 6.662 6.061 ( 3.945 -1.705 -2.514) 4.979 6.135 ( 4.979 1.861 3.427) 6.324 6.338 ( 6.896 -9.420 3.258) 12.121 6.417 ( 2.746 -4.742 -3.939) 6.749 6.481 ( 5.793 -4.805 -1.927) 7.769 6.565 ( 1.813 -1.472 0.594) 2.410 6.670 ( 1.474 -3.949 3.237) 5.315 6.737 ( 1.398 -4.702 3.915) 6.277 6.908 ( 8.865 -0.023 0.368) 8.873 6.976 ( 1.885 -1.925 -2.411) 3.616 7.079 ( 2.941 6.669 -4.072) 8.349 7.188 ( 2.349 -2.122 2.678) 4.146 7.360 ( -3.132 3.149 -0.207) 4.446 7.475 ( 5.654 5.292 -3.616) 8.547 7.572 ( -8.629 -4.184 -11.838) 15.235 7.860 ( -12.018 -1.578 4.155) 12.814 10.077 ( -1.314 5.937 0.655) 6.116 10.318 ( -2.715 2.395 2.362) 4.323 10.438 ( -7.918 5.138 0.285) 9.443 10.674 ( -6.830 -4.449 1.267) 8.249 10.911 ( 1.949 5.974 2.391) 6.723 11.071 ( 1.548 10.694 0.358) 10.812 11.702 ( 4.546 -6.950 -2.510) 8.675 11.901 ( 5.790 -2.011 -1.316) 6.269 13.789 ( -1.053 4.732 1.421) 5.052 14.152 ( 1.438 -7.860 0.268) 7.995 14.265 ( 0.845 -0.397 -1.804) 2.031 14.360 ( -0.654 -3.350 1.679) 3.804 14.455 ( 0.927 -6.270 -2.413) 6.782 14.515 ( -0.660 -4.847 -2.536) 5.510 14.665 ( 0.631 -5.936 -0.546) 5.994 14.880 ( -2.986 -7.622 2.367) 8.522 15.006 ( 3.090 -1.588 -0.883) 3.585 15.112 ( -1.370 -4.372 1.958) 4.982 15.181 ( 1.237 -1.999 -0.001) 2.351 15.268 ( 2.368 -2.636 -0.375) 3.563 24.342 ( -0.933 0.584 1.131) 1.578 24.388 ( -0.349 -0.419 0.172) 0.572 24.446 ( -0.691 1.810 0.576) 2.021 24.542 ( -0.116 -0.456 -0.727) 0.866 25.229 ( -3.117 1.517 3.779) 5.128 25.389 ( -0.613 -3.440 0.995) 3.633 25.654 ( -1.133 2.906 -1.607) 3.509 25.847 ( -3.436 -2.643 -2.749) 5.133 26.803 ( 4.140 3.244 0.459) 5.280 27.112 ( 7.457 6.679 2.752) 10.382 27.333 ( 2.109 -9.243 -3.862) 10.237 27.783 ( 5.638 -7.757 -1.538) 9.712 28.184 ( -0.543 6.638 -0.336) 6.668 28.215 ( -3.060 6.863 7.527) 10.635 28.467 ( -5.578 14.508 -0.305) 15.546 28.996 ( -0.220 -3.643 -5.351) 6.477 ======================= Grid point 102 (50/104) ======================= q-point: (-0.50 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 0.670 5.325 7.230) 9.005 2.009 ( -0.274 3.090 5.490) 6.305 2.091 ( 0.336 7.527 5.295) 9.209 2.183 ( 6.948 10.449 4.205) 13.234 2.516 ( -2.764 0.217 -7.157) 7.675 2.562 ( 0.433 4.133 -7.457) 8.536 2.700 ( -1.151 -1.858 -6.783) 7.127 2.760 ( -3.250 -1.652 -2.598) 4.477 3.012 ( 0.666 2.245 3.921) 4.567 3.153 ( -6.106 -0.093 -0.129) 6.108 3.393 ( 4.378 2.501 -0.960) 5.133 3.458 ( 8.475 2.217 2.573) 9.130 3.530 ( -5.378 13.664 -0.117) 14.685 3.585 ( -0.054 7.497 -0.342) 7.505 3.766 ( -4.890 4.636 3.905) 7.788 3.883 ( -2.564 4.165 8.876) 10.135 3.939 ( -3.798 4.915 -0.963) 6.286 4.209 ( 4.441 2.146 3.983) 6.339 4.285 ( 0.044 9.484 7.039) 11.810 4.382 ( -2.503 6.563 -2.072) 7.324 4.460 ( 3.019 10.701 -2.301) 11.354 4.640 ( -2.569 10.224 3.457) 11.094 4.783 ( -0.482 5.341 1.515) 5.573 4.815 ( 2.500 -1.621 3.024) 4.245 5.014 ( -3.972 -1.120 1.269) 4.317 5.029 ( -1.108 6.472 0.064) 6.567 5.210 ( 1.459 2.782 7.025) 7.696 5.377 ( -0.516 -1.351 -1.499) 2.082 5.419 ( -0.257 -5.482 3.529) 6.525 5.646 ( 2.747 6.278 -7.282) 10.000 5.838 ( 3.426 0.206 -4.146) 5.382 5.868 ( 3.123 0.823 -5.706) 6.557 6.107 ( 2.077 -0.230 0.532) 2.157 6.201 ( -2.742 -0.555 2.878) 4.014 6.385 ( -3.147 -4.962 1.184) 5.994 6.468 ( 4.055 -4.222 -0.452) 5.871 6.538 ( 4.011 -4.765 -0.937) 6.298 6.581 ( -1.309 -0.861 1.123) 1.928 6.653 ( -3.244 -7.452 -1.850) 8.336 6.775 ( -3.186 -3.398 4.270) 6.319 6.959 ( -2.706 0.776 -2.561) 3.805 6.993 ( -0.180 -1.066 -2.603) 2.818 7.077 ( 2.781 1.943 -2.762) 4.375 7.184 ( -2.055 -2.577 -1.560) 3.647 7.364 ( -1.664 2.382 -2.884) 4.094 7.419 ( 4.624 -0.218 -1.039) 4.744 7.585 ( 2.723 4.906 -4.102) 6.950 7.666 ( -1.458 -0.531 -3.281) 3.630 10.097 ( 1.277 5.201 2.861) 6.072 10.270 ( -2.626 2.902 -1.345) 4.138 10.398 ( 0.751 3.320 4.148) 5.366 10.601 ( -1.362 -4.714 0.333) 4.918 10.949 ( -0.660 7.199 3.171) 7.894 11.103 ( 0.874 11.480 0.914) 11.549 11.750 ( 2.271 -6.992 -0.541) 7.371 11.928 ( -0.468 -1.948 -3.338) 3.893 13.792 ( -0.394 4.496 2.234) 5.036 14.131 ( -2.095 -4.834 -3.893) 6.551 14.260 ( 1.189 2.088 -0.882) 2.559 14.355 ( -2.191 -7.445 1.326) 7.873 14.467 ( 1.906 -5.009 -3.604) 6.459 14.487 ( 1.157 -5.621 -1.297) 5.884 14.698 ( 2.145 -9.690 1.644) 10.060 14.822 ( -3.697 -8.601 -1.098) 9.426 15.033 ( 0.719 -0.732 -0.078) 1.029 15.105 ( -1.066 -3.570 1.250) 3.930 15.213 ( 0.623 -1.011 1.720) 2.090 15.295 ( 0.879 -2.589 0.162) 2.739 24.339 ( -0.534 0.590 1.211) 1.449 24.388 ( 0.334 -0.616 0.125) 0.712 24.443 ( -0.472 1.898 0.884) 2.146 24.535 ( 0.216 -0.297 -0.978) 1.045 25.209 ( -2.643 1.761 3.024) 4.385 25.391 ( -0.286 -3.750 1.096) 3.918 25.644 ( 1.384 2.293 -0.949) 2.842 25.807 ( 1.401 -2.179 -2.313) 3.472 26.868 ( 1.432 3.781 2.832) 4.936 27.128 ( -4.284 6.411 -3.352) 8.407 27.414 ( 5.911 -8.476 4.185) 11.149 27.786 ( -1.055 -7.416 -6.197) 9.722 28.152 ( -5.775 9.388 4.064) 11.747 28.217 ( 0.009 7.832 -0.094) 7.833 28.452 ( 1.562 10.594 4.118) 11.473 28.965 ( 2.952 -4.744 -6.015) 8.210 ======================= Grid point 103 (51/104) ======================= q-point: (-0.40 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( -2.793 7.348 3.777) 8.721 1.985 ( -7.917 4.151 3.686) 9.669 2.167 ( 3.544 5.551 0.230) 6.590 2.376 ( 6.608 2.502 -2.763) 7.587 2.400 ( 0.978 3.048 0.574) 3.252 2.530 ( -1.534 4.762 -3.040) 5.854 2.661 ( 8.305 -2.126 -4.978) 9.913 2.791 ( 7.578 -2.578 0.207) 8.007 3.024 ( -0.140 4.252 -0.126) 4.256 3.143 ( 4.745 -0.549 5.181) 7.047 3.355 ( -6.068 14.249 -4.863) 16.233 3.424 ( -2.547 6.834 -2.309) 7.650 3.592 ( 1.552 6.573 4.832) 8.305 3.621 ( -2.965 7.921 3.242) 9.058 3.739 ( 1.521 3.319 -0.693) 3.716 3.844 ( -5.014 1.558 1.448) 5.447 3.951 ( 0.894 6.455 7.867) 10.215 4.269 ( -5.919 9.741 -0.041) 11.399 4.300 ( -3.308 1.299 3.838) 5.231 4.335 ( 0.782 5.792 -0.067) 5.845 4.500 ( 3.062 11.629 -3.127) 12.425 4.627 ( -3.934 9.829 5.860) 12.100 4.802 ( 1.207 1.865 1.799) 2.858 4.901 ( 0.617 -4.068 5.231) 6.655 4.946 ( -2.848 -1.350 0.003) 3.152 5.034 ( -1.604 7.373 2.231) 7.868 5.201 ( -1.315 0.568 -0.223) 1.450 5.392 ( 1.109 4.247 2.644) 5.124 5.429 ( -2.291 -3.371 5.339) 6.717 5.620 ( 0.732 -0.059 -5.946) 5.991 5.842 ( 2.152 4.775 -6.172) 8.095 5.858 ( -0.845 -0.001 -2.824) 2.948 6.093 ( -7.163 -4.324 -3.200) 8.958 6.138 ( -2.180 -2.958 4.577) 5.870 6.291 ( -7.806 -1.416 0.213) 7.936 6.451 ( -2.751 -0.818 -2.692) 3.935 6.498 ( -6.182 -7.021 -2.639) 9.720 6.564 ( -5.170 -3.710 2.842) 6.969 6.658 ( -3.262 -3.212 0.335) 4.590 6.680 ( -4.246 -6.361 5.463) 9.398 6.885 ( -1.338 2.249 -0.978) 2.794 6.954 ( -0.847 -0.845 -2.049) 2.373 7.051 ( -0.173 0.382 -2.944) 2.973 7.141 ( -6.220 2.209 -2.214) 6.962 7.290 ( -3.137 0.991 -3.019) 4.465 7.406 ( 3.852 4.978 -6.271) 8.885 7.537 ( 0.691 1.876 -3.356) 3.906 7.914 ( 20.991 -4.422 0.706) 21.463 10.137 ( -0.701 3.625 2.377) 4.391 10.267 ( 4.208 3.640 -0.180) 5.567 10.473 ( 2.979 2.804 2.824) 4.971 10.652 ( 6.597 -2.203 -0.031) 6.955 10.955 ( -1.447 8.059 3.579) 8.935 11.101 ( -2.533 9.308 0.885) 9.687 11.766 ( -0.911 -7.525 0.616) 7.605 11.832 ( -5.419 -1.928 -4.820) 7.504 13.819 ( 0.261 3.296 4.037) 5.218 14.050 ( -1.412 0.886 -5.077) 5.343 14.273 ( 0.201 -3.577 -0.293) 3.595 14.320 ( -2.059 -5.722 0.850) 6.140 14.438 ( -0.628 -4.279 -3.300) 5.440 14.524 ( 2.764 -7.321 -1.387) 7.947 14.707 ( -2.823 -8.102 -1.229) 8.668 14.801 ( 2.726 -9.846 1.416) 10.314 15.017 ( -2.615 -2.053 0.536) 3.367 15.120 ( 1.429 -3.279 1.425) 3.850 15.209 ( -2.469 -0.603 0.723) 2.643 15.306 ( 0.036 -1.023 0.208) 1.045 24.346 ( 0.079 0.642 1.088) 1.266 24.402 ( 0.664 -0.834 0.693) 1.271 24.445 ( -0.042 2.110 0.692) 2.221 24.533 ( 0.702 0.013 -1.123) 1.324 25.194 ( -1.897 1.975 2.480) 3.695 25.396 ( -0.616 -4.298 1.665) 4.650 25.680 ( 3.394 2.373 -0.852) 4.228 25.845 ( 5.359 -2.698 -2.963) 6.691 26.901 ( -1.879 4.206 4.816) 6.665 26.977 ( -8.153 4.188 -3.465) 9.798 27.532 ( 0.563 -6.889 3.176) 7.606 27.642 ( -6.593 -6.989 -5.906) 11.278 28.085 ( -3.618 9.334 1.348) 10.101 28.236 ( 0.549 4.890 2.821) 5.672 28.544 ( 4.566 11.274 2.636) 12.446 29.002 ( 7.658 -2.594 -5.500) 9.779 ======================= Grid point 104 (52/104) ======================= q-point: (-0.30 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -10.850 14.324 -5.541) 18.804 1.884 ( -12.951 10.598 7.556) 18.362 2.188 ( 1.517 4.529 -6.337) 7.935 2.373 ( 3.789 -2.244 -1.897) 4.795 2.480 ( 3.963 1.362 -1.797) 4.560 2.612 ( 7.086 5.464 -0.134) 8.949 2.701 ( 1.184 -2.183 -2.003) 3.191 2.987 ( 8.575 -2.935 3.027) 9.555 3.103 ( 4.737 8.786 0.729) 10.008 3.195 ( -3.491 14.564 -7.619) 16.803 3.335 ( 7.308 2.847 4.640) 9.113 3.375 ( -2.541 7.233 4.685) 8.984 3.564 ( -1.395 3.356 1.298) 3.859 3.605 ( -3.907 8.781 3.661) 10.285 3.703 ( -0.759 5.908 -5.168) 7.886 3.853 ( 0.131 -1.169 3.648) 3.833 4.002 ( -3.203 1.151 3.347) 4.774 4.094 ( -9.635 14.358 -0.615) 17.302 4.237 ( -5.769 1.949 4.420) 7.524 4.410 ( 5.567 4.260 1.807) 7.239 4.443 ( -3.302 10.011 -5.859) 12.060 4.610 ( -6.358 0.143 2.355) 6.782 4.729 ( -8.604 1.685 5.429) 10.312 4.892 ( -3.205 2.126 -1.608) 4.168 4.952 ( 0.639 3.040 3.270) 4.511 5.044 ( 1.222 7.311 0.575) 7.435 5.293 ( 6.555 -1.276 4.514) 8.061 5.388 ( -3.998 3.618 1.005) 5.485 5.452 ( -1.630 0.095 5.424) 5.665 5.572 ( 0.073 -6.232 -3.760) 7.279 5.710 ( -8.125 1.521 -5.564) 9.965 5.852 ( 1.311 4.286 -1.017) 4.596 5.915 ( -9.074 -3.708 -4.880) 10.950 6.105 ( -6.852 -4.589 5.358) 9.834 6.182 ( -4.378 -3.673 -0.614) 5.748 6.321 ( -9.160 -3.285 -2.988) 10.179 6.359 ( -3.612 -4.381 -3.838) 6.853 6.477 ( -8.871 -0.484 7.725) 11.773 6.527 ( -7.101 -3.266 -0.023) 7.816 6.638 ( -8.665 0.686 1.350) 8.797 6.873 ( -3.091 -4.078 -0.479) 5.139 6.943 ( -0.758 1.587 -2.537) 3.087 7.040 ( 3.436 3.155 4.716) 6.633 7.082 ( 6.321 -1.812 -4.774) 8.126 7.224 ( -1.653 0.494 -5.728) 5.982 7.374 ( 1.023 1.707 -7.120) 7.393 7.585 ( 5.396 6.705 -0.166) 8.608 8.321 ( 22.789 -7.751 1.813) 24.139 10.132 ( -0.637 3.426 0.488) 3.518 10.378 ( 5.777 -0.132 1.820) 6.059 10.555 ( 4.879 7.837 0.534) 9.248 10.752 ( 2.499 1.559 -0.600) 3.006 11.016 ( -0.348 6.149 1.945) 6.459 11.029 ( -0.158 5.377 2.834) 6.080 11.637 ( -9.422 -2.861 -4.845) 10.975 11.755 ( -1.943 -7.564 -0.403) 7.820 13.874 ( 0.453 0.537 6.021) 6.062 13.999 ( 0.643 2.461 -4.418) 5.098 14.257 ( -1.349 -4.875 0.706) 5.107 14.320 ( 0.613 -3.197 1.147) 3.452 14.382 ( -1.722 -3.958 -3.926) 5.835 14.545 ( 0.947 -8.737 -1.300) 8.884 14.654 ( -0.865 -4.840 -1.735) 5.214 14.847 ( -1.452 -6.618 2.534) 7.234 14.981 ( -1.311 -5.236 0.826) 5.461 15.147 ( -4.059 -2.231 0.190) 4.636 15.172 ( 2.605 -2.410 0.979) 3.681 15.300 ( -0.239 0.534 -0.746) 0.948 24.362 ( 0.708 0.810 0.898) 1.401 24.419 ( -0.069 -0.589 1.569) 1.678 24.459 ( 1.365 2.138 0.071) 2.538 24.539 ( 1.180 0.313 -1.172) 1.692 25.192 ( -0.859 1.952 2.653) 3.404 25.402 ( -0.872 -4.833 2.624) 5.568 25.737 ( 3.655 2.935 -0.853) 4.765 25.925 ( 7.163 -3.555 -4.634) 9.243 26.791 ( -9.258 3.475 -2.173) 10.124 26.890 ( -5.025 4.481 5.325) 8.584 27.327 ( -13.884 -7.382 -8.627) 17.936 27.598 ( -5.353 -9.451 4.955) 11.939 28.066 ( 1.016 8.207 0.460) 8.283 28.287 ( 1.442 1.753 4.145) 4.726 28.653 ( 6.264 14.135 -0.007) 15.460 29.139 ( 13.048 1.435 -4.475) 13.869 ======================= Grid point 105 (53/104) ======================= q-point: (-0.20 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( -11.258 21.943 0.313) 24.664 1.688 ( -14.769 19.238 6.164) 25.024 2.152 ( -0.302 3.584 -3.350) 4.915 2.404 ( -2.117 -0.636 -0.106) 2.213 2.519 ( 3.132 -1.413 -6.389) 7.255 2.658 ( 4.003 -4.769 -0.804) 6.278 2.728 ( -1.753 13.002 -0.260) 13.122 2.981 ( -9.758 22.407 0.988) 24.460 3.100 ( -0.840 -2.645 -6.885) 7.423 3.162 ( 4.285 7.157 2.941) 8.845 3.388 ( -1.721 7.376 0.261) 7.578 3.460 ( 2.615 6.949 5.945) 9.512 3.567 ( -0.861 4.647 2.164) 5.197 3.610 ( -1.592 0.726 -4.805) 5.114 3.711 ( 7.592 2.481 5.429) 9.657 3.861 ( -3.086 1.099 0.944) 3.409 3.937 ( -1.004 -2.796 1.499) 3.328 4.006 ( -4.199 5.853 2.663) 7.680 4.186 ( -3.398 6.504 4.097) 8.404 4.335 ( -4.912 3.376 -1.670) 6.190 4.465 ( -7.228 3.073 1.481) 7.992 4.549 ( 5.287 -7.477 4.070) 10.021 4.672 ( -1.743 12.748 -0.471) 12.875 4.832 ( -1.341 5.793 -2.843) 6.591 4.958 ( -2.575 4.365 2.215) 5.531 5.037 ( -1.572 7.234 -3.325) 8.115 5.310 ( -4.048 2.534 0.889) 4.858 5.350 ( -5.998 -2.958 1.132) 6.783 5.443 ( -2.059 0.513 0.454) 2.170 5.521 ( -3.924 1.543 0.272) 4.225 5.641 ( 3.420 -3.734 -2.443) 5.622 5.710 ( -5.481 -0.395 -0.788) 5.551 5.857 ( -1.635 -6.374 -1.165) 6.683 5.973 ( -11.347 -8.207 1.700) 14.107 6.098 ( -4.996 3.406 2.809) 6.667 6.197 ( -2.273 0.902 -4.209) 4.868 6.254 ( -7.223 -2.266 1.691) 7.757 6.386 ( -7.047 -2.218 -1.475) 7.534 6.426 ( -6.578 -3.328 6.704) 9.965 6.476 ( -7.236 1.903 -0.821) 7.527 6.750 ( -7.912 -4.157 -3.292) 9.525 6.888 ( -2.374 -0.858 -3.448) 4.273 7.137 ( 5.361 -0.935 -9.880) 11.280 7.189 ( 3.955 1.526 4.491) 6.176 7.270 ( 10.408 0.097 6.918) 12.498 7.365 ( 4.430 -0.451 -4.613) 6.412 7.675 ( 5.189 10.527 -1.365) 11.816 8.721 ( 20.948 -11.973 -0.959) 24.147 10.137 ( 0.938 4.719 0.522) 4.839 10.461 ( 1.120 -1.956 1.848) 2.915 10.658 ( 5.142 11.942 0.004) 13.002 10.744 ( -0.927 2.089 -0.332) 2.310 10.906 ( -5.099 1.571 0.689) 5.379 11.200 ( 6.181 2.219 4.274) 7.836 11.414 ( -10.014 -3.181 -4.189) 11.311 11.713 ( -0.783 -6.301 -2.516) 6.830 13.935 ( -0.158 -3.276 5.950) 6.794 13.987 ( 1.918 2.380 -3.426) 4.591 14.259 ( -0.174 -4.760 1.763) 5.079 14.303 ( -0.656 -0.879 -4.657) 4.785 14.365 ( 0.513 -1.877 3.349) 3.874 14.538 ( -0.331 -8.267 -0.946) 8.327 14.640 ( 0.331 -3.304 -1.054) 3.484 14.795 ( -5.393 -2.705 1.395) 6.193 14.974 ( -1.286 -5.755 0.648) 5.932 15.078 ( -3.170 0.223 0.338) 3.195 15.236 ( 3.110 -7.438 0.522) 8.079 15.298 ( 2.011 1.554 -1.930) 3.191 24.387 ( 1.188 1.045 0.744) 1.749 24.428 ( -0.272 0.337 1.253) 1.326 24.490 ( 1.789 1.819 0.178) 2.558 24.553 ( 1.686 0.479 -1.377) 2.229 25.215 ( 0.019 1.702 3.747) 4.116 25.420 ( -0.725 -5.360 4.658) 7.138 25.791 ( 2.825 3.387 0.496) 4.438 25.998 ( 6.249 -3.472 -5.607) 9.085 26.626 ( -7.113 1.967 -1.193) 7.476 26.825 ( -7.232 4.917 4.201) 9.702 26.962 ( -18.032 -8.078 -8.687) 21.584 27.483 ( -10.942 -11.870 3.392) 16.497 28.127 ( 4.386 7.368 1.022) 8.635 28.356 ( 1.737 0.311 4.243) 4.595 28.759 ( 6.066 16.898 -1.092) 17.987 29.367 ( 17.672 3.251 -6.640) 19.156 ======================= Grid point 106 (54/104) ======================= q-point: (-0.10 0.29 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( -7.057 26.416 8.711) 28.697 1.517 ( -11.435 25.900 8.601) 29.589 2.122 ( -1.529 0.663 1.461) 2.216 2.227 ( -11.286 2.623 -3.810) 12.197 2.537 ( -1.165 10.503 1.275) 10.644 2.640 ( -3.586 17.879 1.558) 18.302 2.723 ( 1.888 0.488 3.064) 3.632 2.911 ( 0.379 5.385 1.108) 5.511 3.044 ( 2.582 -3.923 -7.067) 8.485 3.252 ( -2.327 4.782 -1.749) 5.598 3.302 ( -0.670 17.704 3.650) 18.088 3.502 ( -2.297 -0.338 1.499) 2.763 3.587 ( 1.325 -4.029 -1.670) 4.558 3.636 ( 1.397 6.668 8.137) 10.613 3.774 ( -1.840 -0.834 3.324) 3.890 3.876 ( -0.589 -0.495 2.848) 2.950 3.954 ( -2.459 3.703 0.542) 4.478 3.984 ( 4.724 -1.504 -2.291) 5.461 4.188 ( -5.026 -7.641 1.800) 9.322 4.274 ( 4.278 3.671 2.723) 6.260 4.416 ( -1.946 16.809 -0.125) 16.922 4.564 ( -3.275 -2.098 1.754) 4.267 4.683 ( -4.149 10.201 -1.059) 11.063 4.798 ( 2.721 6.383 -0.626) 6.967 4.900 ( -1.132 7.285 -2.595) 7.815 4.961 ( -1.512 -0.966 -5.800) 6.071 5.251 ( -4.324 -0.306 1.307) 4.528 5.319 ( 4.645 3.277 -0.865) 5.750 5.342 ( -3.922 5.609 -4.727) 8.318 5.493 ( -4.004 6.083 7.301) 10.312 5.583 ( -5.366 -1.000 2.520) 6.012 5.762 ( -0.116 -3.848 -1.752) 4.230 5.786 ( 1.041 -7.269 -2.325) 7.702 5.858 ( -2.534 -6.637 1.661) 7.296 6.014 ( -8.742 2.417 2.954) 9.539 6.072 ( -6.078 -0.264 -1.501) 6.266 6.176 ( -3.174 -0.106 -0.500) 3.215 6.271 ( -5.778 -2.769 -2.514) 6.882 6.317 ( -6.058 -2.436 4.073) 7.696 6.437 ( -1.078 -3.136 0.931) 3.445 6.583 ( -4.597 -1.198 -4.713) 6.692 6.810 ( -1.161 -4.495 -5.194) 6.967 7.155 ( 5.237 3.223 -7.175) 9.449 7.276 ( 2.074 1.803 1.269) 3.027 7.436 ( 3.418 -0.338 1.424) 3.719 7.532 ( 9.150 -4.601 10.530) 14.690 7.741 ( 4.566 13.012 -3.372) 14.196 8.988 ( 12.820 -16.828 -9.172) 23.058 10.184 ( 2.828 5.208 2.488) 6.427 10.460 ( -2.325 1.024 1.208) 2.814 10.655 ( -1.439 6.286 0.258) 6.454 10.788 ( 1.266 -2.263 1.734) 3.120 10.882 ( 1.034 4.804 -0.597) 4.950 11.183 ( -6.277 -8.807 2.076) 11.012 11.329 ( -1.643 4.465 2.250) 5.263 11.707 ( 3.785 -2.418 -4.224) 6.166 13.964 ( -1.004 -3.408 1.675) 3.928 14.003 ( 1.851 0.528 -0.252) 1.941 14.238 ( 0.017 -2.248 -2.668) 3.489 14.290 ( 0.007 -2.941 -1.166) 3.163 14.404 ( -0.412 0.732 4.227) 4.310 14.518 ( -1.360 -8.007 -0.560) 8.141 14.642 ( 0.591 -1.991 -0.149) 2.082 14.716 ( -3.734 -1.732 0.568) 4.156 14.944 ( -1.353 -1.120 -0.701) 1.891 15.055 ( -1.306 -2.345 2.987) 4.016 15.270 ( 1.812 -6.762 -2.734) 7.515 15.334 ( 3.533 -1.927 -3.210) 5.148 24.410 ( 0.430 0.983 0.527) 1.195 24.435 ( 0.240 0.649 0.328) 0.766 24.518 ( 1.248 1.959 -0.332) 2.346 24.571 ( 1.789 0.511 -1.570) 2.434 25.254 ( -0.397 1.575 4.665) 4.939 25.462 ( -1.152 -6.047 6.962) 9.293 25.854 ( 0.892 2.069 5.390) 5.842 26.047 ( 4.771 -2.267 -3.943) 6.592 26.535 ( -2.283 0.030 -0.189) 2.291 26.581 ( -13.858 -1.898 -5.557) 15.051 26.727 ( -6.275 3.945 1.386) 7.541 27.312 ( -9.800 -13.602 0.414) 16.770 28.213 ( 3.375 6.778 1.651) 7.750 28.413 ( 0.224 0.057 3.634) 3.642 28.839 ( 3.816 18.890 -0.945) 19.295 29.586 ( 15.722 1.039 -13.888) 21.003 ======================= Grid point 107 (55/104) ======================= q-point: ( 0.00 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( -0.370 21.639 7.816) 23.010 1.986 ( -1.883 22.097 5.647) 22.885 2.117 ( 2.326 1.371 5.030) 5.709 2.232 ( 3.392 -0.434 3.421) 4.837 2.411 ( -2.171 -16.240 1.488) 16.452 2.451 ( -2.112 -13.701 3.934) 14.410 2.922 ( 5.665 4.493 -6.827) 9.944 3.012 ( 3.048 -3.423 -4.765) 6.611 3.287 ( 0.371 12.735 -0.756) 12.763 3.309 ( -0.570 4.328 -3.350) 5.503 3.479 ( 2.250 -1.592 -1.783) 3.283 3.528 ( -0.840 -0.024 4.291) 4.373 3.607 ( -1.514 11.438 6.986) 13.488 3.699 ( -3.878 -0.827 6.436) 7.560 3.785 ( -2.166 1.794 0.299) 2.828 3.863 ( 1.678 -4.672 1.371) 5.150 3.971 ( -0.824 0.240 2.400) 2.549 4.016 ( -2.259 -0.591 -1.722) 2.901 4.132 ( -1.483 15.522 -0.400) 15.598 4.386 ( -5.077 -2.481 -0.481) 5.672 4.439 ( -4.165 2.009 -1.141) 4.763 4.605 ( 0.363 -12.356 -4.872) 13.287 4.719 ( 1.959 5.689 5.254) 7.988 4.790 ( 4.978 -3.638 5.432) 8.217 5.007 ( 3.637 7.933 -6.602) 10.943 5.065 ( 4.105 1.912 -3.968) 6.020 5.251 ( -2.134 4.433 3.028) 5.777 5.342 ( -1.151 -3.195 1.486) 3.707 5.453 ( 2.609 5.441 2.261) 6.444 5.521 ( -3.007 -1.338 9.409) 9.968 5.621 ( 0.371 -1.348 -1.460) 2.021 5.644 ( -3.030 -2.799 -1.789) 4.496 5.741 ( -3.392 9.806 -1.898) 10.548 5.883 ( -3.883 -3.438 0.871) 5.259 5.951 ( 3.179 2.122 1.379) 4.063 5.975 ( 1.063 -1.048 -0.560) 1.595 6.089 ( -0.903 0.341 -0.677) 1.178 6.121 ( -3.013 -2.136 -2.551) 4.488 6.287 ( -0.358 1.759 -1.208) 2.164 6.337 ( -0.567 -2.851 -1.891) 3.468 6.585 ( 4.754 1.836 -5.119) 7.224 6.652 ( 2.961 -5.025 -6.304) 8.588 7.287 ( 2.531 7.105 0.406) 7.553 7.363 ( 0.115 1.798 1.445) 2.310 7.452 ( -1.291 0.544 1.466) 2.028 7.574 ( 2.523 -10.317 12.140) 16.130 8.076 ( -0.475 19.936 -7.878) 21.441 8.538 ( -0.874 -24.108 -11.771) 26.842 10.335 ( -0.476 4.719 3.490) 5.888 10.419 ( -1.322 -2.684 1.801) 3.492 10.756 ( -0.086 2.411 0.744) 2.524 10.785 ( 0.335 1.618 0.106) 1.656 10.908 ( -0.168 1.145 3.454) 3.642 11.026 ( 2.555 -8.419 6.517) 10.949 11.451 ( -1.633 10.408 -2.986) 10.950 11.642 ( 0.547 -7.552 -4.037) 8.580 13.940 ( -0.904 2.094 1.118) 2.540 14.002 ( 0.284 -2.978 0.763) 3.088 14.208 ( 1.662 -0.429 -1.265) 2.132 14.233 ( 0.799 -2.154 -1.535) 2.763 14.424 ( -0.765 0.611 0.846) 1.294 14.431 ( -0.216 0.305 0.736) 0.826 14.607 ( -0.083 -1.329 -1.244) 1.822 14.626 ( -0.802 -2.762 -0.908) 3.016 14.938 ( -0.611 1.277 2.171) 2.591 15.001 ( -0.320 -4.462 1.651) 4.769 15.188 ( -0.134 1.331 -3.257) 3.521 15.252 ( 0.022 -3.847 -4.991) 6.302 24.429 ( -0.776 0.826 0.192) 1.150 24.439 ( -0.684 -0.161 0.086) 0.708 24.559 ( 0.494 1.524 -1.786) 2.399 24.581 ( 0.796 -0.528 -1.844) 2.077 25.321 ( -2.554 2.659 5.870) 6.932 25.385 ( -3.386 -3.745 6.765) 8.441 25.960 ( 1.192 4.751 -0.182) 4.902 26.045 ( 3.255 -3.499 -1.240) 4.937 26.534 ( 3.691 0.538 1.812) 4.147 26.546 ( 5.190 -0.711 3.431) 6.262 26.728 ( -3.188 6.092 -2.347) 7.265 26.901 ( -4.119 -10.932 -3.819) 12.290 28.368 ( -0.401 3.804 2.143) 4.385 28.418 ( -1.349 -1.157 2.051) 2.714 29.243 ( 0.646 16.409 -2.494) 16.610 29.511 ( 1.578 -9.582 -8.667) 13.016 ======================= Grid point 108 (56/104) ======================= q-point: ( 0.10 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( 2.150 19.761 7.742) 21.332 2.054 ( 2.099 19.621 7.192) 21.002 2.262 ( 7.293 3.179 3.730) 8.787 2.361 ( 3.531 -7.112 3.024) 8.496 2.425 ( -4.209 -11.180 3.688) 12.502 2.430 ( 5.617 -10.098 -1.470) 11.648 2.923 ( 1.889 3.316 -8.027) 8.888 2.981 ( -0.638 -1.755 -5.872) 6.162 3.303 ( 2.493 6.952 -1.511) 7.538 3.331 ( 4.443 3.094 -1.843) 5.719 3.491 ( -2.378 -2.028 0.153) 3.129 3.503 ( -5.367 -0.813 -0.075) 5.429 3.633 ( 2.292 4.292 3.175) 5.810 3.742 ( -0.605 0.365 -3.357) 3.430 3.790 ( 1.796 7.187 10.905) 13.183 3.890 ( -1.515 -0.446 8.364) 8.512 3.952 ( -1.453 2.409 1.858) 3.372 4.053 ( 0.756 -4.510 4.611) 6.494 4.114 ( 1.982 11.736 -1.073) 11.951 4.281 ( -3.740 -6.747 -3.209) 8.354 4.343 ( -0.979 8.242 1.988) 8.534 4.598 ( 2.602 -7.168 -2.991) 8.191 4.852 ( 6.541 6.320 1.710) 9.255 4.936 ( 5.298 -2.924 -0.831) 6.108 4.992 ( 1.368 9.885 -3.734) 10.654 5.127 ( 5.812 -3.793 -1.174) 7.038 5.176 ( -8.224 7.669 0.801) 11.273 5.272 ( -7.431 -1.923 0.987) 7.739 5.480 ( -3.158 10.371 0.851) 10.874 5.547 ( 2.414 2.029 -4.258) 5.299 5.623 ( 3.774 -1.968 3.273) 5.369 5.690 ( 5.148 -3.305 0.519) 6.140 5.708 ( -0.180 1.087 6.901) 6.988 5.820 ( -0.975 -5.919 1.202) 6.118 5.970 ( 0.502 2.862 -3.423) 4.489 6.034 ( 0.273 -1.610 -4.104) 4.416 6.090 ( 6.884 -0.722 -1.125) 7.013 6.154 ( 5.884 -3.431 -1.892) 7.069 6.323 ( 4.636 0.458 1.438) 4.875 6.351 ( 4.641 -2.263 -1.280) 5.320 6.684 ( 10.002 1.714 -3.485) 10.729 6.713 ( 9.213 -1.860 -5.222) 10.752 7.299 ( -4.670 3.070 -1.040) 5.685 7.329 ( -1.375 1.013 0.718) 1.853 7.433 ( -4.279 10.155 7.275) 13.205 7.680 ( -3.069 -10.779 11.086) 15.764 7.946 ( -5.348 