----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 21:44:48]------------------------- 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: [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cc (9) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.353613645000208 -2.926412655000000 0.000000000000000 b 6.353613645000208 2.926412655000000 0.000000000000000 c -2.845340107219632 0.000000000000000 8.057861510037030 Atomic positions (fractional): *1 Li 0.08356891390287 0.60342201814337 0.41932015870061 6.941 *2 Li 0.78453097049679 0.21273142562160 0.27204883251001 6.941 *3 Li 0.43756490477404 0.91216433732964 0.07947768422770 6.941 *4 Li 0.08921694252399 0.55821780892134 0.90922987638263 6.941 5 Li 0.60342201814337 0.08356891390287 0.91932015870061 6.941 *6 Li 0.40262405798954 0.91711979370983 0.58057171226593 6.941 7 Li 0.21273142562160 0.78453097049679 0.77204883251001 6.941 8 Li 0.91216433732964 0.43756490477404 0.57947768422770 6.941 9 Li 0.55821780892134 0.08921694252399 0.40922987638263 6.941 10 Li 0.91711979370983 0.40262405798954 0.08057171226593 6.941 *11 Si 0.67786064999986 0.32195029398470 0.69736208493442 28.085 12 Si 0.32195029398470 0.67786064999986 0.19736208493442 28.085 *13 P 0.03498439078765 0.96573608343730 0.03750334603912 30.974 *14 P 0.35365049744170 0.32953172254200 0.67223626515997 30.974 15 P 0.96573608343730 0.03498439078765 0.53750334603912 30.974 *16 P 0.64788602120984 0.66703054718398 0.32624447977962 30.974 17 P 0.32953172254200 0.35365049744170 0.17223626515997 30.974 18 P 0.66703054718398 0.64788602120984 0.82624447977962 30.974 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.707227290000416 0.000000000000000 0.000000000000000 b 0.000000000000000 5.852825310000000 0.000000000000000 c -2.845340107219632 0.000000000000000 8.057861510037030 Atomic positions (fractional): *1 Li 0.34349546602312 0.25992655212025 0.41932015870061 6.941 > 1 *2 Li 0.49863119805920 0.71410022756241 0.27204883251001 6.941 > 2 *3 Li 0.17486462105184 0.73729971627780 0.07947768422770 6.941 > 3 *4 Li 0.32371737572267 0.23450043319867 0.90922987638263 6.941 > 4 5 Li 0.34349546602312 0.74007344787975 0.91932015870061 6.941 > 5 *6 Li 0.15987192584968 0.75724786786015 0.58057171226593 6.941 > 6 7 Li 0.49863119805920 0.28589977243759 0.77204883251001 6.941 > 7 8 Li 0.17486462105184 0.26270028372220 0.57947768422770 6.941 > 8 9 Li 0.32371737572267 0.76549956680133 0.40922987638263 6.941 > 9 10 Li 0.15987192584968 0.24275213213985 0.08057171226593 6.941 > 10 11 Li 0.84349546602312 0.75992655212025 0.41932015870061 6.941 > 1 12 Li 0.99863119805920 0.21410022756241 0.27204883251001 6.941 > 2 13 Li 0.67486462105184 0.23729971627780 0.07947768422770 6.941 > 3 14 Li 0.82371737572267 0.73450043319867 0.90922987638263 6.941 > 4 15 Li 0.84349546602312 0.24007344787975 0.91932015870061 6.941 > 5 16 Li 0.65987192584968 0.25724786786015 0.58057171226593 6.941 > 6 17 Li 0.99863119805920 0.78589977243759 0.77204883251001 6.941 > 7 18 Li 0.67486462105184 0.76270028372220 0.57947768422770 6.941 > 8 19 Li 0.82371737572267 0.26549956680133 0.40922987638263 6.941 > 9 20 Li 0.65987192584968 0.74275213213985 0.08057171226593 6.941 > 10 *21 Si 0.49990547199228 0.82204482199242 0.69736208493442 28.085 > 11 22 Si 0.49990547199228 0.17795517800758 0.19736208493442 28.085 > 12 23 Si 0.99990547199228 0.32204482199242 0.69736208493442 28.085 > 11 24 Si 0.99990547199228 0.67795517800758 0.19736208493442 28.085 > 12 *25 P 0.00036023711247 0.96537584632482 0.03750334603912 30.974 > 13 *26 P 0.34159110999185 0.98794061255015 0.67223626515997 30.974 > 14 27 P 0.00036023711247 0.03462415367517 0.53750334603912 30.974 > 15 *28 P 0.15745828419691 0.50957226298707 0.32624447977962 30.974 > 16 29 P 0.34159110999185 0.01205938744985 0.17223626515997 30.974 > 17 30 P 0.15745828419691 0.49042773701293 0.82624447977962 30.974 > 18 31 P 0.50036023711247 0.46537584632482 0.03750334603912 30.974 > 13 32 P 0.84159110999185 0.48794061255015 0.67223626515997 30.974 > 14 33 P 0.50036023711247 0.53462415367518 0.53750334603912 30.974 > 15 34 P 0.65745828419691 0.00957226298707 0.32624447977962 30.974 > 16 35 P 0.84159110999185 0.51205938744985 0.17223626515997 30.974 > 17 36 P 0.65745828419691 0.99042773701293 0.82624447977962 30.974 > 18 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.707227290000416 0.000000000000000 0.000000000000000 b 0.000000000000000 11.705650620000000 0.000000000000000 c -5.690680214439264 0.000000000000000 16.115723020074061 Atomic positions (fractional): *1 Li 0.34349546602312 0.12996327606013 0.20966007935030 6.941 > 1 2 Li 0.34349546602312 0.62996327606013 0.20966007935030 6.941 > 1 3 Li 0.34349546602312 0.12996327606013 0.70966007935030 6.941 > 1 4 Li 0.34349546602312 0.62996327606013 0.70966007935030 6.941 > 1 *5 Li 0.49863119805920 0.35705011378120 0.13602441625501 6.941 > 2 6 Li 0.49863119805920 0.85705011378120 0.13602441625501 6.941 > 2 7 Li 0.49863119805920 0.35705011378120 0.63602441625501 6.941 > 2 8 Li 0.49863119805920 0.85705011378120 0.63602441625501 6.941 > 2 *9 Li 0.17486462105184 0.36864985813890 0.03973884211385 6.941 > 3 10 Li 0.17486462105184 0.86864985813890 0.03973884211385 6.941 > 3 11 Li 0.17486462105184 0.36864985813890 0.53973884211385 6.941 > 3 12 Li 0.17486462105184 0.86864985813890 0.53973884211385 6.941 > 3 *13 Li 0.32371737572267 0.11725021659934 0.45461493819131 6.941 > 4 14 Li 0.32371737572267 0.61725021659934 0.45461493819131 6.941 > 4 15 Li 0.32371737572267 0.11725021659934 0.95461493819131 6.941 > 4 16 Li 0.32371737572267 0.61725021659934 0.95461493819131 6.941 > 4 17 Li 0.34349546602312 0.37003672393987 0.45966007935030 6.941 > 5 18 Li 0.34349546602312 0.87003672393987 0.45966007935030 6.941 > 5 19 Li 0.34349546602312 0.37003672393987 0.95966007935030 6.941 > 5 20 Li 0.34349546602312 0.87003672393987 0.95966007935030 6.941 > 5 *21 Li 0.15987192584968 0.37862393393007 0.29028585613296 6.941 > 6 22 Li 0.15987192584968 0.87862393393007 0.29028585613296 6.941 > 6 23 Li 0.15987192584968 0.37862393393007 0.79028585613296 6.941 > 6 24 Li 0.15987192584968 0.87862393393007 0.79028585613296 6.941 > 6 25 Li 0.49863119805920 0.14294988621880 0.38602441625501 6.941 > 7 26 Li 0.49863119805920 0.64294988621880 0.38602441625501 6.941 > 7 27 Li 0.49863119805920 0.14294988621880 0.88602441625501 6.941 > 7 28 Li 0.49863119805920 0.64294988621880 0.88602441625501 6.941 > 7 29 Li 0.17486462105184 0.13135014186110 0.28973884211385 6.941 > 8 30 Li 0.17486462105184 0.63135014186110 0.28973884211385 6.941 > 8 31 Li 0.17486462105184 0.13135014186110 0.78973884211385 6.941 > 8 32 Li 0.17486462105184 0.63135014186110 0.78973884211385 6.941 > 8 33 Li 0.32371737572267 0.38274978340066 0.20461493819131 6.941 > 9 34 Li 0.32371737572267 0.88274978340066 0.20461493819131 6.941 > 9 35 Li 0.32371737572267 0.38274978340066 0.70461493819131 6.941 > 9 36 Li 0.32371737572267 0.88274978340066 0.70461493819131 6.941 > 9 37 Li 0.15987192584968 0.12137606606993 0.04028585613296 6.941 > 10 38 Li 0.15987192584968 0.62137606606993 0.04028585613296 6.941 > 10 39 Li 0.15987192584968 0.12137606606993 0.54028585613296 6.941 > 10 40 Li 0.15987192584968 0.62137606606993 0.54028585613296 6.941 > 10 41 Li 0.84349546602312 0.37996327606013 0.20966007935030 6.941 > 1 42 Li 0.84349546602312 0.87996327606013 0.20966007935030 6.941 > 1 43 Li 0.84349546602312 0.37996327606013 0.70966007935030 6.941 > 1 44 Li 0.84349546602312 0.87996327606013 0.70966007935030 6.941 > 1 45 Li 0.99863119805920 0.10705011378120 0.13602441625501 6.941 > 2 46 Li 0.99863119805920 0.60705011378120 0.13602441625501 6.941 > 2 47 Li 0.99863119805920 0.10705011378120 0.63602441625501 6.941 > 2 48 Li 0.99863119805920 0.60705011378120 0.63602441625501 6.941 > 2 49 Li 0.67486462105184 0.11864985813890 0.03973884211385 6.941 > 3 50 Li 0.67486462105184 0.61864985813890 0.03973884211385 6.941 > 3 51 Li 0.67486462105184 0.11864985813890 0.53973884211385 6.941 > 3 52 Li 0.67486462105184 0.61864985813890 0.53973884211385 6.941 > 3 53 Li 0.82371737572267 0.36725021659934 0.45461493819131 6.941 > 4 54 Li 0.82371737572267 0.86725021659934 0.45461493819131 6.941 > 4 55 Li 0.82371737572267 0.36725021659934 0.95461493819131 6.941 > 4 56 Li 0.82371737572267 0.86725021659934 0.95461493819131 6.941 > 4 57 Li 0.84349546602312 0.12003672393987 0.45966007935030 6.941 > 5 58 Li 0.84349546602312 0.62003672393987 0.45966007935030 6.941 > 5 59 Li 0.84349546602312 0.12003672393987 0.95966007935030 6.941 > 5 60 Li 0.84349546602312 0.62003672393987 0.95966007935030 6.941 > 5 61 Li 0.65987192584968 0.12862393393007 0.29028585613296 6.941 > 6 62 Li 0.65987192584968 0.62862393393007 0.29028585613296 6.941 > 6 63 Li 0.65987192584968 0.12862393393007 0.79028585613296 6.941 > 6 64 Li 0.65987192584968 0.62862393393007 0.79028585613296 6.941 > 6 65 Li 0.99863119805920 0.39294988621880 0.38602441625501 6.941 > 7 66 Li 0.99863119805920 0.89294988621880 0.38602441625501 6.941 > 7 67 Li 0.99863119805920 0.39294988621880 0.88602441625501 6.941 > 7 68 Li 0.99863119805920 0.89294988621880 0.88602441625501 6.941 > 7 69 Li 0.67486462105184 0.38135014186110 0.28973884211385 6.941 > 8 70 Li 0.67486462105184 0.88135014186110 0.28973884211385 6.941 > 8 71 Li 0.67486462105184 0.38135014186110 0.78973884211385 6.941 > 8 72 Li 0.67486462105184 0.88135014186110 0.78973884211385 6.941 > 8 73 Li 0.82371737572267 0.13274978340066 0.20461493819131 6.941 > 9 74 Li 0.82371737572267 0.63274978340066 0.20461493819131 6.941 > 9 75 Li 0.82371737572267 0.13274978340066 0.70461493819131 6.941 > 9 76 Li 0.82371737572267 0.63274978340066 0.70461493819131 6.941 > 9 77 Li 0.65987192584968 0.37137606606993 0.04028585613296 6.941 > 10 78 Li 0.65987192584968 0.87137606606993 0.04028585613296 6.941 > 10 79 Li 0.65987192584968 0.37137606606993 0.54028585613296 6.941 > 10 80 Li 0.65987192584968 0.87137606606993 0.54028585613296 6.941 > 10 *81 Si 0.49990547199228 0.41102241099621 0.34868104246721 28.085 > 11 82 Si 0.49990547199228 0.91102241099621 0.34868104246721 28.085 > 11 83 Si 0.49990547199228 0.41102241099621 0.84868104246721 28.085 > 11 84 Si 0.49990547199228 0.91102241099621 0.84868104246721 28.085 > 11 85 Si 0.49990547199228 0.08897758900379 0.09868104246721 28.085 > 12 86 Si 0.49990547199228 0.58897758900379 0.09868104246721 28.085 > 12 87 Si 0.49990547199228 0.08897758900379 0.59868104246721 28.085 > 12 88 Si 0.49990547199228 0.58897758900379 0.59868104246721 28.085 > 12 89 Si 0.99990547199228 0.16102241099621 0.34868104246721 28.085 > 11 90 Si 0.99990547199228 0.66102241099621 0.34868104246721 28.085 > 11 91 Si 0.99990547199228 0.16102241099621 0.84868104246721 28.085 > 11 92 Si 0.99990547199228 0.66102241099621 0.84868104246721 28.085 > 11 93 Si 0.99990547199228 0.33897758900379 0.09868104246721 28.085 > 12 94 Si 0.99990547199228 0.83897758900379 0.09868104246721 28.085 > 12 95 Si 0.99990547199228 0.33897758900379 0.59868104246721 28.085 > 12 96 Si 0.99990547199228 0.83897758900379 0.59868104246721 28.085 > 12 *97 P 0.00036023711247 0.48268792316241 0.01875167301956 30.974 > 13 98 P 0.00036023711247 0.98268792316241 0.01875167301956 30.974 > 13 99 P 0.00036023711247 0.48268792316241 0.51875167301956 30.974 > 13 100 P 0.00036023711247 0.98268792316241 0.51875167301956 30.974 > 13 *101 P 0.34159110999185 0.49397030627507 0.33611813257999 30.974 > 14 102 P 0.34159110999185 0.99397030627507 0.33611813257999 30.974 > 14 103 P 0.34159110999185 0.49397030627507 0.83611813257999 30.974 > 14 104 P 0.34159110999185 0.99397030627507 0.83611813257999 30.974 > 14 105 P 0.00036023711247 0.01731207683759 0.26875167301956 30.974 > 15 106 P 0.00036023711247 0.51731207683759 0.26875167301956 30.974 > 15 107 P 0.00036023711247 0.01731207683759 0.76875167301956 30.974 > 15 108 P 0.00036023711247 0.51731207683759 0.76875167301956 30.974 > 15 *109 P 0.15745828419691 0.25478613149354 0.16312223988981 30.974 > 16 110 P 0.15745828419691 0.75478613149354 0.16312223988981 30.974 > 16 111 P 0.15745828419691 0.25478613149354 0.66312223988981 30.974 > 16 112 P 0.15745828419691 0.75478613149354 0.66312223988981 30.974 > 16 113 P 0.34159110999185 0.00602969372493 0.08611813257999 30.974 > 17 114 P 0.34159110999185 0.50602969372493 0.08611813257999 30.974 > 17 115 P 0.34159110999185 0.00602969372493 0.58611813257999 30.974 > 17 116 P 0.34159110999185 0.50602969372493 0.58611813257999 30.974 > 17 117 P 0.15745828419691 0.24521386850647 0.41312223988981 30.974 > 18 118 P 0.15745828419691 0.74521386850646 0.41312223988981 30.974 > 18 119 P 0.15745828419691 0.24521386850647 0.91312223988981 30.974 > 18 120 P 0.15745828419691 0.74521386850646 0.91312223988981 30.974 > 18 121 P 0.50036023711247 0.23268792316241 0.01875167301956 30.974 > 13 122 P 0.50036023711247 0.73268792316241 0.01875167301956 30.974 > 13 123 P 0.50036023711247 0.23268792316241 0.51875167301956 30.974 > 13 124 P 0.50036023711247 0.73268792316241 0.51875167301956 30.974 > 13 125 P 0.84159110999185 0.24397030627507 0.33611813257999 30.974 > 14 126 P 0.84159110999185 0.74397030627507 0.33611813257999 30.974 > 14 127 P 0.84159110999185 0.24397030627507 0.83611813257999 30.974 > 14 128 P 0.84159110999185 0.74397030627507 0.83611813257999 30.974 > 14 129 P 0.50036023711247 0.26731207683759 0.26875167301956 30.974 > 15 130 P 0.50036023711247 0.76731207683759 0.26875167301956 30.974 > 15 131 P 0.50036023711247 0.26731207683759 0.76875167301956 30.974 > 15 132 P 0.50036023711247 0.76731207683759 0.76875167301956 30.974 > 15 133 P 0.65745828419691 0.00478613149354 0.16312223988981 30.974 > 16 134 P 0.65745828419691 0.50478613149354 0.16312223988981 30.974 > 16 135 P 0.65745828419691 0.00478613149354 0.66312223988981 30.974 > 16 136 P 0.65745828419691 0.50478613149354 0.66312223988981 30.974 > 16 137 P 0.84159110999185 0.25602969372493 0.08611813257999 30.974 > 17 138 P 0.84159110999185 0.75602969372493 0.08611813257999 30.974 > 17 139 P 0.84159110999185 0.25602969372493 0.58611813257999 30.974 > 17 140 P 0.84159110999185 0.75602969372493 0.58611813257999 30.974 > 17 141 P 0.65745828419691 0.49521386850646 0.41312223988981 30.974 > 18 142 P 0.65745828419691 0.99521386850646 0.41312223988981 30.974 > 18 143 P 0.65745828419691 0.49521386850646 0.91312223988981 30.974 > 18 144 P 0.65745828419691 0.99521386850646 0.91312223988981 30.974 > 18 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 8.1132771 0.0000000 0.4277405 0.0000000 7.7638208 0.0000000 0.4277665 0.0000000 6.9657686 -------------------------- Born effective charges -------------------------- 1 Li 1.0039151 -0.4528957 0.0717722 -0.0452449 1.1415009 -0.2317393 0.2440304 -0.0785948 1.0895562 2 Li 0.5319558 0.0258698 -0.1277500 -0.0844479 0.9889126 0.2149516 -0.1326759 -0.1916416 0.8579360 3 Li 1.2351594 0.4413892 0.0450877 0.2752162 0.8336223 0.2901057 -0.1328925 0.2312058 0.8498610 4 Li 0.8972962 -0.3678107 0.0101339 -0.0877790 0.5718197 0.1801629 0.1959868 -0.0015976 0.9863456 5 Li 1.0039151 0.4528957 0.0717722 0.0452449 1.1415009 0.2317393 0.2440304 0.0785948 1.0895562 6 Li 0.9487669 0.3163932 -0.0561044 -0.0960983 0.9425684 -0.2732889 -0.1948691 0.1978754 0.8782870 7 Li 0.5319558 -0.0258698 -0.1277500 0.0844479 0.9889126 -0.2149516 -0.1326759 0.1916416 0.8579360 8 Li 1.2351594 -0.4413892 0.0450877 -0.2752162 0.8336223 -0.2901057 -0.1328925 -0.2312058 0.8498610 9 Li 0.8972962 0.3678107 0.0101339 0.0877790 0.5718197 -0.1801629 0.1959868 0.0015976 0.9863456 10 Li 0.9487669 -0.3163932 -0.0561044 0.0960983 0.9425684 0.2732889 -0.1948691 -0.1978754 0.8782870 11 Si 2.8696772 -0.5395597 0.6890918 -0.3591069 2.1693269 1.2159225 0.6949836 1.2674541 1.2555337 12 Si 2.8696772 0.5395597 0.6890918 0.3591069 2.1693269 -1.2159225 0.6949836 -1.2674541 1.2555337 13 P -1.8512816 -0.2450017 0.0633490 -0.2637549 -2.6062314 0.5685492 0.0667748 0.7701359 -2.1067710 14 P -2.9890642 0.6132447 -0.2033972 0.6642451 -2.0673113 0.2067219 -0.1746314 -0.2253352 -1.7557866 15 P -1.8512816 0.2450017 0.0633490 0.2637549 -2.6062314 -0.5685492 0.0667748 -0.7701359 -2.1067710 16 P -2.6464247 0.3500019 -0.4921830 0.5205210 -1.9742080 0.4284565 -0.5667067 0.6226147 -2.0549619 17 P -2.9890642 -0.6132447 -0.2033972 -0.6642451 -2.0673113 -0.2067219 -0.1746314 0.2253352 -1.7557866 18 P -2.6464247 -0.3500019 -0.4921830 -0.5205210 -1.9742080 -0.4284565 -0.5667067 -0.6226147 -2.0549619 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 14400/14400 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5886 Number of blocks in projector: 5886 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: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1296 / 1296 (1) 286 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1296 / 1296 (1) 287 eigenvectors found. (1) Complementary block size: 41 (1) Compute compressed projector. (1) Use standard solver. (1) 24 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1296 / 1296 (1) 286 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 161 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 5 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 157 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 157 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5886, 5806), data: False |-- (666, 657), data: False |-- (666, 9), data: (666, 18) @ (18, 9) |-- (166, 157), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (666, 657), data: False |-- (666, 9), data: (666, 18) @ (18, 9) |-- (166, 157), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (666, 657), data: False |-- (666, 5), data: (666, 14) @ (14, 5) |-- (166, 161), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (1296, 1278), data: False |-- (1296, 26), data: (1296, 44) @ (44, 26) |-- (296, 286), data: True |-- (500, 484), data: False |-- (500, 12), data: (500, 28) @ (28, 12) |-- (250, 238), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1296, 1279), data: False |-- (1296, 24), data: (1296, 41) @ (41, 24) |-- (296, 287), data: True |-- (500, 485), data: False |-- (500, 11), data: (500, 26) @ (26, 11) |-- (250, 239), data: True |-- (250, 235), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), data: True |-- (1296, 1278), data: False |-- (1296, 26), data: (1296, 44) @ (44, 26) |-- (296, 286), data: True |-- (500, 484), data: False |-- (500, 12), data: (500, 28) @ (28, 12) |-- (250, 238), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 1120 - Time: 1.788 Solver_block: 200 / 1120 - Time: 1.585 Solver_block: 300 / 1120 - Time: 1.591 Solver_block: 400 / 1120 - Time: 1.592 Solver_block: 500 / 1120 - Time: 1.591 Solver_block: 600 / 1120 - Time: 1.596 Solver_block: 700 / 1120 - Time: 1.591 Solver_block: 800 / 1120 - Time: 1.600 Solver_block: 900 / 1120 - Time: 1.593 Solver_block: 1000 / 1120 - Time: 1.594 Solver_block: 1100 / 1120 - Time: 1.601 Solver_block: 1120 / 1120 - Time: 0.510 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 18.738 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (yy) -0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 14400/14400 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 5886 Number of blocks in projector: 5886 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: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1296 / 1296 (1) 286 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 233 eigenvectors found. (2) Complementary block size: 34 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 483 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 235 eigenvectors found. (2) Block: 500 / 500 (2) 239 eigenvectors found. (2) Complementary block size: 26 (2) Compute compressed projector. (2) Use standard solver. (2) 11 eigenvectors found. (1) 485 eigenvectors found. (1) Block: 1296 / 1296 (1) 287 eigenvectors found. (1) Complementary block size: 41 (1) Compute compressed projector. (1) Use standard solver. (1) 24 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 1296 Use submatrix version of eigh solver. (1) Block: 500 / 1296 (2) Block: 250 / 500 (2) 232 eigenvectors found. (2) Block: 500 / 500 (2) 232 eigenvectors found. (2) Complementary block size: 36 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found. (1) 482 eigenvectors found. (1) Block: 1000 / 1296 (2) Block: 250 / 500 (2) 234 eigenvectors found. (2) Block: 500 / 500 (2) 238 eigenvectors found. (2) Complementary block size: 28 (2) Compute compressed projector. (2) Use standard solver. (2) 12 eigenvectors found. (1) 484 eigenvectors found. (1) Block: 1296 / 1296 (1) 286 eigenvectors found. (1) Complementary block size: 44 (1) Compute compressed projector. (1) Use standard solver. (1) 26 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 161 eigenvectors found. (1) Complementary block size: 14 (1) Compute compressed projector. (1) Use standard solver. (1) 5 eigenvectors found. --- Eigsh_solver_block: 5 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 157 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. --- Eigsh_solver_block: 6 / 6 --- Block_size: 666 Use submatrix version of eigh solver. (1) Block: 500 / 666 (2) Block: 250 / 500 (2) 241 eigenvectors found. (2) Block: 500 / 500 (2) 242 eigenvectors found. (2) Complementary block size: 17 (2) Compute compressed projector. (2) Use standard solver. (2) 8 eigenvectors found. (1) 491 eigenvectors found. (1) Block: 666 / 666 (1) 157 eigenvectors found. (1) Complementary block size: 18 (1) Compute compressed projector. (1) Use standard solver. (1) 9 eigenvectors found. Tree of FC basis block matrices: - (5886, 5806), data: False |-- (666, 657), data: False |-- (666, 9), data: (666, 18) @ (18, 9) |-- (166, 157), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (666, 657), data: False |-- (666, 9), data: (666, 18) @ (18, 9) |-- (166, 157), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (666, 657), data: False |-- (666, 5), data: (666, 14) @ (14, 5) |-- (166, 161), data: True |-- (500, 491), data: False |-- (500, 8), data: (500, 17) @ (17, 8) |-- (250, 242), data: True |-- (250, 241), data: True |-- (1296, 1278), data: False |-- (1296, 26), data: (1296, 44) @ (44, 26) |-- (296, 286), data: True |-- (500, 484), data: False |-- (500, 12), data: (500, 28) @ (28, 12) |-- (250, 238), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True |-- (1296, 1279), data: False |-- (1296, 24), data: (1296, 41) @ (41, 24) |-- (296, 287), data: True |-- (500, 485), data: False |-- (500, 11), data: (500, 26) @ (26, 11) |-- (250, 239), data: True |-- (250, 235), data: True |-- (500, 483), data: False |-- (500, 17), data: (500, 34) @ (34, 17) |-- (250, 233), data: True |-- (250, 233), data: True |-- (1296, 1278), data: False |-- (1296, 26), data: (1296, 44) @ (44, 26) |-- (296, 286), data: True |-- (500, 484), data: False |-- (500, 12), data: (500, 28) @ (28, 12) |-- (250, 238), data: True |-- (250, 234), data: True |-- (500, 482), data: False |-- (500, 18), data: (500, 36) @ (36, 18) |-- (250, 232), data: True |-- (250, 232), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 21:46:08]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:46:09]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cc (9) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.353613645000208 -2.926412655000000 0.000000000000000 b 6.353613645000208 2.926412655000000 0.000000000000000 c -2.845340107219632 0.000000000000000 8.057861510037030 Atomic positions (fractional): 1 Li 0.08356891390287 0.60342201814337 0.41932015870061 6.941 2 Li 0.78453097049679 0.21273142562160 0.27204883251001 6.941 3 Li 0.43756490477404 0.91216433732964 0.07947768422770 6.941 4 Li 0.08921694252399 0.55821780892134 0.90922987638263 6.941 5 Li 0.60342201814337 0.08356891390287 0.91932015870061 6.941 6 Li 0.40262405798954 0.91711979370983 0.58057171226593 6.941 7 Li 0.21273142562160 0.78453097049679 0.77204883251001 6.941 8 Li 0.91216433732964 0.43756490477404 0.57947768422770 6.941 9 Li 0.55821780892134 0.08921694252399 0.40922987638263 6.941 10 Li 0.91711979370983 0.40262405798954 0.08057171226593 6.941 11 Si 0.67786064999986 0.32195029398470 0.69736208493442 28.085 12 Si 0.32195029398470 0.67786064999986 0.19736208493442 28.085 13 P 0.03498439078765 0.96573608343730 0.03750334603912 30.974 14 P 0.35365049744170 0.32953172254200 0.67223626515997 30.974 15 P 0.96573608343730 0.03498439078765 0.53750334603912 30.974 16 P 0.64788602120984 0.66703054718398 0.32624447977962 30.974 17 P 0.32953172254200 0.35365049744170 0.17223626515997 30.974 18 P 0.66703054718398 0.64788602120984 0.82624447977962 30.974 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.707227290000416 0.000000000000000 0.000000000000000 b 0.000000000000000 11.705650620000000 0.000000000000000 c -5.690680214439264 0.000000000000000 16.115723020074061 Atomic positions (fractional): 1 Li 0.34349546602312 0.12996327606013 0.20966007935030 6.941 > 1 2 Li 0.34349546602312 0.62996327606013 0.20966007935030 6.941 > 1 3 Li 0.34349546602312 0.12996327606013 0.70966007935030 6.941 > 1 4 Li 0.34349546602312 0.62996327606013 0.70966007935030 6.941 > 1 5 Li 0.49863119805920 0.35705011378120 0.13602441625501 6.941 > 5 6 Li 0.49863119805920 0.85705011378120 0.13602441625501 6.941 > 5 7 Li 0.49863119805920 0.35705011378120 0.63602441625501 6.941 > 5 8 Li 0.49863119805920 0.85705011378120 0.63602441625501 6.941 > 5 9 Li 0.17486462105184 0.36864985813890 0.03973884211385 6.941 > 9 10 Li 0.17486462105184 0.86864985813890 0.03973884211385 6.941 > 9 11 Li 0.17486462105184 0.36864985813890 0.53973884211385 6.941 > 9 12 Li 0.17486462105184 0.86864985813890 0.53973884211385 6.941 > 9 13 Li 0.32371737572267 0.11725021659934 0.45461493819131 6.941 > 13 14 Li 0.32371737572267 0.61725021659934 0.45461493819131 6.941 > 13 15 Li 0.32371737572267 0.11725021659934 0.95461493819131 6.941 > 13 16 Li 0.32371737572267 0.61725021659934 0.95461493819131 6.941 > 13 17 Li 0.34349546602312 0.37003672393987 0.45966007935030 6.941 > 17 18 Li 0.34349546602312 0.87003672393987 0.45966007935030 6.941 > 17 19 Li 0.34349546602312 0.37003672393987 0.95966007935030 6.941 > 17 20 Li 0.34349546602312 0.87003672393987 0.95966007935030 6.941 > 17 21 Li 0.15987192584968 0.37862393393007 0.29028585613296 6.941 > 21 22 Li 0.15987192584968 0.87862393393007 0.29028585613296 6.941 > 21 23 Li 0.15987192584968 0.37862393393007 0.79028585613296 6.941 > 21 24 Li 0.15987192584968 0.87862393393007 0.79028585613296 6.941 > 21 25 Li 0.49863119805920 0.14294988621880 0.38602441625501 6.941 > 25 26 Li 0.49863119805920 0.64294988621880 0.38602441625501 6.941 > 25 27 Li 0.49863119805920 0.14294988621880 0.88602441625501 6.941 > 25 28 Li 0.49863119805920 0.64294988621880 0.88602441625501 6.941 > 25 29 Li 0.17486462105184 0.13135014186110 0.28973884211385 6.941 > 29 30 Li 0.17486462105184 0.63135014186110 0.28973884211385 6.941 > 29 31 Li 0.17486462105184 0.13135014186110 0.78973884211385 6.941 > 29 32 Li 0.17486462105184 0.63135014186110 0.78973884211385 6.941 > 29 33 Li 0.32371737572267 0.38274978340066 0.20461493819131 6.941 > 33 34 Li 0.32371737572267 0.88274978340066 0.20461493819131 6.941 > 33 35 Li 0.32371737572267 0.38274978340066 0.70461493819131 6.941 > 33 36 Li 0.32371737572267 0.88274978340066 0.70461493819131 6.941 > 33 37 Li 0.15987192584968 0.12137606606993 0.04028585613296 6.941 > 37 38 Li 0.15987192584968 0.62137606606993 0.04028585613296 6.941 > 37 39 Li 0.15987192584968 0.12137606606993 0.54028585613296 6.941 > 37 40 Li 0.15987192584968 0.62137606606993 0.54028585613296 6.941 > 37 41 Li 0.84349546602312 0.37996327606013 0.20966007935030 6.941 > 1 42 Li 0.84349546602312 0.87996327606013 0.20966007935030 6.941 > 1 43 Li 0.84349546602312 0.37996327606013 0.70966007935030 6.941 > 1 44 Li 0.84349546602312 0.87996327606013 0.70966007935030 6.941 > 1 45 Li 0.99863119805920 0.10705011378120 0.13602441625501 6.941 > 5 46 Li 0.99863119805920 0.60705011378120 0.13602441625501 6.941 > 5 47 Li 0.99863119805920 0.10705011378120 0.63602441625501 6.941 > 5 48 Li 0.99863119805920 0.60705011378120 0.63602441625501 6.941 > 5 49 Li 0.67486462105184 0.11864985813890 0.03973884211385 6.941 > 9 50 Li 0.67486462105184 0.61864985813890 0.03973884211385 6.941 > 9 51 Li 0.67486462105184 0.11864985813890 0.53973884211385 6.941 > 9 52 Li 0.67486462105184 0.61864985813890 0.53973884211385 6.941 > 9 53 Li 0.82371737572267 0.36725021659934 0.45461493819131 6.941 > 13 54 Li 0.82371737572267 0.86725021659934 0.45461493819131 6.941 > 13 55 Li 0.82371737572267 0.36725021659934 0.95461493819131 6.941 > 13 56 Li 0.82371737572267 0.86725021659934 0.95461493819131 6.941 > 13 57 Li 0.84349546602312 0.12003672393987 0.45966007935030 6.941 > 17 58 Li 0.84349546602312 0.62003672393987 0.45966007935030 6.941 > 17 59 Li 0.84349546602312 0.12003672393987 0.95966007935030 6.941 > 17 60 Li 0.84349546602312 0.62003672393987 0.95966007935030 6.941 > 17 61 Li 0.65987192584968 0.12862393393007 0.29028585613296 6.941 > 21 62 Li 0.65987192584968 0.62862393393007 0.29028585613296 6.941 > 21 63 Li 0.65987192584968 0.12862393393007 