13.806 -6.660) 16.235 8.326 ( -8.405 -20.830 -14.287) 26.621 10.342 ( -2.706 4.933 3.727) 6.749 10.419 ( -0.597 -2.065 1.864) 2.845 10.778 ( 1.274 0.706 0.745) 1.636 10.803 ( 1.929 -0.827 -0.986) 2.319 10.990 ( 3.364 7.365 5.887) 10.011 11.171 ( 5.009 -9.395 5.616) 12.037 11.358 ( -3.005 10.421 -4.600) 11.781 11.567 ( -3.220 -9.371 -5.027) 11.111 13.927 ( -1.830 3.535 1.510) 4.257 14.006 ( -0.566 -3.531 0.626) 3.631 14.212 ( 0.236 1.263 -2.428) 2.747 14.242 ( 2.188 -1.941 -1.273) 3.190 14.399 ( -1.752 0.985 0.734) 2.140 14.446 ( -0.287 -3.126 1.340) 3.413 14.609 ( 2.096 -0.779 -1.351) 2.613 14.641 ( 2.307 -3.139 0.551) 3.935 14.942 ( -1.413 1.106 2.636) 3.189 15.007 ( -0.995 -5.305 2.005) 5.758 15.155 ( 0.418 1.596 -3.610) 3.969 15.208 ( 0.546 -2.918 -4.864) 5.698 24.410 ( -1.430 0.846 0.172) 1.671 24.422 ( -1.299 -0.270 0.226) 1.346 24.542 ( -0.615 1.705 -1.379) 2.277 24.569 ( -0.232 -0.857 -1.490) 1.734 25.316 ( -3.556 2.391 5.352) 6.856 25.370 ( -4.208 -2.951 5.439) 7.483 25.960 ( -1.109 6.201 -0.668) 6.335 26.076 ( -0.131 -5.193 0.193) 5.198 26.591 ( 2.641 3.441 -0.778) 4.407 26.664 ( 2.055 -2.244 -1.219) 3.278 26.826 ( 14.831 -0.047 2.983) 15.128 26.913 ( 11.085 -7.388 -3.275) 13.718 28.356 ( -3.477 2.994 2.971) 5.466 28.387 ( -3.776 -0.217 1.630) 4.118 29.186 ( -4.490 14.110 -2.089) 14.954 29.394 ( -5.018 -6.063 -8.414) 11.521 ======================= Grid point 109 (57/104) ======================= q-point: ( 0.20 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -3.853 14.149 6.019) 15.851 2.177 ( 0.901 9.331 8.724) 12.806 2.335 ( -2.388 -5.434 0.657) 5.972 2.405 ( 5.450 4.078 2.228) 7.162 2.475 ( 6.238 -3.492 0.638) 7.178 2.544 ( 7.276 -5.380 -1.844) 9.235 2.805 ( -8.525 3.218 -7.518) 11.813 2.870 ( -4.016 -2.775 -6.966) 8.506 3.268 ( -4.720 4.356 -4.618) 7.911 3.322 ( -3.508 -0.549 -2.432) 4.304 3.430 ( -2.612 2.811 -0.373) 3.855 3.483 ( -1.066 -1.600 4.579) 4.966 3.667 ( -0.585 -0.328 -1.412) 1.563 3.685 ( -3.652 -2.026 -1.852) 4.568 3.889 ( 2.101 5.411 8.784) 10.529 3.952 ( 2.070 -1.639 1.292) 2.939 4.001 ( -0.125 3.755 6.628) 7.619 4.033 ( -1.649 0.792 1.565) 2.407 4.214 ( 6.126 10.383 1.225) 12.117 4.328 ( 9.349 0.654 1.726) 9.529 4.465 ( 7.733 3.604 6.498) 10.724 4.687 ( 9.097 -5.847 2.021) 11.002 4.871 ( -4.895 4.860 -3.126) 7.573 4.941 ( -1.821 -1.463 -4.502) 5.072 4.986 ( -2.201 8.426 0.216) 8.712 5.064 ( -1.447 7.453 3.216) 8.246 5.129 ( -3.663 3.579 -5.215) 7.309 5.219 ( 3.227 -3.137 -2.166) 4.994 5.471 ( 2.554 5.650 1.368) 6.350 5.578 ( 4.541 1.892 -1.868) 5.263 5.730 ( 2.713 -2.706 3.433) 5.145 5.768 ( 5.382 1.019 -4.454) 7.060 5.814 ( 5.143 -0.457 3.969) 6.512 5.890 ( 5.986 -4.464 2.145) 7.769 5.959 ( 4.968 3.074 -5.237) 7.845 6.068 ( 6.289 -4.337 -2.166) 7.941 6.201 ( 7.393 -2.899 -1.047) 8.010 6.235 ( 6.976 -4.636 -1.326) 8.480 6.446 ( 5.040 -0.614 3.621) 6.236 6.459 ( 5.898 -1.975 1.724) 6.454 6.807 ( 6.163 2.894 -4.320) 8.063 6.844 ( 9.367 -0.382 -4.512) 10.405 7.189 ( -3.862 8.412 -0.457) 9.268 7.292 ( -3.963 -0.585 0.093) 4.007 7.458 ( -1.834 10.210 9.446) 14.030 7.668 ( -4.409 -2.444 0.341) 5.053 7.809 ( -7.720 -1.975 4.532) 9.167 8.018 ( -10.381 -15.593 -14.409) 23.633 10.312 ( -3.951 6.070 2.771) 7.754 10.413 ( -2.725 -3.334 2.434) 4.946 10.793 ( -1.774 3.499 0.748) 3.994 10.829 ( 0.798 -0.450 0.800) 1.216 11.053 ( -1.651 7.584 -1.654) 7.936 11.135 ( -7.423 0.613 3.050) 8.049 11.429 ( 10.062 -1.537 -2.387) 10.455 11.519 ( 5.012 -8.427 -2.697) 10.169 13.908 ( -1.739 4.384 1.378) 4.914 13.999 ( -0.615 -4.327 0.398) 4.388 14.194 ( 0.814 2.864 -2.442) 3.850 14.274 ( 2.729 -3.649 -1.356) 4.754 14.385 ( -0.710 -0.313 0.622) 0.995 14.439 ( -1.268 -5.260 0.907) 5.486 14.650 ( 2.060 0.594 0.394) 2.179 14.702 ( 2.372 -3.825 2.795) 5.298 14.936 ( -1.527 0.958 2.104) 2.771 15.004 ( -1.224 -5.697 1.818) 6.104 15.144 ( 1.699 1.969 -2.789) 3.813 15.190 ( 1.967 -2.111 -3.851) 4.812 24.386 ( -1.511 0.900 0.490) 1.826 24.401 ( -1.373 -0.540 0.591) 1.589 24.517 ( -0.942 1.869 -0.784) 2.235 24.550 ( -0.577 -1.202 -0.952) 1.638 25.301 ( -3.337 2.034 4.553) 6.000 25.348 ( -3.217 -2.613 4.031) 5.781 25.899 ( -4.120 5.867 -2.122) 7.476 26.016 ( -5.695 -5.779 -1.381) 8.230 26.675 ( 8.315 2.985 -2.843) 9.281 26.721 ( 8.185 -0.909 -2.595) 8.634 27.104 ( 14.238 -0.657 -1.389) 14.321 27.169 ( 14.546 -6.392 4.193) 16.432 28.313 ( -4.368 2.483 3.436) 6.087 28.329 ( -4.096 0.634 1.905) 4.562 29.056 ( -7.899 11.645 -1.756) 14.181 29.209 ( -7.513 -3.501 -6.088) 10.284 ======================= Grid point 110 (58/104) ======================= q-point: ( 0.30 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -6.063 8.028 3.135) 10.538 2.115 ( -9.919 -3.984 3.030) 11.110 2.398 ( -0.051 7.744 -0.985) 7.806 2.452 ( -4.612 4.326 -1.979) 6.626 2.570 ( 2.981 -1.559 -2.320) 4.086 2.594 ( 2.458 -1.385 -2.909) 4.053 2.668 ( 5.442 4.899 4.642) 8.670 2.805 ( 0.959 -4.071 1.803) 4.554 3.101 ( -9.377 2.271 -3.288) 10.193 3.174 ( -9.962 -4.841 -1.825) 11.225 3.363 ( 0.721 7.211 -3.002) 7.844 3.480 ( -2.598 -4.656 1.147) 5.453 3.636 ( -1.142 1.514 1.951) 2.721 3.682 ( 1.595 -0.695 0.440) 1.795 3.929 ( -1.993 9.072 1.441) 9.400 3.976 ( -4.217 0.467 1.604) 4.536 4.043 ( 1.875 -4.067 -0.679) 4.530 4.063 ( 1.565 0.156 5.958) 6.162 4.365 ( 6.910 10.141 0.995) 12.311 4.470 ( 4.061 -0.152 1.975) 4.518 4.637 ( 1.674 3.572 2.700) 4.780 4.744 ( -3.179 -1.197 -2.891) 4.460 4.807 ( -1.611 -0.672 1.425) 2.254 4.892 ( 3.026 2.384 1.734) 4.225 4.979 ( -0.276 7.947 4.960) 9.372 5.059 ( -1.367 1.079 -0.814) 1.922 5.123 ( 5.567 9.208 0.641) 10.779 5.271 ( 5.392 -2.755 0.549) 6.080 5.508 ( 1.792 9.665 -6.453) 11.759 5.661 ( 4.960 -4.622 -0.170) 6.782 5.761 ( 3.710 3.916 -4.459) 6.999 5.830 ( 3.677 -0.707 -1.978) 4.235 5.964 ( 9.990 -1.617 -1.087) 10.178 5.984 ( 5.405 -3.321 -3.385) 7.190 6.085 ( 9.205 2.882 3.024) 10.109 6.197 ( 8.511 -7.454 0.079) 11.313 6.334 ( 8.707 1.235 -0.704) 8.823 6.405 ( 10.041 -4.917 2.029) 11.363 6.535 ( 0.930 -0.832 3.810) 4.010 6.566 ( 3.383 -3.286 3.544) 5.899 6.841 ( 2.714 3.619 -2.370) 5.106 6.910 ( 2.933 -2.687 -3.003) 4.985 7.174 ( 1.026 6.400 -1.128) 6.579 7.220 ( -2.992 1.741 -0.972) 3.596 7.520 ( -0.976 8.785 6.833) 11.172 7.546 ( -2.941 3.499 -8.432) 9.591 7.709 ( -9.116 -9.267 -10.314) 16.594 7.783 ( -4.957 -11.830 7.895) 15.061 10.258 ( -3.951 6.672 1.075) 7.828 10.368 ( -4.135 -3.270 1.562) 5.498 10.695 ( -10.506 4.157 2.867) 11.657 10.761 ( -10.935 -2.422 1.837) 11.349 10.998 ( 2.995 8.520 -1.996) 9.249 11.127 ( 2.559 -1.744 0.406) 3.123 11.555 ( 8.019 1.400 -2.916) 8.647 11.670 ( 10.313 -6.965 -1.250) 12.508 13.895 ( -1.019 4.784 1.061) 5.005 13.995 ( -0.028 -5.312 0.098) 5.313 14.201 ( 1.980 2.253 -1.527) 3.366 14.308 ( 2.887 -6.051 -2.441) 7.135 14.379 ( -0.624 -0.051 0.554) 0.836 14.427 ( -0.682 -4.663 0.350) 4.726 14.661 ( -2.051 1.842 1.048) 2.949 14.747 ( -1.455 -5.989 3.729) 7.204 14.947 ( 1.963 1.345 0.512) 2.434 15.008 ( 0.346 -4.762 1.312) 4.951 15.157 ( 1.767 1.762 -1.492) 2.907 15.199 ( 1.923 -2.019 -2.001) 3.432 24.367 ( -1.251 0.909 0.825) 1.752 24.385 ( -1.178 -0.756 0.755) 1.590 24.497 ( -0.747 1.995 -0.328) 2.156 24.533 ( -0.483 -1.442 -0.602) 1.635 25.284 ( -2.913 2.059 3.748) 5.174 25.332 ( -2.197 -2.733 2.901) 4.551 25.797 ( -4.045 4.449 -3.044) 6.740 25.887 ( -5.587 -4.427 -3.053) 7.755 26.798 ( 7.937 5.021 -1.856) 9.573 26.896 ( 11.285 -3.579 0.108) 11.839 27.287 ( 7.863 3.897 -2.113) 9.026 27.432 ( 10.804 -9.128 2.333) 14.335 28.283 ( -1.355 2.688 1.770) 3.492 28.295 ( -2.628 1.476 4.196) 5.166 28.888 ( -8.745 10.700 -1.992) 13.962 29.034 ( -6.894 -3.984 -3.902) 8.867 ======================= Grid point 111 (59/104) ======================= q-point: ( 0.40 0.43 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -5.263 4.366 4.425) 8.145 1.987 ( -6.884 -2.704 4.702) 8.764 2.282 ( -5.456 6.582 0.238) 8.553 2.331 ( -3.173 3.871 -2.489) 5.590 2.608 ( 4.348 2.596 -6.785) 8.467 2.669 ( 3.729 0.150 -2.864) 4.704 2.768 ( -5.205 0.695 -4.219) 6.736 2.805 ( -1.882 -1.250 2.401) 3.297 2.981 ( -0.491 4.005 6.263) 7.450 3.104 ( -0.547 -6.471 7.262) 9.742 3.376 ( 1.472 2.392 -2.180) 3.555 3.421 ( -2.464 -1.711 -1.452) 3.333 3.652 ( 1.458 4.545 2.887) 5.578 3.718 ( 0.893 0.478 1.023) 1.439 3.911 ( -3.525 3.172 2.367) 5.300 3.931 ( 2.198 6.654 0.756) 7.048 4.054 ( -0.664 -5.430 0.516) 5.494 4.084 ( -3.026 -0.804 1.423) 3.439 4.399 ( -1.211 4.059 -2.289) 4.815 4.492 ( -0.594 2.841 1.794) 3.412 4.595 ( -7.070 0.752 -2.222) 7.449 4.723 ( 3.437 -3.299 3.345) 5.821 4.857 ( 1.154 7.044 2.764) 7.654 4.944 ( 1.559 3.364 2.863) 4.685 5.033 ( -0.659 4.107 4.653) 6.241 5.076 ( 2.152 5.802 4.722) 7.784 5.250 ( 3.574 3.778 2.073) 5.598 5.356 ( 2.129 -0.418 -0.653) 2.266 5.468 ( 2.757 11.329 -4.994) 12.684 5.710 ( 3.854 -10.681 -5.795) 12.748 5.792 ( 3.120 3.178 -2.845) 5.285 5.833 ( 0.426 0.094 -4.482) 4.503 6.060 ( 6.778 3.028 -3.178) 8.076 6.140 ( 10.122 -3.477 0.425) 10.711 6.265 ( 5.550 1.570 4.007) 7.023 6.319 ( 3.641 -4.307 0.734) 5.687 6.459 ( 5.403 2.569 -1.198) 6.101 6.552 ( -0.237 -3.632 1.724) 4.028 6.573 ( 4.860 0.227 1.039) 4.975 6.651 ( 2.034 -4.437 4.240) 6.466 6.902 ( 5.025 0.354 0.316) 5.047 6.933 ( 1.939 -2.169 -0.533) 2.958 7.160 ( -2.021 0.861 -1.824) 2.856 7.174 ( 0.043 0.429 -1.845) 1.895 7.385 ( -2.940 2.172 -7.244) 8.114 7.475 ( -5.540 -5.422 -9.094) 11.949 7.607 ( 3.258 7.578 1.009) 8.310 7.764 ( -5.082 -7.216 3.340) 9.436 10.208 ( -1.903 6.590 0.404) 6.871 10.316 ( -2.310 -3.160 0.381) 3.933 10.527 ( -9.717 3.529 2.652) 10.673 10.590 ( -9.742 -3.347 3.790) 10.976 11.065 ( 3.384 8.512 1.438) 9.273 11.193 ( 3.455 -1.395 0.925) 3.839 11.651 ( 5.558 4.233 -2.985) 7.597 11.804 ( 6.347 -7.651 -2.735) 10.310 13.890 ( -0.627 5.044 0.856) 5.155 13.997 ( 0.220 -6.122 -0.218) 6.130 14.232 ( 2.520 0.979 -0.736) 2.802 14.327 ( 1.790 -6.603 -2.592) 7.316 14.376 ( 0.396 0.674 -0.438) 0.896 14.422 ( -0.030 -4.126 -0.205) 4.132 14.599 ( -4.530 2.446 -0.666) 5.191 14.718 ( -3.886 -7.707 0.857) 8.674 15.002 ( 2.770 1.086 0.640) 3.044 15.042 ( 1.171 -2.744 2.187) 3.699 15.176 ( 1.348 1.269 0.020) 1.851 15.217 ( 1.253 -2.450 -0.141) 2.755 24.357 ( -0.897 0.865 1.017) 1.608 24.374 ( -0.766 -0.807 0.719) 1.325 24.486 ( -0.369 1.995 -0.025) 2.029 24.522 ( -0.188 -1.492 -0.493) 1.583 25.268 ( -2.428 2.352 3.088) 4.578 25.323 ( -1.560 -3.031 2.243) 4.081 25.718 ( -1.581 3.373 -2.707) 4.605 25.786 ( -2.298 -3.302 -2.980) 5.006 26.911 ( 5.291 7.256 0.534) 8.996 27.081 ( 7.810 -8.752 1.389) 11.812 27.349 ( 2.002 9.797 -1.750) 10.151 27.575 ( 4.472 -11.647 -0.658) 12.493 28.297 ( 0.311 3.707 2.066) 4.255 28.314 ( -0.045 2.193 3.853) 4.434 28.731 ( -6.129 10.926 -2.061) 12.696 28.901 ( -3.874 -6.144 -3.542) 8.081 ======================= Grid point 112 (60/104) ======================= q-point: (-0.50 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( -0.857 3.573 8.657) 9.405 1.984 ( -0.875 -2.656 8.058) 8.529 2.250 ( 0.328 7.365 2.315) 7.728 2.347 ( 3.809 -0.092 2.388) 4.497 2.542 ( -1.875 5.177 -10.451) 11.812 2.636 ( -2.233 -1.539 -7.866) 8.321 2.679 ( 1.358 2.403 -3.801) 4.698 2.731 ( -1.395 -1.633 -3.098) 3.770 3.042 ( -2.506 1.968 6.187) 6.959 3.103 ( -5.931 -3.530 3.421) 7.703 3.422 ( 5.103 1.533 3.677) 6.474 3.462 ( 5.590 -1.549 0.808) 5.857 3.699 ( -2.180 4.658 2.405) 5.678 3.728 ( 1.245 2.947 1.563) 3.561 3.903 ( -3.871 7.837 -2.562) 9.108 3.958 ( 1.284 5.485 6.637) 8.705 4.006 ( -4.533 -0.424 -1.135) 4.692 4.112 ( 2.755 -7.673 6.882) 10.669 4.388 ( 2.886 -0.807 -2.501) 3.903 4.425 ( -2.436 -4.503 -3.081) 5.975 4.576 ( 1.213 10.096 3.952) 10.909 4.752 ( -1.828 -5.117 1.786) 5.720 4.905 ( -0.009 8.443 5.263) 9.949 4.993 ( -0.651 11.523 1.548) 11.644 5.037 ( -3.670 0.937 5.824) 6.947 5.129 ( 0.485 1.100 -0.663) 1.372 5.245 ( -2.408 5.623 3.678) 7.138 5.365 ( -2.626 -2.169 -1.638) 3.779 5.511 ( 4.565 9.492 -1.317) 10.615 5.703 ( 1.226 -5.347 -7.699) 9.454 5.800 ( 2.538 -1.169 -3.341) 4.356 5.820 ( 3.859 -2.663 -4.233) 6.316 6.151 ( 5.003 7.455 -0.437) 8.988 6.277 ( -1.987 2.197 1.906) 3.522 6.324 ( -3.107 -1.045 3.299) 4.651 6.352 ( 3.995 -6.786 2.554) 8.279 6.499 ( 0.945 0.967 -1.909) 2.339 6.533 ( -2.227 -3.073 -1.480) 4.073 6.584 ( -3.531 1.528 0.214) 3.854 6.675 ( -4.490 -6.183 1.718) 7.832 6.953 ( -0.116 -0.289 0.601) 0.677 6.965 ( -0.200 -1.332 0.336) 1.388 7.106 ( 0.039 1.276 -4.711) 4.881 7.141 ( 1.198 -2.065 -3.807) 4.494 7.376 ( 0.758 0.082 -2.682) 2.788 7.395 ( 6.614 -1.615 -2.155) 7.141 7.643 ( 2.594 1.142 -3.601) 4.583 7.656 ( -5.246 -0.445 -3.037) 6.078 10.208 ( 0.523 5.487 1.522) 5.718 10.290 ( -0.933 -1.666 -0.674) 2.025 10.457 ( -0.848 2.433 3.869) 4.649 10.511 ( -2.067 -3.576 3.333) 5.307 11.122 ( 0.291 9.027 3.413) 9.655 11.246 ( 0.403 -0.363 2.321) 2.384 11.688 ( 1.632 3.418 -2.928) 4.787 11.832 ( 0.540 -7.476 -4.473) 8.729 13.887 ( -0.668 4.797 1.005) 4.946 13.995 ( -0.225 -6.224 -0.470) 6.246 14.269 ( 1.822 1.204 0.017) 2.184 14.322 ( -0.175 -1.046 -1.571) 1.896 14.384 ( 1.300 -2.404 -2.505) 3.707 14.421 ( 0.169 -3.607 -0.543) 3.651 14.525 ( -1.401 -0.840 -1.157) 2.002 14.644 ( -2.967 -8.442 -2.449) 9.278 15.040 ( -0.115 1.015 1.512) 1.825 15.063 ( -1.077 -1.248 2.275) 2.809 15.207 ( 1.166 0.703 1.196) 1.812 15.242 ( 1.303 -2.488 0.734) 2.903 24.355 ( -0.423 0.875 1.075) 1.449 24.373 ( -0.161 -0.865 0.770) 1.169 24.483 ( -0.006 1.946 0.096) 1.948 24.517 ( 0.225 -1.380 -0.531) 1.496 25.255 ( -2.056 2.734 2.610) 4.303 25.318 ( -1.311 -3.426 2.062) 4.208 25.696 ( 1.677 2.823 -2.196) 3.950 25.755 ( 1.591 -2.862 -2.607) 4.185 26.987 ( 1.360 7.624 2.814) 8.240 27.150 ( -1.606 -6.959 0.044) 7.142 27.376 ( 2.657 7.675 0.847) 8.165 27.585 ( -1.024 -11.267 -3.244) 11.769 28.301 ( -3.546 4.667 3.285) 6.719 28.325 ( -2.094 2.347 1.435) 3.457 28.675 ( 2.328 10.319 -1.158) 10.642 28.849 ( 2.537 -6.962 -3.963) 8.403 ======================= Grid point 113 (61/104) ======================= q-point: (-0.40 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 0.406 3.099 8.756) 9.298 2.038 ( -2.575 0.655 5.747) 6.331 2.283 ( 0.886 5.308 -2.687) 6.015 2.359 ( -1.423 -2.173 -4.315) 5.037 2.519 ( 6.681 5.565 -2.944) 9.180 2.601 ( 2.507 -1.754 -3.509) 4.656 2.633 ( 1.161 3.400 -1.616) 3.939 2.724 ( 2.584 -4.161 -1.643) 5.166 3.074 ( 2.913 2.052 2.732) 4.490 3.116 ( 5.257 -1.865 5.643) 7.935 3.495 ( -0.045 3.600 1.233) 3.805 3.533 ( -0.579 0.717 -0.407) 1.008 3.710 ( -0.165 4.406 5.549) 7.088 3.770 ( -3.688 1.651 -0.521) 4.074 3.784 ( -0.562 5.651 1.432) 5.857 3.881 ( -3.623 0.090 -5.216) 6.352 4.061 ( -0.925 4.816 6.853) 8.427 4.180 ( -2.228 -7.369 5.624) 9.534 4.399 ( -1.859 1.135 -2.503) 3.318 4.409 ( 2.590 0.945 -3.981) 4.842 4.634 ( 0.158 4.305 2.842) 5.161 4.748 ( 1.257 -6.003 3.434) 7.030 4.900 ( -5.229 12.572 2.515) 13.847 4.980 ( -0.958 11.694 4.322) 12.504 5.016 ( -3.910 2.671 2.835) 5.519 5.156 ( -2.326 0.348 3.291) 4.045 5.217 ( -0.442 1.875 0.735) 2.062 5.299 ( -1.368 -4.231 1.734) 4.773 5.537 ( -0.528 2.935 -2.724) 4.039 5.601 ( -4.457 -2.859 -6.726) 8.560 5.854 ( 5.665 1.339 -2.933) 6.518 5.879 ( 4.750 -0.505 -1.986) 5.173 6.108 ( -10.893 4.738 -4.975) 12.879 6.182 ( -6.939 1.981 0.025) 7.216 6.259 ( -4.633 2.471 4.418) 6.862 6.380 ( -5.320 -3.652 -2.893) 7.072 6.446 ( -6.073 -1.427 -1.420) 6.397 6.504 ( -1.075 -8.523 4.492) 9.694 6.520 ( -4.780 -0.052 3.614) 5.993 6.577 ( -3.594 -4.113 1.273) 5.608 6.921 ( -2.915 1.170 0.144) 3.144 6.937 ( -1.175 -0.682 -0.389) 1.413 7.091 ( 2.427 3.644 -3.998) 5.929 7.155 ( 1.441 -1.583 -3.373) 3.995 7.323 ( -3.896 2.846 -6.090) 7.770 7.408 ( -0.767 -4.202 -6.976) 8.180 7.618 ( 5.477 6.818 -0.082) 8.746 7.780 ( 13.648 -8.212 1.111) 15.966 10.219 ( -0.828 4.168 0.990) 4.364 10.286 ( 1.288 -1.767 -0.221) 2.197 10.542 ( 6.274 3.574 3.260) 7.923 10.604 ( 8.000 -2.561 3.177) 8.980 11.137 ( -2.303 8.880 4.111) 10.052 11.237 ( -4.049 1.488 1.840) 4.690 11.657 ( -2.175 -0.736 -2.198) 3.179 11.743 ( -4.886 -6.338 -5.742) 9.849 13.886 ( -0.696 3.684 1.528) 4.049 13.982 ( -0.474 -5.511 -0.540) 5.558 14.288 ( -0.991 2.731 -3.506) 4.553 14.297 ( 0.840 3.522 1.594) 3.956 14.354 ( -1.230 -3.342 -3.002) 4.658 14.418 ( -0.062 -4.286 -0.307) 4.298 14.546 ( 2.836 -4.991 -0.707) 5.784 14.602 ( 1.830 -8.014 -1.717) 8.398 15.014 ( -3.616 1.464 1.404) 4.146 15.060 ( -2.181 -2.756 2.434) 4.275 15.227 ( 0.071 1.887 0.756) 2.034 15.271 ( 0.917 -2.191 0.700) 2.476 24.363 ( 0.205 0.972 1.090) 1.475 24.383 ( 0.368 -0.988 1.023) 1.469 24.487 ( 0.510 1.978 -0.000) 2.042 24.521 ( 0.737 -1.207 -0.587) 1.531 25.244 ( -1.673 3.002 2.307) 4.139 25.314 ( -1.349 -3.808 2.125) 4.565 25.731 ( 4.309 2.668 -2.233) 5.538 25.788 ( 4.738 -2.905 -2.907) 6.272 27.006 ( -3.041 5.282 4.252) 7.432 27.053 ( -7.649 1.751 -1.174) 7.934 27.422 ( -0.989 -2.354 1.460) 2.941 27.484 ( -5.921 -7.287 -4.046) 10.224 28.239 ( -4.328 5.319 1.320) 6.983 28.289 ( -3.117 0.294 2.374) 3.929 28.770 ( 8.295 9.862 -0.851) 12.915 28.925 ( 9.257 -5.482 -2.927) 11.149 ======================= Grid point 114 (62/104) ======================= q-point: (-0.30 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -4.545 10.697 0.696) 11.643 2.068 ( -2.797 4.714 7.797) 9.531 2.271 ( 0.789 2.953 -4.495) 5.435 2.310 ( 0.988 -2.790 -2.867) 4.120 2.490 ( -2.129 0.921 -3.306) 4.038 2.568 ( -3.597 -6.065 -5.074) 8.687 2.769 ( 10.756 6.242 3.427) 12.899 2.892 ( 11.284 -5.616 3.208) 13.006 3.202 ( 5.756 4.232 1.189) 7.243 3.281 ( 6.158 -2.901 1.458) 6.962 3.481 ( -0.818 6.544 -3.800) 7.612 3.515 ( 2.455 3.989 3.977) 6.145 3.651 ( -2.645 5.021 -2.956) 6.399 3.715 ( -4.064 0.658 2.602) 4.870 3.817 ( -1.989 0.644 0.921) 2.284 3.827 ( -1.126 2.022 0.170) 2.321 4.020 ( -7.204 3.278 1.368) 8.032 4.166 ( -3.959 -9.612 2.810) 10.768 4.295 ( -5.554 4.424 0.909) 7.158 4.375 ( -1.892 -3.377 -2.644) 4.687 4.612 ( -8.473 14.541 3.169) 17.126 4.811 ( -1.856 -0.393 0.562) 1.979 4.824 ( -1.914 8.109 1.654) 8.494 4.915 ( -3.209 1.961 -0.268) 3.770 5.044 ( 0.328 6.446 5.478) 8.465 5.148 ( -1.117 0.722 3.856) 4.079 5.274 ( 1.861 0.358 1.612) 2.489 5.335 ( -0.054 -4.523 4.055) 6.075 5.457 ( -4.490 -2.632 -1.988) 5.571 5.475 ( -1.402 -3.493 -3.773) 5.329 5.784 ( -10.538 4.741 -3.106) 11.966 5.884 ( -5.738 1.849 -0.361) 6.040 5.961 ( -6.234 -0.130 -5.506) 8.318 5.979 ( -2.390 -2.798 -3.333) 4.965 6.196 ( -5.224 2.759 0.185) 5.911 6.264 ( -6.569 -4.430 -1.924) 8.153 6.322 ( -4.522 5.143 3.613) 7.743 6.450 ( -7.138 -4.987 3.597) 9.421 6.486 ( -4.202 1.518 3.426) 5.630 6.564 ( -4.652 -6.099 3.318) 8.358 6.868 ( -2.544 2.904 -1.920) 4.311 6.935 ( 0.516 -2.721 -2.299) 3.600 7.110 ( 0.361 2.941 -2.692) 4.003 7.112 ( 4.162 3.828 -2.848) 6.331 7.225 ( -1.067 0.658 -5.113) 5.265 7.318 ( -0.285 -6.049 -6.175) 8.649 7.776 ( 9.891 12.483 1.163) 15.969 8.072 ( 16.236 -15.348 2.440) 22.475 10.220 ( 0.577 5.057 0.504) 5.115 10.321 ( 2.421 -4.487 0.556) 5.129 10.714 ( 8.974 6.118 2.566) 11.160 10.775 ( 5.964 -0.143 2.713) 6.554 11.130 ( -8.153 4.393 -0.932) 9.308 11.137 ( -0.876 3.990 2.910) 5.015 11.561 ( -7.454 -2.812 -4.357) 9.081 11.601 ( -3.381 -6.508 -1.853) 7.564 13.893 ( -0.318 2.285 1.893) 2.984 13.973 ( -0.019 -4.555 -0.454) 4.578 14.237 ( -0.753 1.890 -3.414) 3.974 14.297 ( -1.447 -3.744 -3.435) 5.283 14.337 ( 1.406 3.950 2.571) 4.918 14.417 ( 0.228 -3.991 0.045) 3.997 14.578 ( 2.576 -0.983 -1.056) 2.952 14.668 ( 3.362 -8.981 1.906) 9.778 14.958 ( -3.586 1.930 0.968) 4.186 15.029 ( -3.114 -4.914 1.615) 6.038 15.226 ( -0.520 3.161 0.185) 3.209 15.282 ( 0.129 -2.087 -0.097) 2.093 24.382 ( 0.822 1.098 1.099) 1.758 24.403 ( 0.644 -0.938 1.320) 1.742 24.502 ( 1.301 1.942 -0.286) 2.355 24.532 ( 1.274 -0.978 -0.732) 1.765 25.242 ( -1.050 2.971 2.600) 4.085 25.312 ( -1.193 -3.975 2.669) 4.935 25.795 ( 5.250 2.886 -2.680) 6.563 25.856 ( 6.234 -3.203 -3.846) 7.995 26.881 ( -9.899 4.959 -1.715) 11.203 26.951 ( -7.473 -0.287 3.265) 8.160 27.254 ( -11.792 1.880 -4.528) 12.771 27.393 ( -7.698 -9.910 2.744) 12.845 28.210 ( 0.181 5.606 1.128) 5.722 28.285 ( 0.181 -1.785 2.660) 3.208 28.926 ( 10.045 11.747 -1.200) 15.503 29.102 ( 12.853 -5.348 -2.084) 14.077 ======================= Grid point 115 (63/104) ======================= q-point: (-0.20 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.921 ( -4.870 18.941 2.277) 19.689 2.058 ( -5.448 14.760 6.208) 16.914 2.211 ( -2.706 -0.258 -2.412) 3.634 2.341 ( 1.485 -6.763 -0.549) 6.945 2.417 ( -4.187 -4.173 -1.741) 6.163 2.485 ( -1.220 -9.259 -1.205) 9.416 2.899 ( 2.385 6.143 -2.796) 7.159 3.002 ( 0.192 -4.265 -3.931) 5.804 3.280 ( 6.733 5.575 -0.528) 8.757 3.392 ( 6.326 -4.243 -0.072) 7.617 3.424 ( -2.479 14.010 -5.066) 15.103 3.599 ( -3.993 4.742 6.049) 8.662 3.635 ( -0.104 1.594 -4.390) 4.672 3.704 ( 0.829 1.123 5.439) 5.615 3.753 ( -0.825 2.310 0.715) 2.555 3.823 ( 1.761 -1.919 2.120) 3.358 3.921 ( -3.967 3.397 2.410) 5.752 4.069 ( -7.518 -8.871 -0.166) 11.629 4.256 ( -4.879 3.191 5.928) 8.314 4.348 ( -0.923 -5.523 3.422) 6.563 4.443 ( -9.521 18.777 2.816) 21.240 4.708 ( -5.187 1.668 -0.185) 5.452 4.861 ( 3.055 3.733 -2.856) 5.606 4.907 ( 2.409 0.846 -3.468) 4.306 5.049 ( -4.763 3.467 0.466) 5.909 5.095 ( -6.625 -1.440 -1.794) 7.013 5.239 ( -5.231 -0.311 1.964) 5.597 5.313 ( -3.465 -2.902 3.409) 5.662 5.462 ( 2.097 -1.311 -1.023) 2.676 5.493 ( 2.564 -2.268 2.553) 4.270 5.625 ( -4.792 2.434 1.150) 5.496 5.746 ( -4.696 -5.248 2.189) 7.375 5.828 ( -3.772 6.061 -3.425) 7.918 5.869 ( -6.427 1.128 -4.520) 7.938 6.139 ( -3.634 0.673 0.656) 3.753 6.173 ( -3.150 -3.529 1.111) 4.859 6.278 ( -4.615 3.107 0.742) 5.612 6.321 ( -8.524 -2.035 -1.508) 8.892 6.419 ( -7.293 1.008 3.608) 8.199 6.464 ( -7.080 -2.773 1.748) 7.802 6.767 ( -5.309 4.778 -4.918) 8.672 6.856 ( -5.015 -2.868 -4.695) 7.444 7.153 ( 7.830 2.737 -5.549) 9.980 7.207 ( 3.034 -1.199 0.794) 3.357 7.242 ( 7.086 0.003 3.690) 7.989 7.310 ( 3.930 -4.530 -2.066) 6.343 7.955 ( 9.690 17.625 -0.756) 20.128 8.364 ( 14.772 -21.112 -0.244) 25.768 10.251 ( 1.756 6.229 1.401) 6.622 10.376 ( 2.156 -5.768 1.890) 6.442 10.822 ( -2.200 4.698 2.269) 5.662 10.869 ( 4.887 4.043 2.354) 6.765 10.947 ( -9.308 5.984 -2.510) 11.346 11.130 ( -4.232 -8.234 -1.570) 9.390 11.435 ( -0.933 4.992 -0.732) 5.131 11.568 ( 1.477 -7.484 -1.500) 7.775 13.911 ( 0.401 1.304 1.837) 2.288 13.974 ( 0.598 -3.596 -0.341) 3.662 14.205 ( 0.177 0.312 -2.377) 2.404 14.249 ( -0.314 -3.505 -3.089) 4.683 14.389 ( 1.175 2.091 2.902) 3.765 14.423 ( 0.424 -2.573 -0.239) 2.619 14.615 ( 1.420 1.757 0.571) 2.330 14.708 ( -1.417 -5.929 1.978) 6.409 14.921 ( -1.215 1.026 0.835) 1.796 14.995 ( -1.489 -5.705 0.683) 5.935 15.218 ( -0.222 3.093 -0.447) 3.133 15.282 ( 0.674 -2.575 -1.104) 2.882 24.410 ( 1.062 1.082 0.959) 1.794 24.426 ( 0.516 -0.501 1.209) 1.407 24.527 ( 1.987 1.649 -0.656) 2.664 24.551 ( 1.818 -0.649 -1.118) 2.231 25.259 ( -0.395 2.701 3.878) 4.742 25.326 ( -0.812 -3.949 4.241) 5.852 25.861 ( 4.884 3.396 -2.530) 6.464 25.928 ( 6.098 -3.366 -4.260) 8.165 26.688 ( -9.400 3.984 -2.124) 10.428 26.784 ( -11.911 -5.422 -2.430) 13.311 27.016 ( -11.705 9.309 0.595) 14.968 27.237 ( -11.872 -12.016 2.621) 17.094 28.259 ( 3.308 5.307 1.437) 6.416 28.335 ( 2.293 -2.325 2.618) 4.185 29.087 ( 9.267 14.537 -1.642) 17.318 29.316 ( 13.379 -7.516 -3.230) 15.682 ======================= Grid point 116 (64/104) ======================= q-point: (-0.10 0.43 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( -4.168 21.761 5.608) 22.855 2.011 ( -5.648 22.029 5.510) 23.399 2.126 ( -5.951 -2.464 2.126) 6.783 2.250 ( -6.179 0.222 -0.445) 6.199 2.428 ( 1.638 -11.604 1.711) 11.843 2.450 ( -3.600 -15.051 2.227) 15.635 2.889 ( 3.455 4.772 -5.933) 8.361 2.978 ( 4.227 -3.546 -5.388) 7.712 3.319 ( -3.132 17.347 -1.883) 17.728 3.362 ( 0.545 5.531 -1.274) 5.702 3.472 ( 2.579 -4.914 -3.474) 6.547 3.520 ( -2.478 -1.537 0.584) 2.974 3.592 ( -3.823 10.146 5.073) 11.970 3.717 ( -4.089 -1.921 5.600) 7.195 3.782 ( -0.713 2.477 5.046) 5.666 3.885 ( -2.816 -4.886 -2.146) 6.035 3.950 ( 2.468 3.739 1.447) 4.708 4.005 ( 3.127 -1.971 3.054) 4.795 4.183 ( -5.246 12.697 1.266) 13.796 4.397 ( 2.263 8.501 1.993) 9.020 4.413 ( 0.706 -7.738 4.873) 9.172 4.655 ( -1.484 -1.602 1.833) 2.851 4.781 ( -9.024 -3.491 -5.674) 11.217 4.821 ( -8.599 -1.831 -1.175) 8.870 4.986 ( 3.967 6.105 -5.285) 8.996 5.024 ( 3.247 2.460 -2.337) 4.696 5.231 ( 0.167 2.887 2.902) 4.097 5.314 ( 1.129 -2.824 1.776) 3.522 5.437 ( -3.723 1.594 2.099) 4.561 5.505 ( -2.701 -5.696 4.673) 7.847 5.656 ( 0.217 2.479 2.468) 3.505 5.711 ( -3.234 -2.058 0.283) 3.844 5.748 ( -0.247 7.626 -3.385) 8.347 5.818 ( 4.321 1.960 -0.287) 4.753 6.042 ( -7.685 1.946 0.757) 7.964 6.083 ( -9.353 -1.106 -1.259) 9.502 6.162 ( -5.140 -0.662 -0.837) 5.249 6.191 ( -4.433 -3.969 -0.345) 5.960 6.332 ( -3.994 2.615 0.657) 4.819 6.384 ( -3.598 -2.439 0.227) 4.352 6.628 ( -3.144 4.333 -6.220) 8.207 6.719 ( -3.603 -4.436 -5.895) 8.210 7.230 ( 5.457 4.615 -3.508) 7.961 7.302 ( 4.598 0.601 1.773) 4.964 7.392 ( 5.277 -3.765 6.270) 9.019 7.415 ( 4.985 -4.939 3.298) 7.754 8.081 ( 6.407 20.701 -4.478) 22.128 8.551 ( 8.778 -24.363 -6.120) 26.609 10.299 ( 1.203 6.033 2.714) 6.723 10.416 ( -0.244 -4.943 2.552) 5.569 10.785 ( -3.176 5.823 0.771) 6.678 10.804 ( -3.754 3.370 -0.583) 5.078 10.920 ( -1.283 -0.485 1.722) 2.202 11.003 ( -5.740 -8.351 1.908) 10.311 11.462 ( 1.874 8.136 -0.629) 8.372 11.618 ( 5.087 -6.428 -2.961) 8.716 13.934 ( 0.320 0.994 1.331) 1.692 13.986 ( 0.798 -2.781 0.185) 2.899 14.197 ( 1.086 -0.213 -1.797) 2.110 14.232 ( 0.649 -3.178 -1.571) 3.604 14.418 ( 0.252 0.105 0.418) 0.499 14.430 ( 0.016 -0.637 1.098) 1.269 14.626 ( -0.571 0.783 -0.085) 0.973 14.669 ( -3.281 -2.794 0.350) 4.323 14.924 ( -0.048 0.877 1.579) 1.806 14.992 ( -0.119 -4.950 1.012) 5.054 15.210 ( 0.271 2.150 -1.748) 2.784 15.282 ( 1.060 -3.734 -3.085) 4.958 24.430 ( 0.283 0.861 0.550) 1.060 24.441 ( 0.123 -0.129 0.573) 0.600 24.553 ( 1.776 1.444 -1.316) 2.640 24.573 ( 1.858 -0.414 -1.628) 2.504 25.295 ( -0.698 2.550 5.415) 6.026 25.360 ( -1.153 -4.002 6.422) 7.654 25.921 ( 3.654 3.784 -0.934) 5.342 25.992 ( 4.987 -3.130 -3.095) 6.652 26.542 ( -4.282 0.620 -1.177) 4.484 26.557 ( -7.846 -0.857 -2.849) 8.391 26.848 ( -8.900 8.092 1.200) 12.088 27.051 ( -10.395 -11.816 0.721) 15.754 28.330 ( 2.586 4.590 1.682) 5.530 28.395 ( 1.385 -1.932 2.416) 3.390 29.207 ( 5.880 16.589 -2.242) 17.743 29.482 ( 9.369 -10.088 -6.173) 15.088 ======================= Grid point 147 (65/104) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( -8.042 0.000 23.107) 24.467 1.271 ( -1.442 0.000 27.574) 27.612 1.482 ( 4.507 0.000 -18.378) 18.922 1.766 ( 0.918 0.000 -17.811) 17.835 2.235 ( -5.015 0.000 33.998) 34.366 2.605 ( 12.054 0.000 -6.008) 13.468 2.737 ( 1.231 0.000 0.882) 1.515 2.756 ( 2.561 0.000 6.032) 6.553 3.117 ( -1.461 0.000 0.878) 1.705 3.148 ( -4.335 0.000 -2.388) 4.949 3.460 ( 2.432 0.000 10.362) 10.644 3.578 ( -4.443 0.000 0.404) 4.462 3.613 ( -4.075 0.000 -2.651) 4.861 3.657 ( 5.493 0.000 -5.254) 7.601 3.783 ( -1.531 0.000 -3.394) 3.723 3.813 ( -1.889 0.000 -4.780) 5.140 3.946 ( -0.877 0.000 -3.949) 4.045 3.963 ( -3.190 0.000 -2.642) 4.142 4.026 ( -5.086 0.000 3.001) 5.905 4.078 ( 6.430 0.000 -3.125) 7.149 4.230 ( 5.132 0.000 0.240) 5.138 4.320 ( -9.450 0.000 -9.919) 13.700 4.352 ( 3.145 0.000 8.388) 8.958 4.569 ( -2.483 0.000 -10.830) 11.111 4.665 ( -6.036 0.000 7.353) 9.513 4.800 ( 11.176 0.000 -5.946) 12.660 5.248 ( -7.422 0.000 8.076) 10.968 5.265 ( -3.087 0.000 10.873) 11.303 5.413 ( 10.253 0.000 -5.985) 11.872 5.470 ( -1.187 0.000 -7.395) 7.489 5.598 ( -7.905 0.000 5.506) 9.634 5.745 ( 7.991 0.000 -7.971) 11.287 5.817 ( -5.192 0.000 8.544) 9.997 5.914 ( 6.903 0.000 5.549) 8.857 5.983 ( 3.834 0.000 -7.313) 8.257 6.035 ( -8.448 0.000 -6.004) 10.364 6.104 ( 1.477 0.000 10.139) 10.246 6.367 ( 0.925 0.000 -13.452) 13.484 6.463 ( -3.452 0.000 4.346) 5.550 6.546 ( 4.126 0.000 -3.932) 5.700 6.788 ( -0.131 0.000 0.627) 0.640 6.801 ( -0.064 0.000 -0.614) 0.618 7.128 ( 1.683 0.000 5.632) 5.878 7.188 ( -1.308 0.000 -0.367) 1.359 7.307 ( 4.241 0.000 -2.164) 4.762 7.352 ( -5.499 0.000 -6.342) 8.394 8.308 ( 3.906 0.000 21.921) 22.266 8.721 ( -3.322 0.000 -17.470) 17.783 10.278 ( 4.176 0.000 6.147) 7.432 10.405 ( -1.516 0.000 -5.066) 5.288 10.439 ( -2.128 0.000 3.727) 4.292 10.516 ( -0.096 0.000 -3.994) 3.995 11.043 ( 8.626 0.000 6.600) 10.862 11.172 ( -8.838 0.000 -5.238) 10.274 11.501 ( -6.107 0.000 5.571) 8.266 11.613 ( 6.534 0.000 -5.027) 8.244 13.980 ( 5.366 0.000 0.401) 5.381 14.010 ( -7.039 0.000 -2.386) 7.432 14.331 ( 0.742 0.000 2.122) 2.248 14.375 ( -1.072 0.000 -1.981) 2.252 14.613 ( -0.714 0.000 5.805) 5.848 14.701 ( -2.041 0.000 -0.948) 2.250 14.718 ( 0.379 0.000 1.072) 1.137 14.789 ( 2.173 0.000 -7.201) 7.521 14.808 ( 5.242 0.000 1.249) 5.389 14.834 ( -3.356 0.000 -0.983) 3.497 15.498 ( 0.576 0.000 4.231) 4.270 15.560 ( -0.521 0.000 -1.905) 1.975 24.400 ( -0.789 0.000 0.172) 0.808 24.403 ( 0.470 0.000 -0.245) 0.530 24.503 ( -1.243 0.000 1.318) 1.812 24.531 ( 1.407 0.000 -1.479) 2.041 25.346 ( -2.662 0.000 6.150) 6.701 25.476 ( 2.759 0.000 -6.020) 6.622 26.107 ( -23.265 0.000 1.083) 23.290 26.125 ( 12.400 0.000 -0.526) 12.411 26.535 ( 0.431 0.000 1.372) 1.438 26.575 ( -0.074 0.000 -2.437) 2.439 27.640 ( -7.257 0.000 1.738) 7.463 27.679 ( 12.251 0.000 -1.917) 12.401 27.947 ( -0.388 0.000 1.433) 1.485 27.964 ( -0.997 0.000 -0.154) 1.009 28.451 ( -8.681 0.000 0.846) 8.722 28.473 ( 16.372 0.000 -1.242) 16.419 ======================= Grid point 148 (66/104) ======================= q-point: ( 0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( 8.661 0.000 20.311) 22.081 1.543 ( 16.744 0.000 -17.850) 24.474 1.576 ( 7.814 0.000 22.370) 23.696 1.683 ( 12.182 0.000 -20.508) 23.853 2.309 ( -6.663 0.000 8.762) 11.008 2.705 ( 7.196 0.000 -17.659) 19.069 2.717 ( -0.680 0.000 0.742) 1.006 2.812 ( 0.015 0.000 -3.706) 3.706 3.134 ( -2.011 0.000 -4.025) 4.500 3.179 ( 5.786 0.000 11.975) 13.299 3.419 ( -10.777 0.000 -1.225) 10.847 3.459 ( -6.647 0.000 0.723) 6.686 3.582 ( -2.632 0.000 5.118) 5.755 3.691 ( 3.760 0.000 -5.990) 7.073 3.766 ( -3.501 0.000 3.880) 5.226 3.773 ( -1.629 0.000 2.796) 3.236 3.820 ( -5.961 0.000 -6.197) 8.598 3.845 ( -6.313 0.000 10.239) 12.029 3.974 ( -0.036 0.000 -0.650) 0.651 4.112 ( -4.532 0.000 2.760) 5.306 4.164 ( 1.587 0.000 -7.813) 7.972 4.345 ( 2.986 0.000 7.183) 7.779 4.560 ( 13.049 0.000 -6.364) 14.518 4.563 ( 2.437 0.000 12.880) 13.109 4.665 ( 5.457 0.000 -2.487) 5.997 4.986 ( 15.987 0.000 -9.263) 18.477 5.145 ( -9.627 0.000 4.880) 10.794 5.306 ( -5.590 0.000 13.215) 14.348 5.402 ( -2.847 0.000 -6.654) 7.238 5.417 ( 3.140 0.000 -6.735) 7.432 5.565 ( -1.898 0.000 4.212) 4.620 5.840 ( 6.419 0.000 -2.429) 6.863 5.879 ( -0.813 0.000 -6.008) 6.063 5.906 ( 5.765 0.000 6.787) 8.905 6.013 ( 6.415 0.000 -5.556) 8.486 6.126 ( 8.962 0.000 8.353) 12.251 6.269 ( 5.744 0.000 9.859) 11.410 6.304 ( 7.682 0.000 -15.519) 17.316 6.463 ( 0.382 0.000 2.659) 2.686 6.582 ( 3.243 0.000 -4.503) 5.549 6.802 ( 0.855 0.000 0.634) 1.065 6.809 ( 1.401 0.000 -0.218) 1.418 7.136 ( -4.578 0.000 -5.442) 7.111 7.177 ( -0.502 0.000 3.311) 3.349 7.198 ( -4.785 0.000 2.437) 5.370 7.368 ( 1.817 0.000 1.187) 2.170 8.399 ( -11.377 0.000 -20.532) 23.473 8.465 ( -7.828 0.000 19.278) 20.806 10.229 ( -8.617 0.000 -7.769) 11.603 10.305 ( -4.506 0.000 5.686) 7.255 10.521 ( 4.793 0.000 4.965) 6.901 10.546 ( 4.497 0.000 -3.254) 5.551 10.949 ( -10.193 0.000 -5.820) 11.738 11.292 ( 12.242 0.000 6.571) 13.894 11.409 ( -9.730 0.000 4.808) 10.853 11.674 ( 5.902 0.000 -5.698) 8.204 13.874 ( -6.295 0.000 -0.310) 6.303 14.047 ( 0.843 0.000 2.091) 2.255 14.438 ( 6.868 0.000 1.350) 6.999 14.442 ( 9.573 0.000 -0.850) 9.610 14.645 ( -1.350 0.000 -2.916) 3.214 14.647 ( -3.515 0.000 6.920) 7.761 14.740 ( 2.160 0.000 0.906) 2.342 14.773 ( -1.377 0.000 -2.981) 3.283 14.776 ( 2.332 0.000 -4.165) 4.774 14.915 ( 6.490 0.000 -0.083) 6.491 15.508 ( -2.740 0.000 -2.797) 3.916 15.523 ( -1.490 0.000 2.924) 3.281 24.385 ( -0.990 0.000 0.095) 0.994 24.404 ( -0.465 0.000 0.621) 0.776 24.488 ( -1.585 0.000 0.924) 1.834 24.538 ( 0.816 0.000 -1.277) 1.516 25.355 ( -2.829 0.000 6.120) 6.742 25.465 ( 2.254 0.000 -6.304) 6.695 25.831 ( -13.420 0.000 8.003) 15.625 26.367 ( 9.415 0.000 5.065) 10.691 26.534 ( -2.833 0.000 -2.313) 3.657 26.578 ( 3.255 0.000 1.189) 3.466 27.525 ( -2.167 0.000 -0.962) 2.370 27.772 ( 2.649 0.000 -3.789) 4.623 27.955 ( -0.537 0.000 0.246) 0.591 27.970 ( 0.989 0.000 2.137) 2.355 28.300 ( -6.818 0.000 -2.568) 7.285 28.713 ( 14.342 0.000 -8.081) 16.461 ======================= Grid point 149 (67/104) ======================= q-point: ( 0.20 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.554 ( 4.059 0.000 9.429) 10.265 1.594 ( 8.316 0.000 -21.405) 22.964 1.841 ( 19.390 0.000 -12.158) 22.886 1.896 ( 8.285 0.000 12.683) 15.149 2.283 ( 0.471 0.000 0.867) 0.987 2.645 ( -5.441 0.000 -4.821) 7.269 2.714 ( 4.734 0.000 -7.721) 9.056 2.718 ( -0.972 0.000 -9.439) 9.489 2.924 ( -10.933 0.000 -6.046) 12.493 3.246 ( -7.166 0.000 0.599) 7.191 3.255 ( -9.740 0.000 6.511) 11.716 3.429 ( 2.894 0.000 0.015) 2.894 3.605 ( 0.666 0.000 9.056) 9.080 3.606 ( -5.797 0.000 -3.397) 6.719 3.693 ( 6.197 0.000 -8.925) 10.865 3.722 ( -6.030 0.000 3.859) 7.159 3.834 ( 0.163 0.000 1.689) 1.697 3.918 ( -1.628 0.000 9.040) 9.185 4.046 ( 5.104 0.000 4.744) 6.968 4.049 ( -3.738 0.000 -2.090) 4.282 4.141 ( 1.628 0.000 -3.394) 3.764 4.415 ( -4.949 0.000 10.453) 11.565 4.696 ( 4.922 0.000 12.430) 13.369 4.812 ( 14.457 0.000 -1.782) 14.566 4.820 ( 7.234 0.000 2.828) 7.768 5.048 ( -1.695 0.000 1.553) 2.299 5.163 ( 11.943 0.000 -6.449) 13.573 5.271 ( -3.605 0.000 -4.495) 5.762 5.316 ( -6.590 0.000 12.349) 13.997 5.463 ( 8.120 0.000 -6.314) 10.286 5.562 ( -4.476 0.000 5.216) 6.873 5.798 ( -1.206 0.000 -2.729) 2.983 5.960 ( 8.491 0.000 -7.423) 11.278 6.093 ( 9.841 0.000 2.235) 10.091 6.169 ( 13.955 0.000 2.760) 14.225 6.342 ( 5.843 0.000 4.227) 7.212 6.364 ( 12.198 0.000 -11.437) 16.722 6.451 ( 5.668 0.000 11.173) 12.528 6.539 ( -1.818 0.000 -6.954) 7.188 6.557 ( 8.378 0.000 0.756) 8.412 6.820 ( 0.966 0.000 -0.173) 0.981 6.840 ( 1.265 0.000 0.839) 1.518 6.980 ( -5.869 0.000 -3.782) 6.982 7.185 ( -1.038 0.000 1.896) 2.162 7.237 ( 2.114 0.000 7.847) 8.127 7.359 ( -3.316 0.000 -0.565) 3.364 7.993 ( -10.920 0.000 -22.211) 24.750 8.400 ( -15.741 0.000 12.463) 20.077 10.025 ( -6.077 0.000 -5.227) 8.016 10.291 ( -2.798 0.000 5.745) 6.390 10.585 ( -5.558 0.000 0.707) 5.603 10.593 ( 4.475 0.000 -3.684) 5.797 10.780 ( -1.194 0.000 0.542) 1.311 11.228 ( -11.866 0.000 -0.002) 11.866 11.589 ( 11.672 0.000 7.994) 14.147 11.717 ( 5.552 0.000 -6.299) 8.396 13.784 ( -4.277 0.000 0.854) 4.361 14.080 ( 0.682 0.000 3.419) 3.486 14.529 ( 2.789 0.000 -1.938) 3.396 14.565 ( -6.701 0.000 -3.793) 7.700 14.599 ( 5.322 0.000 1.324) 5.484 14.615 ( 0.632 0.000 -1.997) 2.095 14.756 ( 0.370 0.000 0.963) 1.032 14.817 ( 5.415 0.000 -0.641) 5.452 14.847 ( 7.477 0.000 3.693) 8.340 15.032 ( 7.147 0.000 -1.270) 7.259 15.422 ( -3.619 0.000 -3.021) 4.714 15.500 ( -3.218 0.000 1.292) 3.468 24.369 ( -0.769 0.000 0.051) 0.770 24.401 ( -0.989 0.000 1.560) 1.847 24.464 ( -1.747 0.000 0.332) 1.779 24.537 ( 0.365 0.000 -1.252) 1.304 25.356 ( -3.628 0.000 6.329) 7.295 25.436 ( 1.455 0.000 -6.680) 6.837 25.735 ( -7.445 0.000 8.772) 11.505 26.276 ( -14.290 0.000 -4.821) 15.081 26.603 ( 7.287 0.000 1.613) 7.464 26.670 ( 6.140 0.000 0.479) 6.158 27.641 ( 9.873 0.000 5.612) 11.356 27.754 ( -0.063 0.000 -3.378) 3.378 27.933 ( -2.363 0.000 0.438) 2.404 28.008 ( 0.816 0.000 0.623) 1.026 28.196 ( -2.439 0.000 1.523) 2.875 28.833 ( 9.539 0.000 -10.381) 14.098 ======================= Grid point 150 (68/104) ======================= q-point: ( 0.30 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 0.168 0.000 -14.156) 14.157 1.662 ( 0.066 0.000 7.914) 7.915 2.042 ( 2.040 0.000 -0.552) 2.113 2.051 ( 17.096 0.000 -12.910) 21.423 2.345 ( 4.235 0.000 3.114) 5.257 2.413 ( -15.533 0.000 4.694) 16.227 2.616 ( -1.138 0.000 -10.079) 10.143 2.690 ( 1.931 0.000 -3.642) 4.122 2.891 ( 4.174 0.000 3.446) 5.413 3.146 ( -6.227 0.000 1.891) 6.507 3.163 ( -3.885 0.000 0.135) 3.887 3.417 ( -3.300 0.000 -3.875) 5.090 3.484 ( -6.709 0.000 -0.688) 6.744 3.686 ( -1.742 0.000 7.039) 7.252 3.728 ( 1.380 0.000 9.049) 9.153 3.772 ( 1.873 0.000 -8.123) 8.336 3.839 ( 9.889 0.000 -3.409) 10.460 3.903 ( -5.714 0.000 1.696) 5.960 3.960 ( 3.624 0.000 -10.054) 10.687 4.122 ( -3.283 0.000 8.074) 8.716 4.167 ( 1.590 0.000 2.376) 2.859 4.439 ( -5.224 0.000 13.269) 14.260 4.880 ( -0.108 0.000 -5.419) 5.420 4.887 ( -2.596 0.000 4.834) 5.487 4.930 ( 4.910 0.000 12.268) 13.214 5.112 ( 7.192 0.000 -4.338) 8.399 5.274 ( 4.591 0.000 2.044) 5.025 5.306 ( -5.390 0.000 8.966) 10.461 5.366 ( 10.992 0.000 2.219) 11.214 5.512 ( -4.699 0.000 5.030) 6.883 5.537 ( 6.949 0.000 -7.624) 10.316 5.790 ( 3.312 0.000 -0.917) 3.436 6.052 ( 9.436 0.000 -3.843) 10.189 6.281 ( 10.091 0.000 -0.508) 10.104 6.329 ( -5.988 0.000 -7.438) 9.548 6.425 ( 4.931 0.000 -1.255) 5.089 6.494 ( 16.807 0.000 -0.993) 16.836 6.581 ( 12.997 0.000 -0.759) 13.019 6.674 ( 5.593 0.000 9.773) 11.260 6.719 ( 10.144 0.000 -3.110) 10.610 6.833 ( -1.678 0.000 1.215) 2.072 6.848 ( -2.865 0.000 3.870) 4.815 6.882 ( 0.537 0.000 -4.152) 4.186 7.179 ( -1.029 0.000 -0.907) 1.371 7.253 ( -5.209 0.000 -3.633) 6.351 7.365 ( 2.727 0.000 7.188) 7.688 7.650 ( -5.172 0.000 -18.646) 19.351 8.149 ( -21.235 0.000 4.437) 21.694 9.942 ( -1.101 0.000 0.326) 1.149 10.305 ( -1.444 0.000 4.297) 4.534 10.408 ( -10.124 0.000 -0.594) 10.142 10.636 ( 3.977 0.000 -3.199) 5.104 10.846 ( 2.031 0.000 4.209) 4.674 11.009 ( -11.575 0.000 -0.947) 11.614 11.768 ( 6.383 0.000 -4.972) 8.091 11.826 ( 7.796 0.000 4.778) 9.144 13.736 ( -2.619 0.000 1.857) 3.211 14.126 ( 0.030 0.000 2.280) 2.280 14.387 ( -5.401 0.000 -6.790) 8.677 14.522 ( 0.436 0.000 -3.663) 3.689 14.624 ( 2.153 0.000 -1.764) 2.783 14.666 ( 0.972 0.000 1.732) 1.986 14.788 ( 1.534 0.000 2.744) 3.144 14.933 ( 5.925 0.000 1.845) 6.206 15.018 ( 6.727 0.000 3.101) 7.407 15.128 ( 5.087 0.000 -2.398) 5.624 15.337 ( -2.804 0.000 -2.167) 3.544 15.440 ( -3.824 0.000 -0.224) 3.830 24.360 ( -0.252 0.000 -0.007) 0.252 24.398 ( -1.589 0.000 2.614) 3.059 24.436 ( -1.081 0.000 -0.496) 1.189 24.528 ( 0.004 0.000 -1.427) 1.427 25.343 ( -4.558 0.000 6.551) 7.981 25.400 ( 1.857 0.000 -6.817) 7.065 25.702 ( -5.505 0.000 8.019) 9.727 25.993 ( -9.567 0.000 -6.697) 11.678 26.733 ( 6.222 0.000 1.008) 6.303 26.794 ( 7.189 0.000 -0.044) 7.189 27.722 ( -0.189 0.000 -2.613) 2.620 27.812 ( 2.945 0.000 3.773) 4.786 27.886 ( -3.171 0.000 0.539) 3.217 27.967 ( -2.414 0.000 -4.357) 4.981 28.297 ( 3.410 0.000 13.746) 14.163 28.875 ( 6.969 0.000 -11.334) 13.305 ======================= Grid point 151 (69/104) ======================= q-point: ( 0.40 0.00 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( 6.623 0.000 3.811) 7.641 1.754 ( 2.548 0.000 8.231) 8.616 2.065 ( 1.558 0.000 1.787) 2.370 2.180 ( 7.458 0.000 -4.578) 8.751 2.254 ( -8.005 0.000 5.426) 9.670 2.447 ( -2.424 0.000 -7.630) 8.005 2.526 ( 9.895 0.000 -5.934) 11.538 2.750 ( 2.691 0.000 0.952) 2.854 2.900 ( -3.451 0.000 -5.394) 6.404 3.031 ( -8.434 0.000 -1.336) 8.539 3.131 ( -2.458 0.000 4.471) 5.102 3.270 ( -5.987 0.000 -5.350) 8.029 3.404 ( -1.227 0.000 3.794) 3.988 3.697 ( -0.595 0.000 -4.936) 4.972 3.738 ( -1.381 0.000 2.155) 2.560 3.771 ( -5.226 0.000 -1.516) 5.442 3.806 ( -2.261 0.000 6.136) 6.539 3.873 ( 3.421 0.000 -6.060) 6.959 4.142 ( -4.298 0.000 12.573) 13.287 4.169 ( 20.050 0.000 -7.451) 21.390 4.243 ( 3.787 0.000 6.059) 7.146 4.430 ( -11.728 0.000 16.971) 20.629 4.792 ( -2.081 0.000 -7.624) 7.903 4.832 ( -3.650 0.000 -2.777) 4.586 5.061 ( -4.041 0.000 12.513) 13.150 5.191 ( 6.752 0.000 -5.417) 8.656 5.286 ( -4.761 0.000 10.707) 11.718 5.347 ( -4.022 0.000 6.916) 8.000 5.486 ( 5.582 0.000 -6.955) 8.918 5.574 ( 6.513 0.000 -8.862) 10.998 5.593 ( 9.774 0.000 1.589) 9.902 5.905 ( 3.817 0.000 6.450) 7.494 6.156 ( -3.948 0.000 -5.261) 6.578 6.254 ( 12.942 0.000 2.353) 13.155 6.389 ( 1.533 0.000 0.063) 1.534 6.568 ( 13.690 0.000 -3.664) 14.172 6.637 ( 2.571 0.000 0.142) 2.575 6.747 ( -0.693 0.000 -4.291) 4.346 6.785 ( 0.034 0.000 -0.294) 0.295 6.797 ( 0.816 0.000 4.051) 4.133 6.869 ( 12.257 0.000 -0.944) 12.294 6.882 ( 0.285 0.000 2.978) 2.992 6.914 ( 3.831 0.000 -1.452) 4.097 7.023 ( -5.472 0.000 -11.554) 12.785 7.246 ( 1.426 0.000 3.548) 3.824 7.422 ( -0.406 0.000 -0.959) 1.042 7.495 ( 2.892 0.000 -10.209) 10.611 7.771 ( -23.366 0.000 3.073) 23.567 9.966 ( 1.356 0.000 3.020) 3.310 10.217 ( -5.900 0.000 -3.783) 7.009 10.361 ( -1.366 0.000 7.791) 7.910 10.655 ( 0.983 0.000 -4.783) 4.883 10.845 ( -5.151 0.000 1.155) 5.279 10.890 ( -0.792 0.000 2.718) 2.831 11.849 ( 6.285 0.000 -2.357) 6.713 11.942 ( 1.964 0.000 1.537) 2.493 13.727 ( -0.915 0.000 3.149) 3.280 14.049 ( -4.911 0.000 -7.290) 8.790 14.341 ( 1.556 0.000 2.127) 2.635 14.495 ( 0.545 0.000 -3.792) 3.831 14.655 ( 3.047 0.000 -1.733) 3.505 14.672 ( -1.747 0.000 1.721) 2.452 14.870 ( 4.051 0.000 3.916) 5.634 15.033 ( 2.497 0.000 2.297) 3.393 15.111 ( 1.438 0.000 0.843) 1.667 15.153 ( 1.073 0.000 -3.789) 3.938 15.299 ( -0.133 0.000 -0.041) 0.139 15.378 ( -2.085 0.000 -1.151) 2.382 24.361 ( 0.335 0.000 -0.046) 0.338 24.385 ( -2.184 0.000 1.870) 2.875 24.429 ( 0.236 0.000 0.496) 0.549 24.511 ( -0.257 0.000 -1.734) 1.753 25.316 ( -5.270 0.000 6.406) 8.295 25.386 ( 3.670 0.000 -6.475) 7.443 25.684 ( -4.265 0.000 6.778) 8.008 25.833 ( -2.776 0.000 -4.754) 5.505 26.839 ( 4.342 0.000 1.369) 4.553 26.901 ( 4.618 0.000 -0.493) 4.644 27.708 ( 0.785 0.000 -1.124) 1.371 27.841 ( -1.087 0.000 0.502) 1.198 27.844 ( -1.871 0.000 0.617) 1.970 27.881 ( -2.327 0.000 -4.136) 4.746 28.470 ( -0.163 0.000 15.186) 15.187 28.878 ( 5.740 0.000 -12.092) 13.385 ======================= Grid point 152 (70/104) ======================= q-point: (-0.50 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 15.963 0.000 9.287) 18.468 1.823 ( -5.948 0.000 2.245) 6.358 2.077 ( -6.499 0.000 7.615) 10.011 2.231 ( 1.647 0.000 0.514) 1.725 2.270 ( 8.878 0.000 -6.334) 10.906 2.304 ( -0.349 0.000 -6.392) 6.401 2.615 ( 0.686 0.000 -3.238) 3.309 2.652 ( -8.599 0.000 -3.450) 9.265 2.876 ( 3.956 0.000 -2.402) 4.628 2.877 ( -3.499 0.000 -2.242) 4.155 3.109 ( -2.045 0.000 3.531) 4.081 3.172 ( -0.465 0.000 -2.525) 2.568 3.517 ( 5.062 0.000 7.803) 9.301 3.596 ( -9.286 0.000 1.468) 9.402 3.684 ( 2.205 0.000 -1.093) 2.461 3.714 ( -3.390 0.000 -4.181) 5.382 3.814 ( -2.558 0.000 3.348) 4.214 3.904 ( 4.996 0.000 -4.711) 6.867 4.178 ( -6.728 0.000 11.588) 13.399 4.323 ( 5.960 0.000 -0.705) 6.002 4.361 ( -10.529 0.000 13.916) 17.451 4.485 ( 13.209 0.000 1.884) 13.343 4.707 ( -5.518 0.000 -6.012) 8.160 4.710 ( 2.362 0.000 -7.217) 7.594 5.087 ( -3.569 0.000 10.427) 11.021 5.245 ( 5.764 0.000 -7.024) 9.086 5.295 ( -5.832 0.000 6.799) 8.958 5.332 ( -5.598 0.000 13.016) 14.169 5.493 ( 5.324 0.000 -10.140) 11.453 5.606 ( 7.175 0.000 -11.492) 13.548 5.782 ( 7.986 0.000 3.493) 8.716 5.851 ( -10.313 0.000 -2.244) 10.554 6.215 ( 6.713 0.000 7.807) 10.296 6.328 ( -7.102 0.000 -3.082) 7.742 6.519 ( 10.049 0.000 5.855) 11.631 6.629 ( -1.758 0.000 1.471) 2.292 6.652 ( -1.647 0.000 -3.550) 3.913 6.712 ( -6.178 0.000 -6.179) 8.738 6.776 ( -5.139 0.000 1.130) 5.262 6.812 ( 1.085 0.000 -1.765) 2.072 6.880 ( 11.382 0.000 -1.350) 11.462 6.906 ( -3.595 0.000 -2.306) 4.271 6.945 ( -2.085 0.000 -1.486) 2.561 6.970 ( 2.184 0.000 -3.543) 4.162 7.252 ( -3.253 0.000 3.138) 4.520 7.330 ( -3.570 0.000 -4.549) 5.783 7.500 ( -10.459 0.000 4.137) 11.247 7.587 ( 14.332 0.000 -4.456) 15.009 10.034 ( 2.897 0.000 3.505) 4.547 10.107 ( -2.852 0.000 -3.437) 4.466 10.434 ( 1.719 0.000 7.158) 7.361 10.585 ( -0.557 0.000 -7.165) 7.187 10.852 ( 1.477 0.000 2.923) 3.275 10.876 ( -2.242 0.000 0.890) 2.412 11.928 ( -3.878 0.000 -0.152) 3.881 11.929 ( 3.755 0.000 -0.407) 3.777 13.767 ( 1.166 0.000 5.291) 5.418 13.902 ( -3.031 0.000 -7.399) 7.996 14.397 ( 1.196 0.000 2.902) 3.139 14.469 ( 0.325 0.000 -4.022) 4.036 14.649 ( -2.384 0.000 1.648) 2.899 14.694 ( 3.354 0.000 -2.206) 4.014 14.986 ( 3.927 0.000 4.674) 6.105 15.023 ( -5.287 0.000 1.111) 5.402 15.104 ( -1.581 0.000 -0.349) 1.619 15.143 ( 2.792 0.000 -4.105) 4.964 15.317 ( 0.952 0.000 1.180) 1.516 15.341 ( -1.396 0.000 -1.118) 1.788 24.366 ( -1.319 0.000 0.864) 1.577 24.372 ( 0.938 0.000 0.086) 0.942 24.445 ( 0.337 0.000 1.719) 1.752 24.488 ( -0.294 0.000 -2.084) 2.105 25.279 ( -5.241 0.000 6.047) 8.002 25.409 ( 5.215 0.000 -6.047) 7.986 25.682 ( -2.431 0.000 5.905) 6.386 25.791 ( 2.278 0.000 -4.247) 4.819 26.901 ( 0.625 0.000 1.690) 1.801 26.930 ( -0.656 0.000 -1.091) 1.274 27.735 ( 2.426 0.000 0.905) 2.590 27.780 ( -2.985 0.000 -3.227) 4.396 27.836 ( 0.338 0.000 0.526) 0.625 27.842 ( -0.377 0.000 -0.389) 0.541 28.569 ( -3.538 0.000 13.871) 14.315 28.855 ( 4.769 0.000 -13.124) 13.964 ======================= Grid point 153 (71/104) ======================= q-point: (-0.40 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( -15.678 0.000 -6.255) 16.880 1.928 ( -0.223 0.000 -7.753) 7.756 2.029 ( -9.810 0.000 9.408) 13.592 2.194 ( -4.340 0.000 -10.359) 11.231 2.316 ( 7.083 0.000 2.886) 7.648 2.419 ( 12.684 0.000 -7.479) 14.724 2.500 ( -5.985 0.000 -0.629) 6.018 2.674 ( 2.486 0.000 12.594) 12.837 2.808 ( -2.674 0.000 -4.369) 5.123 2.992 ( 9.717 0.000 2.151) 9.952 3.160 ( 3.442 0.000 4.190) 5.422 3.197 ( 3.509 0.000 -0.472) 3.540 3.479 ( -5.381 0.000 1.195) 5.512 3.606 ( -4.146 0.000 -0.626) 4.193 3.666 ( 4.059 0.000 5.701) 6.998 3.738 ( 3.046 0.000 2.130) 3.717 3.776 ( -4.224 0.000 3.001) 5.182 3.940 ( 4.187 0.000 -5.211) 6.685 4.054 ( -15.255 0.000 3.909) 15.748 4.318 ( -5.083 0.000 3.725) 6.302 4.364 ( 2.130 0.000 -6.418) 6.763 4.608 ( -2.362 0.000 3.506) 4.228 4.660 ( 3.246 0.000 3.691) 4.916 4.776 ( 9.882 0.000 -6.332) 11.737 5.107 ( -3.057 0.000 5.037) 5.892 5.271 ( 5.785 0.000 -7.852) 9.753 5.271 ( -5.136 0.000 10.838) 11.993 5.356 ( -5.084 0.000 11.880) 12.922 5.481 ( -1.064 0.000 -8.287) 8.355 5.572 ( 1.090 0.000 -11.340) 11.392 5.667 ( -1.501 0.000 -5.512) 5.713 5.926 ( 2.489 0.000 4.922) 5.516 6.129 ( -9.346 0.000 -2.900) 9.785 6.376 ( 3.022 0.000 3.113) 4.339 6.408 ( -11.069 0.000 -10.655) 15.364 6.518 ( -14.198 0.000 0.134) 14.199 6.642 ( -1.000 0.000 4.260) 4.376 6.652 ( -6.168 0.000 -0.545) 6.192 6.739 ( 0.843 0.000 2.545) 2.681 6.782 ( -1.798 0.000 9.297) 9.469 6.834 ( 2.104 0.000 -1.850) 2.802 6.875 ( -11.076 0.000 -1.180) 11.138 6.948 ( -0.505 0.000 -3.576) 3.611 6.979 ( 6.575 0.000 -3.006) 7.229 7.285 ( -2.144 0.000 2.398) 3.217 7.327 ( 5.837 0.000 5.402) 7.953 7.370 ( -6.444 0.000 -1.314) 6.576 7.865 ( 21.233 0.000 -4.881) 21.787 10.043 ( -0.786 0.000 -3.961) 4.039 10.139 ( 5.319 0.000 3.743) 6.504 10.534 ( 2.963 0.000 -8.577) 9.075 10.539 ( 1.978 0.000 6.045) 6.361 10.858 ( 0.974 0.000 0.566) 1.127 10.900 ( 0.800 0.000 1.805) 1.974 11.819 ( -8.036 0.000 0.486) 8.051 11.959 ( -0.314 0.000 -0.322) 0.450 13.815 ( -0.162 0.000 -5.315) 5.317 13.871 ( 3.592 0.000 8.388) 9.125 14.421 ( -1.206 0.000 -4.959) 5.104 14.432 ( 0.401 0.000 2.198) 2.234 14.621 ( -2.423 0.000 1.377) 2.786 14.729 ( 3.260 0.000 -3.160) 4.540 14.919 ( -5.958 0.000 -0.346) 5.968 15.047 ( -4.090 0.000 2.147) 4.619 15.080 ( 0.513 0.000 1.982) 2.048 15.149 ( 1.174 0.000 -3.425) 3.621 15.301 ( -2.039 0.000 -0.248) 2.054 15.354 ( 2.461 0.000 1.067) 2.683 24.357 ( -0.394 0.000 0.440) 0.591 24.395 ( 1.267 0.000 0.525) 1.371 24.465 ( 0.211 0.000 -2.477) 2.486 24.469 ( 0.160 0.000 2.174) 2.179 25.252 ( -3.945 0.000 6.053) 7.225 25.447 ( 5.118 0.000 -5.879) 7.795 25.715 ( -0.061 0.000 6.438) 6.438 25.821 ( 5.978 0.000 -5.920) 8.413 26.867 ( -4.831 0.000 -1.213) 4.982 26.882 ( -4.413 0.000 1.380) 4.624 27.710 ( -2.074 0.000 -1.474) 2.544 27.801 ( 3.050 0.000 2.305) 3.823 27.848 ( 1.274 0.000 0.095) 1.278 27.859 ( 1.641 0.000 0.030) 1.642 28.614 ( -5.043 0.000 12.816) 13.773 28.795 ( 2.999 0.000 -15.343) 15.633 ======================= Grid point 154 (72/104) ======================= q-point: (-0.30 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -15.501 0.000 3.666) 15.929 1.735 ( -20.978 0.000 5.352) 21.650 1.933 ( 2.582 0.000 -6.196) 6.712 2.067 ( -1.558 0.000 -3.183) 3.544 2.423 ( -1.890 0.000 -3.847) 4.286 2.443 ( 2.024 0.000 5.404) 5.771 2.539 ( 8.146 0.000 -6.075) 10.162 2.672 ( -8.369 0.000 0.427) 8.380 2.813 ( -2.210 0.000 7.569) 7.885 3.155 ( 6.755 0.000 0.047) 6.755 3.215 ( 0.856 0.000 -4.916) 4.990 3.309 ( 6.411 0.000 6.144) 8.880 3.491 ( 6.500 0.000 -0.127) 6.501 3.595 ( -1.538 0.000 8.216) 8.359 3.733 ( -0.048 0.000 0.904) 0.905 3.740 ( -7.148 0.000 8.299) 10.953 3.820 ( -5.645 0.000 -0.701) 5.688 3.836 ( 4.931 0.000 0.672) 4.977 3.954 ( 2.910 0.000 -4.493) 5.353 4.262 ( -1.024 0.000 -3.848) 3.982 4.312 ( 0.370 0.000 -8.414) 8.423 4.637 ( -4.582 0.000 12.258) 13.087 4.641 ( -5.461 0.000 -2.979) 6.221 4.864 ( 3.979 0.000 -0.363) 3.995 5.080 ( -3.249 0.000 1.734) 3.683 5.270 ( -8.315 0.000 -4.553) 9.480 5.283 ( -5.905 0.000 10.560) 12.099 5.293 ( 0.942 0.000 -9.988) 10.032 5.379 ( -3.435 0.000 8.620) 9.279 5.549 ( 7.915 0.000 -14.270) 16.319 5.662 ( 5.175 0.000 -5.929) 7.869 5.823 ( -10.459 0.000 -2.317) 10.713 6.072 ( -6.852 0.000 -3.422) 7.659 6.183 ( -0.333 0.000 2.418) 2.441 6.274 ( -9.875 0.000 -0.885) 9.914 6.405 ( -0.152 0.000 0.148) 0.212 6.474 ( -14.155 0.000 -0.782) 14.176 6.582 ( -16.120 0.000 1.166) 16.162 6.607 ( -8.710 0.000 5.605) 10.357 6.793 ( -0.997 0.000 2.091) 2.317 6.830 ( 4.366 0.000 0.538) 4.399 6.881 ( -2.512 0.000 -3.054) 3.954 6.958 ( 1.671 0.000 -1.130) 2.018 7.065 ( 8.170 0.000 0.477) 8.184 7.232 ( -1.456 0.000 -0.133) 1.462 7.360 ( 1.592 0.000 8.773) 8.916 7.430 ( 1.230 0.000 1.023) 1.600 8.217 ( 22.157 0.000 -3.584) 22.445 10.001 ( 0.508 0.000 -4.564) 4.592 10.278 ( 5.737 0.000 3.458) 6.699 10.530 ( 6.185 0.000 -8.951) 10.880 10.567 ( -3.473 0.000 3.464) 4.905 10.898 ( -2.093 0.000 -0.252) 2.108 10.968 ( 9.193 0.000 2.975) 9.662 11.680 ( -8.843 0.000 3.136) 9.383 11.903 ( -4.737 0.000 -2.514) 5.363 13.793 ( 2.141 0.000 -3.657) 4.237 14.046 ( 5.853 0.000 10.268) 11.819 14.341 ( -2.239 0.000 -4.080) 4.654 14.460 ( 0.464 0.000 2.213) 2.261 14.594 ( -1.664 0.000 1.040) 1.962 14.737 ( 0.792 0.000 -4.540) 4.609 14.831 ( -2.734 0.000 -0.573) 2.793 14.949 ( -7.565 0.000 0.313) 7.572 15.075 ( -3.923 0.000 2.766) 4.800 15.094 ( -3.713 0.000 -4.590) 5.904 15.291 ( 0.415 0.000 2.142) 2.182 15.427 ( 4.532 0.000 0.758) 4.594 24.359 ( 0.355 0.000 0.184) 0.400 24.417 ( -0.018 0.000 0.996) 0.996 24.459 ( 2.227 0.000 -2.750) 3.539 24.489 ( -0.174 0.000 2.226) 2.233 25.258 ( -1.980 0.000 6.543) 6.836 25.475 ( 4.090 0.000 -5.835) 7.126 25.818 ( 4.137 0.000 9.765) 10.606 25.876 ( 7.326 0.000 -8.322) 11.087 26.754 ( -6.516 0.000 -0.885) 6.576 26.784 ( -7.170 0.000 0.968) 7.235 27.684 ( -0.741 0.000 0.891) 1.159 27.870 ( 1.569 0.000 -0.682) 1.711 27.885 ( 2.311 0.000 0.645) 2.399 27.887 ( 2.175 0.000 2.022) 2.969 28.633 ( -5.650 0.000 11.589) 12.893 28.655 ( -1.317 0.000 -19.532) 19.577 ======================= Grid point 155 (73/104) ======================= q-point: (-0.20 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 104 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( -14.198 0.000 21.410) 25.690 1.392 ( -25.955 0.000 15.046) 30.000 1.963 ( 6.617 0.000 -13.818) 15.320 2.000 ( -11.913 0.000 8.118) 14.416 2.314 ( -4.349 0.000 -3.133) 5.360 2.387 ( -19.303 0.000 3.399) 19.600 2.514 ( -0.389 0.000 8.719) 8.728 2.732 ( 12.367 0.000 -2.220) 12.565 2.840 ( 2.533 0.000 5.752) 6.285 3.208 ( 1.230 0.000 0.837) 1.488 3.290 ( 8.235 0.000 1.214) 8.324 3.422 ( 1.592 0.000 1.187) 1.986 3.584 ( 4.584 0.000 -0.894) 4.670 3.605 ( 1.997 0.000 1.353) 2.413 3.710 ( -1.150 0.000 -1.993) 2.301 3.831 ( 5.187 0.000 2.801) 5.895 3.841 ( 1.048 0.000 -6.299) 6.386 3.874 ( 5.158 0.000 10.299) 11.519 3.984 ( 0.138 0.000 0.701) 0.715 4.208 ( -0.029 0.000 -5.524) 5.524 4.214 ( -2.509 0.000 -8.924) 9.270 4.531 ( -1.278 0.000 -1.115) 1.696 4.634 ( -9.769 0.000 13.055) 16.305 4.886 ( -1.480 0.000 -5.625) 5.816 5.029 ( -5.119 0.000 1.684) 5.389 5.067 ( -7.408 0.000 -11.388) 13.586 5.195 ( -0.306 0.000 -3.359) 3.373 5.223 ( -6.958 0.000 -1.301) 7.078 5.330 ( -8.033 0.000 3.242) 8.663 5.567 ( 6.103 0.000 -10.659) 12.283 5.697 ( 4.492 0.000 -6.380) 7.803 5.697 ( -3.058 0.000 5.264) 6.088 5.872 ( -8.986 0.000 -1.175) 9.063 6.131 ( -5.453 0.000 -2.301) 5.918 6.164 ( -14.630 0.000 3.828) 15.123 6.247 ( -11.985 0.000 0.094) 11.985 6.390 ( -2.709 0.000 -1.504) 3.098 6.396 ( -0.862 0.000 5.430) 5.498 6.527 ( -3.636 0.000 2.690) 4.523 6.693 ( -5.429 0.000 -9.200) 10.682 6.827 ( -1.025 0.000 -1.203) 1.581 6.870 ( -4.636 0.000 -1.898) 5.009 6.921 ( 4.427 0.000 2.093) 4.896 7.200 ( 1.800 0.000 0.242) 1.816 7.328 ( 8.536 0.000 3.708) 9.307 7.390 ( -2.560 0.000 -5.449) 6.020 7.574 ( 10.041 0.000 15.466) 18.440 8.555 ( 19.027 0.000 -3.180) 19.291 9.990 ( 2.751 0.000 -2.217) 3.533 10.364 ( 2.362 0.000 -0.683) 2.458 10.519 ( -4.759 0.000 3.288) 5.784 10.609 ( 8.624 0.000 -3.585) 9.340 10.827 ( -3.535 0.000 -2.271) 4.201 11.184 ( 10.348 0.000 3.701) 10.990 11.584 ( -6.781 0.000 6.055) 9.091 11.747 ( -7.794 0.000 -6.478) 10.135 13.818 ( 3.899 0.000 -2.514) 4.639 14.163 ( 0.484 0.000 -3.468) 3.502 14.377 ( 5.368 0.000 11.302) 12.512 14.482 ( -0.656 0.000 2.192) 2.288 14.588 ( 0.100 0.000 0.614) 0.622 14.665 ( -3.710 0.000 -4.705) 5.992 14.802 ( -8.986 0.000 1.170) 9.062 14.802 ( -1.025 0.000 -1.317) 1.669 14.952 ( -5.054 0.000 -6.721) 8.410 15.006 ( -5.673 0.000 1.376) 5.837 15.346 ( 2.036 0.000 4.163) 4.634 15.510 ( 3.939 0.000 0.125) 3.941 24.372 ( 1.009 0.000 -0.070) 1.011 24.415 ( -0.495 0.000 0.301) 0.579 24.486 ( 2.820 0.000 -1.877) 3.388 24.503 ( -0.537 0.000 2.035) 2.105 25.296 ( -1.030 0.000 6.609) 6.689 25.485 ( 3.188 0.000 -5.812) 6.629 25.919 ( 6.802 0.000 -8.868) 11.177 26.082 ( 13.965 0.000 14.439) 20.088 26.632 ( -6.131 0.000 -0.891) 6.196 26.674 ( -5.295 0.000 0.205) 5.299 27.692 ( -0.516 0.000 2.515) 2.568 27.806 ( -5.511 0.000 -8.564) 10.184 27.929 ( 1.500 0.000 0.980) 1.792 27.963 ( 2.036 0.000 3.565) 4.106 28.384 ( -7.393 0.000 -17.979) 19.440 28.625 ( -6.482 0.000 9.445) 11.455 ======================= Grid point 156 (74/104) ======================= q-point: (-0.10 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.100 ( -15.728 0.000 24.261) 28.913 1.181 ( -16.785 0.000 24.612) 29.791 1.741 ( -9.862 0.000 -19.521) 21.870 1.860 ( -12.026 0.000 16.710) 20.588 2.136 ( -12.167 0.000 7.654) 14.374 2.393 ( 13.588 0.000 -1.909) 13.721 2.613 ( 1.026 0.000 11.920) 11.964 2.790 ( -2.133 0.000 -1.417) 2.561 3.048 ( 8.524 0.000 3.567) 9.241 3.295 ( 3.744 0.000 9.211) 9.943 3.311 ( -7.321 0.000 -2.219) 7.650 3.507 ( 8.550 0.000 0.749) 8.583 3.645 ( 1.362 0.000 0.336) 1.403 3.664 ( -0.952 0.000 -2.910) 3.062 3.779 ( 16.099 0.000 -0.510) 16.107 3.855 ( 4.800 0.000 -4.375) 6.494 3.876 ( 0.634 0.000 -4.290) 4.337 3.943 ( -3.285 0.000 1.128) 3.473 4.033 ( 1.472 0.000 3.968) 4.233 4.096 ( 0.750 0.000 -11.541) 11.565 4.180 ( 3.047 0.000 -3.293) 4.487 4.498 ( -15.187 0.000 2.174) 15.342 4.568 ( 3.463 0.000 -4.716) 5.851 4.666 ( -9.533 0.000 -10.637) 14.283 4.798 ( -18.562 0.000 5.060) 19.239 4.836 ( -4.025 0.000 -12.933) 13.545 5.206 ( 7.565 0.000 -0.495) 7.581 5.240 ( -0.394 0.000 7.470) 7.480 5.267 ( -3.182 0.000 7.222) 7.892 5.551 ( 1.454 0.000 -8.112) 8.242 5.705 ( 5.431 0.000 -8.986) 10.500 5.720 ( -9.619 0.000 5.133) 10.903 5.770 ( 1.125 0.000 8.069) 8.147 5.961 ( -15.220 0.000 2.619) 15.443 6.026 ( -2.159 0.000 -5.192) 5.623 6.047 ( -3.578 0.000 4.380) 5.656 6.249 ( -9.545 0.000 -3.574) 10.192 6.470 ( -1.456 0.000 6.200) 6.368 6.504 ( -2.331 0.000 -9.989) 10.257 6.526 ( 1.287 0.000 -4.972) 5.136 6.801 ( -2.262 0.000 0.422) 2.301 6.814 ( -0.142 0.000 -0.838) 0.850 7.026 ( 3.861 0.000 4.523) 5.947 7.207 ( -0.323 0.000 -0.467) 0.568 7.299 ( 0.107 0.000 -5.829) 5.830 7.434 ( 2.423 0.000 -3.692) 4.416 7.956 ( 11.743 0.000 21.178) 24.216 8.782 ( 11.614 0.000 -10.522) 15.672 10.094 ( 7.939 0.000 4.501) 9.126 10.390 ( 3.095 0.000 -2.205) 3.800 10.472 ( -4.280 0.000 3.669) 5.637 10.625 ( -3.819 0.000 -4.589) 5.970 10.855 ( 7.546 0.000 2.467) 7.939 11.322 ( -1.742 0.000 1.330) 2.191 11.540 ( -5.418 0.000 6.811) 8.703 11.575 ( 0.719 0.000 -8.428) 8.459 13.883 ( 5.494 0.000 -1.373) 5.663 14.110 ( -1.121 0.000 -4.187) 4.335 14.444 ( -10.856 0.000 -0.846) 10.889 14.455 ( -4.267 0.000 -0.052) 4.267 14.591 ( -0.947 0.000 1.759) 1.998 14.643 ( 6.290 0.000 5.657) 8.460 14.708 ( -2.570 0.000 2.749) 3.763 14.761 ( -1.830 0.000 0.244) 1.846 14.842 ( 0.567 0.000 -9.042) 9.060 14.914 ( -5.218 0.000 0.185) 5.221 15.428 ( 2.166 0.000 4.919) 5.375 15.560 ( 1.950 0.000 -0.843) 2.124 24.391 ( 1.250 0.000 -0.461) 1.332 24.409 ( -0.499 0.000 0.210) 0.542 24.507 ( -0.886 0.000 1.695) 1.912 24.515 ( 2.165 0.000 -1.658) 2.727 25.331 ( -1.896 0.000 6.235) 6.516 25.482 ( 2.750 0.000 -5.873) 6.485 25.975 ( 8.261 0.000 -6.096) 10.266 26.462 ( 7.920 0.000 1.222) 8.014 26.498 ( -7.254 0.000 -2.454) 7.657 26.607 ( -1.803 0.000 -1.480) 2.333 27.534 ( -6.057 0.000 -3.498) 6.995 27.698 ( -2.371 0.000 3.245) 4.019 27.948 ( -0.443 0.000 1.052) 1.142 27.989 ( -1.354 0.000 0.491) 1.440 28.262 ( 4.853 0.000 0.341) 4.865 28.570 ( -7.975 0.000 5.840) 9.885 ======================= Grid point 157 (75/104) ======================= q-point: ( 0.00 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( -5.269 17.686 19.007) 26.492 1.510 ( -1.079 16.726 23.984) 29.260 1.611 ( 2.789 12.076 -15.189) 19.604 1.948 ( 2.668 13.624 -16.169) 21.311 2.439 ( -7.095 19.048 23.307) 30.926 2.631 ( 7.142 1.545 -2.874) 7.852 2.759 ( 2.516 2.633 2.855) 4.628 2.817 ( 6.175 7.976 5.066) 11.288 3.050 ( -1.151 -5.143 1.159) 5.396 3.090 ( -4.080 -4.177 -2.578) 6.383 3.486 ( 3.786 3.120 8.781) 10.058 3.559 ( -4.663 -1.940 -0.721) 5.102 3.639 ( -3.414 0.052 -0.665) 3.479 3.744 ( 3.801 -0.209 -5.410) 6.615 3.792 ( -1.614 -1.589 3.283) 3.989 3.863 ( -1.359 6.303 0.142) 6.449 3.900 ( -2.743 -4.453 -6.520) 8.358 3.932 ( -1.421 2.359 -4.728) 5.471 4.127 ( 1.691 12.001 4.191) 12.824 4.192 ( 0.180 9.679 -1.687) 9.826 4.242 ( 0.508 1.165 0.507) 1.369 4.323 ( -3.848 2.380 -9.805) 10.798 4.436 ( 4.333 7.132 3.476) 9.040 4.588 ( -3.371 2.651 -8.184) 9.240 4.642 ( -4.749 -1.098 8.371) 9.687 4.821 ( 7.569 1.502 -8.364) 11.380 5.240 ( -1.436 0.640 8.550) 8.693 5.318 ( -5.413 2.441 7.562) 9.614 5.380 ( 6.096 -0.860 -4.869) 7.849 5.472 ( -0.742 -0.871 -4.500) 4.643 5.647 ( -6.026 3.186 4.700) 8.280 5.753 ( 5.006 0.373 -4.293) 6.606 5.800 ( -2.025 0.033 3.621) 4.149 5.878 ( 2.380 -3.957 -0.662) 4.665 5.976 ( 4.634 0.366 0.597) 4.687 6.032 ( -5.101 -0.310 -3.584) 6.241 6.095 ( -0.551 -0.726 6.641) 6.703 6.289 ( 0.873 -6.309 -7.322) 9.705 6.436 ( -2.037 -3.015 0.921) 3.754 6.480 ( 2.365 -5.665 -1.976) 6.449 6.645 ( 1.308 -9.227 2.804) 9.732 6.725 ( 0.038 -6.290 -5.171) 8.143 7.159 ( 3.941 1.887 6.076) 7.484 7.270 ( -1.472 6.403 0.309) 6.577 7.314 ( -2.061 0.117 -2.967) 3.614 7.399 ( -1.330 5.350 -6.733) 8.703 8.296 ( 3.909 -2.061 21.703) 22.148 8.731 ( -2.781 -1.703 -20.434) 20.692 10.299 ( 2.797 1.772 4.999) 5.996 10.370 ( -2.470 0.293 -1.299) 2.806 10.584 ( 3.012 7.409 0.248) 8.002 10.615 ( -3.830 9.528 -3.466) 10.838 11.018 ( 8.344 -2.193 6.910) 11.053 11.151 ( -8.421 -1.772 -5.451) 10.187 11.501 ( -4.444 -0.810 6.292) 7.746 11.626 ( 5.733 1.040 -5.609) 8.088 13.984 ( 3.571 -0.082 0.719) 3.643 14.013 ( -5.599 0.128 -1.879) 5.907 14.244 ( 0.766 -5.534 2.582) 6.155 14.305 ( -0.256 -5.648 -2.932) 6.369 14.541 ( -0.323 -4.357 4.508) 6.278 14.621 ( -0.381 -6.342 -2.882) 6.977 14.713 ( 0.325 -0.975 1.338) 1.687 14.735 ( -0.558 -1.604 -0.465) 1.761 14.876 ( 0.785 4.784 2.662) 5.530 14.980 ( 0.849 6.887 -7.295) 10.069 15.383 ( 0.325 -9.668 5.127) 10.948 15.462 ( -0.361 -8.771 -2.621) 9.161 24.404 ( -0.679 0.442 0.354) 0.884 24.411 ( 0.283 0.719 -0.394) 0.867 24.507 ( -1.216 0.407 1.205) 1.760 24.536 ( 1.425 0.427 -1.624) 2.203 25.360 ( -2.805 1.311 6.230) 6.957 25.486 ( 2.438 0.862 -5.564) 6.136 26.062 ( -19.275 -3.852 3.683) 19.998 26.109 ( 10.369 -1.575 -1.363) 10.576 26.539 ( 1.100 0.429 1.472) 1.887 26.580 ( -0.902 0.520 -2.369) 2.588 27.104 ( 15.972 -24.063 14.978) 32.534 27.338 ( -9.540 -18.987 -8.214) 22.781 28.212 ( -1.057 9.933 6.308) 11.814 28.358 ( -0.332 8.619 -7.184) 11.226 28.551 ( -5.707 15.901 8.325) 18.834 28.795 ( 10.498 25.739 -16.606) 32.380 ======================= Grid point 158 (76/104) ======================= q-point: ( 0.10 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 7.264 13.838 17.123) 23.183 1.652 ( 13.608 11.637 -14.397) 22.975 1.746 ( 5.199 12.103 15.526) 20.361 1.892 ( 10.539 14.936 -17.665) 25.421 2.429 ( -4.757 11.444 4.408) 13.154 2.706 ( 1.202 -0.762 2.942) 3.268 2.808 ( -3.259 0.955 -4.722) 5.817 2.832 ( 3.263 10.682 -8.737) 14.181 3.079 ( 0.450 -3.268 -4.805) 5.828 3.153 ( 6.583 -1.785 8.108) 10.596 3.412 ( -9.071 1.523 -0.884) 9.241 3.512 ( -6.390 3.806 2.474) 7.838 3.617 ( -2.235 2.320 5.512) 6.384 3.736 ( 4.812 0.527 -8.162) 9.489 3.766 ( -8.454 -0.771 1.951) 8.711 3.825 ( -1.413 2.137 -0.082) 2.564 3.851 ( -3.125 1.713 3.324) 4.873 3.891 ( 3.511 5.266 5.268) 8.234 4.095 ( -0.875 9.811 -1.413) 9.951 4.154 ( -4.436 6.966 4.233) 9.281 4.259 ( 0.291 11.671 -4.020) 12.347 4.333 ( 2.603 -0.726 2.988) 4.028 4.555 ( 10.362 0.473 -3.631) 10.990 4.620 ( -0.652 4.132 8.049) 9.071 4.647 ( 8.138 -0.626 1.258) 8.258 4.902 ( 9.517 -5.715 -8.747) 14.133 5.171 ( -8.690 2.707 1.999) 9.319 5.324 ( -3.869 -0.691 6.197) 7.338 5.381 ( 0.235 1.576 -1.921) 2.496 5.439 ( 0.847 0.500 -4.375) 4.485 5.621 ( -2.342 3.618 4.387) 6.149 5.830 ( 2.158 -2.215 1.163) 3.304 5.865 ( 6.678 -1.238 -5.128) 8.510 5.909 ( 2.042 -0.159 3.372) 3.945 5.963 ( 6.791 -2.517 -4.244) 8.395 6.107 ( 5.762 -1.990 4.301) 7.461 6.210 ( 4.162 -3.604 4.983) 7.426 6.307 ( 10.222 -0.674 -7.426) 12.653 6.426 ( 0.428 -3.627 0.745) 3.728 6.516 ( 2.998 -5.134 -1.240) 6.074 6.697 ( 2.719 -6.875 -2.956) 7.963 6.728 ( 4.298 -6.194 1.165) 7.629 7.127 ( -7.412 -0.749 -6.043) 9.592 7.237 ( -3.760 5.006 2.615) 6.785 7.276 ( 0.876 4.701 4.403) 6.500 7.413 ( 2.778 4.761 -0.027) 5.513 8.397 ( -11.318 -1.754 -21.921) 24.732 8.456 ( -7.560 -2.051 19.913) 21.399 10.235 ( -6.887 2.255 -1.599) 7.421 10.399 ( -0.791 3.722 0.912) 3.913 10.543 ( 0.199 6.558 0.141) 6.562 10.648 ( 3.132 6.660 1.418) 7.495 10.937 ( -8.779 -0.967 -5.604) 10.460 11.281 ( 12.325 -1.340 6.993) 14.234 11.424 ( -9.339 1.107 3.590) 10.067 11.653 ( 4.075 -2.160 -6.463) 7.939 13.880 ( -5.825 0.740 0.296) 5.879 14.072 ( 1.694 1.981 1.910) 3.231 14.297 ( 4.925 -10.477 0.488) 11.588 14.369 ( 6.471 -6.002 -0.945) 8.876 14.578 ( 0.102 -4.679 3.334) 5.746 14.609 ( 1.844 -4.415 -2.222) 5.276 14.711 ( -1.492 -2.074 -0.582) 2.620 14.735 ( 1.412 0.262 1.128) 1.827 14.890 ( 0.023 5.297 -0.861) 5.367 14.992 ( 5.277 4.763 -1.879) 7.353 15.400 ( -2.541 -9.232 -1.044) 9.632 15.422 ( -1.248 -9.017 1.319) 9.198 24.388 ( -1.188 0.382 0.318) 1.287 24.412 ( -0.282 0.741 0.490) 0.932 24.491 ( -1.625 0.349 0.927) 1.903 24.542 ( 0.809 0.326 -1.368) 1.622 25.364 ( -3.105 0.932 6.118) 6.924 25.470 ( 1.306 0.430 -5.202) 5.381 25.836 ( -11.661 0.592 6.915) 13.570 26.318 ( 7.180 -4.885 3.657) 9.423 26.519 ( -0.815 -0.657 -1.536) 1.859 26.602 ( 1.997 1.658 0.314) 2.614 27.146 ( 2.861 -19.168 -12.876) 23.268 27.462 ( 12.554 -18.510 6.993) 23.433 28.223 ( -5.054 11.644 6.520) 14.270 28.277 ( -1.983 7.706 -4.334) 9.061 28.459 ( -8.918 22.016 3.602) 24.025 28.853 ( 9.311 12.606 -11.334) 19.341 ======================= Grid point 159 (77/104) ======================= q-point: ( 0.20 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( 3.780 8.740 0.136) 9.524 1.724 ( 6.463 12.523 -8.931) 16.684 1.952 ( 15.869 9.207 -16.401) 24.609 2.001 ( 6.760 7.837 11.417) 15.410 2.435 ( 1.067 13.487 1.713) 13.637 2.649 ( -11.188 -1.357 1.790) 11.411 2.688 ( -2.830 -1.854 -7.403) 8.140 2.858 ( 6.960 11.795 -4.882) 14.540 2.940 ( -5.341 3.205 -7.941) 10.092 3.195 ( -3.946 -3.871 1.671) 5.775 3.264 ( -9.444 2.601 1.868) 9.973 3.487 ( 0.874 4.169 1.662) 4.572 3.607 ( -4.026 2.437 -0.695) 4.758 3.665 ( 1.097 2.114 2.901) 3.753 3.724 ( -0.978 3.293 -3.880) 5.182 3.830 ( -0.067 3.075 2.451) 3.933 3.862 ( 2.319 6.579 1.402) 7.116 4.011 ( 1.970 7.804 3.274) 8.689 4.057 ( -3.819 3.003 -1.154) 4.993 4.152 ( 0.536 8.634 -0.655) 8.675 4.267 ( 1.762 13.772 4.963) 14.745 4.391 ( -2.002 -2.838 8.080) 8.795 4.675 ( 3.973 -0.926 8.893) 9.784 4.810 ( 14.318 -0.367 -0.781) 14.344 4.823 ( 7.581 -1.194 2.560) 8.090 4.950 ( -1.505 -4.386 0.372) 4.652 5.114 ( 6.101 -4.214 -2.756) 7.910 5.253 ( -3.082 -1.345 -2.923) 4.455 5.384 ( -2.493 6.402 6.248) 9.286 5.462 ( 3.119 0.215 -1.668) 3.543 5.604 ( -2.341 1.635 2.278) 3.654 5.803 ( -0.732 -0.033 -1.849) 1.988 5.951 ( 6.860 -1.571 -5.474) 8.916 6.036 ( 6.432 -3.821 1.648) 7.661 6.124 ( 10.876 -5.288 0.420) 12.101 6.239 ( 9.549 -3.548 -1.555) 10.305 6.362 ( 5.926 -5.817 4.968) 9.677 6.438 ( 6.447 1.173 -2.379) 6.971 6.469 ( 8.695 -3.020 -2.614) 9.569 6.599 ( 6.509 1.449 1.111) 6.760 6.741 ( 4.189 -4.451 -0.114) 6.114 6.830 ( 4.643 -3.743 1.648) 6.188 6.960 ( -6.149 -0.976 -3.166) 6.985 7.198 ( -1.956 1.711 1.372) 2.939 7.322 ( -1.598 5.956 5.751) 8.432 7.419 ( -1.519 4.656 -1.401) 5.094 7.974 ( -11.867 -2.148 -23.067) 26.030 8.417 ( -14.779 -0.108 15.128) 21.149 10.086 ( -5.972 5.226 -3.542) 8.690 10.361 ( -3.578 5.741 3.788) 7.753 10.605 ( 2.592 3.478 0.878) 4.426 10.663 ( -4.629 5.304 -3.482) 7.854 10.788 ( -0.232 0.744 1.014) 1.279 11.249 ( -12.340 1.814 1.176) 12.528 11.557 ( 11.551 -3.202 4.100) 12.669 11.678 ( 5.725 -3.687 -4.707) 8.278 13.804 ( -3.881 1.996 1.370) 4.574 14.111 ( 0.906 2.411 3.034) 3.980 14.378 ( 3.315 -12.862 -2.245) 13.470 14.445 ( 2.639 -6.614 -0.599) 7.147 14.580 ( -1.230 -0.240 -3.662) 3.871 14.625 ( 0.331 -7.592 1.432) 7.733 14.686 ( -0.164 -0.785 0.049) 0.803 14.821 ( 6.994 -0.840 1.857) 7.285 14.909 ( 3.041 4.732 0.243) 5.631 15.087 ( 5.786 3.420 -0.029) 6.721 15.321 ( -3.165 -8.579 -3.041) 9.636 15.405 ( -2.802 -8.593 1.591) 9.177 24.371 ( -0.999 0.282 0.338) 1.092 24.411 ( -0.793 0.847 1.351) 1.781 24.467 ( -1.785 0.320 0.397) 1.857 24.540 ( 0.360 0.264 -1.244) 1.322 25.361 ( -3.695 0.516 6.120) 7.168 25.436 ( 0.547 -0.082 -5.399) 5.427 25.743 ( -7.002 0.851 6.974) 9.919 26.211 ( -12.732 -5.855 -5.386) 15.013 26.593 ( 5.799 -0.342 0.477) 5.829 26.696 ( 8.603 1.830 1.768) 8.971 27.240 ( 14.350 -16.424 -6.758) 22.832 27.694 ( 8.222 -12.237 3.990) 15.274 28.133 ( -5.280 5.862 -2.589) 8.304 28.246 ( -4.689 16.390 7.378) 18.575 28.347 ( -5.576 16.995 2.023) 18.000 28.894 ( 5.746 6.096 -8.702) 12.079 ======================= Grid point 160 (78/104) ======================= q-point: ( 0.30 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( 1.500 11.164 -13.084) 17.265 1.760 ( -1.010 9.150 6.221) 11.111 2.029 ( 7.503 3.626 -8.552) 11.941 2.246 ( 9.210 10.363 0.686) 13.881 2.372 ( -7.054 1.199 2.084) 7.453 2.461 ( -7.822 7.217 1.910) 10.813 2.594 ( -0.221 -1.597 -9.263) 9.402 2.857 ( 1.627 11.890 -0.913) 12.036 2.962 ( 2.837 6.169 3.934) 7.847 3.116 ( -6.250 -1.927 0.034) 