0.79028585613296 6.941 > 21 64 Li 0.65987192584968 0.62862393393007 0.79028585613296 6.941 > 21 65 Li 0.99863119805920 0.39294988621880 0.38602441625501 6.941 > 25 66 Li 0.99863119805920 0.89294988621880 0.38602441625501 6.941 > 25 67 Li 0.99863119805920 0.39294988621880 0.88602441625501 6.941 > 25 68 Li 0.99863119805920 0.89294988621880 0.88602441625501 6.941 > 25 69 Li 0.67486462105184 0.38135014186110 0.28973884211385 6.941 > 29 70 Li 0.67486462105184 0.88135014186110 0.28973884211385 6.941 > 29 71 Li 0.67486462105184 0.38135014186110 0.78973884211385 6.941 > 29 72 Li 0.67486462105184 0.88135014186110 0.78973884211385 6.941 > 29 73 Li 0.82371737572267 0.13274978340066 0.20461493819131 6.941 > 33 74 Li 0.82371737572267 0.63274978340066 0.20461493819131 6.941 > 33 75 Li 0.82371737572267 0.13274978340066 0.70461493819131 6.941 > 33 76 Li 0.82371737572267 0.63274978340066 0.70461493819131 6.941 > 33 77 Li 0.65987192584968 0.37137606606993 0.04028585613296 6.941 > 37 78 Li 0.65987192584968 0.87137606606993 0.04028585613296 6.941 > 37 79 Li 0.65987192584968 0.37137606606993 0.54028585613296 6.941 > 37 80 Li 0.65987192584968 0.87137606606993 0.54028585613296 6.941 > 37 81 Si 0.49990547199228 0.41102241099621 0.34868104246721 28.085 > 81 82 Si 0.49990547199228 0.91102241099621 0.34868104246721 28.085 > 81 83 Si 0.49990547199228 0.41102241099621 0.84868104246721 28.085 > 81 84 Si 0.49990547199228 0.91102241099621 0.84868104246721 28.085 > 81 85 Si 0.49990547199228 0.08897758900379 0.09868104246721 28.085 > 85 86 Si 0.49990547199228 0.58897758900379 0.09868104246721 28.085 > 85 87 Si 0.49990547199228 0.08897758900379 0.59868104246721 28.085 > 85 88 Si 0.49990547199228 0.58897758900379 0.59868104246721 28.085 > 85 89 Si 0.99990547199228 0.16102241099621 0.34868104246721 28.085 > 81 90 Si 0.99990547199228 0.66102241099621 0.34868104246721 28.085 > 81 91 Si 0.99990547199228 0.16102241099621 0.84868104246721 28.085 > 81 92 Si 0.99990547199228 0.66102241099621 0.84868104246721 28.085 > 81 93 Si 0.99990547199228 0.33897758900379 0.09868104246721 28.085 > 85 94 Si 0.99990547199228 0.83897758900379 0.09868104246721 28.085 > 85 95 Si 0.99990547199228 0.33897758900379 0.59868104246721 28.085 > 85 96 Si 0.99990547199228 0.83897758900379 0.59868104246721 28.085 > 85 97 P 0.00036023711247 0.48268792316241 0.01875167301956 30.974 > 97 98 P 0.00036023711247 0.98268792316241 0.01875167301956 30.974 > 97 99 P 0.00036023711247 0.48268792316241 0.51875167301956 30.974 > 97 100 P 0.00036023711247 0.98268792316241 0.51875167301956 30.974 > 97 101 P 0.34159110999185 0.49397030627507 0.33611813257999 30.974 > 101 102 P 0.34159110999185 0.99397030627507 0.33611813257999 30.974 > 101 103 P 0.34159110999185 0.49397030627507 0.83611813257999 30.974 > 101 104 P 0.34159110999185 0.99397030627507 0.83611813257999 30.974 > 101 105 P 0.00036023711247 0.01731207683759 0.26875167301956 30.974 > 105 106 P 0.00036023711247 0.51731207683759 0.26875167301956 30.974 > 105 107 P 0.00036023711247 0.01731207683759 0.76875167301956 30.974 > 105 108 P 0.00036023711247 0.51731207683759 0.76875167301956 30.974 > 105 109 P 0.15745828419691 0.25478613149354 0.16312223988981 30.974 > 109 110 P 0.15745828419691 0.75478613149354 0.16312223988981 30.974 > 109 111 P 0.15745828419691 0.25478613149354 0.66312223988981 30.974 > 109 112 P 0.15745828419691 0.75478613149354 0.66312223988981 30.974 > 109 113 P 0.34159110999185 0.00602969372493 0.08611813257999 30.974 > 113 114 P 0.34159110999185 0.50602969372493 0.08611813257999 30.974 > 113 115 P 0.34159110999185 0.00602969372493 0.58611813257999 30.974 > 113 116 P 0.34159110999185 0.50602969372493 0.58611813257999 30.974 > 113 117 P 0.15745828419691 0.24521386850647 0.41312223988981 30.974 > 117 118 P 0.15745828419691 0.74521386850646 0.41312223988981 30.974 > 117 119 P 0.15745828419691 0.24521386850647 0.91312223988981 30.974 > 117 120 P 0.15745828419691 0.74521386850646 0.91312223988981 30.974 > 117 121 P 0.50036023711247 0.23268792316241 0.01875167301956 30.974 > 97 122 P 0.50036023711247 0.73268792316241 0.01875167301956 30.974 > 97 123 P 0.50036023711247 0.23268792316241 0.51875167301956 30.974 > 97 124 P 0.50036023711247 0.73268792316241 0.51875167301956 30.974 > 97 125 P 0.84159110999185 0.24397030627507 0.33611813257999 30.974 > 101 126 P 0.84159110999185 0.74397030627507 0.33611813257999 30.974 > 101 127 P 0.84159110999185 0.24397030627507 0.83611813257999 30.974 > 101 128 P 0.84159110999185 0.74397030627507 0.83611813257999 30.974 > 101 129 P 0.50036023711247 0.26731207683759 0.26875167301956 30.974 > 105 130 P 0.50036023711247 0.76731207683759 0.26875167301956 30.974 > 105 131 P 0.50036023711247 0.26731207683759 0.76875167301956 30.974 > 105 132 P 0.50036023711247 0.76731207683759 0.76875167301956 30.974 > 105 133 P 0.65745828419691 0.00478613149354 0.16312223988981 30.974 > 109 134 P 0.65745828419691 0.50478613149354 0.16312223988981 30.974 > 109 135 P 0.65745828419691 0.00478613149354 0.66312223988981 30.974 > 109 136 P 0.65745828419691 0.50478613149354 0.66312223988981 30.974 > 109 137 P 0.84159110999185 0.25602969372493 0.08611813257999 30.974 > 113 138 P 0.84159110999185 0.75602969372493 0.08611813257999 30.974 > 113 139 P 0.84159110999185 0.25602969372493 0.58611813257999 30.974 > 113 140 P 0.84159110999185 0.75602969372493 0.58611813257999 30.974 > 113 141 P 0.65745828419691 0.49521386850646 0.41312223988981 30.974 > 117 142 P 0.65745828419691 0.99521386850646 0.41312223988981 30.974 > 117 143 P 0.65745828419691 0.49521386850646 0.91312223988981 30.974 > 117 144 P 0.65745828419691 0.99521386850646 0.91312223988981 30.974 > 117 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 8.1132771 0.0000000 0.4277405 0.0000000 7.7638208 0.0000000 0.4277665 0.0000000 6.9657686 -------------------------- Born effective charges -------------------------- 1 Li 1.0039151 -0.4528957 0.0717722 -0.0452449 1.1415009 -0.2317393 0.2440304 -0.0785948 1.0895562 2 Li 0.5319558 0.0258698 -0.1277500 -0.0844479 0.9889126 0.2149516 -0.1326759 -0.1916416 0.8579360 3 Li 1.2351594 0.4413892 0.0450877 0.2752162 0.8336223 0.2901057 -0.1328925 0.2312058 0.8498610 4 Li 0.8972962 -0.3678107 0.0101339 -0.0877790 0.5718197 0.1801629 0.1959868 -0.0015976 0.9863456 5 Li 1.0039151 0.4528957 0.0717722 0.0452449 1.1415009 0.2317393 0.2440304 0.0785948 1.0895562 6 Li 0.9487669 0.3163932 -0.0561044 -0.0960983 0.9425684 -0.2732889 -0.1948691 0.1978754 0.8782870 7 Li 0.5319558 -0.0258698 -0.1277500 0.0844479 0.9889126 -0.2149516 -0.1326759 0.1916416 0.8579360 8 Li 1.2351594 -0.4413892 0.0450877 -0.2752162 0.8336223 -0.2901057 -0.1328925 -0.2312058 0.8498610 9 Li 0.8972962 0.3678107 0.0101339 0.0877790 0.5718197 -0.1801629 0.1959868 0.0015976 0.9863456 10 Li 0.9487669 -0.3163932 -0.0561044 0.0960983 0.9425684 0.2732889 -0.1948691 -0.1978754 0.8782870 11 Si 2.8696772 -0.5395597 0.6890918 -0.3591069 2.1693269 1.2159225 0.6949836 1.2674541 1.2555337 12 Si 2.8696772 0.5395597 0.6890918 0.3591069 2.1693269 -1.2159225 0.6949836 -1.2674541 1.2555337 13 P -1.8512816 -0.2450017 0.0633490 -0.2637549 -2.6062314 0.5685492 0.0667748 0.7701359 -2.1067710 14 P -2.9890642 0.6132447 -0.2033972 0.6642451 -2.0673113 0.2067219 -0.1746314 -0.2253352 -1.7557866 15 P -1.8512816 0.2450017 0.0633490 0.2637549 -2.6062314 -0.5685492 0.0667748 -0.7701359 -2.1067710 16 P -2.6464247 0.3500019 -0.4921830 0.5205210 -1.9742080 0.4284565 -0.5667067 0.6226147 -2.0549619 17 P -2.9890642 -0.6132447 -0.2033972 -0.6642451 -2.0673113 -0.2067219 -0.1746314 0.2253352 -1.7557866 18 P -2.6464247 -0.3500019 -0.4921830 -0.5205210 -1.9742080 -0.4284565 -0.5667067 -0.6226147 -2.0549619 ---------------------------------------------------------------------------- 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 5, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 13, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 21, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 101, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Computing fc3[ 109, 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] [-0.0033 0.0000 0.0094] [ 0.0033 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zy) 0.00000000 (zy) 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 21:47:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 21:47:07]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cc (9) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.353613645000208 -2.926412655000000 0.000000000000000 b 6.353613645000208 2.926412655000000 0.000000000000000 c -2.845340107219632 0.000000000000000 8.057861510037030 Atomic positions (fractional): 1 Li 0.08356891390287 0.60342201814337 0.41932015870061 6.941 2 Li 0.78453097049679 0.21273142562160 0.27204883251001 6.941 3 Li 0.43756490477404 0.91216433732964 0.07947768422770 6.941 4 Li 0.08921694252399 0.55821780892134 0.90922987638263 6.941 5 Li 0.60342201814337 0.08356891390287 0.91932015870061 6.941 6 Li 0.40262405798954 0.91711979370983 0.58057171226593 6.941 7 Li 0.21273142562160 0.78453097049679 0.77204883251001 6.941 8 Li 0.91216433732964 0.43756490477404 0.57947768422770 6.941 9 Li 0.55821780892134 0.08921694252399 0.40922987638263 6.941 10 Li 0.91711979370983 0.40262405798954 0.08057171226593 6.941 11 Si 0.67786064999986 0.32195029398470 0.69736208493442 28.085 12 Si 0.32195029398470 0.67786064999986 0.19736208493442 28.085 13 P 0.03498439078765 0.96573608343730 0.03750334603912 30.974 14 P 0.35365049744170 0.32953172254200 0.67223626515997 30.974 15 P 0.96573608343730 0.03498439078765 0.53750334603912 30.974 16 P 0.64788602120984 0.66703054718398 0.32624447977962 30.974 17 P 0.32953172254200 0.35365049744170 0.17223626515997 30.974 18 P 0.66703054718398 0.64788602120984 0.82624447977962 30.974 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.707227290000416 0.000000000000000 0.000000000000000 b 0.000000000000000 11.705650620000000 0.000000000000000 c -5.690680214439264 0.000000000000000 16.115723020074061 Atomic positions (fractional): 1 Li 0.34349546602312 0.12996327606013 0.20966007935030 6.941 > 1 2 Li 0.34349546602312 0.62996327606013 0.20966007935030 6.941 > 1 3 Li 0.34349546602312 0.12996327606013 0.70966007935030 6.941 > 1 4 Li 0.34349546602312 0.62996327606013 0.70966007935030 6.941 > 1 5 Li 0.49863119805920 0.35705011378120 0.13602441625501 6.941 > 5 6 Li 0.49863119805920 0.85705011378120 0.13602441625501 6.941 > 5 7 Li 0.49863119805920 0.35705011378120 0.63602441625501 6.941 > 5 8 Li 0.49863119805920 0.85705011378120 0.63602441625501 6.941 > 5 9 Li 0.17486462105184 0.36864985813890 0.03973884211385 6.941 > 9 10 Li 0.17486462105184 0.86864985813890 0.03973884211385 6.941 > 9 11 Li 0.17486462105184 0.36864985813890 0.53973884211385 6.941 > 9 12 Li 0.17486462105184 0.86864985813890 0.53973884211385 6.941 > 9 13 Li 0.32371737572267 0.11725021659934 0.45461493819131 6.941 > 13 14 Li 0.32371737572267 0.61725021659934 0.45461493819131 6.941 > 13 15 Li 0.32371737572267 0.11725021659934 0.95461493819131 6.941 > 13 16 Li 0.32371737572267 0.61725021659934 0.95461493819131 6.941 > 13 17 Li 0.34349546602312 0.37003672393987 0.45966007935030 6.941 > 17 18 Li 0.34349546602312 0.87003672393987 0.45966007935030 6.941 > 17 19 Li 0.34349546602312 0.37003672393987 0.95966007935030 6.941 > 17 20 Li 0.34349546602312 0.87003672393987 0.95966007935030 6.941 > 17 21 Li 0.15987192584968 0.37862393393007 0.29028585613296 6.941 > 21 22 Li 0.15987192584968 0.87862393393007 0.29028585613296 6.941 > 21 23 Li 0.15987192584968 0.37862393393007 0.79028585613296 6.941 > 21 24 Li 0.15987192584968 0.87862393393007 0.79028585613296 6.941 > 21 25 Li 0.49863119805920 0.14294988621880 0.38602441625501 6.941 > 25 26 Li 0.49863119805920 0.64294988621880 0.38602441625501 6.941 > 25 27 Li 0.49863119805920 0.14294988621880 0.88602441625501 6.941 > 25 28 Li 0.49863119805920 0.64294988621880 0.88602441625501 6.941 > 25 29 Li 0.17486462105184 0.13135014186110 0.28973884211385 6.941 > 29 30 Li 0.17486462105184 0.63135014186110 0.28973884211385 6.941 > 29 31 Li 0.17486462105184 0.13135014186110 0.78973884211385 6.941 > 29 32 Li 0.17486462105184 0.63135014186110 0.78973884211385 6.941 > 29 33 Li 0.32371737572267 0.38274978340066 0.20461493819131 6.941 > 33 34 Li 0.32371737572267 0.88274978340066 0.20461493819131 6.941 > 33 35 Li 0.32371737572267 0.38274978340066 0.70461493819131 6.941 > 33 36 Li 0.32371737572267 0.88274978340066 0.70461493819131 6.941 > 33 37 Li 0.15987192584968 0.12137606606993 0.04028585613296 6.941 > 37 38 Li 0.15987192584968 0.62137606606993 0.04028585613296 6.941 > 37 39 Li 0.15987192584968 0.12137606606993 0.54028585613296 6.941 > 37 40 Li 0.15987192584968 0.62137606606993 0.54028585613296 6.941 > 37 41 Li 0.84349546602312 0.37996327606013 0.20966007935030 6.941 > 1 42 Li 0.84349546602312 0.87996327606013 0.20966007935030 6.941 > 1 43 Li 0.84349546602312 0.37996327606013 0.70966007935030 6.941 > 1 44 Li 0.84349546602312 0.87996327606013 0.70966007935030 6.941 > 1 45 Li 0.99863119805920 0.10705011378120 0.13602441625501 6.941 > 5 46 Li 0.99863119805920 0.60705011378120 0.13602441625501 6.941 > 5 47 Li 0.99863119805920 0.10705011378120 0.63602441625501 6.941 > 5 48 Li 0.99863119805920 0.60705011378120 0.63602441625501 6.941 > 5 49 Li 0.67486462105184 0.11864985813890 0.03973884211385 6.941 > 9 50 Li 0.67486462105184 0.61864985813890 0.03973884211385 6.941 > 9 51 Li 0.67486462105184 0.11864985813890 0.53973884211385 6.941 > 9 52 Li 0.67486462105184 0.61864985813890 0.53973884211385 6.941 > 9 53 Li 0.82371737572267 0.36725021659934 0.45461493819131 6.941 > 13 54 Li 0.82371737572267 0.86725021659934 0.45461493819131 6.941 > 13 55 Li 0.82371737572267 0.36725021659934 0.95461493819131 6.941 > 13 56 Li 0.82371737572267 0.86725021659934 0.95461493819131 6.941 > 13 57 Li 0.84349546602312 0.12003672393987 0.45966007935030 6.941 > 17 58 Li 0.84349546602312 0.62003672393987 0.45966007935030 6.941 > 17 59 Li 0.84349546602312 0.12003672393987 0.95966007935030 6.941 > 17 60 Li 0.84349546602312 0.62003672393987 0.95966007935030 6.941 > 17 61 Li 0.65987192584968 0.12862393393007 0.29028585613296 6.941 > 21 62 Li 0.65987192584968 0.62862393393007 0.29028585613296 6.941 > 21 63 Li 0.65987192584968 0.12862393393007 0.79028585613296 6.941 > 21 64 Li 0.65987192584968 0.62862393393007 0.79028585613296 6.941 > 21 65 Li 0.99863119805920 0.39294988621880 0.38602441625501 6.941 > 25 66 Li 0.99863119805920 0.89294988621880 0.38602441625501 6.941 > 25 67 Li 