6.540 3.193 ( 0.205 4.474 1.086) 4.609 3.462 ( -4.877 -0.941 1.078) 5.083 3.517 ( -5.784 5.142 -2.599) 8.164 3.693 ( -1.071 0.598 1.707) 2.102 3.759 ( 4.016 5.125 0.141) 6.513 3.806 ( -3.375 0.297 4.603) 5.715 3.923 ( -0.552 6.907 -6.151) 9.266 3.994 ( 6.285 9.133 -3.652) 11.673 4.049 ( 5.308 10.563 -3.862) 12.436 4.187 ( 1.151 3.935 2.977) 5.067 4.260 ( -6.038 10.645 7.192) 14.195 4.465 ( -1.887 2.096 10.481) 10.854 4.816 ( -1.001 -6.761 5.755) 8.935 4.864 ( 1.981 -0.870 -4.612) 5.095 4.961 ( 0.555 4.177 10.488) 11.303 5.062 ( 10.239 -3.864 -0.724) 10.968 5.224 ( 5.485 -6.162 -3.467) 8.948 5.281 ( 4.383 -3.414 8.975) 10.555 5.386 ( -2.524 6.703 0.997) 7.232 5.460 ( -1.353 -2.008 3.346) 4.130 5.629 ( 5.157 3.320 -3.514) 7.068 5.801 ( 2.710 0.064 -2.160) 3.466 6.025 ( 6.398 -2.952 -4.655) 8.445 6.093 ( 1.673 -5.911 0.938) 6.214 6.313 ( 10.178 -5.594 -2.975) 11.989 6.407 ( 6.840 -5.374 -0.425) 8.709 6.508 ( 9.919 -1.043 -1.413) 10.073 6.529 ( 7.934 -5.748 0.869) 9.836 6.656 ( 9.379 2.826 -1.098) 9.857 6.718 ( 6.199 1.742 0.854) 6.496 6.840 ( 1.393 -1.638 6.503) 6.849 6.864 ( 0.050 1.067 -1.976) 2.246 6.898 ( 2.665 -0.279 -0.736) 2.779 7.195 ( 0.237 1.054 1.231) 1.638 7.294 ( -4.219 3.498 -2.173) 5.896 7.396 ( -0.465 3.052 2.821) 4.182 7.591 ( -7.101 -3.938 -20.987) 22.503 8.213 ( -20.003 3.446 7.055) 21.488 9.999 ( -1.830 5.008 0.152) 5.334 10.356 ( -2.040 4.212 5.410) 7.154 10.451 ( -10.241 4.401 -2.993) 11.542 10.677 ( 3.569 3.840 -2.431) 5.779 10.859 ( 2.167 1.269 4.455) 5.114 11.037 ( -11.304 2.770 -0.121) 11.639 11.700 ( 7.063 -5.868 -3.820) 9.946 11.815 ( 7.844 -1.655 2.554) 8.414 13.765 ( -2.483 2.762 2.246) 4.341 14.162 ( 0.892 2.931 2.709) 4.090 14.325 ( -3.177 -6.293 -6.837) 9.820 14.481 ( 2.943 -7.906 -1.632) 8.592 14.519 ( -0.108 -1.933 -3.614) 4.100 14.639 ( -1.142 -7.662 2.134) 8.035 14.711 ( 2.590 -2.521 1.137) 3.789 14.964 ( 6.120 -2.613 1.238) 6.769 14.987 ( 3.622 1.986 2.249) 4.703 15.173 ( 3.342 2.371 -0.741) 4.164 15.250 ( -1.623 -7.138 -1.612) 7.495 15.359 ( -2.833 -7.399 0.055) 7.923 24.361 ( -0.527 0.179 0.361) 0.663 24.408 ( -1.552 0.664 2.082) 2.681 24.441 ( -0.928 0.563 -0.242) 1.112 24.532 ( 0.017 0.287 -1.350) 1.380 25.346 ( -4.544 0.209 6.195) 7.686 25.397 ( 1.259 -0.304 -5.922) 6.062 25.700 ( -5.276 -0.128 6.633) 8.477 25.957 ( -8.080 -3.250 -6.658) 10.963 26.699 ( 5.947 -1.130 0.632) 6.086 26.870 ( 8.215 5.431 1.157) 9.916 27.411 ( 8.984 -14.629 -2.643) 17.370 27.819 ( 2.759 -5.644 1.375) 6.431 28.027 ( -2.743 5.513 -3.990) 7.337 28.185 ( -6.598 19.385 1.674) 20.545 28.359 ( -0.766 4.977 11.550) 12.600 28.897 ( 3.837 2.422 -8.707) 9.818 ======================= Grid point 161 (79/104) ======================= q-point: ( 0.40 0.14 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( 6.640 11.720 0.636) 13.486 1.836 ( 2.637 7.880 7.352) 11.095 2.091 ( 4.087 2.972 0.685) 5.099 2.195 ( -7.335 1.454 7.455) 10.559 2.379 ( -2.215 7.667 0.077) 7.981 2.465 ( -3.196 1.488 -7.983) 8.727 2.513 ( 11.061 1.977 -7.922) 13.748 2.884 ( -2.673 7.475 -0.799) 7.979 2.967 ( -5.331 1.399 0.949) 5.592 3.001 ( -1.007 5.487 -3.024) 6.346 3.237 ( 0.686 8.805 0.650) 8.856 3.366 ( -6.303 5.824 -3.958) 9.451 3.414 ( -1.092 1.488 4.134) 4.528 3.624 ( -4.483 -2.992 -2.086) 5.780 3.794 ( 2.831 1.264 2.173) 3.786 3.833 ( -2.393 5.832 -2.534) 6.794 3.879 ( 0.467 9.176 3.044) 9.678 4.002 ( -1.477 9.714 0.352) 9.832 4.166 ( 3.230 6.129 1.832) 7.166 4.233 ( 3.931 3.265 0.280) 5.118 4.339 ( 9.480 9.856 4.282) 14.330 4.484 ( -8.919 4.073 14.505) 17.508 4.789 ( -2.737 0.424 -3.481) 4.448 4.822 ( -1.828 -0.987 -2.774) 3.465 5.018 ( -1.707 -3.418 4.145) 5.637 5.187 ( 0.226 -0.211 9.298) 9.303 5.311 ( -2.446 -2.880 5.084) 6.334 5.326 ( 0.373 3.318 -2.043) 3.914 5.412 ( 6.761 -6.391 0.614) 9.323 5.520 ( 6.111 1.420 -4.569) 7.761 5.697 ( 6.488 3.124 -3.858) 8.169 5.826 ( -1.101 -7.203 0.275) 7.292 6.065 ( 3.776 -2.942 0.515) 4.814 6.228 ( 9.642 -1.709 3.461) 10.386 6.425 ( 4.559 -7.176 -4.538) 9.637 6.476 ( 4.547 2.231 -1.086) 5.179 6.575 ( 0.622 -8.243 -2.930) 8.771 6.661 ( 2.347 -8.160 2.333) 8.805 6.797 ( 9.392 5.499 -2.060) 11.077 6.811 ( 0.598 0.238 2.405) 2.490 6.858 ( 3.456 1.823 -0.253) 3.916 6.916 ( 1.337 -0.170 -3.139) 3.416 6.969 ( 2.135 0.765 3.598) 4.253 7.133 ( -2.636 7.315 -8.597) 11.592 7.276 ( 4.729 3.500 0.946) 5.959 7.365 ( -0.902 -5.167 -8.199) 9.733 7.436 ( 1.928 -2.378 -1.104) 3.254 7.863 ( -22.718 5.581 1.211) 23.425 10.011 ( 1.049 4.000 2.907) 5.055 10.267 ( -6.965 4.119 -3.221) 8.709 10.386 ( -0.699 2.605 6.405) 6.949 10.672 ( -1.773 1.344 -3.795) 4.399 10.901 ( -3.118 5.620 1.134) 6.526 10.914 ( -0.057 2.604 3.215) 4.137 11.795 ( 6.294 -4.976 -1.424) 8.149 11.922 ( 2.549 -2.053 0.037) 3.273 13.759 ( -0.995 3.041 3.438) 4.697 14.090 ( -4.768 3.513 -8.230) 10.139 14.301 ( 2.066 -3.904 2.766) 5.212 14.471 ( 0.450 -2.534 -4.073) 4.818 14.549 ( 3.747 -8.070 -0.962) 8.949 14.620 ( -2.569 -6.906 1.398) 7.500 14.795 ( 4.595 -4.953 2.692) 7.273 15.026 ( -0.472 -3.780 -0.084) 3.810 15.053 ( 1.369 -2.012 1.854) 3.059 15.163 ( -0.349 -1.848 -3.004) 3.544 15.262 ( 1.090 -1.879 1.764) 2.799 15.328 ( 0.056 -4.112 -0.959) 4.223 24.359 ( -0.102 0.064 0.530) 0.543 24.390 ( -1.675 0.292 0.840) 1.896 24.439 ( 0.058 0.943 0.988) 1.367 24.516 ( -0.191 0.396 -1.657) 1.714 25.317 ( -5.053 0.084 5.982) 7.831 25.380 ( 3.086 -0.481 -5.703) 6.502 25.676 ( -3.892 -0.671 5.854) 7.062 25.816 ( -2.224 -1.704 -4.730) 5.498 26.809 ( 4.874 -0.726 1.967) 5.306 26.978 ( 3.467 5.641 -1.344) 6.756 27.525 ( 5.770 -10.421 0.856) 11.943 27.822 ( -1.632 -1.935 -1.980) 3.214 27.973 ( 0.289 7.772 -2.740) 8.245 28.077 ( -6.043 14.662 -0.115) 15.859 28.474 ( -0.620 0.658 13.666) 13.696 28.872 ( 3.402 -0.355 -10.269) 10.823 ======================= Grid point 162 (80/104) ======================= q-point: (-0.50 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 10.446 6.231 6.478) 13.781 1.904 ( -2.698 7.974 1.358) 8.527 2.131 ( -5.259 4.478 8.087) 10.635 2.216 ( 3.919 0.320 2.927) 4.902 2.339 ( 3.108 3.533 -5.572) 7.293 2.359 ( -0.566 5.430 -6.077) 8.169 2.591 ( 3.271 -1.772 -1.228) 3.917 2.684 ( -7.391 0.346 -6.550) 9.882 2.935 ( -0.584 8.042 2.227) 8.366 3.012 ( 1.305 10.479 -4.318) 11.409 3.199 ( -4.771 7.767 1.913) 9.314 3.261 ( 1.263 6.005 -3.521) 7.075 3.494 ( 1.473 1.186 5.404) 5.725 3.556 ( -1.539 -1.361 -0.481) 2.110 3.782 ( -2.994 7.439 2.334) 8.351 3.807 ( -1.714 3.479 -0.121) 3.880 3.924 ( -3.404 11.725 3.567) 12.720 4.005 ( 6.919 9.095 -3.482) 11.946 4.197 ( -4.841 4.209 7.499) 9.869 4.316 ( 3.630 0.652 -0.391) 3.709 4.422 ( -9.917 4.584 10.907) 15.438 4.563 ( 9.445 6.516 2.856) 11.825 4.712 ( 1.110 1.509 -4.836) 5.187 4.760 ( -1.215 4.148 -4.703) 6.388 5.046 ( -0.537 -4.382 6.999) 8.275 5.195 ( -1.280 -4.064 -4.094) 5.909 5.291 ( -5.094 -0.876 9.257) 10.602 5.348 ( -2.313 2.962 6.355) 7.383 5.517 ( 7.688 -5.784 -6.489) 11.604 5.555 ( 5.561 3.865 -9.562) 11.717 5.737 ( -7.289 -8.488 1.534) 11.293 5.782 ( 4.856 -0.071 -2.515) 5.470 6.204 ( 6.022 -1.301 7.089) 9.392 6.339 ( -7.405 -2.172 -5.749) 9.623 6.400 ( 2.570 -7.152 4.355) 8.759 6.506 ( 0.037 -7.037 -5.787) 9.111 6.621 ( 4.857 -1.331 5.109) 7.174 6.702 ( 0.068 -3.811 -0.062) 3.812 6.755 ( -3.656 -4.487 -1.675) 6.026 6.789 ( -3.078 2.961 -5.496) 6.961 6.896 ( -5.119 0.047 1.898) 5.459 6.932 ( 1.306 1.526 -1.815) 2.707 7.020 ( 3.926 4.090 0.520) 5.694 7.076 ( 3.245 6.019 -4.657) 8.274 7.296 ( -7.501 3.135 2.163) 8.413 7.372 ( 6.537 3.049 -5.118) 8.845 7.476 ( -12.956 -0.801 4.602) 13.772 7.578 ( 11.365 -0.433 -5.151) 12.486 10.077 ( 2.789 3.804 3.656) 5.967 10.149 ( -2.983 3.676 -3.198) 5.713 10.455 ( 1.401 1.976 6.603) 7.033 10.586 ( -0.823 0.107 -5.766) 5.825 10.904 ( -1.643 4.577 2.734) 5.579 10.930 ( 1.237 5.848 0.576) 6.005 11.881 ( 3.424 -4.464 0.530) 5.650 11.907 ( -3.123 -2.225 -1.663) 4.180 13.799 ( 0.913 2.982 5.605) 6.415 13.941 ( -2.836 3.520 -7.799) 9.014 14.363 ( 1.200 -3.348 3.143) 4.746 14.440 ( 0.199 -2.891 -4.212) 5.113 14.579 ( -3.157 -7.080 1.039) 7.821 14.605 ( 3.550 -7.683 -1.185) 8.546 14.908 ( 3.771 -5.938 3.315) 7.776 14.958 ( -4.487 -6.468 -1.349) 7.986 15.079 ( 0.063 -1.794 1.842) 2.572 15.140 ( 0.784 -1.810 -3.445) 3.970 15.291 ( -0.113 -1.784 2.068) 2.733 15.324 ( -0.081 -1.348 -1.138) 1.765 24.362 ( -0.854 -0.030 1.193) 1.468 24.379 ( 0.712 0.391 -0.530) 0.970 24.453 ( -0.223 0.698 2.010) 2.139 24.496 ( 0.047 0.680 -2.039) 2.150 25.281 ( -4.931 0.247 5.678) 7.524 25.399 ( 4.545 -0.832 -5.200) 6.956 25.674 ( -2.005 -0.750 5.130) 5.559 25.777 ( 2.232 -1.396 -4.291) 5.035 26.897 ( 1.939 0.642 3.256) 3.844 26.963 ( -2.436 2.807 -2.941) 4.740 27.643 ( 5.024 -5.551 3.535) 8.280 27.736 ( -4.077 -2.656 -5.217) 7.134 27.971 ( -2.367 10.919 1.341) 11.253 28.001 ( 1.198 10.459 -1.486) 10.631 28.566 ( -3.350 0.163 13.149) 13.570 28.836 ( 4.638 -1.672 -12.307) 13.258 ======================= Grid point 163 (81/104) ======================= q-point: (-0.40 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( -14.355 8.465 -4.444) 17.247 1.979 ( 0.009 4.556 -6.090) 7.606 2.083 ( -11.728 5.487 5.404) 14.031 2.301 ( 3.194 5.470 -4.690) 7.881 2.331 ( 6.163 1.396 2.447) 6.776 2.414 ( 0.668 2.114 -0.195) 2.225 2.507 ( 6.108 0.963 -7.232) 9.515 2.829 ( 7.163 10.605 6.196) 14.218 2.924 ( -1.342 7.832 1.585) 8.103 2.973 ( 2.227 3.229 -0.990) 4.045 3.213 ( 2.793 3.650 3.732) 5.920 3.292 ( 2.620 6.705 0.831) 7.246 3.501 ( -2.343 3.239 -0.142) 4.000 3.564 ( 0.580 0.228 1.774) 1.880 3.721 ( -5.306 1.266 2.989) 6.220 3.830 ( -0.130 6.107 1.950) 6.412 3.870 ( 0.013 11.624 1.644) 11.739 4.087 ( -6.923 4.234 -0.166) 8.117 4.098 ( -1.819 13.233 -0.628) 13.372 4.308 ( -1.984 -0.265 -1.786) 2.682 4.371 ( -3.920 1.651 3.364) 5.423 4.673 ( 0.360 3.884 5.218) 6.514 4.723 ( 0.169 6.036 -0.703) 6.079 4.794 ( 10.109 2.364 -6.783) 12.401 5.056 ( -3.404 -4.334 0.966) 5.595 5.191 ( 0.114 -5.389 3.680) 6.526 5.255 ( -4.600 -5.941 4.728) 8.877 5.361 ( -3.034 5.284 6.773) 9.110 5.537 ( 4.148 2.761 -11.743) 12.756 5.555 ( 1.588 -0.512 -5.421) 5.672 5.634 ( -2.562 -2.631 -0.776) 3.753 5.839 ( 1.674 -6.227 -0.030) 6.448 6.106 ( -10.658 -2.706 -3.923) 11.675 6.323 ( -4.278 -3.623 0.309) 5.614 6.369 ( -3.427 -6.996 -2.246) 8.107 6.427 ( -3.918 -2.902 2.964) 5.706 6.558 ( -6.948 -2.624 -2.404) 7.807 6.708 ( -1.995 -7.566 -2.612) 8.249 6.748 ( -8.013 3.002 3.243) 9.150 6.767 ( -3.729 0.013 8.428) 9.216 6.837 ( 3.034 1.659 0.353) 3.476 6.875 ( -1.342 4.349 -1.706) 4.861 7.006 ( 0.998 2.807 -1.663) 3.412 7.120 ( -4.312 6.013 -1.960) 7.655 7.184 ( 0.801 -3.054 2.233) 3.867 7.309 ( -6.842 -3.406 -0.512) 7.659 7.429 ( 2.330 4.215 0.625) 4.856 7.904 ( 24.036 2.583 -2.795) 24.336 10.078 ( -1.246 3.046 -2.904) 4.389 10.196 ( 6.242 4.889 3.257) 8.572 10.493 ( -0.315 -0.798 -1.278) 1.539 10.609 ( 5.481 3.624 -0.078) 6.571 10.893 ( -0.196 4.102 1.900) 4.525 10.956 ( 0.680 4.925 -0.323) 4.982 11.794 ( -7.460 -2.465 -1.261) 7.957 11.915 ( -0.584 -4.263 0.541) 4.337 13.854 ( -0.072 3.524 -5.635) 6.646 13.900 ( 3.072 2.539 8.762) 9.626 14.387 ( -1.190 -3.570 -4.458) 5.833 14.402 ( 0.281 -2.949 1.917) 3.529 14.528 ( -3.603 -7.964 0.865) 8.784 14.653 ( 3.243 -6.767 -1.444) 7.642 14.835 ( -5.865 -6.468 -0.974) 8.785 15.002 ( 1.265 -5.554 1.718) 5.950 15.095 ( -0.764 2.084 1.984) 2.978 15.120 ( 0.856 -4.273 -2.887) 5.227 15.290 ( -2.078 -0.415 -0.035) 2.120 15.307 ( 0.303 -3.646 0.342) 3.675 24.358 ( -0.345 0.182 0.588) 0.706 24.401 ( 1.810 0.428 -0.110) 1.863 24.457 ( -0.910 0.056 0.721) 1.162 24.490 ( 0.799 1.195 -0.574) 1.548 25.256 ( -3.672 0.452 5.730) 6.821 25.435 ( 4.464 -1.208 -4.804) 6.668 25.705 ( 0.243 -0.833 5.335) 5.405 25.803 ( 5.549 -1.680 -5.670) 8.109 26.858 ( -6.034 0.563 -2.555) 6.576 26.926 ( -2.533 3.248 3.401) 5.341 27.586 ( -6.724 -7.131 -4.814) 10.920 27.762 ( 3.967 -3.057 3.389) 6.047 27.936 ( -1.876 7.580 1.479) 7.947 28.068 ( 5.443 13.646 0.370) 14.697 28.590 ( -5.430 -1.619 8.579) 10.282 28.821 ( 6.121 2.158 -11.136) 12.889 ======================= Grid point 164 (82/104) ======================= q-point: (-0.30 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -13.409 12.479 4.542) 18.872 1.839 ( -20.317 7.778 7.958) 23.165 1.926 ( 4.028 4.328 -8.712) 10.528 2.307 ( 1.903 14.368 -4.274) 15.110 2.403 ( 1.417 -0.073 1.256) 1.895 2.454 ( 0.897 2.773 1.883) 3.470 2.566 ( 8.389 1.483 -8.375) 11.946 2.850 ( -8.856 14.195 5.464) 17.600 2.921 ( 0.603 8.766 1.741) 8.957 3.118 ( 7.233 -2.701 0.385) 7.731 3.238 ( -1.181 4.324 -3.795) 5.873 3.403 ( 3.156 6.720 7.222) 10.357 3.508 ( 5.610 -0.268 -1.932) 5.939 3.593 ( -0.545 2.074 7.517) 7.817 3.698 ( -1.423 -2.639 5.196) 5.999 3.846 ( -11.545 6.954 2.196) 13.655 3.863 ( 2.141 6.012 1.380) 6.530 3.918 ( 2.399 9.069 -1.239) 9.462 4.091 ( 0.114 10.436 -3.970) 11.167 4.255 ( -2.156 0.320 -2.555) 3.358 4.356 ( 1.127 4.968 -0.533) 5.122 4.658 ( -5.163 0.258 -3.598) 6.298 4.713 ( -2.524 6.472 4.885) 8.493 4.858 ( 2.504 -1.341 -1.358) 3.148 5.006 ( -4.102 -4.235 0.795) 5.949 5.091 ( -9.846 -9.676 5.468) 14.848 5.292 ( -1.011 1.421 -3.773) 4.156 5.363 ( -2.200 5.027 1.314) 5.643 5.478 ( -0.693 1.706 -5.232) 5.547 5.533 ( 4.186 -0.032 -7.604) 8.680 5.607 ( 0.203 -2.295 -1.566) 2.786 5.813 ( -1.608 -4.023 -2.857) 5.189 5.960 ( -5.298 -5.860 0.874) 7.948 6.153 ( -6.362 -0.210 -5.077) 8.142 6.261 ( -6.841 -4.010 0.803) 7.970 6.392 ( -5.584 -2.485 -0.056) 6.112 6.436 ( -10.102 -6.075 4.678) 12.682 6.566 ( -11.072 4.812 1.872) 12.216 6.578 ( -8.724 -4.374 -0.563) 9.775 6.731 ( -6.237 -2.681 5.588) 8.793 6.848 ( 0.382 0.903 -2.787) 2.954 6.903 ( 1.219 0.454 -0.420) 1.367 7.030 ( -3.555 -0.361 -10.666) 11.248 7.131 ( 8.740 4.979 8.244) 13.005 7.216 ( 2.593 0.795 3.483) 4.415 7.258 ( -0.164 -4.807 6.980) 8.476 7.466 ( 1.760 2.772 -1.840) 3.764 8.311 ( 24.199 5.275 -3.276) 24.983 10.039 ( 0.196 3.432 -3.185) 4.686 10.355 ( 7.007 7.005 3.430) 10.485 10.478 ( 1.740 -1.803 -2.675) 3.665 10.658 ( 0.266 5.379 -1.129) 5.503 10.924 ( -1.999 2.547 -1.278) 3.481 11.004 ( 8.603 3.492 2.797) 9.697 11.642 ( -8.907 -3.598 1.056) 9.664 11.863 ( -4.750 -3.891 -1.700) 6.372 13.829 ( 2.107 3.309 -3.994) 5.598 14.065 ( 4.733 1.131 11.228) 12.237 14.303 ( -2.609 -3.631 -5.085) 6.772 14.433 ( 0.656 -3.334 2.351) 4.132 14.472 ( -3.578 -7.841 1.172) 8.698 14.690 ( 2.553 -6.256 -1.929) 7.027 14.736 ( -4.201 -5.604 -0.939) 7.066 14.973 ( -5.098 -3.905 0.329) 6.430 15.039 ( -3.909 3.350 -2.821) 5.871 15.152 ( 1.169 -1.473 1.720) 2.549 15.235 ( -2.804 -1.379 -0.356) 3.145 15.351 ( 3.553 -7.013 0.668) 7.890 24.362 ( 0.436 0.349 0.222) 0.600 24.430 ( 0.299 1.215 0.712) 1.439 24.451 ( 1.496 -0.526 -1.189) 1.981 24.504 ( 0.382 1.033 0.723) 1.318 25.263 ( -1.778 0.584 6.324) 6.595 25.464 ( 3.874 -1.136 -4.708) 6.202 25.793 ( 3.269 -1.975 8.178) 9.026 25.855 ( 7.019 -1.890 -7.578) 10.501 26.721 ( -6.941 -0.625 -1.359) 7.101 26.866 ( -6.768 5.635 1.749) 8.979 27.412 ( -9.515 -14.572 -2.832) 17.632 27.821 ( -1.302 -5.508 1.482) 5.851 27.949 ( 1.885 6.004 3.026) 6.983 28.185 ( 6.668 17.276 1.232) 18.559 28.545 ( -3.641 -2.596 0.096) 4.472 28.837 ( 5.234 10.596 -7.963) 14.251 ======================= Grid point 165 (83/104) ======================= q-point: (-0.20 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( -12.448 14.713 18.282) 26.564 1.556 ( -22.116 13.719 14.471) 29.778 1.967 ( 7.493 4.056 -8.198) 11.824 2.211 ( -7.015 8.886 -9.814) 14.983 2.392 ( -7.705 14.263 7.739) 17.964 2.509 ( -0.388 1.448 9.372) 9.491 2.656 ( -10.988 18.984 1.164) 21.966 2.711 ( 10.218 -1.520 -1.350) 10.419 2.927 ( -0.475 7.157 0.873) 7.225 3.196 ( 2.112 -0.580 -0.865) 2.355 3.247 ( 4.700 -2.338 2.491) 5.811 3.458 ( -0.528 3.947 3.841) 5.533 3.576 ( 3.817 -0.654 -0.876) 3.970 3.651 ( 3.024 0.348 1.698) 3.486 3.745 ( 0.098 -0.293 -0.111) 0.329 3.814 ( 2.012 6.115 3.364) 7.264 3.928 ( 3.331 8.424 0.409) 9.068 3.965 ( 4.745 1.372 1.268) 5.099 4.050 ( -1.619 9.122 -0.779) 9.297 4.184 ( -3.112 0.863 -1.513) 3.566 4.361 ( -1.492 12.093 -2.878) 12.520 4.525 ( -1.776 -2.252 -3.104) 4.226 4.692 ( -6.781 5.152 6.595) 10.771 4.870 ( -2.025 -2.098 -4.876) 5.681 4.883 ( -7.817 -7.901 -2.483) 11.389 5.013 ( -6.891 -8.545 6.008) 12.514 5.126 ( -3.098 0.739 -13.938) 14.297 5.267 ( -4.167 5.042 -3.494) 7.416 5.395 ( -6.298 2.514 2.209) 7.132 5.544 ( 3.691 -0.871 -5.162) 6.405 5.664 ( 4.076 -0.910 1.187) 4.342 5.765 ( -1.489 -0.425 -3.389) 3.726 5.880 ( -3.849 0.545 0.559) 3.928 6.032 ( -6.498 -3.063 0.963) 7.248 6.139 ( -8.802 -6.420 -1.311) 10.973 6.202 ( -10.353 -0.699 0.963) 10.421 6.340 ( -8.024 -2.685 2.110) 8.720 6.429 ( -1.898 0.241 -0.709) 2.040 6.456 ( -7.456 -4.305 3.399) 9.256 6.641 ( -6.068 -3.379 -2.049) 7.241 6.799 ( -9.172 -4.566 -3.442) 10.809 6.835 ( -0.365 -3.287 -1.390) 3.587 6.959 ( 3.588 2.328 -2.859) 5.145 7.220 ( 0.579 1.595 -0.720) 1.843 7.362 ( 7.504 2.301 4.364) 8.981 7.447 ( 1.109 5.141 -4.961) 7.230 7.527 ( 12.152 -2.090 17.878) 21.717 8.661 ( 20.475 4.575 -8.501) 22.636 10.043 ( 2.842 4.782 -0.168) 5.565 10.419 ( 0.918 4.634 -1.463) 4.945 10.551 ( 0.581 3.663 4.729) 6.010 10.662 ( 5.726 4.183 -3.261) 7.805 10.848 ( -3.322 1.638 -2.929) 4.722 11.213 ( 9.674 2.988 3.780) 10.808 11.519 ( -7.679 -5.879 4.474) 10.656 11.723 ( -6.672 -2.700 -5.504) 9.061 13.848 ( 3.569 2.731 -2.966) 5.385 14.189 ( -0.225 2.183 -3.624) 4.237 14.264 ( -0.094 -10.647 8.464) 13.602 14.428 ( -1.900 -7.399 1.296) 7.748 14.471 ( -0.028 -1.030 3.838) 3.974 14.673 ( -1.911 -5.236 -0.670) 5.614 14.705 ( 1.388 -4.591 -2.031) 5.208 14.852 ( -7.555 -2.589 -0.948) 8.042 14.929 ( -5.043 4.930 -2.196) 7.387 15.129 ( -1.930 6.269 -3.614) 7.489 15.245 ( 1.177 -8.267 4.260) 9.374 15.422 ( 3.687 -8.022 -0.128) 8.830 24.376 ( 1.093 0.495 -0.099) 1.204 24.426 ( -0.549 0.919 0.147) 1.081 24.484 ( 2.420 -0.007 -0.712) 2.523 24.514 ( 0.090 0.861 0.653) 1.084 25.303 ( -0.823 0.772 6.583) 6.679 25.484 ( 3.431 -0.307 -5.130) 6.179 25.904 ( 6.976 -1.380 -7.996) 10.701 26.008 ( 10.349 -6.226 13.923) 18.431 26.603 ( -5.108 -1.077 -0.442) 5.239 26.735 ( -7.943 4.211 -1.132) 9.061 27.159 ( -18.618 -20.937 -0.036) 28.017 27.741 ( -7.590 -10.889 -0.366) 13.278 28.044 ( 4.100 5.492 4.111) 7.992 28.323 ( 7.553 20.125 1.611) 21.556 28.479 ( -0.470 2.524 -5.995) 6.522 28.844 ( 3.883 19.951 -8.361) 21.977 ======================= Grid point 166 (84/104) ======================= q-point: (-0.10 0.14 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -12.706 15.295 20.294) 28.412 1.397 ( -12.715 16.677 22.867) 31.027 1.853 ( -9.534 10.228 -16.733) 21.806 2.027 ( -1.716 8.953 -3.124) 9.637 2.358 ( -13.028 22.574 25.151) 36.220 2.513 ( 5.387 8.772 -3.920) 11.015 2.644 ( 2.891 7.326 8.602) 11.663 2.803 ( -0.730 -0.099 -4.143) 4.208 2.996 ( 5.570 -3.953 2.350) 7.223 3.227 ( -3.835 -5.988 -0.727) 7.148 3.324 ( 2.345 3.661 8.468) 9.519 3.541 ( 6.110 2.724 0.590) 6.716 3.654 ( 4.547 -3.669 -0.835) 5.902 3.717 ( 1.104 -0.156 -2.586) 2.816 3.767 ( 5.170 -0.084 2.555) 5.767 3.854 ( 1.320 6.933 0.616) 7.085 3.925 ( 1.166 -0.531 -5.803) 5.943 4.018 ( -3.566 -3.098 -1.228) 4.881 4.051 ( 1.650 12.610 0.930) 12.751 4.183 ( 3.724 9.303 1.194) 10.091 4.256 ( -3.267 5.704 -4.014) 7.702 4.525 ( -1.828 2.091 -7.445) 7.946 4.544 ( -10.864 1.804 -2.341) 11.259 4.664 ( -7.076 -1.292 -3.500) 7.999 4.716 ( -10.450 -2.191 3.723) 11.307 4.858 ( -1.330 1.395 -11.406) 11.567 5.146 ( 3.424 -3.223 5.220) 7.025 5.270 ( 4.946 4.593 1.002) 6.823 5.330 ( -3.611 1.857 4.319) 5.928 5.547 ( 0.046 -1.088 -4.392) 4.525 5.675 ( -2.317 -0.263 1.933) 3.029 5.788 ( 2.453 1.777 2.496) 3.925 5.799 ( -3.320 1.114 -0.533) 3.543 5.917 ( -11.268 -1.705 -1.480) 11.492 5.969 ( -2.438 -2.589 0.625) 3.611 6.075 ( -4.284 1.113 -0.285) 4.435 6.220 ( -9.209 -2.259 0.971) 9.532 6.353 ( -3.138 -7.304 -1.483) 8.086 6.443 ( 1.407 -5.949 -1.118) 6.214 6.518 ( -3.930 -1.651 -3.080) 5.259 6.650 ( -5.312 -7.810 1.573) 9.575 6.787 ( -1.601 -5.606 -4.237) 7.207 7.035 ( 4.960 1.092 2.181) 5.527 7.239 ( 1.700 3.319 0.771) 3.808 7.381 ( -1.433 5.139 -4.275) 6.837 7.473 ( 2.335 3.721 -4.420) 6.232 7.943 ( 12.242 -1.472 21.335) 24.642 8.833 ( 11.103 0.307 -16.679) 20.039 10.153 ( 6.608 4.889 4.374) 9.311 10.419 ( -0.708 1.972 -0.151) 2.101 10.548 ( -0.056 6.689 0.298) 6.696 10.704 ( -1.980 6.852 -3.137) 7.792 10.849 ( 6.008 -0.972 1.711) 6.322 11.320 ( -4.650 -0.409 1.279) 4.840 11.477 ( -1.374 -4.433 6.592) 8.062 11.593 ( 1.307 0.315 -6.733) 6.866 13.899 ( 4.781 1.519 -1.770) 5.320 14.129 ( -2.023 1.125 -3.646) 4.318 14.263 ( -5.601 -11.209 3.417) 12.988 14.384 ( -4.078 -6.361 -1.358) 7.677 14.513 ( -0.938 -1.831 5.178) 5.572 14.653 ( -0.302 -6.052 -1.355) 6.210 14.707 ( -0.400 -4.340 -0.592) 4.398 14.744 ( -1.875 0.680 0.365) 2.028 14.858 ( -1.527 6.303 0.467) 6.502 15.053 ( -1.077 6.978 -6.649) 9.699 15.315 ( 1.432 -9.241 5.378) 10.787 15.466 ( 1.941 -8.420 -1.364) 8.748 24.396 ( 1.188 0.517 -0.396) 1.355 24.418 ( -0.506 0.795 0.046) 0.943 24.510 ( -0.039 0.275 1.006) 1.044 24.522 ( 1.479 0.641 -1.303) 2.073 25.343 ( -1.701 1.145 6.306) 6.631 25.490 ( 2.930 0.591 -5.571) 6.322 25.968 ( 8.149 -0.664 -5.732) 9.985 26.353 ( 5.280 -12.666 4.679) 14.498 26.501 ( -5.645 0.310 -1.354) 5.814 26.605 ( -1.133 -1.301 0.509) 1.799 26.842 ( -14.885 -18.646 14.019) 27.672 27.567 ( -9.978 -15.379 -3.043) 18.583 28.147 ( 2.365 6.873 5.043) 8.847 28.420 ( 0.960 7.728 -7.770) 11.001 28.475 ( 5.983 18.139 3.920) 19.498 28.815 ( 3.830 28.055 -12.203) 30.833 ======================= Grid point 167 (85/104) ======================= q-point: ( 0.00 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -2.929 21.462 12.777) 25.149 1.811 ( -1.302 14.122 13.028) 19.258 1.924 ( 0.390 16.767 -3.170) 17.069 2.171 ( 5.977 8.225 -11.637) 15.453 2.613 ( -0.761 -3.601 0.224) 3.688 2.629 ( 0.806 -3.643 -1.711) 4.105 2.915 ( -2.259 -5.151 2.797) 6.282 2.985 ( 3.458 -3.235 -3.496) 5.886 3.037 ( 1.050 16.661 9.126) 19.026 3.103 ( -0.324 12.804 1.226) 12.867 3.540 ( 1.038 1.895 6.077) 6.450 3.577 ( -3.004 5.596 9.641) 11.545 3.642 ( -1.507 -1.403 -1.846) 2.766 3.672 ( -0.276 0.509 3.896) 3.939 3.798 ( -2.216 -3.131 -2.564) 4.614 3.838 ( -1.152 5.565 -0.777) 5.736 3.949 ( 2.399 0.574 -0.749) 2.578 3.996 ( -0.179 4.867 -4.316) 6.508 4.201 ( 1.051 -4.472 3.935) 6.049 4.292 ( 0.066 5.122 -2.480) 5.691 4.378 ( 0.868 2.556 -1.941) 3.325 4.451 ( -7.487 1.518 -10.040) 12.616 4.640 ( 2.221 15.172 6.497) 16.653 4.712 ( 0.545 8.000 3.306) 8.673 4.788 ( -0.427 17.396 -5.682) 18.305 4.862 ( 2.793 3.766 -7.987) 9.262 5.230 ( 1.581 -1.592 7.223) 7.564 5.310 ( -0.851 -2.089 0.694) 2.360 5.410 ( 0.223 1.079 -0.834) 1.382 5.478 ( 0.167 2.723 -5.270) 5.934 5.689 ( -8.006 1.086 4.535) 9.265 5.750 ( 3.838 -1.076 0.185) 3.990 5.776 ( 3.654 -1.956 5.282) 6.714 5.876 ( -4.097 3.563 -2.973) 6.190 5.980 ( 2.937 -0.016 3.024) 4.216 6.028 ( -3.615 0.293 -3.092) 4.766 6.055 ( -0.867 -3.376 4.281) 5.520 6.166 ( 1.100 -5.861 -2.841) 6.605 6.350 ( 0.892 -4.063 2.599) 4.905 6.378 ( -3.324 -3.931 -0.800) 5.210 6.503 ( 3.057 -4.202 -0.680) 5.240 6.595 ( 2.928 -6.215 -8.337) 10.803 7.211 ( 5.896 3.784 4.786) 8.484 7.327 ( -4.489 1.448 -4.298) 6.381 7.406 ( -2.505 6.719 3.956) 8.190 7.544 ( 0.902 9.042 -8.065) 12.149 8.186 ( 3.513 -9.193 19.259) 21.628 8.587 ( -2.315 -12.663 -19.474) 23.344 10.344 ( 1.056 2.758 4.123) 5.072 10.404 ( -2.078 2.403 -1.574) 3.545 10.721 ( 1.512 5.673 2.001) 6.203 10.766 ( -1.556 3.243 -2.229) 4.231 10.984 ( 5.395 -0.252 6.613) 8.538 11.123 ( -4.634 -0.167 -6.116) 7.675 11.451 ( -3.132 -3.714 9.005) 10.232 11.621 ( 3.886 -2.363 -7.200) 8.516 13.965 ( -1.642 -0.992 2.161) 2.889 14.012 ( 0.550 -0.226 -1.999) 2.086 14.197 ( -0.771 0.368 -0.484) 0.982 14.214 ( 1.347 -2.511 -1.763) 3.351 14.466 ( -1.928 -2.823 1.984) 3.953 14.496 ( 1.708 -5.440 -0.918) 5.775 14.668 ( 0.823 -3.497 1.103) 3.758 14.686 ( -1.200 -3.431 -0.398) 3.657 14.958 ( -0.572 3.135 3.458) 4.702 15.070 ( 0.630 2.187 -7.007) 7.368 15.186 ( 0.088 -8.459 4.089) 9.396 15.266 ( -0.122 -8.966 -3.396) 9.589 24.418 ( -0.764 0.926 0.536) 1.315 24.429 ( 0.121 0.925 -0.426) 1.025 24.518 ( -0.868 0.624 0.578) 1.215 24.544 ( 1.330 0.195 -1.777) 2.228 25.397 ( -2.950 2.301 6.200) 7.241 25.501 ( 0.970 0.312 -3.008) 3.176 25.987 ( -11.152 -2.727 5.248) 12.623 26.065 ( 8.606 -2.650 -2.518) 9.350 26.554 ( 2.882 1.119 1.937) 3.648 26.602 ( -2.871 1.825 -2.504) 4.224 26.782 ( 13.454 -9.656 11.790) 20.329 27.009 ( -9.326 -13.425 -9.480) 18.897 28.346 ( 0.578 4.894 4.812) 6.888 28.431 ( -2.146 1.840 -2.304) 3.647 28.935 ( -1.778 17.793 7.734) 19.483 29.199 ( 4.256 12.603 -17.337) 21.852 ======================= Grid point 168 (86/104) ======================= q-point: ( 0.10 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 4.240 17.400 8.792) 19.951 1.964 ( 11.576 14.305 -1.832) 18.493 1.970 ( 0.698 13.556 6.956) 15.252 2.155 ( 7.638 11.383 -16.227) 21.242 2.556 ( -1.209 -2.306 -0.472) 2.646 2.654 ( -0.971 -5.731 -0.230) 5.817 2.852 ( -5.981 1.017 1.148) 6.174 2.938 ( -2.740 -3.223 -2.657) 4.996 3.134 ( 3.317 3.250 0.702) 4.697 3.183 ( 4.816 10.684 -2.004) 11.890 3.517 ( -5.160 2.633 -0.676) 5.833 3.587 ( -4.766 1.904 3.030) 5.959 3.686 ( 2.305 7.442 6.010) 9.840 3.739 ( -2.133 -0.163 5.223) 5.644 3.761 ( 3.145 3.467 -1.992) 5.087 3.864 ( 3.686 5.248 1.593) 6.608 3.900 ( -0.514 0.984 -4.436) 4.573 3.967 ( 0.977 6.675 1.659) 6.947 4.144 ( -4.225 -1.214 2.504) 5.060 4.271 ( -1.527 -2.221 -4.989) 5.671 4.433 ( 5.380 6.747 3.946) 9.489 4.512 ( 10.192 -1.361 7.599) 12.786 4.660 ( -5.019 20.888 -8.124) 22.967 4.733 ( 0.677 13.027 3.097) 13.407 4.764 ( 3.579 7.753 3.654) 9.288 4.844 ( 4.177 0.240 -8.270) 9.268 5.219 ( -8.354 1.501 -2.224) 8.775 5.299 ( -1.038 -0.226 0.378) 1.127 5.377 ( 0.623 -2.632 4.368) 5.137 5.492 ( 2.511 3.206 -3.510) 5.376 5.656 ( -1.819 -0.140 4.110) 4.497 5.778 ( -1.021 0.042 -2.103) 2.338 5.844 ( 5.597 -1.034 -0.002) 5.692 5.889 ( -1.710 -1.614 2.657) 3.548 5.947 ( 4.530 -0.567 -0.204) 4.570 6.047 ( 2.034 -3.527 3.534) 5.391 6.155 ( 5.515 -3.103 0.478) 6.346 6.250 ( 8.286 -5.269 -1.524) 9.937 6.349 ( 3.373 -1.852 -1.517) 4.136 6.444 ( 5.048 -2.202 5.835) 8.024 6.580 ( 7.121 -3.284 -4.903) 9.248 6.619 ( 7.528 -4.320 -5.084) 10.058 7.145 ( -8.022 3.250 -5.231) 10.114 7.328 ( -2.060 2.196 0.517) 3.055 7.380 ( -0.704 8.215 7.371) 11.059 7.532 ( 1.789 6.242 -2.911) 7.116 8.276 ( -10.277 -10.509 -17.770) 23.061 8.339 ( -6.354 -10.095 15.756) 19.762 10.303 ( -4.843 4.114 0.183) 6.357 10.444 ( 2.729 1.749 1.606) 3.617 10.710 ( -2.061 7.105 -1.349) 7.519 10.768 ( 1.773 3.838 1.566) 4.509 10.937 ( -5.152 2.529 -4.356) 7.205 11.245 ( 11.508 -1.698 4.425) 12.446 11.419 ( -8.239 -2.349 5.792) 10.342 11.581 ( 0.807 -5.110 -8.018) 9.542 13.908 ( -4.101 2.025 1.297) 4.754 14.061 ( 3.136 -4.037 0.448) 5.131 14.168 ( -0.653 -0.534 0.151) 0.857 14.265 ( 4.154 -3.351 -1.248) 5.481 14.465 ( -0.261 -5.347 1.621) 5.593 14.535 ( 3.418 -3.114 -1.366) 4.821 14.644 ( -1.349 -4.135 -0.284) 4.359 14.724 ( 2.896 -1.943 1.128) 3.665 14.977 ( -0.903 3.056 2.006) 3.765 15.058 ( 3.516 1.666 -2.425) 4.585 15.206 ( -1.589 -8.527 0.650) 8.698 15.222 ( -1.225 -8.995 -0.619) 9.099 24.402 ( -1.436 0.930 0.628) 1.822 24.429 ( -0.338 0.717 0.547) 0.963 24.502 ( -1.401 0.721 0.494) 1.652 24.546 ( 0.656 -0.008 -1.393) 1.540 25.392 ( -3.750 1.712 5.807) 7.121 25.475 ( -1.200 -0.125 -1.895) 2.246 25.863 ( -7.326 2.255 3.240) 8.322 26.187 ( 3.219 -7.328 -1.001) 8.067 26.520 ( 1.047 0.804 -1.255) 1.821 26.628 ( -0.176 0.474 -1.747) 1.818 26.878 ( 9.675 -7.313 -9.506) 15.409 27.152 ( 15.535 -12.300 7.505) 21.189 28.346 ( -4.368 3.865 -2.109) 6.202 28.383 ( -2.017 3.505 5.120) 6.525 28.908 ( -8.342 18.525 4.894) 20.898 29.110 ( 1.027 10.526 -9.863) 14.461 ======================= Grid point 169 (87/104) ======================= q-point: ( 0.20 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.885 ( 0.818 12.552 -0.152) 12.580 2.011 ( 3.189 13.970 -4.725) 15.088 2.143 ( 6.428 9.753 -10.136) 15.465 2.206 ( 11.886 12.394 3.323) 17.491 2.557 ( -8.327 -4.199 3.054) 9.813 2.583 ( 3.279 -4.335 -6.840) 8.737 2.726 ( -8.933 3.736 2.240) 9.938 2.894 ( -0.638 -4.102 1.069) 4.287 3.162 ( 1.321 10.240 -4.211) 11.151 3.176 ( -3.729 3.140 1.473) 5.093 3.372 ( -7.236 3.198 -1.864) 8.128 3.522 ( -3.707 3.413 0.752) 5.095 3.689 ( -0.684 1.066 0.232) 1.287 3.732 ( -3.341 3.027 -0.647) 4.555 3.790 ( -2.775 1.836 4.102) 5.282 3.897 ( 6.270 12.606 -4.556) 14.798 4.015 ( 5.524 0.565 0.179) 5.556 4.058 ( 6.558 4.239 0.486) 7.824 4.166 ( 0.203 2.782 8.792) 9.224 4.290 ( 6.196 -2.679 0.600) 6.777 4.496 ( -4.647 20.309 -5.943) 21.665 4.574 ( 2.178 11.010 7.674) 13.596 4.688 ( 2.259 3.335 5.806) 7.066 4.765 ( 2.280 1.364 -3.444) 4.349 4.873 ( 5.409 1.989 -4.092) 7.068 4.925 ( 9.994 1.147 4.726) 11.114 5.098 ( -0.798 5.369 1.779) 5.712 5.259 ( -4.106 1.553 2.186) 4.905 5.414 ( -2.798 -2.720 4.332) 5.831 5.534 ( 5.731 3.267 -3.703) 7.565 5.603 ( -2.983 0.727 -0.564) 3.122 5.791 ( 0.990 -0.321 -0.458) 1.137 5.884 ( 5.474 -4.228 -3.381) 7.699 5.987 ( 7.494 -0.974 3.022) 8.139 6.047 ( 3.431 -4.635 0.699) 5.809 6.153 ( 7.307 -2.902 0.253) 7.866 6.244 ( 5.550 -6.202 0.197) 8.325 6.346 ( 6.603 -5.212 -0.989) 8.470 6.517 ( 11.564 2.237 2.150) 11.973 6.612 ( 6.370 -1.721 6.672) 9.384 6.659 ( 7.304 -1.449 -5.257) 9.115 6.738 ( 9.296 -3.599 -3.990) 10.738 6.991 ( -4.785 5.020 -2.335) 7.318 7.243 ( -4.384 2.399 0.102) 4.999 7.452 ( -1.976 7.359 6.579) 10.067 7.493 ( -2.065 2.136 -4.569) 5.450 7.885 ( -11.692 -7.053 -20.474) 24.610 8.328 ( -12.035 -9.444 15.565) 21.824 10.206 ( -5.188 6.288 -1.523) 8.293 10.462 ( -2.570 2.944 2.085) 4.429 10.715 ( 1.873 6.527 1.721) 7.005 10.791 ( -6.008 6.496 -5.640) 10.493 10.818 ( 1.708 3.186 2.495) 4.392 11.277 ( -12.099 0.212 4.867) 13.043 11.458 ( 8.851 -6.394 -2.997) 11.323 11.587 ( 8.082 -4.881 -2.304) 9.718 13.862 ( -2.859 3.473 1.871) 4.872 14.102 ( 1.381 -6.547 0.015) 6.691 14.183 ( 1.845 -2.521 0.558) 3.174 14.320 ( 3.009 -4.636 -1.212) 5.658 14.472 ( -0.304 -6.788 0.644) 6.825 14.549 ( -0.662 -3.447 -2.308) 4.201 14.641 ( 0.986 -1.824 -0.606) 2.160 14.808 ( 5.477 -1.337 1.047) 5.734 14.973 ( -0.586 0.884 0.911) 1.398 15.119 ( 2.858 -1.684 0.641) 3.379 15.166 ( 0.157 -3.393 -1.865) 3.875 15.207 ( -2.402 -9.370 2.070) 9.892 24.383 ( -1.303 0.894 0.730) 1.741 24.426 ( -0.997 0.400 1.319) 1.701 24.479 ( -1.438 0.972 0.195) 1.746 24.542 ( 0.188 -0.188 -1.092) 1.124 25.376 ( -3.912 0.864 5.352) 6.685 25.430 ( -1.517 -0.538 -2.167) 2.699 25.774 ( -5.818 2.345 2.417) 6.722 26.072 ( -8.600 -7.175 -6.425) 12.912 26.600 ( 5.628 1.060 -0.451) 5.744 26.719 ( 12.259 -0.169 1.860) 12.401 27.043 ( 13.617 -3.273 -6.614) 15.488 27.456 ( 12.669 -11.236 4.193) 17.445 28.241 ( -4.290 5.312 -2.840) 7.396 28.387 ( -3.549 2.391 6.536) 7.812 28.760 ( -9.789 18.070 -0.057) 20.551 29.045 ( -2.559 7.112 -2.605) 7.995 ======================= Grid point 170 (88/104) ======================= q-point: ( 0.30 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( -1.430 10.914 -3.242) 11.475 2.011 ( 2.618 14.733 -4.104) 15.516 2.138 ( 0.998 5.530 -3.194) 6.463 2.366 ( -11.137 -0.738 1.775) 11.301 2.419 ( 6.089 6.852 -0.851) 9.206 2.546 ( 0.109 -0.851 -3.958) 4.050 2.685 ( -0.813 9.849 0.769) 9.912 2.916 ( 1.155 -4.636 3.467) 5.903 3.081 ( -7.278 -1.121 0.021) 7.364 3.150 ( 0.394 10.754 1.234) 10.832 3.328 ( -0.719 -1.791 5.193) 5.541 3.461 ( -1.624 8.283 -3.973) 9.328 3.622 ( -5.706 4.309 0.798) 7.194 3.728 ( -5.055 1.285 -1.472) 5.419 3.760 ( 2.527 -1.414 3.977) 4.920 3.923 ( 2.398 7.519 -2.183) 8.188 4.017 ( 0.714 2.814 -4.784) 5.596 4.173 ( 2.308 3.495 -0.333) 4.201 4.270 ( 1.275 6.819 6.840) 9.743 4.421 ( 6.836 18.870 -5.246) 20.745 4.456 ( 3.158 6.313 7.825) 10.538 4.539 ( -7.211 8.367 -3.120) 11.477 4.700 ( 2.834 -1.932 3.863) 5.166 4.892 ( 2.496 2.763 -2.688) 4.592 5.024 ( 13.965 2.213 8.787) 16.647 5.072 ( 2.945 0.400 4.896) 5.727 5.142 ( -1.709 5.847 -4.273) 7.441 5.278 ( -0.511 1.663 13.169) 13.284 5.342 ( -4.732 -6.411 2.246) 8.279 5.556 ( 1.066 7.346 -2.801) 7.934 5.652 ( 8.121 -0.938 -5.464) 9.833 5.797 ( 1.152 0.308 -2.485) 2.757 5.955 ( 4.528 -3.550 -4.285) 7.174 6.070 ( 3.833 -0.392 3.414) 5.148 6.211 ( 11.456 -5.630 0.920) 12.798 6.251 ( 6.385 -4.417 -3.913) 8.694 6.384 ( 6.406 -6.740 2.904) 9.741 6.476 ( 7.892 -1.640 -1.373) 8.176 6.704 ( 4.348 -3.898 3.987) 7.071 6.733 ( 4.322 -1.461 1.037) 4.679 6.771 ( 6.123 -0.657 3.700) 7.184 6.845 ( 7.298 -2.479 -5.203) 9.300 6.951 ( 3.173 7.557 -3.209) 8.802 7.205 ( -1.083 -0.196 2.138) 2.404 7.371 ( -2.133 0.971 -7.219) 7.590 7.461 ( -4.827 5.939 3.645) 8.477 7.526 ( -7.021 -3.310 -17.391) 19.045 8.193 ( -16.307 -6.336 8.463) 19.434 10.120 ( -2.884 6.616 -0.286) 7.223 10.419 ( -4.487 0.885 2.483) 5.204 10.590 ( -9.450 8.766 -2.178) 13.073 10.768 ( -0.444 4.301 0.249) 4.331 10.901 ( 3.575 3.139 4.304) 6.415 11.117 ( -7.549 4.618 1.209) 8.931 11.557 ( 7.634 -7.364 -3.268) 11.099 11.753 ( 8.933 -4.568 -0.412) 10.042 13.839 ( -2.019 4.187 2.459) 5.259 14.123 ( 1.568 -8.820 -1.266) 9.048 14.225 ( 1.865 -1.286 0.022) 2.265 14.342 ( 1.717 -4.526 -2.186) 5.311 14.466 ( -2.125 -6.901 0.850) 7.270 14.489 ( -1.082 -2.428 -4.079) 4.869 14.647 ( 0.631 -3.454 -0.565) 3.556 14.911 ( 4.496 -3.159 -0.168) 5.498 14.972 ( -1.289 -3.942 1.844) 4.539 15.139 ( 0.825 -1.029 -0.251) 1.342 15.176 ( -1.148 -7.137 1.420) 7.367 15.216 ( 2.918 -1.159 0.899) 3.266 24.371 ( -0.862 0.780 0.727) 1.371 24.415 ( -1.776 -0.049 1.409) 2.268 24.462 ( -0.564 1.402 0.162) 1.520 24.533 ( -0.093 -0.262 -1.060) 1.096 25.351 ( -4.246 0.373 5.007) 6.576 25.389 ( -0.149 -0.518 -3.221) 3.266 25.705 ( -4.709 0.830 2.923) 5.605 25.879 ( -5.556 -4.109 -6.127) 9.235 26.711 ( 6.634 2.382 0.812) 7.095 26.980 ( 11.811 3.821 4.306) 13.139 27.183 ( 8.688 -6.545 -5.607) 12.237 27.667 ( 7.823 -9.281 1.095) 12.188 28.161 ( -1.273 7.136 -2.890) 7.804 28.386 ( -3.537 1.437 6.516) 7.552 28.591 ( -8.398 16.063 0.031) 18.126 28.964 ( -3.809 3.210 -2.657) 5.646 ======================= Grid point 171 (89/104) ======================= q-point: ( 0.40 0.29 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( 3.788 10.819 1.089) 11.515 2.053 ( 2.979 12.064 2.397) 12.656 2.155 ( 0.996 2.390 4.037) 4.796 2.241 ( -7.201 3.357 7.876) 11.187 2.438 ( 2.768 -0.503 -6.884) 7.437 2.515 ( -1.159 4.544 -4.037) 6.188 2.620 ( -3.288 4.446 -6.475) 8.515 2.883 ( -10.602 -3.557 -1.174) 11.244 3.043 ( 2.285 4.906 4.855) 7.270 3.209 ( 4.057 10.739 -0.056) 11.480 3.316 ( -4.858 -2.366 -1.728) 5.673 3.436 ( 0.939 0.154 4.172) 4.279 3.527 ( -0.636 9.353 -4.077) 10.223 3.640 ( -3.753 4.929 0.501) 6.216 3.843 ( 1.250 2.810 3.226) 4.457 3.951 ( 0.558 4.034 -5.138) 6.556 4.026 ( 1.889 4.793 7.597) 9.179 4.174 ( -0.313 4.209 1.643) 4.530 4.332 ( 1.010 5.266 2.384) 5.868 4.406 ( -2.409 11.372 -2.424) 11.874 4.480 ( 2.383 4.279 3.044) 5.767 4.615 ( 3.809 10.664 3.876) 11.969 4.796 ( 2.942 1.703 2.364) 4.140 4.869 ( -3.728 5.804 0.829) 6.948 5.025 ( -4.151 6.473 -2.454) 8.072 5.152 ( -0.613 -3.140 6.459) 7.208 5.280 ( -1.128 -1.854 4.421) 4.925 5.332 ( 9.367 0.674 1.873) 9.576 5.397 ( 1.168 2.152 5.024) 5.589 5.535 ( 0.098 2.008 -2.172) 2.960 5.701 ( 3.593 0.061 -6.902) 7.782 5.777 ( 0.774 -0.342 -4.087) 4.173 6.012 ( 6.628 -3.470 -1.925) 7.725 6.226 ( 6.193 1.695 4.409) 7.789 6.327 ( 6.942 -1.499 -4.211) 8.257 6.397 ( 6.169 -6.575 2.654) 9.398 6.442 ( 1.799 -5.710 -2.359) 6.435 6.573 ( 3.083 -0.711 1.370) 3.448 6.729 ( -3.909 -7.849 0.746) 8.800 6.834 ( 2.623 -2.850 5.258) 6.530 6.903 ( 7.006 0.267 -3.115) 7.672 6.921 ( 5.519 -0.751 0.051) 5.570 6.981 ( 1.570 5.885 -4.892) 7.812 7.205 ( -1.852 -1.209 -3.071) 3.785 7.271 ( 1.899 -3.648 -6.993) 8.113 7.352 ( 3.257 0.863 -4.866) 5.919 7.453 ( -0.678 5.661 1.076) 5.802 7.910 ( -19.758 -1.604 0.645) 19.833 10.108 ( 0.460 5.284 2.099) 5.705 10.332 ( -5.880 1.304 -1.504) 6.208 10.473 ( -3.265 5.708 3.107) 7.272 10.691 ( -7.054 0.153 -0.122) 7.057 10.993 ( 1.381 5.603 4.930) 7.590 11.074 ( 1.517 10.283 -0.627) 10.413 11.668 ( 6.204 -6.861 -0.001) 9.250 11.854 ( 4.026 -4.833 -2.978) 6.959 13.838 ( -1.038 4.340 3.504) 5.674 14.102 ( -0.885 -5.353 -6.066) 8.139 14.245 ( 0.756 0.915 1.244) 1.720 14.371 ( 3.479 -6.212 -2.304) 7.484 14.405 ( -2.119 -5.496 -0.996) 5.974 14.468 ( -0.631 -5.613 -0.829) 5.709 14.669 ( 2.161 -7.829 0.498) 8.137 14.893 ( -4.532 -9.650 -1.402) 10.753 15.004 ( 2.809 -0.686 1.122) 3.101 15.135 ( -1.400 -0.779 0.172) 1.612 15.210 ( 2.434 -3.070 2.143) 4.465 15.269 ( 1.975 -1.672 0.399) 2.618 24.367 ( -0.434 0.600 0.840) 1.120 24.394 ( -1.381 0.027 0.494) 1.467 24.462 ( -0.112 1.276 0.959) 1.600 24.520 ( -0.150 -0.151 -1.315) 1.332 25.322 ( -4.151 0.488 4.761) 6.335 25.370 ( 1.508 -0.541 -3.310) 3.677 25.664 ( -3.021 -0.257 3.151) 4.372 25.770 ( -1.471 -2.683 -4.420) 5.376 26.837 ( 5.496 3.565 2.686) 7.080 27.114 ( 1.553 7.619 -3.391) 8.483 27.324 ( 9.524 -9.324 3.775) 13.853 27.734 ( 0.720 -7.201 -2.987) 7.829 28.153 ( 2.807 9.119 -1.926) 9.734 28.334 ( -7.467 8.207 1.510) 11.198 28.528 ( -1.297 6.312 6.562) 9.197 28.867 ( -2.415 -0.375 -5.737) 6.236 ======================= Grid point 172 (90/104) ======================= q-point: (-0.50 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( 4.161 7.156 6.751) 10.682 2.092 ( -1.967 8.264 -1.386) 8.608 2.226 ( -3.537 4.423 6.353) 8.510 2.247 ( 3.910 3.286 4.182) 6.601 2.397 ( 3.230 1.080 -2.956) 4.509 2.461 ( -3.564 3.491 -7.353) 8.885 2.572 ( 5.161 0.941 0.516) 5.272 2.664 ( -5.956 -1.135 -5.911) 8.468 3.090 ( -0.882 4.373 3.659) 5.769 3.145 ( -2.939 1.649 -1.104) 3.546 3.364 ( 6.358 6.013 -0.632) 8.774 3.408 ( -5.438 9.891 -4.825) 12.276 3.585 ( 3.452 5.542 4.311) 7.824 3.623 ( 1.045 8.573 1.150) 8.713 3.838 ( -4.697 1.055 2.975) 5.660 3.898 ( -0.536 2.120 -2.599) 3.396 4.086 ( -4.028 4.930 9.056) 11.070 4.230 ( 4.369 8.021 -4.178) 10.044 4.359 ( 1.426 3.173 2.667) 4.384 4.398 ( 0.374 6.204 -0.201) 6.218 4.527 ( -7.940 8.920 9.289) 15.129 4.673 ( 7.364 6.670 -2.136) 10.162 4.802 ( -4.536 7.349 1.092) 8.705 4.855 ( 4.064 1.192 -2.362) 4.849 4.991 ( -0.812 3.360 5.286) 6.316 5.133 ( -3.069 0.766 -0.782) 3.258 5.258 ( -6.063 -0.116 2.420) 6.529 5.421 ( 6.359 -2.535 -3.839) 7.849 5.474 ( 0.040 7.704 3.538) 8.478 5.555 ( -0.658 -5.349 6.168) 8.191 5.680 ( 2.300 3.036 -6.860) 7.847 5.766 ( 3.438 -2.292 -7.513) 8.574 6.141 ( 6.541 -3.683 2.940) 8.062 6.210 ( -7.642 -3.088 -2.461) 8.602 6.401 ( -2.790 1.917 0.239) 3.393 6.424 ( 3.175 -0.343 -2.132) 3.839 6.548 ( 5.865 -5.330 2.342) 8.265 6.606 ( -6.824 -8.026 -2.672) 10.869 6.669 ( 4.777 -1.482 6.562) 8.251 6.815 ( -7.348 -3.507 -5.152) 9.635 6.904 ( -1.443 2.174 1.927) 3.243 6.950 ( 0.812 0.360 -1.470) 1.718 7.050 ( 1.616 -0.326 0.439) 1.706 7.108 ( 1.069 -2.041 -4.432) 4.996 7.346 ( 0.901 0.998 0.847) 1.589 7.387 ( -1.209 -1.021 -2.392) 2.868 7.524 ( 4.982 3.798 -0.004) 6.265 7.581 ( -3.089 0.558 -4.304) 5.327 10.164 ( 2.262 4.366 3.336) 5.942 10.227 ( -2.622 3.457 -2.715) 5.119 10.503 ( 0.722 2.395 5.224) 5.792 10.585 ( -1.548 -0.479 -2.346) 2.851 11.034 ( -1.637 8.301 4.417) 9.544 11.102 ( 1.742 10.316 -1.647) 10.591 11.761 ( 2.781 -6.992 2.142) 7.824 11.838 ( -1.611 -4.718 -4.775) 6.904 13.872 ( 0.195 3.633 5.517) 6.608 14.008 ( -1.631 1.553 -7.127) 7.474 14.278 ( 0.463 -3.589 2.537) 4.419 14.348 ( -0.762 -5.624 -3.262) 6.546 14.420 ( -0.420 -6.149 0.743) 6.208 14.454 ( 1.925 -6.183 -1.815) 6.726 14.736 ( 3.480 -10.863 2.116) 11.601 14.784 ( -4.464 -10.246 -2.356) 11.422 15.060 ( 0.581 0.333 2.250) 2.347 15.103 ( -0.486 -0.864 -1.441) 1.749 15.257 ( -0.438 -1.665 2.209) 2.801 15.290 ( 1.037 -1.998 -0.876) 2.415 24.367 ( -0.790 0.480 1.247) 1.552 24.385 ( 0.704 0.189 -0.504) 0.887 24.470 ( -0.579 0.922 1.696) 2.016 24.507 ( 0.402 0.184 -1.687) 1.744 25.293 ( -4.015 1.004 4.735) 6.289 25.380 ( 2.587 -1.093 -2.813) 3.975 25.658 ( -0.828 -0.633 2.779) 2.968 25.738 ( 2.143 -2.368 -4.150) 5.237 26.946 ( 2.856 4.325 4.490) 6.857 27.043 ( -4.129 4.933 -4.625) 7.923 27.522 ( 6.492 -6.447 5.993) 10.937 27.653 ( -4.389 -6.100 -6.539) 9.962 28.203 ( -5.168 10.810 1.105) 12.033 28.214 ( 2.663 9.736 -0.204) 10.096 28.594 ( -1.854 2.778 9.188) 9.777 28.797 ( 4.002 -2.041 -9.688) 10.679 ======================= Grid point 173 (91/104) ======================= q-point: (-0.40 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( -10.699 12.124 -2.148) 16.312 2.101 ( -0.759 6.801 -1.641) 7.037 2.201 ( -7.781 5.179 5.376) 10.783 2.316 ( -0.782 -1.750 -0.941) 2.136 2.372 ( 5.836 2.487 -1.891) 6.620 2.495 ( 2.119 2.529 -4.251) 5.381 2.561 ( 9.144 4.472 -0.396) 10.186 2.834 ( 13.010 -3.851 3.083) 13.914 3.086 ( 0.189 4.147 3.030) 5.140 3.221 ( -2.327 15.608 -3.429) 16.148 3.247 ( 2.480 -0.151 3.371) 4.188 3.419 ( 0.183 5.701 1.456) 5.887 3.592 ( -2.700 4.283 -5.156) 7.227 3.654 ( 2.384 6.942 -1.095) 7.421 3.781 ( -6.126 5.884 7.802) 11.533 3.896 ( -0.233 -0.179 0.746) 0.802 4.092 ( -3.690 5.466 3.421) 7.429 4.225 ( -0.340 8.815 -2.715) 9.230 4.339 ( -2.633 2.857 0.095) 3.886 4.403 ( -1.998 -0.038 1.015) 2.242 4.428 ( -5.579 16.668 1.208) 17.619 4.728 ( -4.092 2.678 1.620) 5.152 4.829 ( 6.189 5.436 -2.726) 8.677 4.876 ( 1.283 2.074 -2.076) 3.203 5.023 ( -2.121 3.521 2.712) 4.925 5.128 ( -9.291 2.368 6.762) 11.733 5.169 ( 6.895 -1.222 1.052) 7.081 5.480 ( -3.127 3.009 4.527) 6.271 5.484 ( 4.341 -0.519 -7.133) 8.366 5.577 ( -3.709 -3.797 6.516) 8.404 5.659 ( 4.621 5.965 -11.618) 13.854 5.746 ( 1.258 -2.409 -5.165) 5.836 6.012 ( -9.468 -5.093 -2.657) 11.075 6.246 ( -1.278 -2.901 3.858) 4.993 6.282 ( -7.345 0.409 0.093) 7.357 6.403 ( -4.570 -1.053 -0.988) 4.793 6.456 ( -7.173 -6.995 -2.108) 10.239 6.623 ( -4.935 -1.256 -2.676) 5.753 6.669 ( 0.446 -7.218 5.799) 9.269 6.815 ( -4.694 -0.582 6.176) 7.779 6.873 ( 1.236 0.848 0.958) 1.779 6.910 ( -1.785 0.368 -1.845) 2.593 6.992 ( -2.526 -0.777 -3.889) 4.702 7.138 ( -4.052 -0.611 3.725) 5.538 7.203 ( -4.230 0.922 -3.804) 5.763 7.329 ( -1.745 2.389 -1.093) 3.154 7.492 ( 3.126 3.358 -1.866) 4.953 7.912 ( 23.213 -2.657 -0.139) 23.365 10.149 ( -1.782 3.828 -1.340) 4.430 10.287 ( 6.344 2.819 2.110) 7.256 10.515 ( 0.395 3.099 0.036) 3.125 10.667 ( 7.557 1.739 1.561) 7.910 11.031 ( -1.748 9.172 3.209) 9.873 11.083 ( -1.617 7.403 -2.863) 8.101 11.720 ( -6.325 -4.823 -4.712) 9.245 11.796 ( -1.346 -7.239 2.213) 7.688 13.930 ( 0.006 2.569 -2.948) 3.910 13.949 ( 0.987 1.923 5.108) 5.546 14.286 ( -1.535 -4.642 -0.034) 4.889 14.321 ( 0.196 -4.191 -0.161) 4.199 14.390 ( -2.115 -5.073 0.033) 5.496 14.488 ( 2.736 -7.675 -1.893) 8.365 14.683 ( -3.488 -8.424 -0.923) 9.164 14.846 ( 4.291 -10.607 2.547) 11.723 15.025 ( -3.181 -1.785 -0.236) 3.655 15.134 ( 2.549 0.483 0.115) 2.597 15.227 ( -3.780 -2.631 0.608) 4.646 15.291 ( -0.171 -0.657 -1.435) 1.588 24.366 ( -0.155 0.672 0.693) 0.978 24.406 ( 1.896 -0.038 -0.360) 1.930 24.468 ( -1.042 0.917 1.031) 1.729 24.508 ( 1.001 0.436 -0.840) 1.377 25.274 ( -3.008 1.385 4.909) 5.921 25.402 ( 2.360 -1.950 -1.985) 3.649 25.688 ( 1.592 -0.655 2.340) 2.905 25.760 ( 4.869 -2.361 -4.902) 7.301 26.904 ( -6.930 4.012 -3.562) 8.764 27.012 ( -1.031 5.130 5.611) 7.673 27.448 ( -10.162 -6.505 -7.232) 14.067 27.661 ( 2.476 -7.075 3.916) 8.457 28.115 ( -4.205 9.279 1.621) 10.316 28.307 ( 3.956 7.788 3.163) 9.290 28.599 ( -1.550 4.040 1.641) 4.628 28.862 ( 10.426 1.311 -6.139) 12.170 ======================= Grid point 174 (92/104) ======================= q-point: (-0.30 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( -8.537 16.822 4.820) 19.470 2.015 ( -9.053 10.271 2.674) 13.950 2.084 ( -2.984 8.968 -1.689) 9.601 2.353 ( 3.173 -3.244 1.009) 4.649 2.464 ( 6.620 1.394 -1.420) 6.913 2.521 ( 2.278 0.721 -4.067) 4.717 2.695 ( 5.088 8.314 -0.111) 9.748 3.024 ( 1.122 -1.213 -4.753) 5.032 3.056 ( 2.908 2.893 0.414) 4.123 3.157 ( -1.029 12.245 1.321) 12.359 3.369 ( 3.767 2.539 3.508) 5.740 3.479 ( -1.673 1.645 -7.884) 8.226 3.550 ( 6.983 6.056 7.883) 12.148 3.678 ( -0.231 4.314 1.376) 4.534 3.744 ( -5.166 8.190 8.112) 12.632 3.871 ( -2.019 -1.629 -1.322) 2.912 4.002 ( -5.144 3.390 -1.244) 6.285 4.149 ( -6.645 9.072 2.974) 11.632 4.309 ( -3.175 5.653 0.918) 6.548 4.358 ( -2.255 14.696 -0.350) 14.873 4.468 ( 6.694 2.827 3.416) 8.029 4.613 ( -7.341 -1.073 -3.076) 8.031 4.781 ( -5.905 -1.472 -3.286) 6.916 4.848 ( -3.542 4.079 0.127) 5.404 5.016 ( -5.427 6.622 2.522) 8.926 5.068 ( -0.424 4.965 3.210) 5.927 5.328 ( 3.277 1.086 -3.751) 5.098 5.394 ( 0.968 -2.994 -6.284) 7.028 5.450 ( -2.252 0.709 -3.777) 4.454 5.549 ( -4.910 -2.784 3.727) 6.764 5.625 ( 1.176 4.802 -5.260) 7.219 5.740 ( 1.040 0.296 -2.009) 2.281 5.881 ( -5.153 -3.560 1.616) 6.468 6.143 ( -6.396 -5.840 -2.356) 8.976 6.177 ( -4.560 -0.798 0.996) 4.735 6.257 ( -11.488 -4.390 -2.297) 12.511 6.373 ( -3.450 -2.999 3.768) 5.924 6.492 ( -7.819 -2.385 -2.675) 8.601 6.660 ( -9.153 -1.077 6.224) 11.121 