0.99863119805920 0.39294988621880 0.88602441625501 6.941 > 25 68 Li 0.99863119805920 0.89294988621880 0.88602441625501 6.941 > 25 69 Li 0.67486462105184 0.38135014186110 0.28973884211385 6.941 > 29 70 Li 0.67486462105184 0.88135014186110 0.28973884211385 6.941 > 29 71 Li 0.67486462105184 0.38135014186110 0.78973884211385 6.941 > 29 72 Li 0.67486462105184 0.88135014186110 0.78973884211385 6.941 > 29 73 Li 0.82371737572267 0.13274978340066 0.20461493819131 6.941 > 33 74 Li 0.82371737572267 0.63274978340066 0.20461493819131 6.941 > 33 75 Li 0.82371737572267 0.13274978340066 0.70461493819131 6.941 > 33 76 Li 0.82371737572267 0.63274978340066 0.70461493819131 6.941 > 33 77 Li 0.65987192584968 0.37137606606993 0.04028585613296 6.941 > 37 78 Li 0.65987192584968 0.87137606606993 0.04028585613296 6.941 > 37 79 Li 0.65987192584968 0.37137606606993 0.54028585613296 6.941 > 37 80 Li 0.65987192584968 0.87137606606993 0.54028585613296 6.941 > 37 81 Si 0.49990547199228 0.41102241099621 0.34868104246721 28.085 > 81 82 Si 0.49990547199228 0.91102241099621 0.34868104246721 28.085 > 81 83 Si 0.49990547199228 0.41102241099621 0.84868104246721 28.085 > 81 84 Si 0.49990547199228 0.91102241099621 0.84868104246721 28.085 > 81 85 Si 0.49990547199228 0.08897758900379 0.09868104246721 28.085 > 85 86 Si 0.49990547199228 0.58897758900379 0.09868104246721 28.085 > 85 87 Si 0.49990547199228 0.08897758900379 0.59868104246721 28.085 > 85 88 Si 0.49990547199228 0.58897758900379 0.59868104246721 28.085 > 85 89 Si 0.99990547199228 0.16102241099621 0.34868104246721 28.085 > 81 90 Si 0.99990547199228 0.66102241099621 0.34868104246721 28.085 > 81 91 Si 0.99990547199228 0.16102241099621 0.84868104246721 28.085 > 81 92 Si 0.99990547199228 0.66102241099621 0.84868104246721 28.085 > 81 93 Si 0.99990547199228 0.33897758900379 0.09868104246721 28.085 > 85 94 Si 0.99990547199228 0.83897758900379 0.09868104246721 28.085 > 85 95 Si 0.99990547199228 0.33897758900379 0.59868104246721 28.085 > 85 96 Si 0.99990547199228 0.83897758900379 0.59868104246721 28.085 > 85 97 P 0.00036023711247 0.48268792316241 0.01875167301956 30.974 > 97 98 P 0.00036023711247 0.98268792316241 0.01875167301956 30.974 > 97 99 P 0.00036023711247 0.48268792316241 0.51875167301956 30.974 > 97 100 P 0.00036023711247 0.98268792316241 0.51875167301956 30.974 > 97 101 P 0.34159110999185 0.49397030627507 0.33611813257999 30.974 > 101 102 P 0.34159110999185 0.99397030627507 0.33611813257999 30.974 > 101 103 P 0.34159110999185 0.49397030627507 0.83611813257999 30.974 > 101 104 P 0.34159110999185 0.99397030627507 0.83611813257999 30.974 > 101 105 P 0.00036023711247 0.01731207683759 0.26875167301956 30.974 > 105 106 P 0.00036023711247 0.51731207683759 0.26875167301956 30.974 > 105 107 P 0.00036023711247 0.01731207683759 0.76875167301956 30.974 > 105 108 P 0.00036023711247 0.51731207683759 0.76875167301956 30.974 > 105 109 P 0.15745828419691 0.25478613149354 0.16312223988981 30.974 > 109 110 P 0.15745828419691 0.75478613149354 0.16312223988981 30.974 > 109 111 P 0.15745828419691 0.25478613149354 0.66312223988981 30.974 > 109 112 P 0.15745828419691 0.75478613149354 0.66312223988981 30.974 > 109 113 P 0.34159110999185 0.00602969372493 0.08611813257999 30.974 > 113 114 P 0.34159110999185 0.50602969372493 0.08611813257999 30.974 > 113 115 P 0.34159110999185 0.00602969372493 0.58611813257999 30.974 > 113 116 P 0.34159110999185 0.50602969372493 0.58611813257999 30.974 > 113 117 P 0.15745828419691 0.24521386850647 0.41312223988981 30.974 > 117 118 P 0.15745828419691 0.74521386850646 0.41312223988981 30.974 > 117 119 P 0.15745828419691 0.24521386850647 0.91312223988981 30.974 > 117 120 P 0.15745828419691 0.74521386850646 0.91312223988981 30.974 > 117 121 P 0.50036023711247 0.23268792316241 0.01875167301956 30.974 > 97 122 P 0.50036023711247 0.73268792316241 0.01875167301956 30.974 > 97 123 P 0.50036023711247 0.23268792316241 0.51875167301956 30.974 > 97 124 P 0.50036023711247 0.73268792316241 0.51875167301956 30.974 > 97 125 P 0.84159110999185 0.24397030627507 0.33611813257999 30.974 > 101 126 P 0.84159110999185 0.74397030627507 0.33611813257999 30.974 > 101 127 P 0.84159110999185 0.24397030627507 0.83611813257999 30.974 > 101 128 P 0.84159110999185 0.74397030627507 0.83611813257999 30.974 > 101 129 P 0.50036023711247 0.26731207683759 0.26875167301956 30.974 > 105 130 P 0.50036023711247 0.76731207683759 0.26875167301956 30.974 > 105 131 P 0.50036023711247 0.26731207683759 0.76875167301956 30.974 > 105 132 P 0.50036023711247 0.76731207683759 0.76875167301956 30.974 > 105 133 P 0.65745828419691 0.00478613149354 0.16312223988981 30.974 > 109 134 P 0.65745828419691 0.50478613149354 0.16312223988981 30.974 > 109 135 P 0.65745828419691 0.00478613149354 0.66312223988981 30.974 > 109 136 P 0.65745828419691 0.50478613149354 0.66312223988981 30.974 > 109 137 P 0.84159110999185 0.25602969372493 0.08611813257999 30.974 > 113 138 P 0.84159110999185 0.75602969372493 0.08611813257999 30.974 > 113 139 P 0.84159110999185 0.25602969372493 0.58611813257999 30.974 > 113 140 P 0.84159110999185 0.75602969372493 0.58611813257999 30.974 > 113 141 P 0.65745828419691 0.49521386850646 0.41312223988981 30.974 > 117 142 P 0.65745828419691 0.99521386850646 0.41312223988981 30.974 > 117 143 P 0.65745828419691 0.49521386850646 0.91312223988981 30.974 > 117 144 P 0.65745828419691 0.99521386850646 0.91312223988981 30.974 > 117 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 8.1132771 0.0000000 0.4277405 0.0000000 7.7638208 0.0000000 0.4277665 0.0000000 6.9657686 -------------------------- Born effective charges -------------------------- 1 Li 1.0039151 -0.4528957 0.0717722 -0.0452449 1.1415009 -0.2317393 0.2440304 -0.0785948 1.0895562 2 Li 0.5319558 0.0258698 -0.1277500 -0.0844479 0.9889126 0.2149516 -0.1326759 -0.1916416 0.8579360 3 Li 1.2351594 0.4413892 0.0450877 0.2752162 0.8336223 0.2901057 -0.1328925 0.2312058 0.8498610 4 Li 0.8972962 -0.3678107 0.0101339 -0.0877790 0.5718197 0.1801629 0.1959868 -0.0015976 0.9863456 5 Li 1.0039151 0.4528957 0.0717722 0.0452449 1.1415009 0.2317393 0.2440304 0.0785948 1.0895562 6 Li 0.9487669 0.3163932 -0.0561044 -0.0960983 0.9425684 -0.2732889 -0.1948691 0.1978754 0.8782870 7 Li 0.5319558 -0.0258698 -0.1277500 0.0844479 0.9889126 -0.2149516 -0.1326759 0.1916416 0.8579360 8 Li 1.2351594 -0.4413892 0.0450877 -0.2752162 0.8336223 -0.2901057 -0.1328925 -0.2312058 0.8498610 9 Li 0.8972962 0.3678107 0.0101339 0.0877790 0.5718197 -0.1801629 0.1959868 0.0015976 0.9863456 10 Li 0.9487669 -0.3163932 -0.0561044 0.0960983 0.9425684 0.2732889 -0.1948691 -0.1978754 0.8782870 11 Si 2.8696772 -0.5395597 0.6890918 -0.3591069 2.1693269 1.2159225 0.6949836 1.2674541 1.2555337 12 Si 2.8696772 0.5395597 0.6890918 0.3591069 2.1693269 -1.2159225 0.6949836 -1.2674541 1.2555337 13 P -1.8512816 -0.2450017 0.0633490 -0.2637549 -2.6062314 0.5685492 0.0667748 0.7701359 -2.1067710 14 P -2.9890642 0.6132447 -0.2033972 0.6642451 -2.0673113 0.2067219 -0.1746314 -0.2253352 -1.7557866 15 P -1.8512816 0.2450017 0.0633490 0.2637549 -2.6062314 -0.5685492 0.0667748 -0.7701359 -2.1067710 16 P -2.6464247 0.3500019 -0.4921830 0.5205210 -1.9742080 0.4284565 -0.5667067 0.6226147 -2.0549619 17 P -2.9890642 -0.6132447 -0.2033972 -0.6642451 -2.0673113 -0.2067219 -0.1746314 0.2253352 -1.7557866 18 P -2.6464247 -0.3500019 -0.4921830 -0.5205210 -1.9742080 -0.4284565 -0.5667067 -0.6226147 -2.0549619 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000000 (yyy) -0.00000000 (yyy) -0.00000000 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 6 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.62, Number of G-points: 307, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/172) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 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 3.211 ( 0.000 0.000 0.000) 0.000 3.635 ( 0.000 0.000 0.000) 0.000 4.118 ( 0.000 0.000 0.000) 0.000 4.131 ( 0.000 0.000 0.000) 0.000 4.828 ( 0.000 0.000 -0.000) 0.000 4.878 ( 0.000 0.000 0.000) 0.000 5.228 ( 0.000 0.000 0.000) 0.000 5.314 ( 0.000 0.000 0.000) 0.000 5.677 ( 0.000 0.000 0.000) 0.000 6.007 ( 0.000 0.000 0.000) 0.000 6.038 ( 0.000 0.000 0.000) 0.000 6.108 ( 0.000 0.000 0.000) 0.000 6.343 ( 0.000 0.000 0.000) 0.000 6.564 ( 0.000 0.000 0.000) 0.000 6.620 ( 0.000 0.000 0.000) 0.000 6.732 ( 0.000 0.000 0.000) 0.000 6.906 ( -0.000 0.000 0.000) 0.000 7.443 ( 0.000 0.000 0.000) 0.000 7.924 ( 0.000 0.000 0.000) 0.000 8.085 ( 0.000 0.000 0.000) 0.000 8.264 ( 0.000 0.000 0.000) 0.000 8.310 ( 0.000 0.000 0.000) 0.000 8.429 ( 0.000 0.000 0.000) 0.000 8.633 ( 0.000 0.000 0.000) 0.000 8.982 ( 0.000 0.000 0.000) 0.000 9.231 ( 0.000 0.000 0.000) 0.000 9.269 ( 0.000 0.000 0.000) 0.000 9.672 ( -0.000 0.000 0.000) 0.000 9.674 ( 0.000 0.000 0.000) 0.000 10.120 ( 0.000 0.000 0.000) 0.000 10.282 ( 0.000 0.000 0.000) 0.000 10.393 ( 0.000 0.000 0.000) 0.000 10.519 ( 0.000 0.000 0.000) 0.000 10.685 ( 0.000 0.000 0.000) 0.000 10.784 ( 0.000 0.000 0.000) 0.000 11.171 ( 0.000 0.000 0.000) 0.000 11.242 ( 0.000 0.000 0.000) 0.000 11.432 ( 0.000 0.000 0.000) 0.000 11.482 ( 0.000 0.000 0.000) 0.000 11.801 ( 0.000 0.000 0.000) 0.000 11.864 ( 0.000 0.000 0.000) 0.000 12.055 ( 0.000 0.000 0.000) 0.000 12.133 ( 0.000 0.000 0.000) 0.000 12.399 ( 0.000 0.000 0.000) 0.000 12.466 ( 0.000 0.000 0.000) 0.000 12.806 ( 0.000 0.000 0.000) 0.000 13.450 ( 0.000 0.000 0.000) 0.000 15.762 ( 0.000 0.000 0.000) 0.000 16.034 ( 0.000 0.000 0.000) 0.000 16.072 ( 0.000 0.000 0.000) 0.000 16.150 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/172) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.691 ( 14.853 -34.532 1.708) 37.630 0.767 ( 16.020 -34.962 4.593) 38.731 1.239 ( 34.544 -52.254 13.492) 64.076 3.209 ( 0.340 -0.001 -2.108) 2.136 3.671 ( 3.555 -2.765 -2.595) 5.198 4.036 ( -3.090 5.222 -1.410) 6.229 4.142 ( -3.031 -0.157 0.071) 3.036 4.701 ( -5.622 9.031 -0.563) 10.653 4.836 ( -1.684 6.238 0.209) 6.465 5.084 ( -2.401 10.723 1.260) 11.061 5.382 ( 2.032 -0.638 1.824) 2.804 5.635 ( -4.364 1.048 -1.278) 4.667 5.966 ( 3.822 5.497 0.924) 6.759 6.083 ( 1.532 -0.103 0.624) 1.658 6.177 ( 2.365 -5.713 1.947) 6.482 6.429 ( -2.218 -3.843 -3.182) 5.460 6.568 ( -1.829 -3.180 1.196) 3.858 6.659 ( -0.517 -1.956 0.750) 2.158 6.770 ( 1.294 -1.527 1.931) 2.781 6.960 ( 0.296 -3.473 0.618) 3.540 7.483 ( 1.043 -3.826 -0.571) 4.006 7.948 ( -2.517 -0.932 1.426) 3.039 8.097 ( -0.625 -3.130 0.150) 3.195 8.303 ( 0.779 -3.073 -1.515) 3.514 8.432 ( -5.656 -5.813 -0.741) 8.144 8.573 ( -2.680 -6.063 -3.150) 7.339 8.704 ( -2.163 -3.541 0.336) 4.163 9.022 ( 0.592 -0.302 6.214) 6.249 9.248 ( 0.075 -1.362 1.577) 2.085 9.293 ( 5.054 -0.265 -7.097) 8.716 9.653 ( -1.993 1.575 -0.967) 2.718 9.689 ( -0.379 0.790 -1.433) 1.680 10.105 ( 3.174 2.592 1.159) 4.258 10.301 ( -2.876 -3.046 -0.003) 4.189 10.409 ( -0.260 -0.728 1.540) 1.724 10.520 ( -1.609 -0.608 -0.780) 1.888 10.735 ( 5.581 -0.785 -0.213) 5.640 11.018 ( 0.742 4.460 1.480) 4.758 11.178 ( -3.373 -1.301 0.454) 3.644 11.327 ( -4.454 1.213 -0.539) 4.648 11.430 ( 0.214 -0.099 -4.375) 4.382 11.626 ( -10.091 -4.216 -1.584) 11.050 11.752 ( -1.393 4.689 -0.272) 4.899 11.936 ( 11.401 6.928 3.951) 13.914 12.039 ( 5.267 5.321 0.106) 7.488 12.210 ( -2.837 2.886 0.452) 4.072 12.440 ( -2.681 0.813 1.472) 3.165 12.630 ( -3.335 -4.411 -15.291) 16.261 12.939 ( 10.655 8.537 16.493) 21.411 13.425 ( 1.056 3.925 -1.732) 4.418 15.860 ( 11.688 1.239 2.228) 11.963 16.052 ( 2.759 0.057 0.505) 2.806 16.149 ( 0.303 -0.673 -0.695) 1.014 16.653 ( -1.036 1.200 0.763) 1.759 ======================= Grid point 2 (3/172) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( 13.773 -31.727 2.299) 34.664 1.483 ( 13.389 -33.742 3.030) 36.427 2.369 ( 30.560 -44.243 11.218) 54.929 3.209 ( 0.665 -0.853 -3.264) 3.439 3.752 ( 5.152 -2.968 -8.275) 10.189 3.901 ( -4.054 5.795 -1.559) 7.242 4.090 ( -4.076 2.922 2.055) 5.419 4.475 ( -7.361 10.833 -0.413) 13.103 4.663 ( -1.157 10.797 0.905) 10.896 4.886 ( -4.795 8.729 1.258) 10.039 5.333 ( 0.102 6.786 2.240) 7.147 5.600 ( -2.783 0.353 -0.515) 2.852 5.909 ( 2.882 4.670 -0.422) 5.504 6.073 ( 3.376 4.069 5.086) 7.336 6.246 ( -0.272 0.895 0.301) 0.983 6.496 ( -3.110 -10.111 -4.843) 11.634 6.643 ( -2.488 -5.103 -2.390) 6.159 6.728 ( 0.705 -5.634 3.350) 6.592 6.833 ( -0.172 -4.751 -2.487) 5.366 7.024 ( 0.933 -3.344 1.337) 3.720 7.566 ( 2.549 -3.948 -0.612) 4.739 7.946 ( -4.296 -1.690 2.216) 5.121 8.216 ( 0.172 -10.319 0.774) 10.349 8.371 ( 0.405 -4.975 -2.058) 5.399 8.524 ( -1.984 -8.787 -0.919) 9.055 8.633 ( -4.819 -5.823 -0.977) 7.622 8.794 ( 0.312 -6.798 0.536) 6.826 9.042 ( -1.594 -0.895 2.236) 2.889 9.262 ( -2.187 0.052 4.087) 4.635 9.348 ( 3.406 -3.587 -3.280) 5.935 9.606 ( 0.814 1.387 -1.536) 2.224 9.685 ( 0.561 -1.320 -1.006) 1.752 10.110 ( 4.471 1.037 2.410) 5.185 10.320 ( -6.052 -2.281 0.035) 6.468 10.414 ( 3.300 1.858 -0.696) 3.851 10.522 ( -3.126 -2.498 -0.740) 4.069 10.782 ( 1.953 -0.280 0.207) 1.984 10.943 ( -0.391 5.022 3.205) 5.971 11.156 ( -4.820 -0.350 -1.317) 5.009 11.256 ( -1.401 4.274 -1.597) 4.773 11.391 ( 1.291 4.541 -4.530) 6.542 11.564 ( -5.665 4.277 3.089) 7.742 11.668 ( 2.083 3.932 -2.431) 5.070 11.905 ( 6.228 7.838 3.120) 10.486 11.965 ( 5.865 7.110 0.308) 9.222 12.122 ( -4.138 3.484 0.523) 5.435 12.401 ( -1.349 2.073 1.226) 2.760 12.645 ( 0.586 -2.122 -6.353) 6.724 12.908 ( 1.527 4.619 7.065) 8.577 13.346 ( 2.831 6.098 -2.228) 7.082 15.963 ( 6.177 -3.892 1.370) 7.428 16.050 ( 2.709 2.262 -2.273) 4.198 16.194 ( 1.852 -3.306 1.359) 4.026 16.620 ( -1.017 1.588 -0.521) 1.956 ======================= Grid point 3 (4/172) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 11.356 -27.438 2.502) 29.800 2.136 ( 10.316 -30.579 1.718) 32.318 3.101 ( 6.494 -9.559 -1.122) 11.611 3.339 ( 11.308 -16.701 2.916) 20.379 3.681 ( -2.503 7.083 -8.662) 11.466 3.878 ( 4.822 -1.942 -3.414) 6.219 4.005 ( -0.823 5.467 4.698) 7.255 4.236 ( -5.774 9.024 0.006) 10.713 4.538 ( 3.667 3.677 3.473) 6.247 4.738 ( -5.459 3.808 0.720) 6.695 5.210 ( -0.460 7.515 2.880) 8.061 5.555 ( -2.101 2.208 -0.517) 3.092 5.836 ( 0.787 5.184 -2.849) 5.967 6.017 ( 0.296 5.599 5.701) 7.997 6.226 ( -0.118 -0.065 0.317) 0.345 6.614 ( -4.848 -4.804 -3.428) 7.637 6.697 ( -1.112 -5.116 -3.387) 6.235 6.810 ( -3.832 -5.167 -0.124) 6.434 6.928 ( 3.163 -5.292 -0.669) 6.201 7.108 ( 1.995 -4.413 2.149) 5.299 7.647 ( 4.016 -2.640 -0.020) 4.806 7.949 ( -6.620 -2.782 1.643) 7.366 8.378 ( -1.883 -6.693 -0.075) 6.953 8.481 ( 1.619 -7.575 -1.314) 7.857 8.654 ( -1.775 -7.043 -0.091) 7.264 8.785 ( 1.181 -15.326 2.298) 15.543 8.895 ( -2.858 -5.374 -2.329) 6.517 9.054 ( -3.926 -4.303 -1.020) 5.913 9.236 ( -1.031 2.464 4.574) 5.297 9.422 ( 2.006 -3.038 -0.801) 3.728 9.650 ( 6.975 -3.072 -0.917) 7.677 9.760 ( 1.737 -6.838 -0.516) 7.074 10.124 ( 1.687 3.013 3.136) 4.664 10.264 ( -5.964 1.758 0.358) 6.228 10.403 ( 4.774 3.200 -2.180) 6.146 10.548 ( -2.390 -2.938 -1.433) 4.049 10.750 ( -2.752 4.468 0.781) 5.305 10.858 ( -2.247 5.040 3.353) 6.457 11.102 ( -3.484 4.246 0.545) 5.519 11.149 ( -2.720 2.625 -1.978) 4.266 11.309 ( 2.243 3.446 -6.140) 7.390 11.455 ( -1.505 6.001 3.798) 7.260 11.591 ( 2.862 8.617 0.074) 9.080 11.765 ( 2.638 9.932 -3.568) 10.878 11.903 ( 4.093 7.036 3.682) 8.934 12.073 ( -2.008 -1.355 0.857) 2.570 12.362 ( -0.972 1.602 1.031) 2.139 12.670 ( 1.538 -0.998 -3.110) 3.610 12.852 ( -1.713 2.952 2.287) 4.108 13.261 ( 3.316 5.938 -1.152) 6.898 16.004 ( 2.552 3.085 -1.800) 4.390 16.092 ( 2.229 -4.947 -0.359) 5.438 16.283 ( 3.207 -3.970 2.135) 5.532 16.585 ( -0.705 1.478 -0.867) 1.852 ======================= Grid point 4 (5/172) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( 7.365 -19.394 2.144) 20.856 2.689 ( 7.075 -25.286 1.183) 26.284 3.150 ( 0.173 -1.064 -3.594) 3.752 3.406 ( -4.433 8.871 -4.409) 10.853 3.560 ( -2.137 7.298 -1.832) 7.822 3.865 ( -2.767 3.903 -0.893) 4.867 3.959 ( 0.958 4.722 0.960) 4.913 4.253 ( 14.780 -6.587 4.824) 16.885 4.616 ( 6.894 -2.319 3.432) 8.043 4.676 ( -6.806 -3.551 -0.740) 7.712 5.099 ( -0.720 5.364 2.392) 5.917 5.504 ( -2.836 1.210 0.213) 3.091 5.735 ( -0.142 5.128 -4.050) 6.536 5.977 ( 2.433 0.381 4.187) 4.858 6.221 ( -2.258 0.793 -0.391) 2.425 6.562 ( -5.299 2.472 -1.833) 6.128 6.764 ( -0.448 -3.261 -1.889) 3.795 6.876 ( -2.092 -4.622 -0.129) 5.075 7.024 ( 2.339 -3.026 -0.555) 3.865 7.197 ( 1.431 -3.134 1.590) 3.795 7.722 ( 4.806 -1.866 0.760) 5.211 7.937 ( -7.185 -1.846 0.074) 7.419 8.427 ( -1.995 -2.063 0.025) 2.870 8.613 ( 1.784 -6.005 -0.438) 6.279 8.748 ( 0.003 -4.128 0.668) 4.182 8.863 ( -2.246 2.312 -1.696) 3.642 9.119 ( -3.712 -6.772 -1.488) 7.865 9.144 ( 0.811 -14.233 1.082) 14.297 9.260 ( 0.822 -9.582 1.804) 9.785 9.479 ( 1.291 -1.934 1.642) 2.847 9.764 ( 11.065 -0.191 -2.316) 11.307 9.912 ( 0.097 -7.222 1.373) 7.352 10.017 ( -2.014 6.429 2.062) 7.045 10.223 ( -4.410 0.161 2.774) 5.212 10.343 ( 4.701 6.994 -5.722) 10.186 10.531 ( -5.060 4.321 1.047) 6.736 10.613 ( -4.458 3.380 0.248) 5.600 10.780 ( 2.249 3.315 1.066) 4.145 11.040 ( -2.368 -0.383 1.221) 2.691 11.117 ( -4.421 -1.453 -0.268) 4.662 11.247 ( 2.257 5.459 -4.069) 7.173 11.373 ( 1.300 4.225 1.373) 4.629 11.435 ( 0.367 8.071 0.266) 8.083 11.633 ( 2.205 6.683 -2.322) 7.411 11.818 ( 1.060 5.206 1.796) 5.609 12.120 ( 0.552 -3.126 1.236) 3.407 12.338 ( -0.728 0.743 0.384) 1.109 12.672 ( -0.086 0.760 -1.006) 1.264 12.814 ( -0.670 0.356 -0.488) 0.902 13.194 ( 2.014 3.908 0.003) 4.397 15.969 ( 1.319 1.983 -1.372) 2.749 16.166 ( 0.263 -2.476 -0.262) 2.503 16.385 ( 3.124 -4.014 1.780) 5.389 16.551 ( -0.741 1.677 -0.862) 2.026 ======================= Grid point 5 (6/172) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( 0.000 -0.000 0.000) 0.000 3.040 ( 0.000 -0.000 -0.000) 0.000 3.164 ( -0.000 -0.000 0.000) 0.000 3.210 ( 0.000 -0.000 0.000) 0.000 3.427 ( -0.000 -0.000 0.000) 0.000 3.811 ( 0.000 -0.000 0.000) 0.000 3.910 ( -0.000 -0.000 -0.000) 0.000 4.418 ( -0.000 -0.000 -0.000) 0.000 4.606 ( 0.000 -0.000 0.000) 0.000 4.747 ( 0.000 -0.000 -0.000) 0.000 5.050 ( 0.000 -0.000 0.000) 0.000 5.478 ( -0.000 -0.000 -0.000) 0.000 5.677 ( -0.000 -0.000 0.000) 0.000 6.031 ( 0.000 -0.000 -0.000) 0.000 6.171 ( 0.000 -0.000 -0.000) 0.000 6.509 ( 0.000 -0.000 0.000) 0.000 6.787 ( -0.000 -0.000 -0.000) 0.000 6.910 ( 0.000 -0.000 0.000) 0.000 7.059 ( 0.000 -0.000 -0.000) 0.000 7.233 ( 0.000 -0.000 0.000) 0.000 7.768 ( -0.000 -0.000 -0.000) 0.000 7.915 ( 0.000 -0.000 0.000) 0.000 8.436 ( 0.000 -0.000 0.000) 0.000 8.685 ( -0.000 -0.000 0.000) 0.000 8.790 ( 0.000 -0.000 -0.000) 0.000 8.810 ( 0.000 -0.000 0.000) 0.000 9.125 ( 0.000 -0.000 -0.000) 0.000 9.300 ( 0.000 -0.000 0.000) 0.000 9.405 ( 0.000 -0.000 -0.000) 0.000 9.566 ( 0.000 -0.000 0.000) 0.000 9.742 ( -0.000 0.000 0.000) 0.000 9.931 ( 0.000 -0.000 -0.000) 0.000 10.012 ( -0.000 -0.000 0.000) 0.000 10.186 ( -0.000 -0.000 0.000) 0.000 10.281 ( 0.000 -0.000 -0.000) 0.000 10.453 ( 0.000 -0.000 0.000) 0.000 10.570 ( -0.000 -0.000 0.000) 0.000 10.775 ( 0.000 -0.000 0.000) 0.000 11.039 ( 0.000 -0.000 -0.000) 0.000 11.121 ( 0.000 -0.000 -0.000) 0.000 11.185 ( 0.000 -0.000 0.000) 0.000 11.314 ( 0.000 -0.000 0.000) 0.000 11.395 ( 0.000 -0.000 -0.000) 0.000 11.575 ( -0.000 -0.000 0.000) 0.000 11.777 ( 0.000 -0.000 -0.000) 0.000 12.157 ( 0.000 -0.000 0.000) 0.000 12.328 ( 0.000 -0.000 0.000) 0.000 12.658 ( 0.000 -0.000 0.000) 0.000 12.812 ( 0.000 -0.000 0.000) 0.000 13.167 ( 0.000 -0.000 0.000) 0.000 15.955 ( 0.000 -0.000 -0.000) 0.000 16.186 ( -0.000 -0.000 0.000) 0.000 16.449 ( 0.000 -0.000 0.000) 0.000 16.520 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 12 (7/172) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.646 ( 35.726 0.000 13.811) 38.302 0.697 ( 39.128 0.000 12.877) 41.193 1.214 ( 67.910 0.000 21.596) 71.261 3.216 ( 2.094 0.000 -4.378) 4.853 3.674 ( 6.545 0.000 -5.123) 8.312 4.063 ( -6.602 -0.000 -0.922) 6.666 4.075 ( -5.899 -0.000 -1.548) 6.099 4.687 ( -13.953 -0.000 -2.423) 14.162 4.904 ( 1.025 0.000 2.760) 2.944 5.203 ( -5.612 -0.000 3.871) 6.817 5.348 ( -0.360 -0.000 1.683) 1.721 5.613 ( -3.266 -0.000 -1.161) 3.466 5.974 ( -3.364 -0.000 -5.345) 6.316 6.132 ( 10.717 0.000 4.395) 11.583 6.241 ( 4.224 0.000 6.862) 8.058 6.342 ( 0.391 0.000 -1.309) 1.366 6.509 ( -6.890 -0.000 -3.056) 7.538 6.633 ( 0.927 0.000 1.394) 1.674 6.812 ( -5.697 -0.000 7.253) 9.223 6.911 ( 1.428 0.000 -1.730) 2.244 7.454 ( 1.601 0.000 -0.623) 1.718 7.892 ( -4.637 -0.000 2.470) 5.254 8.082 ( -0.552 -0.000 -0.952) 1.101 8.238 ( -2.393 -0.000 2.016) 3.129 8.348 ( 4.038 0.000 -3.472) 5.325 8.481 ( -2.445 -0.000 -3.282) 4.093 8.611 ( -3.038 -0.000 0.586) 3.094 9.055 ( -2.265 -0.000 8.038) 8.351 9.232 ( -1.045 -0.000 2.794) 2.983 9.330 ( 4.702 0.000 -15.250) 15.959 9.658 ( -1.643 -0.000 -2.562) 3.043 9.659 ( -0.260 -0.000 -1.039) 1.071 10.169 ( 4.280 0.000 1.353) 4.489 10.239 ( -6.702 -0.000 -1.218) 6.812 10.394 ( -3.624 -0.000 3.806) 5.255 10.516 ( 0.498 0.000 -0.634) 0.806 10.798 ( 1.659 0.000 -0.110) 1.662 11.001 ( -3.253 -0.000 1.877) 3.756 11.189 ( 0.792 0.000 -0.740) 1.084 11.206 ( -2.597 -0.000 -2.686) 3.736 11.453 ( 3.995 0.000 -3.954) 5.621 11.514 ( 1.803 0.000 2.527) 3.104 11.778 ( -3.005 -0.000 0.426) 3.035 12.066 ( 2.140 0.000 4.726) 5.187 12.136 ( -0.291 -0.000 1.182) 1.217 12.256 ( 2.172 0.000 1.612) 2.704 12.415 ( 2.677 0.000 -0.726) 2.773 12.558 ( 5.927 0.000 -11.919) 13.311 13.207 ( -0.931 -0.000 10.170) 10.213 13.432 ( -1.412 -0.000 -1.936) 2.396 16.061 ( 6.161 0.000 -2.780) 6.760 16.067 ( -0.052 -0.000 -1.793) 1.793 16.151 ( 1.046 0.000 -2.031) 2.285 16.679 ( -0.807 -0.000 4.590) 4.660 ======================= Grid point 13 (8/172) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( 30.041 -17.835 9.098) 36.101 1.201 ( 30.621 -18.687 9.570) 37.127 2.083 ( 53.512 -29.520 18.085) 63.735 3.210 ( 2.637 0.789 -5.545) 6.191 3.736 ( 8.010 -1.992 -9.983) 12.953 3.940 ( -7.190 4.326 -1.437) 8.513 4.054 ( -7.150 -1.570 0.524) 7.339 4.518 ( -14.542 4.952 -2.195) 15.519 4.844 ( 1.389 8.520 2.680) 9.039 5.021 ( -6.940 11.052 3.906) 13.623 5.407 ( -3.086 -2.134 3.321) 5.010 5.555 ( -2.558 2.011 -0.545) 3.299 5.982 ( -0.419 -1.150 -3.287) 3.508 6.183 ( 4.721 4.444 4.416) 7.844 6.250 ( 5.485 -0.849 2.622) 6.139 6.360 ( -3.538 -0.665 -4.519) 5.778 6.508 ( -4.035 -6.798 -2.187) 8.202 6.665 ( -0.250 -2.294 1.208) 2.605 6.786 ( 0.533 -1.177 0.566) 1.410 6.967 ( 0.899 -3.949 -0.299) 4.061 7.510 ( 3.025 -4.370 -1.263) 5.462 7.884 ( -6.803 -1.872 3.480) 7.868 8.091 ( -0.415 -3.784 -0.261) 3.816 8.292 ( -1.487 -4.742 -0.894) 5.049 8.377 ( 0.172 -4.193 -2.095) 4.691 8.504 ( -3.944 -4.251 -2.221) 6.210 8.659 ( -4.275 -7.496 1.364) 8.736 9.045 ( -0.884 1.113 2.843) 3.179 9.246 ( -2.059 -1.279 3.876) 4.571 9.323 ( 2.235 -0.910 -5.714) 6.203 9.614 ( -1.555 1.418 -1.534) 2.604 9.680 ( 1.055 -0.879 -1.167) 1.802 10.151 ( -4.023 0.549 0.465) 4.087 10.227 ( -2.417 -2.006 1.302) 3.400 10.389 ( -1.861 -1.822 1.348) 2.932 10.530 ( 3.078 0.530 -0.527) 3.168 10.811 ( 4.004 0.232 -0.841) 4.098 11.008 ( -3.816 0.173 2.016) 4.320 11.116 ( -2.465 2.399 -0.160) 3.443 11.241 ( -2.528 -2.151 -4.173) 5.332 11.438 ( 2.461 2.539 -1.914) 4.021 11.568 ( -0.830 -1.067 0.069) 1.354 11.720 ( -2.049 2.864 -0.120) 3.524 12.040 ( 1.430 4.631 4.364) 6.522 12.133 ( -1.602 1.356 1.458) 2.555 12.196 ( 6.024 8.626 1.361) 10.609 12.432 ( 1.632 1.403 0.719) 2.269 12.604 ( 4.232 -2.732 -6.461) 8.192 13.094 ( 3.148 11.173 7.157) 13.637 13.422 ( 0.456 1.341 -3.463) 3.742 16.010 ( 5.390 2.539 -0.257) 5.963 16.108 ( 4.022 1.732 -3.558) 5.642 16.172 ( 3.320 -2.211 1.241) 4.178 16.651 ( 0.468 2.794 1.248) 3.096 ======================= Grid point 14 (9/172) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 22.754 -22.330 5.680) 32.383 1.796 ( 22.132 -23.087 6.112) 32.561 2.961 ( 30.498 -21.921 8.608) 38.532 3.229 ( 6.070 -4.317 -2.777) 7.949 3.733 ( -1.876 4.133 -10.409) 11.356 3.859 ( 0.241 -1.589 -5.345) 5.582 4.044 ( -0.355 -0.670 4.176) 4.244 4.304 ( -11.469 6.276 -0.937) 13.108 4.695 ( 2.480 9.990 2.754) 10.655 4.808 ( -6.218 8.321 4.565) 11.346 5.333 ( -2.473 6.990 2.319) 7.769 5.542 ( -3.880 -1.180 0.649) 4.107 5.938 ( 0.901 4.969 -1.305) 5.216 6.098 ( -5.526 4.481 2.077) 7.411 6.269 ( 3.461 4.146 1.796) 5.692 6.440 ( -0.027 -10.486 -4.445) 11.389 6.597 ( -0.509 -5.932 -3.104) 6.714 6.700 ( -3.098 -3.232 -0.704) 4.532 6.865 ( 3.459 -5.134 0.201) 6.194 7.049 ( 1.498 -4.448 1.136) 4.829 7.620 ( 4.852 -4.634 -0.976) 6.780 7.861 ( -8.013 -1.498 2.832) 8.630 8.212 ( -1.430 -9.795 -0.098) 9.899 8.366 ( -0.142 -6.150 -0.301) 6.159 8.494 ( -0.700 -8.515 -2.698) 8.959 8.567 ( -3.038 -9.016 0.791) 9.547 8.765 ( -3.977 -7.605 0.531) 8.598 9.016 ( -1.793 1.387 -1.035) 2.491 9.259 ( -1.430 -0.510 4.130) 4.400 9.367 ( 0.212 -3.952 -1.831) 4.361 9.599 ( -0.702 -2.007 -0.197) 2.135 9.722 ( 4.538 -2.411 -1.008) 5.237 10.136 ( -7.003 -3.456 0.310) 7.816 10.229 ( -2.361 0.994 3.578) 4.401 10.421 ( 0.182 -2.426 -3.119) 3.956 10.539 ( 4.530 1.979 -0.236) 4.949 10.812 ( 1.180 2.982 1.642) 3.603 10.946 ( -1.219 4.822 2.093) 5.396 11.061 ( -4.917 0.316 -1.828) 5.255 11.227 ( -1.057 1.864 -1.749) 2.766 11.359 ( -3.007 5.672 -2.825) 7.014 11.528 ( -0.128 3.232 1.029) 3.394 11.691 ( 1.690 1.217 -1.616) 2.636 11.939 ( -1.246 9.372 -0.031) 9.454 12.036 ( -3.229 5.908 3.183) 7.447 12.141 ( 8.700 5.749 1.938) 10.606 12.405 ( 1.123 2.930 1.377) 3.426 12.663 ( 3.394 -1.736 -2.774) 4.715 12.954 ( 1.232 8.748 3.249) 9.413 13.373 ( 2.562 4.547 -3.177) 6.110 16.040 ( 2.019 -0.446 -2.995) 3.639 16.089 ( 4.777 1.437 -0.704) 5.038 16.259 ( 4.573 -3.103 2.247) 5.966 16.612 ( 0.654 2.424 -0.161) 2.516 ======================= Grid point 15 (10/172) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( 16.838 -20.085 4.125) 26.532 2.352 ( 15.213 -23.076 3.190) 27.823 3.142 ( 3.177 0.202 -4.931) 5.869 3.456 ( 2.158 -0.680 -2.809) 3.607 3.600 ( -4.427 3.127 -4.888) 7.299 3.890 ( -3.181 0.057 -2.592) 4.104 4.061 ( 1.788 5.053 0.301) 5.368 4.261 ( 11.305 -6.745 7.261) 15.034 4.578 ( -3.352 3.734 -0.165) 5.021 4.711 ( 3.068 2.201 6.862) 7.833 5.187 ( -4.215 7.079 1.282) 8.338 5.504 ( -3.810 1.441 -0.414) 4.095 5.840 ( 1.569 6.731 -2.604) 7.386 6.014 ( -3.228 0.630 2.870) 4.365 6.230 ( 1.054 2.834 0.947) 3.168 6.542 ( -2.363 -1.796 -3.070) 4.270 6.691 ( 2.645 -4.972 -2.065) 5.998 6.753 ( -2.340 -6.676 -0.025) 7.075 6.982 ( 3.352 -4.628 -0.513) 5.738 7.144 ( 1.129 -4.510 1.534) 4.895 7.722 ( 4.191 -2.528 0.721) 4.947 7.840 ( -6.468 -3.002 0.409) 7.142 8.332 ( -4.006 -6.264 0.242) 7.439 8.505 ( 1.762 -8.124 -0.588) 8.334 8.623 ( -1.351 -8.915 -0.429) 9.027 8.804 ( -1.669 -16.409 1.407) 16.554 8.857 ( -0.124 -7.269 -0.885) 7.324 8.978 ( -3.284 -1.350 -2.788) 4.515 9.259 ( 0.672 1.057 2.854) 3.117 9.435 ( -0.441 -4.112 -0.772) 4.207 9.697 ( -0.131 -9.217 1.943) 9.421 9.826 ( 5.395 -5.033 -1.045) 7.452 10.131 ( -6.045 0.273 -0.115) 6.052 10.178 ( -2.327 2.486 5.245) 6.254 10.431 ( 0.647 1.173 -5.638) 5.795 10.526 ( 1.496 2.440 -0.468) 2.899 10.734 ( -0.796 8.209 2.648) 8.662 10.840 ( -1.704 4.768 1.759) 5.360 11.026 ( -3.999 -0.533 -3.252) 5.182 11.114 ( -2.392 6.587 2.577) 7.466 11.285 ( -1.051 0.226 -5.262) 5.370 11.467 ( 0.609 5.053 1.998) 5.467 11.629 ( 1.676 9.574 -0.120) 9.721 11.750 ( -1.887 7.179 -3.933) 8.401 11.914 ( -2.543 7.034 2.050) 7.755 12.146 ( 7.367 1.732 3.806) 8.471 12.369 ( 1.003 2.468 1.387) 3.003 12.692 ( 1.518 0.333 -0.569) 1.656 12.848 ( 1.006 4.551 -0.296) 4.670 13.294 ( 2.262 5.810 -2.120) 6.585 16.006 ( 0.079 2.438 -3.898) 4.598 16.146 ( 3.753 -1.892 1.008) 4.322 16.355 ( 4.065 -3.361 2.057) 5.662 16.577 ( 0.535 2.192 -0.538) 2.319 ======================= Grid point 16 (11/172) ======================= q-point: ( 0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.642 ( 10.552 -11.614 2.497) 15.890 2.832 ( 9.803 -20.323 1.769) 22.633 3.150 ( 1.487 -0.793 -3.023) 3.461 3.330 ( -2.030 9.210 -3.474) 10.051 3.498 ( -3.030 5.859 -3.570) 7.500 3.833 ( -1.062 1.802 0.387) 2.127 3.949 ( -1.030 5.664 0.980) 5.840 4.416 ( -4.804 0.487 -0.572) 4.862 4.532 ( -2.399 -1.808 0.848) 3.121 4.794 ( 6.998 -1.950 6.116) 9.496 5.060 ( -3.393 3.649 0.574) 5.016 5.466 ( -1.587 -0.577 0.668) 1.816 5.740 ( 3.129 5.336 -3.233) 6.980 6.056 ( 4.701 -2.309 1.038) 5.339 6.177 ( -1.812 3.432 2.341) 4.532 6.512 ( -0.556 0.496 -1.320) 1.515 6.768 ( 1.816 -2.518 -0.600) 3.162 6.865 ( 0.600 -5.466 0.820) 5.559 7.055 ( 1.944 -1.501 -1.023) 2.661 7.212 ( -0.214 -2.364 0.653) 2.462 7.744 ( -4.674 -0.622 0.527) 4.744 7.900 ( 4.918 -3.931 -0.172) 6.299 8.389 ( -3.134 -4.061 0.745) 5.184 8.636 ( 0.828 -5.494 0.252) 5.562 8.743 ( -0.105 -5.369 -0.306) 5.378 8.834 ( -0.656 2.327 -1.357) 2.772 9.037 ( -4.002 -8.172 -3.369) 9.703 9.181 ( 2.173 -16.759 1.081) 16.933 9.292 ( 2.146 -5.893 1.620) 6.477 9.481 ( -2.135 -2.311 0.578) 3.199 9.858 ( -5.491 -7.356 1.048) 9.239 9.915 ( 6.693 4.157 -1.234) 7.975 10.041 ( 2.537 2.465 3.004) 4.641 10.173 ( -3.203 -2.154 2.529) 4.614 10.323 ( -3.725 9.314 -2.288) 10.289 10.474 ( -2.918 1.165 -1.874) 3.658 10.570 ( -0.045 5.624 0.940) 5.702 10.822 ( 1.782 0.716 -0.481) 1.980 10.970 ( -4.645 0.878 -0.930) 4.818 11.073 ( -2.253 -2.039 0.983) 3.194 11.243 ( -0.241 2.854 -3.298) 4.368 11.396 ( 0.765 3.506 0.788) 3.674 11.453 ( 1.819 9.140 0.211) 9.322 11.641 ( -0.170 5.217 -1.763) 5.509 11.782 ( -4.132 4.667 0.133) 6.235 12.194 ( 4.984 0.778 3.167) 5.956 12.349 ( 1.682 1.400 1.160) 2.477 12.678 ( 0.907 1.447 0.838) 1.902 12.819 ( 1.724 0.594 -1.246) 2.209 13.206 ( 0.265 4.692 -1.705) 5.000 15.958 ( -1.029 1.424 -2.245) 2.851 16.196 ( 2.887 -0.609 0.892) 3.083 16.441 ( 2.766 -2.441 1.443) 3.961 16.536 ( -0.474 2.444 -0.755) 2.602 ======================= Grid point 17 (12/172) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.724 ( 1.977 9.910 -0.195) 10.108 3.033 ( -1.599 16.498 -1.215) 16.620 3.184 ( 4.322 -1.347 1.575) 4.793 3.249 ( 2.841 -11.772 2.003) 12.275 3.439 ( 2.219 -4.842 -2.546) 5.904 3.829 ( -1.573 -1.858 1.469) 2.843 3.911 ( 1.508 -0.476 0.556) 1.676 4.248 ( -12.467 6.919 -2.124) 14.416 4.537 ( -7.261 -1.684 -1.622) 7.628 4.831 ( 3.255 3.562 1.350) 5.011 5.010 ( -3.076 -0.988 -0.702) 3.307 5.512 ( 3.822 -1.754 1.400) 4.432 5.711 ( 3.579 0.181 0.126) 3.585 6.001 ( -1.767 6.568 -2.226) 7.157 6.201 ( 0.244 -2.929 1.315) 3.220 6.564 ( 6.588 -3.527 1.657) 7.655 6.805 ( 1.758 -0.012 0.550) 1.842 6.931 ( 2.280 -0.544 0.837) 2.489 7.056 ( -0.169 1.821 -0.503) 1.897 7.217 ( -1.593 1.030 -0.700) 2.022 7.704 ( -4.930 0.548 -0.520) 4.987 8.003 ( 7.545 -1.301 0.269) 7.661 8.430 ( -0.953 -2.353 0.680) 2.628 8.675 ( -0.921 1.576 0.374) 1.863 8.774 ( -1.371 1.184 -1.091) 2.115 8.841 ( 3.059 -3.441 0.220) 4.610 9.107 ( -0.791 -3.932 -2.678) 4.823 9.331 ( 2.706 1.765 2.023) 3.812 9.383 ( -2.173 0.061 -0.817) 2.322 9.555 ( -0.957 0.224 -0.168) 0.997 9.694 ( -6.384 7.798 1.519) 10.192 9.914 ( -1.757 1.193 -0.902) 2.307 10.027 ( 2.539 2.208 -2.023) 3.926 10.201 ( 0.658 -3.514 0.445) 3.603 10.258 ( -2.734 -2.613 4.934) 6.216 10.464 ( 0.858 -2.718 -1.048) 3.037 10.590 ( 1.960 -5.393 -0.112) 5.739 10.751 ( -1.200 4.729 -2.846) 5.648 10.979 ( -4.997 -5.421 -1.243) 7.477 11.126 ( -0.612 -5.244 1.571) 5.508 11.214 ( 3.022 1.591 -2.057) 3.987 11.325 ( 1.326 2.952 -0.438) 3.266 11.405 ( 0.723 0.916 2.117) 2.417 11.566 ( -1.640 1.305 0.889) 2.277 11.720 ( -4.455 -1.834 -2.061) 5.240 12.192 ( 2.369 3.276 1.201) 4.217 12.350 ( 1.970 0.729 0.617) 2.190 12.686 ( 3.060 0.163 2.324) 3.846 12.823 ( 1.201 0.231 -0.380) 1.281 13.144 ( -2.136 0.750 -2.031) 3.041 15.934 ( -1.834 -0.469 -0.717) 2.025 16.217 ( 2.865 1.416 1.276) 3.441 16.434 ( -1.423 4.299 -1.028) 4.644 16.528 ( 0.657 -1.807 0.565) 2.004 ======================= Grid point 18 (13/172) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( -2.479 25.298 -0.986) 25.439 2.598 ( -3.916 28.827 -0.591) 29.098 3.189 ( 2.704 3.074 2.835) 4.980 3.469 ( -1.277 0.045 -1.975) 2.352 3.579 ( 0.533 -8.186 4.826) 9.518 3.830 ( -8.183 -3.821 -3.950) 9.857 3.930 ( 2.342 0.498 1.889) 3.049 4.136 ( 0.455 -3.652 1.485) 3.969 4.468 ( -6.703 0.113 -4.070) 7.843 4.780 ( 3.816 3.809 0.564) 5.421 5.059 ( -2.890 -7.660 -2.402) 8.532 5.547 ( 2.246 0.201 0.578) 2.328 5.778 ( 1.942 -3.381 3.886) 5.505 5.930 ( -0.655 -1.351 -4.490) 4.735 6.218 ( -1.782 -0.498 -0.865) 2.042 6.687 ( 6.939 -1.954 2.915) 7.775 6.797 ( 1.976 3.008 1.488) 3.894 6.923 ( 3.202 4.426 0.204) 5.466 6.994 ( -1.488 4.055 0.495) 4.348 7.154 ( -2.571 3.704 -1.626) 4.793 7.654 ( -3.032 1.429 -0.281) 3.363 8.043 ( 5.445 2.571 -0.542) 6.046 8.452 ( 0.933 0.498 0.589) 1.210 8.595 ( -0.659 6.231 0.541) 6.290 8.727 ( -1.690 2.504 -0.997) 3.181 8.922 ( 3.685 -0.981 1.014) 3.946 9.099 ( -1.851 13.233 -1.687) 13.468 9.202 ( 3.741 1.567 -2.271) 4.649 9.265 ( 3.145 14.551 2.020) 15.024 9.440 ( -2.028 0.615 -1.472) 2.580 9.584 ( -13.000 1.176 2.223) 13.241 9.893 ( -0.681 6.176 -0.861) 6.273 10.061 ( 4.086 -4.853 -1.932) 6.632 10.263 ( -0.919 -0.705 0.459) 1.246 10.281 ( -2.688 -4.720 2.253) 5.881 10.598 ( 3.039 -4.186 -1.223) 5.315 10.653 ( 0.114 -5.576 1.361) 5.741 10.777 ( 3.261 -6.294 -1.891) 7.336 11.027 ( -2.316 -3.909 -0.902) 4.632 11.187 ( 2.902 1.347 -0.376) 3.221 11.239 ( 0.001 -5.262 1.847) 5.577 11.346 ( -1.407 -3.308 -0.125) 3.597 11.432 ( 0.032 -5.614 -0.273) 5.621 11.606 ( -2.879 -6.706 2.863) 7.839 11.750 ( -3.462 -5.681 -3.103) 7.341 12.145 ( 1.953 3.909 0.419) 4.390 12.357 ( 1.301 -0.051 -0.418) 1.368 12.707 ( 2.720 1.698 3.979) 5.110 12.835 ( 1.900 -0.823 -1.425) 2.514 13.144 ( -3.603 -3.935 -1.273) 5.485 15.941 ( -2.005 -2.168 0.185) 2.959 16.186 ( 1.597 5.297 1.488) 5.729 16.329 ( -2.511 4.609 -1.809) 5.551 16.566 ( 0.531 -1.657 0.595) 1.839 ======================= Grid point 19 (14/172) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -3.034 32.331 -0.774) 32.482 2.016 ( -3.968 34.868 -0.142) 35.093 2.917 ( -9.458 36.114 -3.277) 37.476 3.248 ( -1.046 4.181 0.921) 4.407 3.769 ( 1.718 -5.504 6.295) 8.537 3.844 ( -1.070 0.265 0.432) 1.184 3.999 ( 0.633 -8.278 -2.906) 8.796 4.301 ( 1.492 -11.739 -0.284) 11.837 4.502 ( 0.428 -8.311 -0.898) 8.370 4.805 ( 2.537 -3.666 0.240) 4.464 5.191 ( -0.612 -9.276 -1.517) 9.419 5.571 ( -0.160 -2.168 0.462) 2.223 5.848 ( 0.353 -2.492 1.917) 3.163 5.970 ( -1.079 -4.037 -3.753) 5.616 6.219 ( -0.416 -1.542 -0.400) 1.647 6.699 ( 2.859 7.070 2.777) 8.116 6.744 ( 1.836 4.723 1.424) 5.264 6.821 ( -1.340 7.313 -2.254) 7.769 6.936 ( 2.390 4.030 2.381) 5.256 7.061 ( -2.128 3.460 -1.670) 4.392 7.604 ( -1.399 2.354 0.050) 2.739 8.013 ( 2.297 3.597 -0.875) 4.357 8.393 ( 0.244 8.350 -0.064) 8.353 8.475 ( -0.138 6.877 0.963) 6.946 8.667 ( 0.021 4.348 -0.122) 4.350 8.765 ( -0.197 11.655 -0.967) 11.696 8.959 ( 2.946 9.598 1.829) 10.205 9.073 ( -0.873 3.781 -1.664) 4.222 9.274 ( 5.771 -0.542 -2.324) 6.245 9.392 ( -2.640 3.119 0.943) 4.194 9.529 ( -6.871 -4.356 1.656) 8.302 9.758 ( 0.365 6.938 -0.112) 6.949 10.086 ( -0.940 1.944 -1.537) 2.651 10.310 ( -0.937 -4.424 1.536) 4.776 10.362 ( 0.177 -4.243 -0.472) 4.273 10.582 ( 1.259 1.733 -0.158) 2.148 10.795 ( 1.806 -1.119 0.743) 2.250 10.870 ( 1.364 -3.480 -2.117) 4.295 11.122 ( 0.312 -8.828 -0.518) 8.848 11.209 ( 2.402 -0.243 1.464) 2.824 11.293 ( -2.173 -4.198 2.536) 5.365 11.464 ( 1.253 -9.687 -2.115) 9.994 11.551 ( -1.685 -7.596 0.188) 7.783 11.719 ( -3.440 -7.453 1.208) 8.297 11.833 ( -1.428 -6.683 -1.641) 7.028 12.115 ( 1.624 0.654 0.086) 1.752 12.375 ( 0.737 -1.426 -0.677) 1.742 12.700 ( 1.769 1.929 4.023) 4.799 12.858 ( 0.783 -0.544 -3.131) 3.273 13.211 ( -2.606 -6.810 0.280) 7.297 15.967 ( -1.685 -1.706 -0.024) 2.398 16.071 ( -1.092 7.229 0.655) 7.341 16.244 ( -0.717 3.742 -0.791) 3.891 16.599 ( 0.473 -1.742 0.399) 1.848 ======================= Grid point 20 (15/172) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -0.000 35.994 0.000) 35.994 1.366 ( -0.000 38.488 0.000) 38.488 2.059 ( -0.000 54.227 0.000) 54.227 3.217 ( -0.000 0.803 0.000) 0.803 3.727 ( -0.000 4.771 0.000) 4.771 3.947 ( 0.000 -6.803 -0.000) 6.803 4.116 ( 0.000 -4.526 -0.000) 4.526 4.520 ( 0.000 -12.785 -0.000) 12.785 4.693 ( 0.000 -11.456 -0.000) 11.456 4.925 ( 0.000 -8.488 -0.000) 8.488 5.324 ( 0.000 -5.884 -0.000) 5.884 5.622 ( 0.000 -3.126 -0.000) 3.126 5.878 ( 0.000 -1.803 -0.000) 1.803 6.028 ( 0.000 -4.053 -0.000) 4.053 6.246 ( -0.000 0.043 0.000) 0.043 6.550 ( -0.000 9.525 0.000) 9.525 6.664 ( -0.000 7.470 0.000) 7.470 6.697 ( -0.000 3.366 0.000) 3.366 6.855 ( -0.000 6.572 0.000) 6.572 7.010 ( -0.000 2.342 0.000) 2.342 7.548 ( -0.000 3.698 0.000) 3.698 7.972 ( -0.000 1.753 0.000) 1.753 8.211 ( -0.000 10.065 0.000) 10.065 8.374 ( -0.000 5.169 0.000) 5.169 8.549 ( -0.000 6.754 0.000) 6.754 8.701 ( -0.000 0.711 0.000) 0.711 8.761 ( -0.000 11.075 0.000) 11.075 9.045 ( -0.000 1.670 0.000) 1.670 9.282 ( -0.000 1.814 0.000) 1.814 9.314 ( -0.000 3.364 0.000) 3.364 9.603 ( 0.000 -5.121 -0.000) 5.121 9.689 ( -0.000 1.537 0.000) 1.537 10.058 ( 0.000 -0.537 -0.000) 0.537 10.370 ( -0.000 2.039 0.000) 2.039 10.373 ( 0.000 -2.420 -0.000) 2.420 10.575 ( -0.000 1.622 0.000) 1.622 10.755 ( -0.000 3.453 0.000) 3.453 10.935 ( 0.000 -4.084 -0.000) 4.084 11.199 ( 0.000 -0.051 -0.000) 0.051 11.277 ( 0.000 -5.278 -0.000) 5.278 11.389 ( 0.000 -5.610 -0.000) 5.610 11.627 ( 0.000 -7.661 -0.000) 7.661 11.659 ( 0.000 -5.996 -0.000) 5.996 11.795 ( 0.000 -3.840 -0.000) 3.840 11.931 ( 0.000 -5.679 -0.000) 5.679 12.156 ( 0.000 -3.969 -0.000) 3.969 12.412 ( 0.000 -2.428 -0.000) 2.428 12.701 ( 0.000 -0.065 -0.000) 0.065 12.843 ( -0.000 1.146 0.000) 1.146 13.324 ( 0.000 -6.926 -0.000) 6.926 15.897 ( -0.000 6.832 0.000) 6.832 16.030 ( 0.000 -1.287 -0.000) 1.287 16.180 ( -0.000 3.025 0.000) 3.025 16.633 ( 0.000 -1.695 -0.000) 1.695 ======================= Grid point 23 (16/172) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( 33.771 0.000 13.441) 36.347 1.367 ( 37.020 0.000 12.037) 38.927 2.349 ( 60.834 0.000 18.913) 63.706 3.230 ( 3.997 0.000 -7.390) 8.402 3.748 ( 6.400 0.000 -13.470) 14.913 3.903 ( -12.273 -0.000 -2.532) 12.531 3.992 ( -1.370 -0.000 3.780) 4.020 4.423 ( -17.110 -0.000 -2.959) 17.364 4.942 ( 1.097 0.000 2.763) 2.973 5.124 ( -7.386 -0.000 7.826) 10.761 5.272 ( -8.447 -0.000 2.169) 8.721 5.613 ( 1.479 0.000 1.147) 1.872 5.901 ( -1.984 -0.000 -6.699) 6.987 6.300 ( -3.816 -0.000 0.375) 3.834 6.315 ( 6.448 0.000 2.195) 6.811 6.351 ( 4.241 0.000 -0.159) 4.244 6.352 ( -6.882 -0.000 -1.087) 6.967 6.651 ( 0.499 0.000 -0.361) 0.616 6.773 ( -1.298 -0.000 0.488) 1.387 6.938 ( 3.465 0.000 -1.721) 3.868 7.488 ( 3.524 0.000 -1.269) 3.745 7.815 ( -7.474 -0.000 4.404) 8.675 8.057 ( -1.648 -0.000 -1.926) 2.535 8.221 ( -0.835 -0.000 0.818) 1.169 8.373 ( 1.650 0.000 -4.203) 4.515 8.416 ( -3.982 -0.000 -0.372) 4.000 8.548 ( -5.326 -0.000 1.327) 5.489 9.055 ( -2.040 -0.000 3.106) 3.716 9.230 ( -1.239 -0.000 3.456) 3.672 9.298 ( -1.686 -0.000 -6.617) 6.828 9.616 ( -1.623 -0.000 -1.461) 2.184 9.676 ( 2.454 0.000 0.670) 2.543 10.072 ( -12.211 -0.000 -1.048) 12.256 10.217 ( 0.654 0.000 -0.338) 0.737 10.378 ( -1.104 -0.000 2.885) 3.089 10.558 ( 4.843 0.000 1.821) 5.174 10.825 ( 2.108 0.000 -2.070) 2.954 10.980 ( -1.179 -0.000 3.484) 3.678 11.159 ( -0.706 -0.000 -3.410) 3.482 11.182 ( -0.094 -0.000 -2.936) 2.938 11.517 ( 6.647 0.000 -3.632) 7.574 11.527 ( -2.940 -0.000 3.097) 4.270 11.722 ( -3.961 -0.000 0.624) 4.010 12.102 ( -0.660 -0.000 3.569) 3.630 12.127 ( -1.943 -0.000 1.963) 2.761 12.315 ( 2.405 0.000 4.269) 4.900 12.485 ( 6.367 0.000 0.112) 6.368 12.589 ( 3.977 0.000 -6.006) 7.204 13.268 ( 3.498 0.000 3.854) 5.205 13.390 ( -1.731 -0.000 -3.923) 4.288 16.050 ( -0.427 -0.000 -2.791) 2.823 16.164 ( 2.417 0.000 -3.249) 4.049 16.170 ( 7.994 0.000 0.358) 8.002 16.698 ( 1.026 0.000 1.812) 2.082 ======================= Grid point 24 (17/172) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 29.667 -10.115 11.585) 33.416 1.765 ( 33.007 -9.325 9.411) 35.566 2.977 ( 43.735 -12.905 12.615) 47.313 3.237 ( 6.450 0.312 -5.338) 8.378 3.731 ( -3.522 1.504 -10.612) 11.282 3.790 ( -7.522 -0.997 -6.559) 10.029 4.051 ( 7.245 -2.152 4.697) 8.898 4.258 ( -16.126 1.853 -2.875) 16.485 4.875 ( -1.462 7.985 1.438) 8.244 4.947 ( -3.915 10.715 8.240) 14.073 5.329 ( -7.402 -5.659 4.257) 10.244 5.550 ( 0.104 5.518 0.456) 5.538 5.930 ( -4.390 -3.430 -3.834) 6.763 6.160 ( -5.813 6.088 -2.616) 8.815 6.287 ( -0.530 -1.978 -1.043) 2.298 6.379 ( 1.703 1.498 1.689) 2.828 6.471 ( 3.218 -6.988 -1.493) 7.837 6.655 ( -0.457 -0.892 -0.950) 1.381 6.808 ( 1.744 -3.890 -0.085) 4.264 6.998 ( 3.451 -3.298 -0.625) 4.814 7.566 ( 5.135 -5.133 -1.518) 7.418 7.780 ( -9.100 -1.347 4.003) 10.032 8.070 ( -1.737 -4.504 -1.492) 5.053 8.266 ( -1.502 -4.671 0.952) 4.998 8.375 ( 0.495 -3.523 -3.244) 4.814 8.435 ( -3.234 -4.031 -0.486) 5.191 8.586 ( -5.691 -7.754 1.362) 9.714 9.031 ( -2.042 1.358 0.671) 2.542 9.235 ( -1.720 -0.962 2.201) 2.955 9.287 ( -3.142 -2.928 -3.095) 5.294 9.593 ( -0.225 0.872 -0.427) 0.997 9.717 ( 3.095 -1.642 0.802) 3.594 9.995 ( -11.240 -2.652 -0.511) 11.560 10.223 ( -1.336 -0.878 -0.188) 1.610 10.386 ( 0.107 -1.094 1.297) 1.700 10.609 ( 5.762 0.458 2.702) 6.380 10.848 ( 2.076 -0.901 -3.472) 4.144 10.967 ( -2.271 1.737 3.546) 4.555 11.100 ( 0.379 4.285 -1.075) 4.434 11.198 ( -0.304 -1.591 -4.048) 4.360 11.440 ( -3.546 5.672 2.066) 7.001 11.572 ( 3.274 0.662 -2.760) 4.333 11.689 ( -2.398 -0.122 0.771) 2.522 12.055 ( -1.515 5.202 1.152) 5.539 12.095 ( -2.704 2.818 2.687) 4.741 12.302 ( 3.596 4.353 3.699) 6.750 12.490 ( 4.757 4.030 0.450) 6.251 12.642 ( 3.369 -2.823 -2.761) 5.191 13.159 ( 2.251 11.421 1.248) 11.708 13.417 ( 1.791 -0.890 -3.360) 3.910 16.041 ( 0.749 -0.261 -2.793) 2.903 16.150 ( 3.416 2.136 -2.700) 4.850 16.260 ( 6.462 -2.225 1.272) 6.952 16.679 ( 2.042 3.312 1.031) 4.025 ======================= Grid point 25 (18/172) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 23.268 -14.709 8.493) 28.808 2.217 ( 26.148 -13.007 5.843) 29.783 3.179 ( 4.516 1.864 -6.252) 7.935 3.440 ( 7.366 -3.834 1.835) 8.505 3.592 ( -8.451 3.389 -5.563) 10.671 3.817 ( -0.272 -3.704 -7.261) 8.156 4.125 ( -1.012 1.460 -0.461) 1.835 4.244 ( 11.463 -7.886 7.923) 16.011 4.684 ( -4.786 10.167 1.607) 11.352 4.826 ( 3.892 5.971 7.911) 10.648 5.277 ( -4.926 6.001 0.424) 7.775 5.490 ( -3.562 1.117 0.352) 3.749 5.894 ( -5.582 -0.718 -0.872) 5.695 6.022 ( -1.490 6.031 -0.096) 6.213 6.322 ( 1.551 3.777 0.746) 4.150 6.406 ( -2.184 -9.300 -5.014) 10.789 6.614 ( 3.084 -6.630 0.047) 7.312 6.677 ( 1.418 -1.745 -0.637) 2.338 6.912 ( 2.269 -5.888 0.155) 6.312 7.084 ( 2.406 -3.827 0.201) 4.525 7.700 ( 2.904 -3.926 0.627) 4.923 7.741 ( -5.639 -2.899 0.240) 6.345 8.166 ( -4.012 -8.347 -0.212) 9.264 8.366 ( -0.186 -8.157 1.495) 8.295 8.470 ( -0.022 -7.534 -3.072) 8.136 8.542 ( -1.338 -11.395 0.750) 11.498 8.690 ( -5.281 -8.926 0.622) 10.390 8.985 ( -1.120 2.236 -1.755) 3.055 9.255 ( -1.791 -2.305 1.004) 3.087 9.327 ( -3.081 -5.097 -0.906) 6.024 9.602 ( 0.611 -2.306 1.061) 2.611 9.782 ( 2.074 -3.292 0.225) 3.897 9.982 ( -9.448 -5.198 0.290) 10.788 10.222 ( -1.311 0.101 1.561) 2.041 10.416 ( 0.534 -1.440 -1.967) 2.495 10.630 ( 5.784 3.811 2.220) 7.274 10.829 ( -0.087 4.038 0.988) 4.158 10.930 ( -1.033 1.191 -1.468) 2.154 11.005 ( -1.007 5.972 -0.755) 6.104 11.204 ( -0.792 0.621 -1.134) 1.516 11.287 ( -4.307 6.947 0.117) 8.175 11.547 ( 0.849 3.335 0.230) 3.449 11.689 ( -0.734 -0.234 -1.615) 1.790 11.896 ( -2.370 10.927 -0.978) 11.223 12.019 ( -1.279 5.199 2.704) 5.998 12.268 ( 4.665 4.070 3.190) 6.964 12.447 ( 3.104 4.460 1.394) 5.610 12.694 ( 1.875 -1.180 -0.870) 2.381 12.986 ( 1.522 9.808 -0.725) 9.952 13.399 ( 3.089 4.127 -2.717) 5.827 16.033 ( 0.619 1.551 -4.051) 4.381 16.152 ( 2.659 -0.601 -0.240) 2.736 16.348 ( 5.110 -2.201 