6.697 ( -10.281 1.321 5.700) 11.829 6.825 ( -4.246 -5.003 -3.671) 7.519 6.895 ( -3.058 -1.062 -2.823) 4.295 6.937 ( 3.572 0.089 -5.868) 6.870 7.185 ( 3.607 -0.010 7.466) 8.292 7.222 ( 4.705 0.712 6.261) 7.864 7.291 ( 0.058 1.474 -0.808) 1.682 7.552 ( 5.237 6.575 -3.263) 9.016 8.307 ( 22.049 -6.560 -2.922) 23.189 10.126 ( 0.442 5.015 -0.741) 5.088 10.423 ( 5.617 -2.036 1.904) 6.271 10.562 ( 5.269 10.257 0.321) 11.535 10.765 ( 0.663 5.104 0.950) 5.234 10.989 ( -4.590 3.641 -3.326) 6.737 11.102 ( 7.121 5.501 2.529) 9.347 11.545 ( -9.108 -5.549 -2.595) 10.976 11.750 ( -4.880 -7.077 -0.111) 8.597 13.906 ( 1.701 3.537 -4.004) 5.607 14.027 ( -0.473 -4.903 7.306) 8.811 14.259 ( -0.102 0.045 -2.237) 2.240 14.302 ( -2.336 -6.805 0.495) 7.212 14.395 ( 0.904 -1.975 3.960) 4.517 14.506 ( 1.489 -8.603 -2.254) 9.017 14.641 ( -1.022 -4.872 0.074) 4.979 14.890 ( -2.935 -4.802 1.600) 5.851 14.992 ( 0.176 -5.831 -0.013) 5.833 15.141 ( -3.057 1.813 -0.436) 3.581 15.191 ( 1.672 -6.862 0.325) 7.070 15.259 ( -0.956 0.928 -2.743) 3.050 24.375 ( 0.669 0.950 0.264) 1.192 24.439 ( 1.664 -0.652 -0.289) 1.810 24.462 ( 0.194 1.686 0.229) 1.712 24.520 ( 0.742 0.402 -0.198) 0.867 25.284 ( -1.344 1.480 5.674) 6.016 25.428 ( 2.426 -2.398 -1.374) 3.677 25.758 ( 3.340 -1.172 3.764) 5.167 25.811 ( 6.339 -2.274 -5.829) 8.907 26.744 ( -7.812 2.917 -2.153) 8.613 27.000 ( -6.138 7.308 4.227) 10.438 27.167 ( -14.181 -9.521 -5.730) 18.016 27.664 ( -5.606 -9.797 1.526) 11.390 28.100 ( 0.617 8.195 2.599) 8.620 28.393 ( 1.313 0.867 4.821) 5.072 28.627 ( 5.592 12.536 -2.468) 13.947 29.010 ( 12.246 5.363 -6.328) 14.791 ======================= Grid point 175 (93/104) ======================= q-point: (-0.20 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -8.823 20.124 12.798) 25.428 1.873 ( -13.629 16.664 11.561) 24.436 2.085 ( 4.880 7.054 -4.059) 9.489 2.358 ( -6.423 6.182 -7.991) 11.972 2.449 ( -1.095 -2.682 4.706) 5.526 2.626 ( 9.789 -5.508 -2.537) 11.515 2.758 ( 3.621 10.606 1.535) 11.311 2.933 ( -1.200 -5.570 -5.638) 8.015 3.078 ( -7.704 17.370 5.407) 19.756 3.220 ( 5.890 1.446 -0.737) 6.109 3.350 ( -2.407 11.801 -1.657) 12.158 3.502 ( 4.872 -3.886 0.981) 6.309 3.592 ( -6.126 6.646 6.278) 11.005 3.713 ( 1.599 8.363 3.663) 9.269 3.792 ( 1.037 3.276 3.879) 5.183 3.866 ( 3.477 -2.442 -1.901) 4.655 3.961 ( -1.637 -0.045 2.903) 3.333 4.050 ( -6.615 5.102 1.036) 8.417 4.241 ( -3.258 6.149 0.179) 6.961 4.338 ( -2.873 3.975 0.914) 4.988 4.457 ( -4.327 8.532 -2.228) 9.823 4.640 ( 6.470 9.143 2.111) 11.398 4.667 ( -4.033 -8.217 2.219) 9.418 4.788 ( -3.100 2.771 0.630) 4.205 4.899 ( -3.911 5.096 -8.241) 10.449 5.014 ( -9.753 5.984 -0.806) 11.471 5.203 ( 0.699 6.703 -9.530) 11.673 5.354 ( -1.678 1.166 -5.787) 6.137 5.389 ( -7.066 -1.107 3.393) 7.916 5.568 ( 3.359 0.498 1.698) 3.796 5.619 ( 3.053 -0.241 -3.913) 4.969 5.742 ( -0.195 0.769 2.952) 3.057 5.810 ( -5.390 -7.513 1.510) 9.369 6.002 ( -10.489 -6.010 1.039) 12.134 6.089 ( -0.696 3.711 -3.968) 5.477 6.135 ( -4.053 -2.705 0.450) 4.894 6.295 ( -10.123 -2.029 -0.435) 10.333 6.326 ( -3.467 -5.558 -1.392) 6.697 6.515 ( -11.744 4.835 4.203) 13.378 6.578 ( -8.684 -2.748 3.967) 9.934 6.675 ( -9.104 -6.082 -1.694) 11.079 6.773 ( -3.737 -3.083 -7.235) 8.707 6.988 ( 5.778 2.835 -2.937) 7.074 7.250 ( 1.868 0.660 -0.145) 1.987 7.382 ( 6.482 -0.363 5.459) 8.482 7.491 ( 9.958 -2.585 14.061) 17.422 7.600 ( 5.406 9.791 -4.574) 12.084 8.600 ( 17.026 -10.844 -10.172) 22.604 10.161 ( 3.057 6.503 1.992) 7.457 10.487 ( 0.928 0.501 0.122) 1.062 10.684 ( 2.428 9.344 3.079) 10.134 10.753 ( 1.534 4.923 -0.380) 5.171 10.883 ( -3.005 1.969 -2.795) 4.552 11.278 ( 6.102 0.162 3.106) 6.848 11.387 ( -6.049 -4.246 2.141) 7.694 11.634 ( -4.807 -5.808 -4.703) 8.886 13.912 ( 2.540 2.960 -3.084) 4.972 14.058 ( -1.761 -7.754 4.499) 9.136 14.217 ( -1.207 -0.896 -2.979) 3.337 14.294 ( -0.766 -5.324 1.424) 5.565 14.454 ( 0.261 -1.018 3.952) 4.089 14.512 ( 1.189 -7.618 -0.742) 7.746 14.636 ( -0.006 -2.493 0.204) 2.501 14.810 ( -5.744 -1.917 0.375) 6.067 14.980 ( -1.944 -1.497 0.010) 2.453 15.104 ( -1.191 -3.669 1.822) 4.266 15.207 ( -0.165 -0.650 -3.993) 4.049 15.244 ( 3.258 -5.652 -1.770) 6.760 24.393 ( 1.237 1.141 -0.155) 1.690 24.443 ( -0.291 0.530 -0.016) 0.605 24.490 ( 2.317 0.684 -0.503) 2.467 24.529 ( 0.507 0.425 -0.257) 0.709 25.327 ( -0.334 1.581 6.310) 6.513 25.463 ( 3.140 -1.813 -1.850) 4.070 25.871 ( 6.886 -1.765 -4.794) 8.574 25.893 ( 5.503 -4.106 7.792) 10.386 26.604 ( -6.001 1.131 -0.768) 6.154 26.798 ( -15.473 -1.153 -5.725) 16.538 26.928 ( -11.899 -0.641 4.711) 12.814 27.509 ( -11.363 -11.916 -0.787) 16.485 28.173 ( 3.846 6.891 3.160) 8.501 28.445 ( 0.937 -1.577 2.229) 2.887 28.734 ( 7.098 17.525 -0.049) 18.908 29.158 ( 12.931 8.901 -10.976) 19.155 ======================= Grid point 176 (94/104) ======================= q-point: (-0.10 0.29 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -7.110 20.253 14.815) 26.081 1.775 ( -10.524 20.015 15.734) 27.548 2.085 ( -11.440 9.619 -7.084) 16.540 2.143 ( 5.081 6.372 -4.648) 9.382 2.522 ( 4.783 -1.731 2.061) 5.489 2.699 ( -0.502 -7.541 -2.619) 7.999 2.875 ( 6.710 7.269 2.181) 10.130 2.902 ( 0.893 -4.596 -0.321) 4.693 2.998 ( -6.891 22.142 9.594) 25.096 3.173 ( -4.311 5.203 -2.036) 7.057 3.435 ( 3.681 4.532 5.877) 8.284 3.563 ( -1.037 2.464 6.167) 6.721 3.608 ( 1.482 -1.538 2.693) 3.437 3.740 ( -3.687 8.317 0.354) 9.105 3.817 ( 1.877 2.690 0.372) 3.301 3.882 ( 0.922 -3.390 -5.205) 6.280 3.942 ( -1.692 -0.893 0.799) 2.074 3.967 ( -2.191 1.537 1.916) 3.291 4.215 ( -4.857 -6.595 -0.996) 8.251 4.258 ( 4.361 6.716 -2.913) 8.521 4.475 ( -1.752 11.429 4.240) 12.315 4.573 ( -3.574 7.557 -1.611) 8.514 4.689 ( -6.819 4.302 2.257) 8.373 4.721 ( -3.026 2.594 -8.806) 9.665 4.811 ( 0.899 14.431 -4.880) 15.260 4.862 ( 1.965 0.106 -2.823) 3.442 5.171 ( 1.499 7.492 -1.666) 7.820 5.300 ( -1.105 -2.891 -0.395) 3.120 5.371 ( 1.844 2.288 3.252) 4.383 5.554 ( -2.527 2.390 -3.740) 5.107 5.675 ( 2.289 -0.806 3.087) 3.926 5.729 ( -3.574 -5.590 2.050) 6.944 5.804 ( 0.187 -0.210 3.100) 3.113 5.874 ( -3.132 -1.348 0.180) 3.415 6.007 ( -5.043 3.356 -2.728) 6.643 6.060 ( -3.318 -2.889 0.020) 4.400 6.153 ( -5.569 -3.684 -0.135) 6.679 6.255 ( -6.086 -3.308 -0.820) 6.975 6.361 ( -5.037 0.089 0.294) 5.047 6.465 ( -6.446 -3.039 1.189) 7.225 6.525 ( -6.107 -4.469 0.945) 7.627 6.656 ( -0.972 -6.192 -8.238) 10.352 7.079 ( 6.054 3.885 0.309) 7.200 7.306 ( 3.260 2.720 1.873) 4.641 7.459 ( -1.498 2.259 0.078) 2.712 7.593 ( 3.293 8.157 -7.083) 11.294 7.874 ( 10.998 -5.345 18.174) 21.905 8.702 ( 8.484 -13.189 -16.767) 22.958 10.257 ( 3.877 5.181 3.788) 7.498 10.468 ( -2.694 2.234 -0.428) 3.526 10.685 ( -0.074 6.516 1.606) 6.711 10.800 ( -0.326 -1.663 -0.627) 1.807 10.866 ( 2.879 6.528 0.705) 7.170 11.265 ( -6.342 -5.824 2.579) 8.988 11.410 ( -2.361 -1.292 6.830) 7.341 11.579 ( 6.829 -1.796 -7.865) 10.570 13.935 ( 2.648 1.626 -1.710) 3.547 14.052 ( -2.548 -5.414 1.970) 6.300 14.186 ( 0.538 -0.153 -1.766) 1.852 14.266 ( -2.534 -3.790 -1.138) 4.699 14.475 ( -0.336 -3.707 1.739) 4.108 14.507 ( -2.042 -4.743 0.251) 5.170 14.641 ( 0.815 -3.094 -0.030) 3.200 14.730 ( -3.443 -1.934 0.537) 3.986 14.952 ( -1.559 2.708 1.624) 3.521 15.116 ( 0.159 -3.566 -0.207) 3.576 15.162 ( 0.138 -1.972 -3.155) 3.724 15.276 ( 2.108 -8.453 -2.587) 9.088 24.412 ( 1.024 1.080 -0.300) 1.518 24.437 ( -0.412 0.890 -0.151) 0.993 24.518 ( 0.758 0.473 0.097) 0.898 24.534 ( 1.117 0.425 -1.300) 1.766 25.375 ( -1.137 2.031 6.284) 6.701 25.495 ( 2.827 -0.382 -3.086) 4.202 25.950 ( 7.473 -1.008 -4.461) 8.761 26.074 ( -0.136 -10.501 10.661) 14.965 26.511 ( -4.944 0.663 -0.874) 5.064 26.562 ( -1.247 -1.624 3.005) 3.636 26.757 ( -10.797 2.597 2.306) 11.342 27.274 ( -12.432 -13.384 -4.007) 18.702 28.271 ( 3.229 5.851 3.773) 7.675 28.463 ( 0.059 -0.122 -0.610) 0.625 28.855 ( 4.023 18.067 4.090) 18.956 29.237 ( 9.758 11.445 -16.345) 22.212 ======================= Grid point 177 (95/104) ======================= q-point: ( 0.00 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -0.748 16.128 6.585) 17.437 2.099 ( -1.729 13.161 3.395) 13.701 2.206 ( 0.730 7.948 3.264) 8.623 2.267 ( 4.123 -1.163 -1.679) 4.601 2.469 ( -3.182 -6.666 4.793) 8.805 2.525 ( 0.249 -6.083 1.408) 6.249 2.799 ( 1.824 -2.393 -2.741) 4.070 2.871 ( 2.858 -6.685 -7.558) 10.487 3.257 ( 1.602 6.298 -0.138) 6.500 3.278 ( -1.171 4.507 -1.060) 4.776 3.482 ( 1.436 -2.262 2.042) 3.369 3.550 ( -0.834 -6.090 -2.731) 6.726 3.726 ( -5.057 3.047 2.195) 6.299 3.747 ( -2.351 1.004 -0.170) 2.562 3.863 ( 1.900 6.075 5.839) 8.637 3.930 ( 3.456 -2.188 0.275) 4.100 4.027 ( -0.642 7.045 6.665) 9.719 4.088 ( 0.690 -3.070 8.661) 9.215 4.119 ( -1.009 9.910 -1.282) 10.043 4.314 ( -6.248 -5.363 -7.976) 11.464 4.426 ( -3.830 4.580 0.394) 5.983 4.481 ( 2.270 2.432 -5.449) 6.385 4.844 ( 1.625 4.219 3.770) 5.887 4.881 ( 2.909 7.677 -1.007) 8.272 4.911 ( -2.338 -0.241 2.981) 3.796 5.003 ( 5.547 -1.608 -2.115) 6.151 5.290 ( -4.399 7.404 0.460) 8.625 5.335 ( 3.131 6.978 -4.503) 8.875 5.388 ( 1.192 -2.879 1.030) 3.282 5.491 ( 0.327 -3.985 -8.993) 9.841 5.698 ( -1.875 -0.701 5.734) 6.074 5.701 ( -0.733 -1.281 4.645) 4.874 5.811 ( -1.749 4.259 5.410) 7.104 5.895 ( -2.933 -2.466 -2.167) 4.402 5.983 ( 5.616 -0.147 1.688) 5.866 5.998 ( -0.154 -1.260 1.797) 2.200 6.063 ( -1.084 1.722 -1.332) 2.432 6.076 ( -6.469 -1.094 -1.241) 6.677 6.298 ( -1.374 -1.142 2.695) 3.233 6.314 ( -4.211 -2.347 1.077) 4.940 6.461 ( 6.385 -0.681 -5.821) 8.667 6.488 ( 5.311 -3.743 -8.166) 10.436 7.308 ( 2.972 4.602 1.691) 5.734 7.352 ( -1.827 0.210 -2.146) 2.826 7.572 ( -0.482 10.960 9.161) 14.293 7.746 ( 1.116 4.991 -2.809) 5.835 7.979 ( 1.254 -3.867 6.403) 7.584 8.248 ( -1.789 -19.341 -15.139) 24.627 10.407 ( 0.329 3.021 2.882) 4.188 10.439 ( -1.354 0.347 -0.178) 1.409 10.771 ( 0.102 -0.323 0.599) 0.688 10.781 ( -0.063 -0.134 -0.375) 0.403 11.026 ( 0.657 4.651 6.919) 8.363 11.121 ( 1.283 -2.531 0.091) 2.839 11.415 ( -2.271 2.341 1.792) 3.721 11.525 ( 1.187 -6.499 -6.763) 9.454 13.976 ( -0.766 2.009 2.155) 3.045 14.009 ( 0.380 -0.490 -0.551) 0.829 14.184 ( 1.212 -0.713 -0.568) 1.516 14.196 ( 0.018 -1.213 -1.546) 1.965 14.441 ( 2.178 0.297 0.593) 2.277 14.444 ( -2.564 0.521 0.335) 2.638 14.589 ( 0.469 -3.141 -0.157) 3.180 14.603 ( -0.908 -4.021 -1.182) 4.288 15.001 ( -0.866 1.561 3.971) 4.354 15.054 ( -0.426 -4.156 3.263) 5.301 15.100 ( 0.191 1.164 -4.754) 4.898 15.143 ( 0.438 -3.365 -4.916) 5.973 24.436 ( -0.722 0.715 0.485) 1.126 24.442 ( -0.336 0.218 0.045) 0.403 24.531 ( 0.013 0.655 -0.603) 0.891 24.542 ( 0.898 -0.375 -1.532) 1.815 25.447 ( -2.681 2.487 5.187) 6.346 25.489 ( -1.363 -1.476 1.826) 2.715 25.969 ( -1.800 0.856 1.297) 2.378 26.009 ( 4.789 -2.714 -2.169) 5.916 26.587 ( 5.226 2.182 3.256) 6.533 26.645 ( 5.540 -2.363 3.483) 6.957 26.669 ( -2.014 2.530 -0.763) 3.323 26.791 ( -7.599 -8.309 -6.467) 12.985 28.423 ( -0.044 2.637 2.621) 3.719 28.450 ( -1.212 -0.067 0.389) 1.275 29.217 ( -0.047 9.738 1.202) 9.812 29.319 ( 1.581 -0.029 -8.286) 8.435 ======================= Grid point 178 (96/104) ======================= q-point: ( 0.10 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( 3.460 14.751 2.630) 15.378 2.186 ( 4.118 10.771 4.738) 12.466 2.270 ( 6.449 9.106 -2.188) 11.371 2.341 ( 7.450 3.510 -6.145) 10.276 2.437 ( -3.206 -5.712 2.712) 7.089 2.485 ( -5.533 -9.045 0.907) 10.642 2.798 ( 0.115 -3.110 -1.399) 3.412 2.828 ( -0.541 -5.808 -6.669) 8.861 3.265 ( 0.878 6.672 -1.454) 6.885 3.313 ( 2.338 2.849 0.014) 3.685 3.486 ( -3.222 -1.946 -3.120) 4.889 3.534 ( 0.934 -5.014 3.029) 5.932 3.704 ( -2.804 -0.525 3.963) 4.883 3.730 ( -1.609 -2.045 3.521) 4.378 3.902 ( 2.720 3.099 -0.608) 4.168 3.937 ( -0.608 1.485 -3.179) 3.561 4.070 ( -1.866 3.994 0.533) 4.440 4.088 ( -0.656 5.809 0.752) 5.894 4.176 ( 1.783 4.645 -0.251) 4.982 4.250 ( 2.061 1.130 8.674) 8.986 4.424 ( 5.307 2.685 4.743) 7.607 4.557 ( 7.268 -1.216 0.655) 7.398 4.870 ( 1.416 3.515 -2.771) 4.695 4.905 ( -1.502 1.962 2.325) 3.393 4.919 ( 3.692 9.089 -5.725) 11.358 5.035 ( 1.268 6.894 -6.890) 9.829 5.234 ( -3.031 -0.161 2.412) 3.877 5.266 ( -7.443 -3.882 3.740) 9.190 5.403 ( 5.416 7.727 -2.954) 9.888 5.516 ( 1.005 -0.953 -3.000) 3.304 5.663 ( 0.318 1.615 3.268) 3.659 5.755 ( -0.077 -4.412 0.507) 4.441 5.851 ( -0.900 0.416 0.911) 1.346 5.886 ( 0.265 3.571 2.780) 4.533 5.896 ( -3.416 -3.860 1.190) 5.290 5.978 ( 1.451 -3.871 -0.147) 4.137 6.090 ( 4.393 -0.553 1.307) 4.616 6.142 ( 3.103 -4.648 1.621) 5.819 6.357 ( 7.118 1.418 2.864) 7.803 6.394 ( 5.283 -2.405 5.613) 8.075 6.564 ( 11.392 -0.035 -8.584) 14.263 6.567 ( 11.714 -0.575 -7.630) 13.992 7.258 ( -5.113 6.582 -2.324) 8.652 7.341 ( -1.337 -1.229 0.530) 1.892 7.606 ( -3.598 13.180 4.596) 14.414 7.675 ( -2.450 8.130 -4.536) 9.627 8.007 ( -7.866 -13.433 -9.260) 18.112 8.062 ( -5.143 -15.476 8.751) 18.508 10.393 ( -2.504 4.402 0.500) 5.089 10.456 ( 0.694 -1.227 1.551) 2.096 10.787 ( 1.408 0.846 0.215) 1.656 10.794 ( 1.841 0.306 0.012) 1.866 11.065 ( -0.322 8.498 -1.099) 8.575 11.210 ( 8.377 -3.876 -2.092) 9.465 11.362 ( -7.492 -0.091 6.157) 9.698 11.453 ( -1.525 -6.877 -4.472) 8.344 13.961 ( -2.301 3.003 1.074) 3.932 14.008 ( -0.143 -1.502 -0.302) 1.539 14.169 ( -0.452 0.694 -1.147) 1.415 14.215 ( 2.017 -2.848 -1.037) 3.641 14.407 ( -1.500 0.520 0.119) 1.592 14.468 ( -0.498 -4.121 0.459) 4.177 14.594 ( 2.991 0.770 0.100) 3.091 14.657 ( 4.259 -4.167 0.832) 6.016 15.011 ( -2.401 0.979 2.761) 3.788 15.058 ( -1.281 -3.502 0.733) 3.801 15.088 ( 1.257 -0.003 -0.109) 1.262 15.117 ( 1.385 -2.316 -2.734) 3.841 24.422 ( -1.430 0.952 0.858) 1.921 24.435 ( -0.977 -0.210 0.858) 1.317 24.521 ( -0.571 1.031 -0.439) 1.258 24.539 ( 0.212 -0.705 -1.117) 1.338 25.429 ( -4.196 1.845 4.665) 6.540 25.461 ( -3.517 -1.226 2.075) 4.263 25.931 ( -2.822 4.550 -1.419) 5.538 26.044 ( 0.353 -6.500 -3.526) 7.404 26.550 ( 1.149 2.128 -2.230) 3.289 26.602 ( -0.559 -2.648 -4.123) 4.932 26.842 ( 13.758 2.829 0.221) 14.047 26.953 ( 14.939 -7.696 4.605) 17.424 28.408 ( -3.499 2.089 -0.082) 4.076 28.424 ( -2.553 0.569 2.692) 3.753 29.176 ( -6.130 8.010 1.110) 10.147 29.238 ( -3.309 1.768 -4.497) 5.857 ======================= Grid point 179 (97/104) ======================= q-point: ( 0.20 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -5.136 12.083 1.563) 13.222 2.254 ( 2.870 9.330 -2.579) 10.096 2.325 ( -3.652 3.616 -3.130) 6.018 2.413 ( 8.728 2.185 -3.000) 9.484 2.432 ( 2.998 -2.613 -2.522) 4.709 2.488 ( 5.188 -3.564 -1.702) 6.520 2.723 ( -3.985 -0.260 1.861) 4.406 2.804 ( 0.512 -4.931 1.109) 5.080 3.221 ( -6.246 2.836 0.180) 6.862 3.293 ( -4.660 -3.170 -0.548) 5.663 3.386 ( -3.647 7.706 -1.763) 8.705 3.552 ( -1.217 -5.703 1.594) 6.045 3.683 ( -2.061 0.397 2.831) 3.524 3.718 ( -3.446 -1.563 3.041) 4.854 3.903 ( 1.475 4.771 -3.816) 6.285 3.993 ( 4.431 -3.322 -0.734) 5.586 4.038 ( 2.483 2.217 -1.469) 3.638 4.063 ( -2.329 0.831 -0.705) 2.571 4.304 ( 5.486 8.264 6.418) 11.815 4.387 ( 7.509 4.077 3.511) 9.237 4.602 ( 7.824 3.173 4.017) 9.350 4.726 ( 1.771 -2.612 -2.667) 4.132 4.802 ( 1.724 3.972 -2.743) 5.126 4.880 ( -1.145 2.039 -0.694) 2.439 4.941 ( 4.595 11.799 -2.677) 12.942 5.038 ( 4.703 4.482 1.932) 6.778 5.189 ( -1.449 1.816 5.162) 5.660 5.255 ( -4.918 -3.703 5.705) 8.393 5.429 ( -0.481 5.751 -1.988) 6.104 5.521 ( 5.214 -0.574 -4.578) 6.962 5.691 ( 0.325 4.144 -1.162) 4.316 5.763 ( 3.091 -3.159 -2.129) 4.906 5.839 ( 2.346 -0.637 -1.612) 2.917 5.863 ( 2.913 -7.121 -1.192) 7.786 6.016 ( 4.738 1.515 6.107) 7.876 6.092 ( 6.542 -5.529 4.669) 9.755 6.183 ( 6.301 2.070 -0.141) 6.634 6.253 ( 8.314 -4.114 1.840) 9.457 6.518 ( 6.294 -0.937 3.386) 7.208 6.535 ( 4.393 -3.131 4.372) 6.944 6.692 ( 9.768 2.170 -5.124) 11.242 6.713 ( 11.825 -0.030 -7.309) 13.902 7.160 ( -2.928 9.946 -2.372) 10.636 7.275 ( -4.498 -0.480 -1.515) 4.771 7.518 ( -4.198 1.689 -8.612) 9.728 7.598 ( -4.336 -0.122 -3.150) 5.361 7.760 ( -9.260 4.054 -2.632) 10.445 8.049 ( -9.008 -16.870 12.465) 22.828 10.337 ( -3.876 6.518 -0.590) 7.606 10.450 ( -2.850 -3.886 0.572) 4.853 10.826 ( 1.133 3.804 2.120) 4.500 10.855 ( 3.700 1.114 1.728) 4.232 10.982 ( -6.005 10.478 -3.751) 12.645 11.195 ( -6.389 -9.243 -0.566) 11.250 11.388 ( 5.084 1.778 0.557) 5.414 11.479 ( 7.843 -5.733 -0.727) 9.742 13.932 ( -1.726 3.343 0.832) 3.853 13.997 ( -0.468 -3.243 -0.593) 3.330 14.163 ( 0.695 0.863 -0.582) 1.251 14.236 ( 1.928 -4.934 -1.996) 5.660 14.393 ( -0.539 -0.104 0.396) 0.677 14.450 ( -1.292 -4.937 0.042) 5.104 14.659 ( 2.616 3.281 0.205) 4.201 14.746 ( 4.242 -4.494 1.120) 6.281 14.968 ( -2.784 0.760 -0.175) 2.892 15.033 ( -1.345 -5.531 -0.228) 5.697 15.122 ( 1.383 1.085 1.718) 2.458 15.149 ( 2.229 -1.037 1.214) 2.742 24.404 ( -1.519 1.108 1.079) 2.168 24.423 ( -1.478 -0.633 1.315) 2.077 24.505 ( -0.733 1.411 -0.278) 1.614 24.530 ( -0.210 -0.986 -0.737) 1.249 25.395 ( -3.953 1.004 3.791) 5.568 25.415 ( -3.245 -0.934 1.269) 3.608 25.839 ( -4.938 4.100 -2.432) 6.863 25.939 ( -5.609 -5.792 -5.609) 9.822 26.635 ( 7.971 2.272 -0.733) 8.321 26.686 ( 11.549 -2.545 -0.250) 11.829 27.080 ( 12.527 5.801 -1.114) 13.850 27.242 ( 13.497 -9.716 2.475) 16.813 28.338 ( -3.521 4.006 -0.502) 5.357 28.394 ( -3.157 -1.352 2.493) 4.244 29.036 ( -9.162 9.065 -0.649) 12.905 29.125 ( -7.243 0.094 -0.081) 7.244 ======================= Grid point 180 (98/104) ======================= q-point: ( 0.30 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -5.260 8.520 1.490) 10.123 2.173 ( -7.160 -3.134 2.622) 8.244 2.302 ( 1.841 12.594 -5.633) 13.918 2.382 ( -3.724 2.708 -2.502) 5.240 2.462 ( 1.390 -1.297 -6.773) 7.035 2.536 ( 5.917 -4.178 -3.824) 8.190 2.821 ( -2.729 2.558 0.115) 3.742 2.843 ( 5.074 0.492 8.774) 10.147 3.086 ( -6.905 2.627 1.212) 7.486 3.196 ( -3.219 -6.844 4.800) 8.958 3.364 ( -0.937 8.943 2.044) 9.221 3.519 ( -5.232 -4.888 1.885) 7.404 3.672 ( -1.361 1.213 0.635) 1.931 3.715 ( 0.402 -0.616 2.040) 2.168 3.876 ( 1.885 9.065 -4.542) 10.313 3.980 ( -2.442 -1.118 -2.115) 3.419 4.025 ( 2.374 0.426 -1.056) 2.633 4.120 ( 1.724 -6.120 0.869) 6.417 4.415 ( -0.311 5.841 0.842) 5.909 4.508 ( 0.849 -1.008 -0.737) 1.510 4.662 ( -1.379 2.308 -0.553) 2.745 4.684 ( 5.510 4.878 2.494) 7.770 4.847 ( 1.724 9.752 0.216) 9.905 4.921 ( 5.285 3.918 0.794) 6.627 5.113 ( 8.956 3.425 6.163) 11.398 5.138 ( 1.010 3.723 3.555) 5.246 5.217 ( -4.850 -0.665 9.059) 10.297 5.269 ( 2.877 -1.128 1.047) 3.262 5.379 ( 1.031 8.853 -1.960) 9.126 5.573 ( 4.778 -6.050 -6.400) 10.020 5.698 ( 2.185 4.911 -2.125) 5.780 5.775 ( 0.466 -2.574 -2.835) 3.858 5.913 ( 6.067 -0.988 -2.977) 6.830 5.953 ( 9.246 -5.618 -0.132) 10.820 6.173 ( 8.003 1.300 3.983) 9.033 6.226 ( 6.386 -3.123 0.288) 7.115 6.337 ( 8.214 4.178 2.152) 9.463 6.438 ( 9.889 -3.198 0.976) 10.439 6.597 ( 0.079 -2.761 1.618) 3.201 6.639 ( 3.957 -5.168 2.561) 6.995 6.809 ( 6.152 2.237 0.003) 6.546 6.834 ( 7.486 -0.048 -3.250) 8.162 7.122 ( 1.622 7.668 -3.430) 8.555 7.196 ( -2.839 -0.621 -0.559) 2.959 7.339 ( -5.315 -1.045 -9.915) 11.298 7.416 ( -4.581 -7.004 -12.931) 15.403 7.671 ( -5.361 13.616 5.556) 15.653 7.970 ( -10.518 -14.466 7.307) 19.321 10.258 ( -3.575 6.862 -0.819) 7.780 10.379 ( -4.319 -4.522 -0.623) 6.284 10.756 ( -11.556 6.281 1.830) 13.279 10.818 ( -8.292 0.034 3.001) 8.818 10.999 ( 6.530 6.950 2.377) 9.828 11.143 ( 1.902 -4.488 1.054) 4.987 11.491 ( 7.442 3.310 -2.668) 8.571 11.628 ( 8.839 -7.618 -2.362) 11.905 13.918 ( -1.002 3.432 1.254) 3.788 13.988 ( 0.203 -4.132 -0.862) 4.226 14.183 ( 1.919 -0.492 -0.112) 1.985 14.247 ( 2.070 -5.654 -3.046) 6.748 14.388 ( -0.705 -0.248 0.552) 0.929 14.428 ( -0.911 -3.468 -0.382) 3.606 14.650 ( -2.713 4.247 -2.241) 5.516 14.780 ( -1.794 -7.768 -0.973) 8.032 14.959 ( 2.244 2.168 0.710) 3.200 15.036 ( 1.757 -5.449 1.196) 5.849 15.161 ( 1.046 1.941 1.865) 2.888 15.198 ( 1.500 -1.454 1.886) 2.814 24.389 ( -1.243 0.996 1.007) 1.884 24.407 ( -1.628 -0.681 1.206) 2.137 24.492 ( -0.467 1.518 -0.075) 1.590 24.519 ( -0.324 -1.076 -0.577) 1.264 25.362 ( -3.305 0.642 3.006) 4.514 25.376 ( -1.832 -0.727 0.248) 1.987 25.738 ( -4.146 2.407 -1.386) 4.991 25.799 ( -4.212 -3.611 -4.495) 7.141 26.792 ( 8.854 5.396 1.140) 10.432 26.920 ( 12.283 -6.796 2.194) 14.208 27.242 ( 7.491 9.171 -2.215) 12.047 27.456 ( 8.797 -11.149 0.102) 14.202 28.293 ( -0.461 5.502 -0.852) 5.587 28.373 ( -1.177 -2.369 1.937) 3.279 28.861 ( -9.719 9.934 -0.269) 13.900 28.983 ( -8.586 -2.158 -0.062) 8.853 ======================= Grid point 181 (99/104) ======================= q-point: ( 0.40 0.43 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.024 ( -0.199 6.920 5.034) 8.559 2.123 ( -3.500 -2.777 7.531) 8.757 2.288 ( 2.166 6.160 -2.177) 6.883 2.317 ( -2.894 2.890 3.272) 5.238 2.448 ( 2.320 3.257 -7.581) 8.571 2.551 ( 1.715 -3.263 -7.035) 7.943 2.689 ( -7.545 4.652 -2.358) 9.172 2.796 ( -8.789 -5.072 -1.965) 10.337 3.143 ( 0.709 5.133 6.113) 8.014 3.240 ( -3.313 -4.368 3.027) 6.262 3.368 ( 3.349 4.380 1.965) 5.854 3.420 ( -2.326 -1.239 1.423) 2.995 3.692 ( 3.402 6.867 0.548) 7.683 3.743 ( -0.155 2.647 1.430) 3.012 3.911 ( 1.451 4.460 -1.313) 4.871 3.967 ( 1.039 -1.055 -0.867) 1.716 4.079 ( 2.665 -0.463 3.375) 4.325 4.132 ( 0.829 -5.512 5.143) 7.584 4.346 ( -2.371 1.362 -2.729) 3.863 4.437 ( -3.541 -4.616 -5.952) 8.323 4.672 ( -2.562 8.835 8.043) 12.219 4.809 ( 0.828 -3.077 3.847) 4.995 4.889 ( 3.689 14.267 -0.346) 14.740 5.017 ( 1.672 4.009 2.378) 4.952 5.146 ( -1.956 5.066 0.706) 5.476 5.191 ( -1.383 -2.730 5.111) 5.957 5.260 ( 2.465 9.742 -1.098) 10.109 5.359 ( 3.889 -1.053 4.941) 6.375 5.439 ( 1.965 1.491 3.385) 4.188 5.558 ( 2.387 -4.653 -6.621) 8.437 5.709 ( 1.760 1.164 -5.006) 5.433 5.734 ( -1.182 -1.466 -3.954) 4.379 6.009 ( 8.711 5.042 -1.778) 10.221 6.167 ( 12.702 -7.817 1.624) 15.003 6.331 ( 6.245 0.642 0.497) 6.298 6.343 ( 4.223 -1.448 1.128) 4.605 6.436 ( 2.093 6.219 0.097) 6.562 6.568 ( -0.093 -6.846 -0.352) 6.855 6.588 ( 2.082 3.453 0.689) 4.090 6.721 ( 2.151 -7.324 2.010) 7.894 6.905 ( 4.717 0.650 -0.430) 4.781 6.922 ( 4.017 -0.170 -0.263) 4.029 7.093 ( -3.622 3.666 -3.681) 6.333 7.143 ( -5.039 -3.070 -2.732) 6.502 7.226 ( 6.673 0.379 -4.741) 8.194 7.299 ( 2.379 -4.777 -5.586) 7.725 7.619 ( -3.864 9.364 0.068) 10.130 7.804 ( -12.266 -8.153 0.367) 14.733 10.218 ( -0.538 5.402 0.608) 5.463 10.310 ( -2.436 -3.222 -0.772) 4.113 10.588 ( -8.336 5.135 2.425) 10.087 10.668 ( -9.844 -2.589 2.445) 10.468 11.134 ( 4.083 7.645 4.970) 9.991 11.229 ( 4.254 1.500 1.843) 4.872 11.586 ( 5.548 1.714 -2.228) 6.220 11.720 ( 5.070 -8.217 -4.784) 10.775 13.918 ( -0.687 3.353 1.969) 3.949 13.985 ( 0.436 -4.221 -1.129) 4.391 14.224 ( 2.238 -1.507 0.318) 2.717 14.260 ( 2.855 -4.807 -3.215) 6.449 14.374 ( -1.208 0.934 0.236) 1.545 14.412 ( -0.277 -1.587 -0.950) 1.870 14.560 ( -3.667 0.779 -2.161) 4.327 14.690 ( -4.998 -9.434 -3.125) 11.124 15.028 ( 3.420 2.523 1.502) 4.508 15.091 ( 1.413 -3.301 1.887) 4.057 15.195 ( 1.281 1.287 1.484) 2.345 15.232 ( 0.590 -2.013 1.363) 2.502 24.380 ( -0.766 0.671 0.893) 1.355 24.391 ( -1.139 -0.331 0.747) 1.401 24.487 ( -0.185 1.196 0.222) 1.230 24.509 ( -0.187 -0.870 -0.646) 1.100 25.337 ( -2.574 0.943 2.870) 3.969 25.356 ( -0.594 -0.864 0.076) 1.051 25.674 ( -2.016 1.294 -0.502) 2.447 25.715 ( -1.390 -2.566 -3.214) 4.341 26.948 ( 6.442 7.156 2.760) 10.016 27.113 ( 6.303 -8.566 0.984) 10.680 27.322 ( 4.198 10.011 -0.160) 10.857 27.543 ( 2.200 -10.965 -2.244) 11.407 28.312 ( 3.027 6.071 -0.529) 6.804 28.387 ( 0.153 -1.205 1.628) 2.032 28.707 ( -6.749 8.736 0.397) 11.046 28.834 ( -6.700 -3.615 -2.002) 7.872 ======================= Grid point 182 (100/104) ======================= q-point: (-0.50 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 1.360 4.706 8.171) 9.527 2.163 ( -1.197 -0.410 6.573) 6.694 2.311 ( -3.014 3.792 2.836) 5.613 2.357 ( -0.116 5.339 -5.469) 7.643 2.379 ( 3.882 -1.408 0.387) 4.147 2.460 ( -0.502 -3.051 -8.248) 8.808 2.627 ( 1.782 2.803 -0.940) 3.452 2.655 ( -2.791 -0.254 -3.435) 4.433 3.130 ( -1.783 0.818 2.229) 2.969 3.144 ( -3.914 -0.667 0.665) 4.026 3.478 ( 4.025 4.072 2.539) 6.263 3.511 ( 2.526 0.881 1.277) 2.965 3.727 ( 0.842 6.708 1.366) 6.898 3.769 ( 1.428 3.565 0.521) 3.876 3.867 ( -3.744 2.279 -0.030) 4.384 3.909 ( -2.973 -0.622 -3.404) 4.562 4.170 ( -0.902 3.500 8.283) 9.037 4.259 ( 3.297 -4.903 4.940) 7.701 4.314 ( -0.263 -0.671 -3.634) 3.705 4.361 ( 1.816 -5.554 -2.908) 6.527 4.702 ( -1.480 5.348 7.700) 9.491 4.799 ( -2.269 -4.587 1.053) 5.224 4.946 ( 2.234 14.029 -1.950) 14.339 4.990 ( -1.535 9.989 -3.598) 10.728 5.119 ( -2.828 6.336 6.205) 9.309 5.208 ( -0.860 0.766 1.375) 1.794 5.325 ( -1.606 2.251 3.555) 4.504 5.345 ( -2.621 -4.165 2.556) 5.545 5.505 ( 2.337 1.820 0.431) 2.993 5.573 ( 0.154 0.297 -2.084) 2.111 5.675 ( 3.406 -1.613 -7.463) 8.361 5.708 ( 4.709 -2.841 -6.231) 8.311 6.176 ( 8.027 7.756 2.800) 11.508 6.252 ( -8.434 5.092 -3.672) 10.514 6.381 ( -2.191 -4.008 1.775) 4.900 6.400 ( 4.795 -9.184 0.630) 10.379 6.478 ( 2.075 2.903 0.900) 3.680 6.506 ( -3.536 -0.484 -1.082) 3.729 6.634 ( 0.031 -0.618 3.987) 4.035 6.695 ( -5.474 -6.244 -0.592) 8.325 6.939 ( -0.645 0.607 -1.659) 1.880 6.952 ( 0.888 -0.314 -1.259) 1.573 7.042 ( -0.517 0.107 -0.820) 0.976 7.059 ( 2.006 -1.842 -2.807) 3.911 7.337 ( 1.315 -0.717 -0.593) 1.611 7.352 ( 3.888 -1.970 -1.678) 4.670 7.577 ( 3.897 1.393 -1.744) 4.491 7.589 ( -6.308 0.037 -2.623) 6.832 10.242 ( 1.063 3.089 1.612) 3.642 10.271 ( -1.103 0.511 -1.142) 1.668 10.540 ( -0.141 1.281 3.260) 3.505 10.565 ( -1.911 -1.304 1.032) 2.533 11.218 ( -0.186 8.739 5.218) 10.181 11.285 ( 0.452 4.807 -0.066) 4.829 11.639 ( 1.686 -2.632 -0.119) 3.127 11.713 ( -0.078 -7.120 -6.096) 9.373 13.928 ( -0.816 2.091 2.784) 3.576 13.978 ( 0.107 -3.013 -1.524) 3.379 14.252 ( 0.577 -0.068 -0.744) 0.944 14.275 ( 1.568 -2.059 -2.623) 3.685 14.362 ( -0.872 1.034 0.928) 1.640 14.396 ( 0.338 0.701 -1.791) 1.952 14.528 ( 0.779 -7.150 1.623) 7.373 14.581 ( -2.862 -8.848 -3.202) 9.835 15.083 ( -0.462 1.481 2.054) 2.574 15.101 ( -0.434 -0.072 0.672) 0.803 15.230 ( 0.307 -0.503 1.069) 1.221 15.247 ( 1.224 -1.924 -0.360) 2.308 24.378 ( -0.496 0.537 0.933) 1.185 24.386 ( 0.149 -0.184 0.247) 0.342 24.488 ( -0.186 0.842 0.490) 0.992 24.503 ( 0.322 -0.528 -0.818) 1.025 25.321 ( -2.478 1.628 3.177) 4.345 25.354 ( -0.145 -1.502 0.506) 1.592 25.658 ( 0.746 0.796 -0.596) 1.243 25.689 ( 1.801 -2.185 -3.137) 4.226 27.059 ( 2.396 6.140 3.844) 7.630 27.128 ( -2.766 1.394 -2.403) 3.921 27.419 ( 3.975 -1.526 3.338) 5.410 27.503 ( -2.793 -7.691 -4.405) 9.293 28.360 ( -3.058 4.236 1.613) 5.468 28.364 ( -1.119 4.062 1.759) 4.566 28.670 ( 0.941 4.244 1.537) 4.611 28.747 ( 2.806 -3.138 -5.255) 6.734 ======================= Grid point 183 (101/104) ======================= q-point: (-0.40 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( -5.897 9.111 -0.808) 10.883 2.207 ( 1.610 1.071 4.498) 4.896 2.257 ( -5.290 -0.272 3.021) 6.098 2.274 ( -1.227 -0.369 -1.123) 1.704 2.438 ( 2.558 4.030 -4.911) 6.848 2.505 ( 3.420 -1.696 -3.837) 5.413 2.646 ( 6.585 4.200 2.035) 8.071 2.742 ( 9.117 -5.019 2.739) 10.761 3.153 ( 3.393 3.214 3.922) 6.101 3.214 ( 5.198 -2.510 3.651) 6.830 3.454 ( -2.698 6.212 -5.480) 8.712 3.494 ( -1.968 1.214 -2.962) 3.758 3.705 ( -4.153 6.984 -2.299) 8.444 3.766 ( -0.343 2.478 -0.306) 2.520 3.877 ( -0.658 1.408 4.949) 5.187 3.878 ( -0.339 0.043 3.297) 3.315 4.146 ( -6.418 2.212 0.218) 6.792 4.252 ( -4.524 -7.383 -2.846) 9.114 4.323 ( 3.045 -0.404 -0.098) 3.073 4.342 ( 0.073 -1.984 -1.144) 2.292 4.750 ( -1.669 5.409 6.305) 8.473 4.817 ( 1.666 1.807 -0.783) 2.579 4.890 ( -2.310 10.475 -0.204) 10.729 4.999 ( -1.743 6.706 -0.073) 6.929 5.130 ( -2.880 5.279 5.026) 7.837 5.200 ( -0.184 0.281 -1.068) 1.120 5.243 ( -2.585 6.856 2.838) 7.857 5.400 ( -0.294 -7.903 5.235) 9.484 5.481 ( -2.887 -2.392 -2.129) 4.312 5.525 ( -3.575 -2.152 0.027) 4.173 5.725 ( 9.290 2.970 -7.658) 12.401 5.764 ( 6.592 0.770 -7.897) 10.316 6.006 ( -13.053 6.098 -2.474) 14.618 6.188 ( -12.547 -8.211 -0.011) 14.995 6.327 ( -8.251 1.754 -0.755) 8.469 6.336 ( -1.106 0.633 1.959) 2.337 6.436 ( -4.000 4.345 0.443) 5.922 6.547 ( 0.543 -3.638 1.533) 3.985 6.598 ( -4.252 -0.971 0.365) 4.377 6.680 ( -2.237 -9.226 6.615) 11.570 6.906 ( -2.021 1.873 -1.039) 2.945 6.924 ( -2.269 0.400 -0.557) 2.371 7.043 ( 1.917 3.614 -0.139) 4.093 7.102 ( 2.345 -2.696 -0.300) 3.586 7.215 ( -6.928 1.644 -3.322) 7.857 7.296 ( -3.443 -4.777 -3.585) 6.895 7.617 ( 7.572 8.471 0.087) 11.362 7.795 ( 15.771 -8.238 0.735) 17.808 10.229 ( -0.971 3.861 -0.203) 3.986 10.292 ( 1.961 -1.939 0.784) 2.867 10.599 ( 6.051 4.440 1.470) 7.648 10.667 ( 8.514 -1.839 2.228) 8.991 11.220 ( -3.867 7.519 2.587) 8.842 11.233 ( -4.533 5.935 -2.629) 7.917 11.614 ( -4.736 -4.253 -4.970) 8.076 11.643 ( -2.263 -6.729 1.528) 7.262 13.936 ( -1.173 0.293 2.543) 2.816 13.966 ( 0.139 -1.406 -1.212) 1.861 14.227 ( -1.553 -0.521 -0.801) 1.823 14.264 ( -0.422 -3.274 -3.519) 4.825 14.360 ( 0.029 3.228 2.312) 3.970 14.402 ( 0.957 -1.003 -0.780) 1.591 14.538 ( 1.181 -3.934 -0.027) 4.107 14.619 ( 4.844 -10.139 2.968) 11.622 15.040 ( -4.103 2.404 0.590) 4.792 15.100 ( -2.050 -3.115 1.024) 3.867 15.224 ( -0.309 1.661 -0.991) 1.959 15.264 ( 0.824 -1.903 -1.302) 2.449 24.383 ( 0.268 0.885 0.607) 1.106 24.399 ( 1.003 -0.632 0.222) 1.206 24.489 ( 0.009 1.080 0.169) 1.093 24.506 ( 0.780 -0.553 -0.567) 1.112 25.311 ( -2.002 2.193 3.566) 4.640 25.358 ( -0.232 -2.346 1.258) 2.672 25.687 ( 3.327 0.674 -1.117) 3.574 25.715 ( 4.329 -1.965 -3.523) 5.917 27.010 ( -7.235 5.894 -2.828) 9.751 27.089 ( -3.420 0.197 3.176) 4.672 27.367 ( -6.915 0.861 -4.194) 8.133 27.490 ( -0.421 -8.950 2.625) 9.337 28.279 ( -4.936 6.365 2.217) 8.355 28.359 ( -3.198 -1.365 3.507) 4.939 28.739 ( 7.617 7.581 -1.891) 10.912 28.850 ( 11.071 -2.946 -3.326) 11.929 ======================= Grid point 184 (102/104) ======================= q-point: (-0.30 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.031 ( -2.096 13.333 2.618) 13.748 2.210 ( -0.854 2.421 -0.982) 2.748 2.253 ( -1.177 6.444 1.104) 6.643 2.269 ( -1.563 0.251 6.581) 6.769 2.424 ( 3.528 -3.130 -3.144) 5.669 2.485 ( -3.062 -5.687 -0.731) 6.500 2.814 ( 7.066 5.580 0.958) 9.054 2.934 ( 6.414 -5.707 0.111) 8.586 3.172 ( -0.645 6.675 -5.564) 8.714 3.298 ( 2.193 -5.639 -1.688) 6.282 3.393 ( 2.056 10.145 -1.899) 10.524 3.542 ( 6.926 -2.441 -1.167) 7.436 3.647 ( 1.076 5.949 2.876) 6.695 3.735 ( -2.275 -0.376 -0.278) 2.323 3.826 ( -6.105 2.916 0.259) 6.770 3.896 ( -2.581 -0.620 4.838) 5.519 4.024 ( -5.041 3.405 -0.603) 6.113 4.156 ( -2.856 -6.952 -2.118) 7.808 4.365 ( 1.154 0.525 3.004) 3.261 4.403 ( 0.812 -2.985 6.441) 7.145 4.688 ( -11.224 13.348 2.545) 17.625 4.762 ( -2.900 7.022 -4.620) 8.891 4.867 ( -1.413 3.714 -2.030) 4.462 4.893 ( -7.301 5.535 2.096) 9.398 5.134 ( -3.106 1.741 3.160) 4.760 5.148 ( -2.179 1.108 -1.708) 2.982 5.327 ( 4.789 2.619 1.741) 5.730 5.382 ( -1.811 -1.778 -4.950) 5.563 5.420 ( -4.509 -3.207 0.140) 5.535 5.474 ( -0.973 -3.848 1.690) 4.314 5.722 ( -2.879 4.486 -3.375) 6.309 5.777 ( 2.660 2.199 -7.280) 8.057 5.863 ( -4.165 1.518 0.870) 4.517 5.953 ( -10.450 -9.228 0.006) 13.942 6.191 ( -5.423 2.363 0.952) 5.991 6.233 ( -6.983 -1.706 -1.384) 7.320 6.384 ( -5.326 4.344 0.463) 6.889 6.455 ( -8.632 -2.091 -1.416) 8.994 6.579 ( -2.943 -2.461 3.538) 5.219 6.638 ( -6.776 -6.331 2.480) 9.599 6.821 ( -5.942 2.875 -1.863) 6.859 6.856 ( -3.433 -0.813 -4.038) 5.362 7.064 ( -0.759 8.296 1.176) 8.413 7.178 ( 5.359 -0.091 4.284) 6.862 7.191 ( 2.968 -3.053 3.752) 5.676 7.241 ( 1.299 -5.703 -0.348) 5.859 7.759 ( 9.077 13.827 -2.680) 16.757 8.071 ( 15.379 -15.351 -2.420) 21.864 10.237 ( 1.630 5.826 1.003) 6.132 10.350 ( 3.273 -4.923 1.840) 6.192 10.759 ( 9.389 7.759 1.331) 12.253 10.833 ( 6.003 0.521 1.858) 6.305 11.077 ( -8.336 5.194 -3.999) 10.604 11.165 ( -2.937 -1.265 -0.422) 3.225 11.477 ( -5.935 1.247 -2.033) 6.397 11.591 ( -4.608 -8.009 0.776) 9.273 13.935 ( -0.457 0.205 0.886) 1.017 13.964 ( 0.140 -1.510 0.291) 1.545 14.195 ( -1.530 -2.209 -0.418) 2.719 14.220 ( -0.495 -3.340 -2.230) 4.046 14.397 ( 1.476 0.423 1.452) 2.113 14.409 ( 0.391 -1.090 0.038) 1.159 14.593 ( 2.949 2.174 2.320) 4.337 14.727 ( 2.909 -9.285 3.331) 10.285 14.969 ( -3.539 2.375 -0.036) 4.262 15.050 ( -3.520 -5.303 0.142) 6.366 15.207 ( -0.164 2.676 -1.932) 3.304 15.252 ( 0.035 -1.503 -2.571) 2.979 24.398 ( 0.992 1.237 0.254) 1.605 24.422 ( 1.291 -1.033 0.120) 1.658 24.495 ( 0.743 1.465 -0.288) 1.668 24.517 ( 0.894 -0.673 -0.475) 1.216 25.323 ( -0.732 2.303 4.420) 5.038 25.374 ( 0.466 -2.722 2.138) 3.493 25.750 ( 4.715 0.350 -0.691) 4.778 25.770 ( 5.656 -1.593 -3.654) 6.919 26.834 ( -9.529 5.747 -2.553) 11.417 26.970 ( -11.037 -7.488 -1.674) 13.442 27.207 ( -8.648 10.466 0.400) 13.582 27.440 ( -7.625 -11.895 1.610) 14.220 28.253 ( -0.334 6.483 2.542) 6.971 28.354 ( -0.508 -3.536 3.191) 4.790 28.885 ( 10.329 10.856 -2.249) 15.152 29.032 ( 12.721 -3.267 -3.930) 13.709 ======================= Grid point 185 (103/104) ======================= q-point: (-0.20 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 176 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.039 ( -3.993 17.739 8.100) 19.905 2.180 ( -2.994 11.378 4.742) 12.685 2.243 ( -3.231 7.953 4.177) 9.546 2.348 ( 5.455 -6.444 1.381) 8.555 2.387 ( -8.012 -4.658 0.523) 9.282 2.479 ( 2.421 -8.971 0.049) 9.292 2.838 ( -2.791 0.947 -3.983) 4.954 2.872 ( -0.954 -0.449 -6.976) 7.055 3.246 ( 8.035 3.145 -1.462) 8.752 3.337 ( 5.261 -5.673 -5.103) 9.268 3.379 ( -1.523 11.846 -0.420) 11.951 3.559 ( -1.209 -2.296 0.245) 2.607 3.721 ( -1.912 2.552 0.544) 3.235 3.763 ( 2.834 -1.657 -0.589) 3.335 3.794 ( 3.706 5.249 5.821) 8.670 3.929 ( -1.435 -2.180 5.278) 5.888 3.960 ( -2.045 5.406 3.000) 6.512 4.068 ( -4.977 -5.239 -0.313) 7.233 4.354 ( -8.271 3.681 2.376) 9.360 4.422 ( -4.273 1.742 1.525) 4.859 4.533 ( -5.276 9.565 6.632) 12.779 4.689 ( -0.272 3.553 -1.224) 3.768 4.806 ( -2.938 0.892 -2.156) 3.752 4.847 ( 0.208 4.054 -0.287) 4.069 5.001 ( -8.923 3.905 -4.464) 10.714 5.079 ( -7.081 -1.205 -0.454) 7.197 5.272 ( -1.777 0.513 -0.538) 1.927 5.328 ( -1.755 -0.853 -1.241) 2.313 5.448 ( 2.210 2.733 -1.709) 3.908 5.504 ( 4.498 -2.922 -2.471) 5.906 5.689 ( -1.745 0.960 3.045) 3.638 5.713 ( -2.509 3.283 -3.425) 5.366 5.792 ( -2.662 1.679 1.613) 3.536 5.833 ( -4.967 -7.729 1.891) 9.380 6.133 ( -3.162 1.284 -3.451) 4.854 6.158 ( -0.301 0.567 -0.757) 0.992 6.236 ( -8.317 -0.484 -5.776) 10.138 6.275 ( -8.554 -1.476 -0.165) 8.682 6.517 ( -8.002 -2.355 2.904) 8.832 6.520 ( -8.989 -3.184 5.770) 11.146 6.665 ( -8.542 3.821 -4.187) 10.252 6.723 ( -5.927 -2.016 -6.599) 9.096 7.112 ( 4.507 8.589 1.244) 9.779 7.242 ( 3.944 -1.974 1.434) 4.638 7.355 ( 6.452 -1.748 6.802) 9.537 7.386 ( 6.533 -6.058 9.721) 13.186 7.874 ( 8.636 17.482 -6.533) 20.564 8.270 ( 12.372 -19.932 -8.287) 24.880 10.298 ( 2.827 6.895 2.650) 7.909 10.428 ( 2.639 -5.478 2.408) 6.540 10.856 ( -3.266 4.959 -0.011) 5.938 10.895 ( -7.068 6.976 -1.583) 10.056 10.921 ( 4.984 4.243 1.740) 6.773 11.131 ( -3.081 -10.552 2.746) 11.331 11.421 ( 1.701 3.650 -0.933) 4.134 11.511 ( -2.086 -5.604 -3.423) 6.890 13.941 ( 0.547 0.724 0.292) 0.953 13.976 ( 0.573 -1.838 0.963) 2.153 14.170 ( -0.265 -0.938 -1.128) 1.491 14.210 ( 0.039 -3.914 -0.031) 3.914 14.407 ( 0.425 -0.581 -0.937) 1.182 14.437 ( 1.001 -2.376 1.401) 2.934 14.645 ( -0.270 3.570 1.609) 3.925 14.743 ( -3.453 -4.962 1.188) 6.160 14.943 ( 0.126 0.568 1.341) 1.462 15.012 ( -0.809 -5.525 1.018) 5.676 15.181 ( -0.221 1.885 -2.872) 3.443 15.222 ( 0.244 -1.480 -4.243) 4.500 24.419 ( 1.219 1.309 -0.151) 1.795 24.441 ( 0.739 -0.716 -0.062) 1.031 24.510 ( 1.526 1.122 -0.756) 2.040 24.528 ( 0.945 -0.506 -0.692) 1.276 25.366 ( 0.424 2.255 5.249) 5.729 25.416 ( 1.687 -2.579 2.594) 4.029 25.842 ( 5.455 -0.663 0.861) 5.563 25.847 ( 6.076 -1.055 -1.854) 6.439 26.646 ( -8.774 2.868 -1.591) 9.367 26.717 ( -13.175 -4.195 -2.976) 14.144 27.050 ( -10.933 9.332 1.826) 14.490 27.267 ( -12.208 -11.726 0.148) 16.928 28.303 ( 2.822 5.657 2.452) 6.780 28.394 ( 1.809 -3.388 2.235) 4.444 29.043 ( 9.255 12.272 -1.850) 15.481 29.207 ( 11.832 -3.429 -6.186) 13.784 ======================= Grid point 186 (104/104) ======================= q-point: (-0.10 0.43 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.01e-04 2.01e-04 2.01e-04 2.01e-04 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 6.10e-05 Number of triplets: 175 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.036 ( -4.558 18.043 8.697) 20.542 2.155 ( -7.773 14.865 7.605) 18.418 2.207 ( -4.934 4.884 4.261) 8.145 2.262 ( -3.823 0.906 0.651) 3.982 2.455 ( 3.704 -8.041 1.842) 9.043 2.484 ( 0.251 -9.534 -0.545) 9.553 2.783 ( 1.942 -1.094 -2.849) 3.617 2.865 ( 4.185 -5.225 -5.326) 8.555 3.283 ( -1.724 6.336 -3.838) 7.606 3.307 ( -0.888 4.277 0.469) 4.393 3.433 ( 3.129 1.118 1.055) 3.487 3.563 ( 0.053 -5.475 0.944) 5.556 3.748 ( 2.547 6.278 5.280) 8.590 3.806 ( 0.578 -2.416 -2.721) 3.684 3.837 ( -1.372 0.205 3.421) 3.691 3.849 ( -6.535 -1.166 2.556) 7.113 3.981 ( -0.426 5.675 2.620) 6.265 4.056 ( -0.205 0.547 2.892) 2.950 4.198 ( -6.988 12.376 -0.351) 14.217 4.397 ( 2.755 4.881 -2.837) 6.282 4.488 ( -6.491 -2.666 0.082) 7.018 4.634 ( -8.483 -6.871 -5.395) 12.177 4.760 ( 1.535 6.105 5.873) 8.610 4.859 ( -1.641 -1.742 4.800) 5.364 4.891 ( 1.205 7.963 -2.386) 8.400 4.980 ( -0.852 1.889 -2.011) 2.888 5.272 ( 1.783 2.002 -0.057) 2.681 5.343 ( 1.288 -2.603 0.245) 2.915 5.412 ( -1.528 8.776 -4.362) 9.919 5.528 ( 2.589 -4.410 -4.000) 6.492 5.671 ( -1.771 2.640 2.253) 3.896 5.693 ( -1.245 0.033 2.173) 2.505 5.803 ( 0.147 0.921 4.412) 4.510 5.852 ( 4.004 -2.191 2.822) 5.366 6.002 ( -5.719 -0.274 -4.307) 7.165 6.034 ( -6.866 -2.071 -4.069) 8.246 6.130 ( -2.393 1.681 -1.687) 3.376 6.186 ( -2.970 -3.270 -1.095) 4.551 6.394 ( -11.050 0.726 6.091) 12.638 6.417 ( -8.102 -1.698 3.979) 9.184 6.482 ( -3.462 1.546 -6.733) 7.727 6.554 ( -3.584 -4.252 -8.985) 10.567 7.217 ( 5.351 9.187 1.377) 10.720 7.337 ( 3.920 -0.808 1.153) 4.165 7.489 ( 1.967 2.087 6.074) 6.717 7.616 ( 7.068 -8.900 11.153) 15.924 7.937 ( 5.618 16.115 -7.279) 18.553 8.340 ( 6.384 -21.032 -13.147) 25.611 10.365 ( 1.474 5.453 2.834) 6.320 10.462 ( -0.830 -3.313 1.206) 3.622 10.790 ( -3.117 2.398 0.183) 3.937 10.798 ( -1.880 2.180 -0.546) 2.931 10.979 ( -1.232 5.129 4.598) 6.998 11.115 ( -3.546 -7.969 6.853) 11.092 11.428 ( 0.105 3.167 -1.899) 3.694 11.515 ( 6.376 -4.398 -6.670) 10.222 13.959 ( 0.719 1.512 0.897) 1.899 13.998 ( 0.780 -1.529 0.754) 1.875 14.167 ( 0.984 -0.027 -0.835) 1.291 14.209 ( -0.031 -3.251 -0.520) 3.293 14.411 ( 0.945 0.475 -0.376) 1.122 14.461 ( 0.116 -2.811 1.139) 3.035 14.610 ( -2.574 1.143 -1.200) 3.061 14.670 ( -4.370 -3.669 -0.308) 5.714 14.975 ( 0.284 0.854 3.187) 3.312 15.027 ( 0.228 -4.203 2.376) 4.834 15.145 ( -0.251 0.793 -4.137) 4.220 15.183 ( 0.583 -2.293 -5.560) 6.043 24.435 ( 0.637 0.996 -0.185) 1.197 24.446 ( 0.007 -0.044 -0.120) 0.128 24.528 ( 1.124 0.534 -0.847) 1.506 24.537 ( 1.078 -0.208 -1.276) 1.683 25.422 ( -0.123 2.471 5.322) 5.869 25.469 ( 1.461 -2.037 1.969) 3.188 25.934 ( 5.596 -0.394 -1.614) 5.837 25.950 ( 2.534 -2.633 3.780) 5.257 26.525 ( -3.674 0.727 -0.065) 3.746 26.540 ( -2.166 -0.783 1.307) 2.648 26.855 ( -11.503 6.858 -0.446) 13.400 27.031 ( -12.781 -10.502 -2.586) 16.743 28.377 ( 2.459 4.339 2.428) 5.547 28.441 ( 1.242 -2.044 1.215) 2.682 29.164 ( 5.564 11.892 -0.716) 13.148 29.316 ( 7.650 -2.552 -8.268) 11.550 =================== 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 3/29400 10.0 1379.108 1725.912 1434.179 0.000 -41.530 0.000 3/29400 20.0 149.123 212.968 155.326 0.000 -1.791 0.000 3/29400 30.0 41.222 63.612 42.641 0.000 -1.320 0.000 3/29400 40.0 18.834 29.807 19.281 0.000 -0.769 0.000 3/29400 50.0 11.190 17.871 11.356 0.000 -0.512 0.000 3/29400 60.0 7.750 12.395 7.801 0.000 -0.381 0.000 3/29400 70.0 5.903 9.412 5.894 0.000 -0.304 0.000 3/29400 80.0 4.783 7.581 4.738 0.000 -0.253 0.000 3/29400 90.0 4.039 6.358 3.972 0.000 -0.217 0.000 3/29400 100.0 3.510 5.487 3.430 0.000 -0.190 0.000 3/29400 110.0 3.115 4.838 3.026 0.000 -0.169 0.000 3/29400 120.0 2.807 4.335 2.714 0.000 -0.152 0.000 3/29400 130.0 2.561 3.935 2.465 0.000 -0.138 0.000 3/29400 140.0 2.359 3.608 2.261 0.000 -0.127 0.000 3/29400 150.0 2.189 3.336 2.091 0.000 -0.117 0.000 3/29400 160.0 2.045 3.107 1.948 0.000 -0.109 0.000 3/29400 170.0 1.922 2.910 1.824 0.000 -0.101 0.000 3/29400 180.0 1.814 2.740 1.717 0.000 -0.095 0.000 3/29400 190.0 1.719 2.591 1.623 0.000 -0.089 0.000 3/29400 200.0 1.635 2.460 1.540 0.000 -0.084 0.000 3/29400 210.0 1.561 2.343 1.466 0.000 -0.080 0.000 3/29400 220.0 1.494 2.238 1.399 0.000 -0.076 0.000 3/29400 230.0 1.433 2.144 1.339 0.000 -0.072 0.000 3/29400 240.0 1.378 2.058 1.285 0.000 -0.069 0.000 3/29400 250.0 1.328 1.980 1.235 0.000 -0.066 0.000 3/29400 260.0 1.283 1.909 1.189 0.000 -0.064 0.000 3/29400 270.0 1.240 1.844 1.147 0.000 -0.061 0.000 3/29400 280.0 1.201 1.783 1.109 0.000 -0.059 0.000 3/29400 290.0 1.165 1.727 1.073 0.000 -0.057 0.000 3/29400 300.0 1.131 1.675 1.039 0.000 -0.055 0.000 3/29400 310.0 1.100 1.626 1.008 0.000 -0.053 0.000 3/29400 320.0 1.070 1.581 0.979 0.000 -0.052 0.000 3/29400 330.0 1.043 1.538 0.952 0.000 -0.050 0.000 3/29400 340.0 1.017 1.498 0.926 0.000 -0.049 0.000 3/29400 350.0 0.992 1.460 0.902 0.000 -0.047 0.000 3/29400 360.0 0.969 1.424 0.879 0.000 -0.046 0.000 3/29400 370.0 0.947 1.390 0.857 0.000 -0.045 0.000 3/29400 380.0 0.926 1.358 0.837 0.000 -0.044 0.000 3/29400 390.0 0.906 1.327 0.817 0.000 -0.043 0.000 3/29400 400.0 0.886 1.298 0.798 0.000 -0.041 0.000 3/29400 410.0 0.868 1.270 0.781 0.000 -0.041 0.000 3/29400 420.0 0.851 1.244 0.764 0.000 -0.040 0.000 3/29400 430.0 0.834 1.218 0.748 0.000 -0.039 0.000 3/29400 440.0 0.818 1.194 0.732 0.000 -0.038 0.000 3/29400 450.0 0.803 1.170 0.717 0.000 -0.037 0.000 3/29400 460.0 0.788 1.148 0.703 0.000 -0.036 0.000 3/29400 470.0 0.774 1.126 0.689 0.000 -0.036 0.000 3/29400 480.0 0.760 1.106 0.676 0.000 -0.035 0.000 3/29400 490.0 0.747 1.086 0.664 0.000 -0.034 0.000 3/29400 500.0 0.734 1.067 0.652 0.000 -0.034 0.000 3/29400 510.0 0.722 1.048 0.640 0.000 -0.033 0.000 3/29400 520.0 0.710 1.030 0.629 0.000 -0.032 0.000 3/29400 530.0 0.698 1.013 0.618 0.000 -0.032 0.000 3/29400 540.0 0.687 0.996 0.607 0.000 -0.031 0.000 3/29400 550.0 0.676 0.980 0.597 0.000 -0.031 0.000 3/29400 560.0 0.666 0.964 0.587 0.000 -0.030 0.000 3/29400 570.0 0.656 0.949 0.578 0.000 -0.030 0.000 3/29400 580.0 0.646 0.935 0.569 0.000 -0.029 0.000 3/29400 590.0 0.636 0.920 0.560 0.000 -0.029 0.000 3/29400 600.0 0.627 0.907 0.551 0.000 -0.028 0.000 3/29400 610.0 0.618 0.893 0.543 0.000 -0.028 0.000 3/29400 620.0 0.609 0.880 0.535 0.000 -0.027 0.000 3/29400 630.0 0.601 0.868 0.527 0.000 -0.027 0.000 3/29400 640.0 0.592 0.855 0.519 0.000 -0.027 0.000 3/29400 650.0 0.584 0.843 0.512 0.000 -0.026 0.000 3/29400 660.0 0.576 0.832 0.505 0.000 -0.026 0.000 3/29400 670.0 0.569 0.820 0.498 0.000 -0.026 0.000 3/29400 680.0 0.561 0.809 0.491 0.000 -0.025 0.000 3/29400 690.0 0.554 0.799 0.484 0.000 -0.025 0.000 3/29400 700.0 0.547 0.788 0.478 0.000 -0.024 0.000 3/29400 710.0 0.540 0.778 0.471 0.000 -0.024 0.000 3/29400 720.0 0.533 0.768 0.465 0.000 -0.024 0.000 3/29400 730.0 0.527 0.759 0.459 0.000 -0.024 0.000 3/29400 740.0 0.520 0.749 0.453 0.000 -0.023 0.000 3/29400 750.0 0.514 0.740 0.448 0.000 -0.023 0.000 3/29400 760.0 0.508 0.731 0.442 0.000 -0.023 0.000 3/29400 770.0 0.502 0.722 0.437 0.000 -0.022 0.000 3/29400 780.0 0.496 0.714 0.432 0.000 -0.022 0.000 3/29400 790.0 0.490 0.705 0.426 0.000 -0.022 0.000 3/29400 800.0 0.485 0.697 0.421 0.000 -0.022 0.000 3/29400 810.0 0.479 0.689 0.416 0.000 -0.021 0.000 3/29400 820.0 0.474 0.681 0.412 0.000 -0.021 0.000 3/29400 830.0 0.469 0.674 0.407 0.000 -0.021 0.000 3/29400 840.0 0.464 0.666 0.402 0.000 -0.021 0.000 3/29400 850.0 0.459 0.659 0.398 0.000 -0.020 0.000 3/29400 860.0 0.454 0.652 0.393 0.000 -0.020 0.000 3/29400 870.0 0.449 0.645 0.389 0.000 -0.020 0.000 3/29400 880.0 0.444 0.638 0.385 0.000 -0.020 0.000 3/29400 890.0 0.440 0.631 0.381 0.000 -0.019 0.000 3/29400 900.0 0.435 0.625 0.377 0.000 -0.019 0.000 3/29400 910.0 0.431 0.618 0.373 0.000 -0.019 0.000 3/29400 920.0 0.427 0.612 0.369 0.000 -0.019 0.000 3/29400 930.0 0.422 0.606 0.365 0.000 -0.019 0.000 3/29400 940.0 0.418 0.600 0.362 0.000 -0.018 0.000 3/29400 950.0 0.414 0.594 0.358 0.000 -0.018 0.000 3/29400 960.0 0.410 0.588 0.354 0.000 -0.018 0.000 3/29400 970.0 0.406 0.582 0.351 0.000 -0.018 0.000 3/29400 980.0 0.402 0.576 0.347 0.000 -0.018 0.000 3/29400 990.0 0.398 0.571 0.344 0.000 -0.018 0.000 3/29400 1000.0 0.395 0.566 0.341 0.000 -0.017 0.000 3/29400 Thermal conductivity related properties were written into "kappa-m1075.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 04:45:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|