1.682) 5.812 16.640 ( 2.424 3.541 0.460) 4.316 ======================= Grid point 26 (19/172) ======================= q-point: ( 0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.538 ( 16.850 -13.558 5.290) 22.264 2.634 ( 17.567 -14.088 3.073) 22.727 3.153 ( 0.983 1.251 -4.969) 5.218 3.396 ( -7.973 2.438 -3.286) 8.962 3.516 ( -2.654 1.107 -2.298) 3.681 3.826 ( 0.416 -1.006 -6.047) 6.144 4.069 ( -0.023 5.977 2.154) 6.353 4.392 ( -2.515 3.430 0.999) 4.369 4.555 ( -0.293 2.333 5.015) 5.539 4.831 ( 3.436 1.249 5.990) 7.018 5.135 ( 0.326 5.774 -0.006) 5.783 5.442 ( -3.109 -0.152 0.301) 3.127 5.850 ( 1.018 4.985 -3.075) 5.944 5.997 ( 0.204 -4.471 1.801) 4.824 6.281 ( 4.300 4.014 2.375) 6.344 6.480 ( -2.964 -2.919 -3.595) 5.498 6.731 ( 0.345 -4.653 -0.225) 4.671 6.766 ( 5.142 -6.054 1.316) 8.051 7.021 ( 1.884 -4.190 -0.826) 4.667 7.159 ( 0.290 -3.515 0.399) 3.549 7.683 ( -7.061 -1.263 1.057) 7.251 7.863 ( 6.919 -5.611 -1.130) 8.980 8.261 ( -5.096 -7.004 1.129) 8.735 8.524 ( 0.751 -8.345 0.199) 8.381 8.616 ( 0.579 -8.858 -0.526) 8.893 8.754 ( -3.556 -11.531 -0.716) 12.088 8.862 ( -0.553 -16.724 1.375) 16.790 8.935 ( -0.233 1.207 -3.146) 3.378 9.285 ( 1.591 -1.470 -0.038) 2.166 9.393 ( -3.828 -5.332 -0.787) 6.611 9.681 ( -3.956 -6.313 1.932) 7.697 9.872 ( 0.283 -7.054 0.930) 7.121 10.028 ( -4.383 -6.532 0.735) 7.900 10.198 ( 1.111 3.870 2.695) 4.845 10.404 ( 0.229 2.478 -4.607) 5.236 10.555 ( 0.711 9.333 2.122) 9.597 10.743 ( 0.370 9.608 1.151) 9.684 10.816 ( -1.800 3.536 -1.187) 4.141 10.970 ( -0.639 -1.321 -1.989) 2.472 11.099 ( -1.389 6.882 2.976) 7.625 11.236 ( -1.863 -0.645 -2.970) 3.565 11.476 ( -0.814 4.778 0.551) 4.878 11.633 ( -1.282 7.310 -0.647) 7.450 11.696 ( -0.873 7.183 -2.596) 7.688 11.900 ( -0.719 8.602 1.301) 8.729 12.263 ( 3.884 1.850 3.208) 5.366 12.407 ( 2.419 3.076 1.905) 4.352 12.707 ( 1.053 0.573 0.260) 1.227 12.870 ( 1.748 4.456 -1.678) 5.073 13.314 ( 1.884 7.053 -2.102) 7.597 15.981 ( -0.384 2.864 -3.020) 4.180 16.198 ( 2.127 -2.000 0.293) 2.934 16.425 ( 3.419 -2.376 1.520) 4.433 16.595 ( 1.546 3.865 0.016) 4.163 ======================= Grid point 27 (20/172) ======================= q-point: ( 0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( 9.056 -3.679 2.307) 10.043 2.991 ( 8.144 -15.070 0.662) 17.143 3.136 ( -1.940 -0.244 -0.989) 2.191 3.314 ( 1.284 2.529 -2.572) 3.829 3.450 ( -0.017 4.475 -1.339) 4.671 3.816 ( -1.076 2.193 -3.102) 3.948 3.954 ( -0.720 5.036 2.420) 5.633 4.279 ( -4.640 4.663 0.151) 6.580 4.477 ( -7.358 2.642 1.275) 7.921 4.808 ( -5.627 -0.263 -0.546) 5.659 5.073 ( 2.423 5.354 1.149) 5.988 5.498 ( 4.003 -4.325 3.846) 7.037 5.772 ( 2.537 3.649 -3.207) 5.480 6.078 ( -0.817 -1.758 -0.988) 2.176 6.209 ( 1.279 7.569 1.950) 7.920 6.540 ( 4.305 -5.437 0.913) 6.995 6.798 ( 1.365 -2.393 0.388) 2.782 6.905 ( 3.712 -4.795 0.570) 6.090 7.067 ( 0.069 -0.724 -1.103) 1.321 7.203 ( -0.871 -1.425 0.154) 1.677 7.660 ( -4.497 -1.115 -0.136) 4.636 8.008 ( 6.861 -4.682 -0.159) 8.308 8.342 ( -3.261 -5.983 1.208) 6.920 8.641 ( -0.196 -4.582 0.602) 4.626 8.742 ( 0.117 -5.252 -1.063) 5.360 8.827 ( 0.339 0.257 -0.035) 0.427 8.964 ( -2.661 -8.501 -2.874) 9.360 9.219 ( 1.901 -17.888 0.789) 18.006 9.354 ( 4.944 -4.457 0.245) 6.661 9.426 ( -3.661 -2.844 -0.869) 4.717 9.709 ( -12.232 -3.571 1.312) 12.810 10.013 ( 5.237 0.624 -0.430) 5.291 10.105 ( 3.154 0.405 2.289) 3.918 10.159 ( -0.551 -5.150 1.685) 5.447 10.254 ( -3.375 14.486 -0.258) 14.877 10.411 ( -3.643 -0.254 -0.417) 3.676 10.593 ( 2.009 5.701 -1.422) 6.210 10.811 ( -1.926 -1.134 -0.957) 2.431 10.929 ( -0.087 6.577 -1.022) 6.656 11.045 ( -1.830 -2.839 0.806) 3.472 11.219 ( -0.781 -0.194 -0.874) 1.188 11.407 ( 0.555 2.887 -0.264) 2.951 11.485 ( 1.772 7.577 0.037) 7.781 11.604 ( -2.626 3.035 -1.260) 4.207 11.741 ( -1.342 8.083 0.461) 8.206 12.260 ( 1.687 2.284 1.530) 3.226 12.389 ( 1.639 1.743 1.306) 2.726 12.719 ( 3.179 -0.369 1.855) 3.699 12.838 ( 1.094 0.907 -1.143) 1.824 13.191 ( -0.570 6.742 -2.062) 7.073 15.928 ( -1.097 1.644 -1.466) 2.461 16.245 ( 2.226 -1.122 0.619) 2.568 16.485 ( 1.878 -0.821 1.067) 2.310 16.527 ( -0.327 3.869 -0.598) 3.928 ======================= Grid point 28 (21/172) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.755 ( 1.366 15.409 0.136) 15.470 2.990 ( -1.804 16.967 -1.022) 17.093 3.283 ( 2.807 -1.237 1.842) 3.578 3.314 ( 5.158 -9.549 1.303) 10.931 3.463 ( 2.544 -6.346 -2.070) 7.143 3.718 ( -9.142 1.161 -1.418) 9.324 3.934 ( -0.282 -1.533 -0.147) 1.566 4.192 ( 4.174 5.583 4.233) 8.155 4.398 ( -7.624 -0.420 -2.724) 8.107 4.800 ( -3.345 -3.614 -1.737) 5.222 4.998 ( 0.422 3.935 0.469) 3.985 5.587 ( 3.045 -0.010 1.683) 3.479 5.766 ( 2.422 -1.060 0.131) 2.647 5.968 ( -0.898 7.975 -1.264) 8.124 6.178 ( -1.929 -1.885 -0.429) 2.731 6.681 ( 4.485 -4.896 2.022) 6.941 6.832 ( 1.015 -0.245 0.129) 1.053 6.981 ( 3.012 -0.897 -0.074) 3.144 7.044 ( -1.177 2.667 -0.083) 2.916 7.188 ( -1.164 2.198 -0.325) 2.508 7.645 ( -1.911 -0.078 -0.226) 1.926 8.100 ( 3.732 -0.550 -0.026) 3.773 8.418 ( -0.752 -4.312 0.592) 4.417 8.669 ( -0.114 1.592 0.319) 1.627 8.745 ( -1.079 1.971 -0.795) 2.384 8.887 ( 1.990 -4.932 0.174) 5.321 9.085 ( -0.265 -6.636 -1.576) 6.826 9.328 ( -2.143 1.458 -0.050) 2.593 9.415 ( 5.067 1.436 0.404) 5.282 9.538 ( -1.940 3.741 -0.077) 4.215 9.586 ( -5.916 6.290 1.023) 8.695 9.882 ( -1.132 3.845 -0.617) 4.056 10.058 ( 2.043 0.741 -1.383) 2.576 10.195 ( -1.368 -1.735 1.876) 2.899 10.270 ( 0.784 -3.661 1.186) 3.927 10.457 ( -1.201 -5.493 0.532) 5.647 10.614 ( 1.237 -6.903 -0.894) 7.070 10.732 ( 0.422 4.675 -1.692) 4.990 10.906 ( -2.861 -4.968 -0.410) 5.747 11.123 ( -0.411 -6.157 0.507) 6.192 11.234 ( 0.701 -0.832 -0.678) 1.282 11.342 ( 0.963 4.032 -0.731) 4.210 11.439 ( 1.619 1.801 1.416) 2.805 11.533 ( -2.360 1.175 0.525) 2.689 11.662 ( -1.486 -0.740 -0.995) 1.935 12.221 ( 0.666 3.480 0.435) 3.570 12.374 ( 0.573 1.179 0.126) 1.317 12.770 ( 4.199 -0.045 3.479) 5.453 12.831 ( -0.127 -0.020 -1.479) 1.485 13.092 ( -2.152 2.036 -1.775) 3.454 15.906 ( -0.908 -0.406 -0.356) 1.056 16.268 ( 2.040 1.086 0.978) 2.510 16.403 ( -1.307 6.759 -0.849) 6.936 16.540 ( 0.339 -1.870 0.287) 1.922 ======================= Grid point 29 (22/172) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -0.000 27.308 0.000) 27.308 2.563 ( -0.000 29.930 0.000) 29.930 3.238 ( -0.000 5.786 0.000) 5.786 3.398 ( -0.000 10.575 0.000) 10.575 3.625 ( 0.000 -11.545 -0.000) 11.545 3.748 ( 0.000 -10.184 -0.000) 10.184 3.957 ( -0.000 1.479 0.000) 1.479 4.163 ( 0.000 -2.526 -0.000) 2.526 4.395 ( 0.000 -3.684 -0.000) 3.684 4.807 ( -0.000 1.859 0.000) 1.859 5.023 ( 0.000 -7.791 -0.000) 7.791 5.569 ( -0.000 1.764 0.000) 1.764 5.812 ( 0.000 -2.438 -0.000) 2.438 5.909 ( 0.000 -1.362 -0.000) 1.362 6.194 ( 0.000 -1.083 -0.000) 1.083 6.759 ( 0.000 -1.070 -0.000) 1.070 6.818 ( -0.000 2.328 0.000) 2.328 6.948 ( -0.000 7.148 0.000) 7.148 6.994 ( -0.000 1.384 0.000) 1.384 7.120 ( -0.000 4.478 0.000) 4.478 7.629 ( -0.000 1.161 0.000) 1.161 8.086 ( -0.000 3.329 0.000) 3.329 8.461 ( 0.000 -0.108 -0.000) 0.108 8.594 ( -0.000 6.311 0.000) 6.311 8.705 ( -0.000 2.025 0.000) 2.025 8.963 ( -0.000 0.047 0.000) 0.047 9.072 ( -0.000 10.932 0.000) 10.932 9.217 ( -0.000 8.638 0.000) 8.638 9.372 ( -0.000 10.166 0.000) 10.166 9.403 ( 0.000 -1.455 -0.000) 1.455 9.430 ( -0.000 1.418 0.000) 1.418 9.886 ( -0.000 5.335 0.000) 5.335 10.098 ( 0.000 -3.754 -0.000) 3.754 10.222 ( 0.000 -3.326 -0.000) 3.326 10.290 ( 0.000 -0.980 -0.000) 0.980 10.609 ( 0.000 -4.151 -0.000) 4.151 10.661 ( 0.000 -7.679 -0.000) 7.679 10.813 ( 0.000 -6.868 -0.000) 6.868 10.994 ( 0.000 -6.100 -0.000) 6.100 11.202 ( 0.000 -0.382 -0.000) 0.382 11.254 ( 0.000 -4.657 -0.000) 4.657 11.334 ( 0.000 -1.417 -0.000) 1.417 11.432 ( 0.000 -3.963 -0.000) 3.963 11.588 ( 0.000 -6.597 -0.000) 6.597 11.713 ( 0.000 -5.565 -0.000) 5.565 12.162 ( -0.000 3.516 0.000) 3.516 12.365 ( -0.000 0.035 0.000) 0.035 12.757 ( -0.000 3.064 0.000) 3.064 12.848 ( 0.000 -1.181 -0.000) 1.181 13.100 ( 0.000 -4.203 -0.000) 4.203 15.924 ( 0.000 -2.019 -0.000) 2.019 16.209 ( -0.000 7.574 0.000) 7.574 16.299 ( -0.000 3.596 0.000) 3.596 16.572 ( 0.000 -1.728 -0.000) 1.728 ======================= Grid point 34 (23/172) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 30.473 0.000 12.792) 33.050 1.991 ( 34.009 0.000 11.039) 35.755 3.182 ( 16.617 0.000 -5.306) 17.443 3.353 ( 27.316 0.000 9.712) 28.991 3.686 ( -7.367 -0.000 -2.391) 7.746 3.696 ( -1.237 -0.000 -11.332) 11.400 4.091 ( -9.991 -0.000 0.094) 9.992 4.143 ( 2.224 0.000 -1.746) 2.828 4.929 ( -4.451 -0.000 2.033) 4.893 5.106 ( -0.993 -0.000 9.895) 9.945 5.163 ( -6.926 -0.000 4.548) 8.285 5.631 ( -0.428 -0.000 1.300) 1.369 5.815 ( -5.045 -0.000 -7.232) 8.818 6.131 ( -8.027 -0.000 -5.729) 9.862 6.319 ( -3.515 -0.000 3.478) 4.944 6.336 ( 0.569 0.000 -1.203) 1.331 6.474 ( 5.313 0.000 1.814) 5.614 6.640 ( -0.366 -0.000 -2.948) 2.970 6.776 ( 1.348 0.000 -1.158) 1.777 7.006 ( 6.104 0.000 -0.953) 6.178 7.554 ( 5.636 0.000 -1.047) 5.732 7.704 ( -9.603 -0.000 4.322) 10.531 8.013 ( -2.325 -0.000 -2.269) 3.248 8.218 ( 0.145 0.000 -0.273) 0.309 8.354 ( -1.311 -0.000 -3.214) 3.471 8.360 ( -3.391 -0.000 1.079) 3.558 8.476 ( -4.339 -0.000 1.716) 4.666 9.021 ( -4.018 -0.000 1.652) 4.344 9.203 ( -5.319 -0.000 -5.335) 7.533 9.238 ( 0.185 0.000 2.701) 2.708 9.600 ( -0.145 -0.000 -0.120) 0.188 9.727 ( 2.542 0.000 1.843) 3.140 9.886 ( -9.873 -0.000 -0.941) 9.918 10.200 ( -1.292 -0.000 -1.350) 1.868 10.380 ( -0.567 -0.000 2.073) 2.149 10.662 ( 4.232 0.000 5.340) 6.813 10.839 ( 3.292 0.000 -6.237) 7.053 10.998 ( 0.138 0.000 5.560) 5.562 11.153 ( 2.022 0.000 -2.883) 3.522 11.163 ( 0.186 0.000 -3.796) 3.801 11.461 ( -6.353 -0.000 2.347) 6.773 11.611 ( 7.226 0.000 -2.869) 7.775 11.661 ( -4.918 -0.000 1.905) 5.274 12.092 ( -2.254 -0.000 1.554) 2.738 12.104 ( -1.911 -0.000 1.278) 2.299 12.356 ( -0.556 -0.000 4.566) 4.600 12.599 ( 6.630 0.000 2.082) 6.949 12.610 ( 2.055 0.000 -3.819) 4.337 13.342 ( -0.873 -0.000 -5.218) 5.290 13.350 ( 4.765 0.000 1.334) 4.948 16.027 ( -0.457 -0.000 -2.616) 2.655 16.189 ( 2.930 0.000 -3.209) 4.345 16.300 ( 7.421 0.000 1.131) 7.507 16.729 ( 1.746 0.000 0.948) 1.986 ======================= Grid point 35 (24/172) ======================= q-point: ( 0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 26.702 -5.739 11.683) 29.705 2.322 ( 31.031 -4.719 8.703) 32.571 3.212 ( 2.968 0.535 -9.943) 10.390 3.430 ( -10.651 1.216 0.512) 10.732 3.611 ( -0.167 5.476 -3.306) 6.399 3.757 ( 2.768 -0.257 -6.857) 7.399 4.073 ( 3.381 -8.535 3.337) 9.768 4.255 ( 13.295 -3.561 3.877) 14.299 4.816 ( -4.970 8.270 2.725) 10.026 4.998 ( 2.879 7.455 7.060) 10.664 5.252 ( -4.795 -4.538 3.296) 7.379 5.535 ( -2.297 6.505 -0.479) 6.915 5.803 ( -7.520 -2.861 -2.599) 8.455 6.083 ( -1.325 -0.843 -4.091) 4.382 6.254 ( -3.815 0.865 0.618) 3.960 6.363 ( -0.519 -0.911 -1.401) 1.750 6.545 ( 3.237 -4.166 0.092) 5.276 6.652 ( 0.875 -2.359 -1.225) 2.798 6.828 ( 0.855 -4.789 -0.452) 4.886 7.069 ( 5.967 -1.469 -0.704) 6.185 7.639 ( -4.442 -2.221 2.119) 5.399 7.659 ( 0.928 -4.271 -0.327) 4.383 8.024 ( -2.733 -4.334 -1.411) 5.315 8.258 ( -0.376 -4.465 1.564) 4.746 8.345 ( -1.608 -4.066 -2.620) 5.097 8.403 ( -1.616 -5.259 -0.010) 5.501 8.511 ( -4.115 -6.547 1.319) 7.844 8.990 ( -3.284 0.243 0.045) 3.293 9.165 ( -5.273 -2.289 -3.091) 6.527 9.266 ( 0.461 -1.907 1.623) 2.546 9.596 ( 0.307 0.087 0.320) 0.452 9.754 ( -0.283 -0.738 0.619) 1.004 9.847 ( -6.013 -3.427 0.136) 6.923 10.198 ( -0.965 -1.127 -0.640) 1.615 10.392 ( -0.273 -1.172 0.978) 1.551 10.705 ( 1.887 -0.201 5.907) 6.205 10.857 ( 4.175 -0.215 -7.559) 8.638 10.975 ( -0.007 4.475 4.437) 6.302 11.108 ( 1.462 4.241 -1.792) 4.831 11.184 ( 1.008 -0.961 -3.182) 3.474 11.372 ( -5.469 5.179 2.634) 7.979 11.595 ( -2.629 2.633 0.985) 3.849 11.675 ( 2.990 -0.968 -1.679) 3.563 12.024 ( -2.061 5.880 -0.271) 6.237 12.076 ( -1.789 2.164 1.976) 3.433 12.343 ( -0.436 1.775 3.408) 3.867 12.560 ( 3.302 4.490 -0.254) 5.579 12.684 ( 3.125 -1.892 0.376) 3.673 13.177 ( 0.780 11.318 -2.602) 11.640 13.445 ( 3.195 -1.425 -1.742) 3.908 16.030 ( 0.047 -1.047 -2.425) 2.642 16.180 ( 2.176 2.004 -2.130) 3.645 16.368 ( 5.720 -1.125 1.168) 5.945 16.719 ( 2.117 2.792 0.704) 3.574 ======================= Grid point 36 (25/172) ======================= q-point: ( 0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 20.591 -8.665 9.208) 24.164 2.658 ( 25.349 -5.354 4.756) 26.341 3.169 ( -2.186 2.119 -8.893) 9.399 3.307 ( -13.158 0.318 -0.187) 13.163 3.469 ( -11.123 0.984 -2.682) 11.484 3.779 ( 2.165 -3.877 -8.044) 9.188 4.163 ( 5.167 3.508 2.086) 6.585 4.467 ( 6.952 -1.446 5.138) 8.765 4.629 ( -3.862 8.478 3.245) 9.865 4.948 ( 4.836 5.899 5.735) 9.544 5.223 ( -0.178 2.988 -1.338) 3.279 5.427 ( -3.962 2.530 -0.008) 4.701 5.821 ( -2.775 -4.552 -0.224) 5.336 6.036 ( 2.553 5.232 -0.298) 5.829 6.276 ( -5.541 -6.816 -1.592) 8.927 6.399 ( 3.418 -2.427 -1.164) 4.350 6.637 ( 0.506 -4.565 -0.962) 4.692 6.730 ( 3.044 -4.963 1.311) 5.968 6.936 ( 0.623 -6.500 0.035) 6.530 7.128 ( 3.237 -1.098 -0.517) 3.457 7.602 ( -7.491 -1.737 1.406) 7.818 7.808 ( 6.206 -6.466 -1.772) 9.136 8.098 ( -4.366 -7.150 0.760) 8.412 8.380 ( 0.954 -8.533 1.311) 8.686 8.459 ( -0.023 -10.323 -1.108) 10.382 8.516 ( -1.933 -10.006 -0.914) 10.232 8.625 ( -3.106 -10.099 0.854) 10.600 8.957 ( -1.359 1.448 -1.457) 2.463 9.190 ( -4.364 -5.870 -1.711) 7.512 9.314 ( 0.592 -2.566 1.063) 2.840 9.615 ( 0.062 -1.393 0.777) 1.596 9.758 ( -4.170 -3.531 0.094) 5.464 9.900 ( -1.486 -5.382 0.583) 5.614 10.220 ( 0.422 -1.519 0.583) 1.681 10.407 ( -0.581 -0.359 -0.766) 1.026 10.721 ( 2.194 3.059 5.756) 6.878 10.824 ( 1.088 5.491 -4.729) 7.328 10.907 ( -0.616 3.207 -0.674) 3.335 11.013 ( 1.887 7.366 -0.668) 7.634 11.187 ( -1.121 0.674 0.170) 1.319 11.240 ( -1.763 5.843 0.586) 6.131 11.523 ( -3.933 2.876 0.802) 4.938 11.681 ( 1.190 2.287 -1.566) 3.016 11.869 ( -0.460 10.186 -1.007) 10.246 12.014 ( -1.002 4.620 1.486) 4.955 12.321 ( 0.642 1.677 2.298) 2.916 12.503 ( 2.473 4.844 0.993) 5.529 12.721 ( 1.764 -0.170 0.608) 1.874 12.989 ( 0.221 9.321 -2.505) 9.654 13.435 ( 2.520 4.604 -1.383) 5.428 16.023 ( 0.402 2.024 -2.360) 3.134 16.173 ( 0.688 -1.118 -0.523) 1.413 16.428 ( 3.564 -1.172 1.061) 3.899 16.679 ( 1.907 3.887 0.428) 4.351 ======================= Grid point 37 (26/172) ======================= q-point: ( 0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( 12.023 -7.295 5.084) 14.954 2.898 ( 12.046 -4.407 1.270) 12.890 3.091 ( -5.283 -0.927 -5.014) 7.342 3.248 ( -7.155 -3.521 -0.246) 7.978 3.447 ( -3.765 -4.528 -0.866) 5.952 3.844 ( 3.816 -1.431 -4.883) 6.360 4.079 ( -0.773 9.187 2.214) 9.482 4.372 ( 2.211 8.457 0.056) 8.741 4.512 ( -6.683 5.844 2.916) 9.344 4.833 ( -2.112 7.599 0.129) 7.888 5.187 ( 2.269 5.097 0.419) 5.595 5.444 ( 1.654 -5.666 2.342) 6.350 5.830 ( -0.763 2.089 -2.525) 3.365 6.015 ( 0.405 -1.819 0.682) 1.984 6.369 ( 3.437 3.857 1.603) 5.409 6.432 ( -0.673 -7.493 -1.452) 7.662 6.731 ( 0.045 -5.942 -0.360) 5.953 6.854 ( 3.560 -5.373 1.504) 6.619 7.025 ( -0.439 -3.324 -0.907) 3.474 7.164 ( 0.279 -2.139 0.025) 2.158 7.599 ( -3.218 -2.372 0.219) 4.004 7.955 ( 4.318 -6.270 -0.917) 7.668 8.198 ( -3.130 -7.683 1.182) 8.380 8.533 ( 0.269 -7.944 0.315) 7.955 8.622 ( 0.256 -8.029 -0.412) 8.044 8.710 ( -1.321 -11.915 -0.336) 11.993 8.856 ( -0.569 -16.442 0.756) 16.470 8.922 ( 0.095 -1.879 -1.615) 2.480 9.286 ( -1.165 -8.484 -1.500) 8.694 9.357 ( 0.357 -1.443 0.545) 1.583 9.606 ( -4.585 0.504 0.818) 4.685 9.874 ( -0.120 -11.585 0.824) 11.615 10.000 ( -0.543 -7.081 0.175) 7.104 10.239 ( 1.947 2.009 1.196) 3.043 10.380 ( -0.961 1.787 -1.701) 2.648 10.569 ( -0.104 17.037 1.422) 17.097 10.749 ( 0.014 6.974 -0.602) 7.000 10.787 ( -0.576 3.589 -0.603) 3.685 10.971 ( 0.719 -0.727 -0.475) 1.128 11.103 ( -0.024 7.568 1.396) 7.695 11.200 ( -1.035 -0.433 -0.985) 1.493 11.452 ( -1.515 2.570 0.006) 2.983 11.605 ( -0.927 5.636 -0.590) 5.742 11.694 ( 0.679 9.381 -0.694) 9.431 11.897 ( -0.311 8.827 0.424) 8.843 12.306 ( 0.662 1.562 1.105) 2.025 12.447 ( 1.099 3.542 0.972) 3.834 12.733 ( 1.368 -0.146 0.708) 1.548 12.874 ( 0.100 3.612 -1.362) 3.861 13.329 ( 0.865 8.535 -0.852) 8.621 15.965 ( -0.157 3.493 -1.111) 3.668 16.218 ( 0.510 -2.964 -0.037) 3.008 16.472 ( 1.474 -1.543 0.619) 2.222 16.615 ( 0.744 5.047 0.070) 5.102 ======================= Grid point 38 (27/172) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.908 ( -0.000 1.897 0.000) 1.897 3.062 ( 0.000 -9.759 -0.000) 9.759 3.106 ( 0.000 -2.461 -0.000) 2.461 3.308 ( 0.000 -5.714 -0.000) 5.714 3.478 ( -0.000 2.127 0.000) 2.127 3.775 ( -0.000 9.427 0.000) 9.427 3.941 ( -0.000 3.623 0.000) 3.623 4.322 ( -0.000 1.347 0.000) 1.347 4.358 ( -0.000 6.046 0.000) 6.046 4.741 ( -0.000 0.896 0.000) 0.896 5.093 ( -0.000 5.932 0.000) 5.932 5.562 ( 0.000 -4.874 -0.000) 4.874 5.780 ( -0.000 1.973 0.000) 1.973 6.063 ( 0.000 -1.563 -0.000) 1.563 6.216 ( -0.000 10.570 0.000) 10.570 6.594 ( 0.000 -7.962 -0.000) 7.962 6.809 ( 0.000 -2.972 -0.000) 2.972 6.952 ( 0.000 -3.696 -0.000) 3.696 7.053 ( 0.000 -0.818 -0.000) 0.818 7.197 ( 0.000 -0.867 -0.000) 0.867 7.622 ( 0.000 -1.553 -0.000) 1.553 8.071 ( 0.000 -4.676 -0.000) 4.676 8.314 ( 0.000 -6.956 -0.000) 6.956 8.641 ( 0.000 -4.241 -0.000) 4.241 8.738 ( 0.000 -4.522 -0.000) 4.522 8.833 ( 0.000 -1.613 -0.000) 1.613 8.934 ( 0.000 -8.295 -0.000) 8.295 9.242 ( 0.000 -18.358 -0.000) 18.358 9.365 ( 0.000 -1.841 -0.000) 1.841 9.451 ( 0.000 -8.492 -0.000) 8.492 9.568 ( 0.000 -0.048 -0.000) 0.048 10.060 ( 0.000 -1.272 -0.000) 1.272 10.133 ( 0.000 -8.804 -0.000) 8.804 10.173 ( -0.000 2.756 0.000) 2.756 10.219 ( -0.000 18.855 0.000) 18.855 10.377 ( 0.000 -2.360 -0.000) 2.360 10.605 ( -0.000 6.147 0.000) 6.147 10.789 ( 0.000 -1.115 -0.000) 1.115 10.929 ( -0.000 9.242 0.000) 9.242 11.031 ( 0.000 -3.670 -0.000) 3.670 11.212 ( 0.000 -1.352 -0.000) 1.352 11.411 ( -0.000 2.266 0.000) 2.266 11.499 ( -0.000 5.768 0.000) 5.768 11.577 ( -0.000 4.040 0.000) 4.040 11.733 ( -0.000 8.923 0.000) 8.923 12.276 ( -0.000 2.533 0.000) 2.533 12.405 ( -0.000 2.125 0.000) 2.125 12.763 ( 0.000 -2.204 -0.000) 2.204 12.838 ( -0.000 1.063 0.000) 1.063 13.178 ( -0.000 8.303 0.000) 8.303 15.915 ( -0.000 1.845 0.000) 1.845 16.265 ( 0.000 -1.893 -0.000) 1.893 16.508 ( 0.000 -1.579 -0.000) 1.579 16.518 ( -0.000 6.215 0.000) 6.215 ======================= Grid point 45 (28/172) ======================= q-point: ( 0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( 25.804 0.000 11.859) 28.398 2.550 ( 28.814 0.000 9.583) 30.365 3.174 ( -6.295 -0.000 -13.302) 14.717 3.352 ( -9.139 -0.000 0.824) 9.177 3.621 ( -3.794 -0.000 -6.816) 7.801 3.753 ( -18.294 -0.000 -5.409) 19.077 4.092 ( 28.552 0.000 8.170) 29.698 4.328 ( 9.675 0.000 1.401) 9.776 4.868 ( -3.926 -0.000 2.185) 4.493 5.121 ( -1.517 -0.000 4.076) 4.349 5.161 ( 1.145 0.000 6.800) 6.896 5.616 ( -1.933 -0.000 0.815) 2.098 5.666 ( -7.514 -0.000 -5.993) 9.611 6.031 ( -1.955 -0.000 -3.691) 4.177 6.279 ( -3.028 -0.000 2.185) 3.734 6.333 ( -0.260 -0.000 -0.956) 0.991 6.513 ( -0.256 -0.000 0.139) 0.291 6.627 ( 0.777 0.000 -2.382) 2.505 6.786 ( 0.586 0.000 -1.173) 1.311 7.112 ( 7.343 0.000 -0.652) 7.372 7.570 ( -9.299 -0.000 2.705) 9.684 7.645 ( 5.652 0.000 -0.317) 5.661 7.965 ( -2.132 -0.000 -1.595) 2.663 8.220 ( 0.435 0.000 -0.683) 0.810 8.309 ( -2.407 -0.000 -0.841) 2.550 8.321 ( -2.337 -0.000 1.065) 2.568 8.439 ( -1.425 -0.000 0.885) 1.677 8.955 ( -4.277 -0.000 0.096) 4.278 9.105 ( -3.591 -0.000 -2.648) 4.462 9.260 ( 0.849 0.000 1.465) 1.693 9.597 ( -0.397 -0.000 -0.191) 0.440 9.764 ( 0.914 0.000 1.200) 1.508 9.766 ( -4.710 -0.000 -0.257) 4.717 10.179 ( -0.516 -0.000 -0.733) 0.897 10.381 ( -0.449 -0.000 1.072) 1.162 10.712 ( -0.892 -0.000 4.015) 4.112 10.880 ( 5.309 0.000 -5.287) 7.493 11.038 ( 0.696 0.000 5.198) 5.245 11.148 ( 0.478 0.000 -3.544) 3.576 11.182 ( 3.612 0.000 -3.086) 4.751 11.380 ( -5.488 -0.000 3.265) 6.386 11.590 ( -4.706 -0.000 1.392) 4.907 11.701 ( 5.397 0.000 -1.689) 5.656 12.056 ( -2.692 -0.000 0.613) 2.761 12.085 ( -1.062 -0.000 0.391) 1.132 12.354 ( -1.755 -0.000 2.554) 3.098 12.615 ( 0.830 0.000 -2.015) 2.180 12.698 ( 3.798 0.000 2.410) 4.498 13.309 ( 0.018 0.000 -4.113) 4.113 13.420 ( 3.161 0.000 0.330) 3.179 16.010 ( -0.243 -0.000 -1.523) 1.543 16.215 ( 2.014 0.000 -1.954) 2.806 16.401 ( 4.408 0.000 0.813) 4.483 16.758 ( 1.312 0.000 0.472) 1.394 ======================= Grid point 46 (29/172) ======================= q-point: ( 0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 20.118 -2.746 10.023) 22.643 2.811 ( 23.156 -3.298 6.036) 24.156 3.066 ( -13.638 -2.139 -9.802) 16.931 3.292 ( -2.441 3.148 0.430) 4.007 3.416 ( -16.772 8.550 -5.451) 19.599 3.693 ( -0.521 -4.036 -3.521) 5.381 4.277 ( 7.986 2.373 1.590) 8.481 4.460 ( 7.593 -6.602 3.692) 10.717 4.772 ( -1.884 8.208 1.349) 8.529 5.093 ( 3.936 3.808 4.484) 7.078 5.206 ( -2.377 -1.632 -0.418) 2.913 5.482 ( -2.555 6.395 -0.972) 6.955 5.716 ( -2.399 -5.700 -0.104) 6.185 6.051 ( -0.391 -4.955 -2.870) 5.740 6.202 ( -2.373 5.579 1.099) 6.162 6.362 ( 0.564 -3.548 -0.526) 3.631 6.566 ( 0.313 -4.980 -0.281) 4.997 6.659 ( 0.301 -3.522 -0.525) 3.573 6.831 ( 0.009 -5.060 -0.276) 5.068 7.160 ( 4.605 0.422 -0.444) 4.646 7.523 ( -5.844 -1.335 1.267) 6.127 7.735 ( 3.679 -5.654 -0.531) 6.766 7.979 ( -1.879 -3.646 -0.443) 4.126 8.269 ( 0.676 -5.650 1.023) 5.782 8.311 ( -1.233 -3.986 -1.030) 4.298 8.373 ( -1.469 -5.961 -0.159) 6.141 8.479 ( -0.981 -5.217 0.527) 5.335 8.940 ( -2.101 -1.108 -0.366) 2.404 9.092 ( -2.054 -1.932 -1.078) 3.019 9.284 ( 0.599 -1.724 0.685) 1.949 9.600 ( 0.111 -0.962 0.055) 0.969 9.712 ( -2.520 1.286 -0.142) 2.833 9.819 ( -0.113 -3.919 0.502) 3.953 10.189 ( -0.014 -1.652 -0.186) 1.662 10.391 ( -0.264 -0.973 0.357) 1.069 10.726 ( -0.879 -1.442 2.338) 2.884 10.893 ( 2.881 1.367 -3.259) 4.559 11.003 ( 0.624 5.698 2.271) 6.166 11.122 ( 1.230 3.004 -1.548) 3.597 11.190 ( 1.292 1.038 -1.778) 2.431 11.317 ( -3.023 3.830 2.321) 5.403 11.540 ( -2.992 2.373 0.628) 3.870 11.725 ( 2.633 1.038 -0.867) 2.960 11.996 ( -1.062 5.236 -0.264) 5.349 12.060 ( -0.940 1.937 0.693) 2.261 12.343 ( -0.723 0.569 1.246) 1.549 12.588 ( 0.782 3.036 -0.412) 3.161 12.732 ( 1.591 -0.473 1.062) 1.970 13.169 ( 0.177 11.324 -1.809) 11.469 13.479 ( 1.487 -1.209 -0.492) 1.979 16.020 ( -0.011 -1.349 -0.888) 1.615 16.196 ( 0.822 2.530 -0.844) 2.791 16.438 ( 2.200 -0.755 0.472) 2.373 16.747 ( 0.876 2.356 0.256) 2.527 ======================= Grid point 47 (30/172) ======================= q-point: ( 0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( 0.000 -4.749 -0.000) 4.749 2.952 ( 0.000 -1.147 -0.000) 1.147 3.077 ( -0.000 6.017 0.000) 6.017 3.118 ( 0.000 -4.779 -0.000) 4.779 3.330 ( 0.000 -3.699 -0.000) 3.699 3.778 ( 0.000 -5.681 -0.000) 5.681 4.226 ( -0.000 6.423 0.000) 6.423 4.536 ( -0.000 3.416 0.000) 3.416 4.593 ( -0.000 9.834 0.000) 9.834 4.997 ( -0.000 10.119 0.000) 10.119 5.238 ( 0.000 -2.109 -0.000) 2.109 5.391 ( -0.000 1.559 0.000) 1.559 5.798 ( 0.000 -4.159 -0.000) 4.159 6.067 ( -0.000 5.867 0.000) 5.867 6.215 ( 0.000 -11.745 -0.000) 11.745 6.433 ( 0.000 -2.110 -0.000) 2.110 6.636 ( 0.000 -3.990 -0.000) 3.990 6.757 ( 0.000 -7.181 -0.000) 7.181 6.939 ( 0.000 -6.510 -0.000) 6.510 7.160 ( -0.000 1.020 0.000) 1.020 7.539 ( 0.000 -2.736 -0.000) 2.736 7.860 ( 0.000 -6.670 -0.000) 6.670 8.059 ( 0.000 -6.732 -0.000) 6.732 8.397 ( 0.000 -7.505 -0.000) 7.505 8.455 ( 0.000 -13.504 -0.000) 13.504 8.492 ( 0.000 -8.741 -0.000) 8.741 8.603 ( 0.000 -10.177 -0.000) 10.177 8.938 ( -0.000 0.774 0.000) 0.774 9.147 ( 0.000 -5.894 -0.000) 5.894 9.326 ( 0.000 -2.460 -0.000) 2.460 9.614 ( -0.000 0.721 0.000) 0.721 9.719 ( 0.000 -5.181 -0.000) 5.181 9.895 ( 0.000 -5.120 -0.000) 5.120 10.229 ( 0.000 -2.525 -0.000) 2.525 10.398 ( -0.000 0.416 0.000) 0.416 10.752 ( 0.000 -0.995 -0.000) 0.995 10.818 ( -0.000 9.750 0.000) 9.750 10.904 ( -0.000 5.244 0.000) 5.244 11.032 ( -0.000 7.098 0.000) 7.098 11.176 ( -0.000 0.493 0.000) 0.493 11.231 ( -0.000 5.121 0.000) 5.121 11.484 ( -0.000 2.464 0.000) 2.464 11.689 ( -0.000 4.155 0.000) 4.155 11.864 ( -0.000 9.348 0.000) 9.348 12.008 ( -0.000 4.259 0.000) 4.259 12.330 ( -0.000 0.932 0.000) 0.932 12.526 ( -0.000 4.451 0.000) 4.451 12.742 ( -0.000 0.152 0.000) 0.152 12.980 ( -0.000 9.300 0.000) 9.300 13.453 ( -0.000 4.854 0.000) 4.854 16.020 ( -0.000 2.138 0.000) 2.138 16.176 ( 0.000 -1.084 -0.000) 1.084 16.460 ( 0.000 -0.848 -0.000) 0.848 16.696 ( -0.000 3.931 0.000) 3.931 ======================= Grid point 58 (31/172) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( 0.000 0.000 0.000) 0.000 2.883 ( 0.000 0.000 0.000) 0.000 2.939 ( -0.000 -0.000 0.000) 0.000 3.309 ( 0.000 0.000 0.000) 0.000 3.441 ( 0.000 0.000 0.000) 0.000 3.645 ( 0.000 0.000 0.000) 0.000 4.355 ( 0.000 0.000 0.000) 0.000 4.411 ( 0.000 0.000 -0.000) 0.000 4.842 ( 0.000 0.000 0.000) 0.000 5.131 ( 0.000 0.000 0.000) 0.000 5.194 ( 0.000 0.000 0.000) 0.000 5.577 ( 0.000 0.000 0.000) 0.000 5.597 ( 0.000 0.000 0.000) 0.000 6.007 ( 0.000 0.000 0.000) 0.000 6.260 ( 0.000 0.000 0.000) 0.000 6.325 ( 0.000 0.000 -0.000) 0.000 6.506 ( 0.000 0.000 0.000) 0.000 6.628 ( 0.000 0.000 0.000) 0.000 6.786 ( 0.000 0.000 0.000) 0.000 7.185 ( 0.000 0.000 0.000) 0.000 7.487 ( 0.000 0.000 -0.000) 0.000 7.696 ( 0.000 0.000 0.000) 0.000 7.940 ( 0.000 0.000 0.000) 0.000 8.222 ( 0.000 0.000 0.000) 0.000 8.285 ( 0.000 0.000 -0.000) 0.000 8.303 ( 0.000 0.000 0.000) 0.000 8.432 ( 0.000 0.000 -0.000) 0.000 8.916 ( -0.000 -0.000 0.000) 0.000 9.069 ( 0.000 0.000 0.000) 0.000 9.272 ( 0.000 0.000 0.000) 0.000 9.591 ( 0.000 0.000 0.000) 0.000 9.730 ( 0.000 0.000 0.000) 0.000 9.773 ( 0.000 0.000 0.000) 0.000 10.174 ( 0.000 0.000 -0.000) 0.000 10.380 ( 0.000 0.000 0.000) 0.000 10.711 ( 0.000 0.000 0.000) 0.000 10.911 ( 0.000 0.000 0.000) 0.000 11.062 ( 0.000 0.000 -0.000) 0.000 11.140 ( 0.000 0.000 0.000) 0.000 11.213 ( 0.000 0.000 -0.000) 0.000 11.338 ( 0.000 0.000 0.000) 0.000 11.553 ( 0.000 0.000 -0.000) 0.000 11.744 ( 0.000 0.000 0.000) 0.000 12.032 ( 0.000 0.000 0.000) 0.000 12.077 ( 0.000 0.000 0.000) 0.000 12.345 ( 0.000 0.000 0.000) 0.000 12.616 ( 0.000 0.000 0.000) 0.000 12.735 ( 0.000 0.000 0.000) 0.000 13.297 ( 0.000 0.000 0.000) 0.000 13.447 ( 0.000 0.000 0.000) 0.000 16.004 ( 0.000 0.000 0.000) 0.000 16.226 ( 0.000 0.000 0.000) 0.000 16.439 ( 0.000 0.000 0.000) 0.000 16.771 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 105 (32/172) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( 1.912 0.000 37.039) 37.088 0.812 ( 5.559 0.000 38.655) 39.053 1.267 ( 3.753 0.000 59.310) 59.428 3.099 ( -1.974 -0.000 -10.935) 11.112 3.416 ( 0.745 0.000 -18.175) 18.190 4.178 ( -4.530 -0.000 0.655) 4.577 4.228 ( -4.279 -0.000 9.859) 10.748 4.845 ( -6.337 -0.000 1.735) 6.570 4.931 ( 2.092 0.000 3.700) 4.251 5.223 ( 4.801 0.000 -0.995) 4.903 5.243 ( 7.367 0.000 -6.403) 9.760 5.592 ( -2.274 -0.000 -7.954) 8.272 5.971 ( -5.186 -0.000 -3.559) 6.290 6.034 ( 7.780 0.000 2.223) 8.092 6.254 ( 5.447 0.000 5.452) 7.707 6.307 ( 0.014 0.000 -2.648) 2.648 6.563 ( -2.929 -0.000 -0.438) 2.961 6.621 ( 1.655 0.000 -0.170) 1.664 6.828 ( 4.367 0.000 -3.496) 5.594 6.869 ( -0.861 -0.000 -3.198) 3.312 7.505 ( -1.812 -0.000 4.034) 4.422 7.892 ( 3.630 0.000 -2.993) 4.705 8.069 ( -0.378 -0.000 -1.516) 1.563 8.216 ( 3.422 0.000 -4.218) 5.432 8.386 ( -5.142 -0.000 7.042) 8.719 8.444 ( -2.203 -0.000 1.588) 2.716 8.648 ( 0.232 0.000 1.330) 1.350 9.065 ( 4.129 0.000 3.061) 5.140 9.209 ( 4.707 0.000 -1.464) 4.929 9.505 ( -10.529 -0.000 -6.358) 12.300 9.737 ( -4.471 -0.000 5.267) 6.909 9.738 ( -17.324 -0.000 -0.967) 17.351 10.134 ( 2.465 0.000 1.130) 2.711 10.310 ( -1.438 -0.000 2.457) 2.847 10.464 ( 3.123 0.000 1.204) 3.347 10.513 ( -1.455 -0.000 -0.377) 1.503 10.693 ( 12.213 0.000 -5.374) 13.343 10.739 ( 1.501 0.000 -4.090) 4.357 11.237 ( -1.620 -0.000 1.584) 2.266 11.251 ( -3.902 -0.000 0.848) 3.993 11.510 ( 3.137 0.000 2.494) 4.007 11.750 ( -25.416 -0.000 -3.534) 25.661 11.824 ( -0.304 -0.000 1.885) 1.909 11.938 ( 15.245 0.000 -1.022) 15.279 12.124 ( 1.107 0.000 -0.481) 1.207 12.146 ( 5.322 0.000 1.965) 5.673 12.410 ( -1.303 -0.000 1.041) 1.667 12.523 ( -8.511 -0.000 -0.005) 8.511 13.226 ( 10.485 0.000 -0.330) 10.490 13.421 ( -1.466 -0.000 -2.644) 3.024 15.790 ( 10.987 0.000 0.501) 10.998 16.025 ( -1.449 -0.000 -3.670) 3.945 16.179 ( -3.189 -0.000 2.042) 3.787 16.390 ( 13.767 0.000 -1.792) 13.883 ======================= Grid point 106 (33/172) ======================= q-point: ( 0.10 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( 11.719 -16.294 29.110) 35.359 1.199 ( 11.008 -20.490 30.457) 38.323 1.885 ( 23.820 -32.562 41.110) 57.600 3.055 ( -0.179 -0.208 -11.947) 11.950 3.408 ( 2.696 -3.076 -19.505) 19.929 4.068 ( -4.866 5.656 2.023) 7.730 4.232 ( -8.485 -1.305 6.287) 10.640 4.712 ( -10.683 6.491 1.313) 12.569 4.881 ( 0.574 8.198 4.551) 9.394 5.088 ( 2.011 11.111 -1.294) 11.365 5.364 ( 6.950 -1.302 -3.345) 7.822 5.560 ( -2.904 -0.818 -5.601) 6.362 5.928 ( -0.195 1.438 -3.379) 3.678 6.104 ( 8.038 0.019 1.269) 8.138 6.264 ( 2.162 -2.031 4.314) 5.235 6.351 ( -1.902 -0.890 -2.458) 3.233 6.558 ( -5.457 -3.414 -1.819) 6.689 6.662 ( 1.726 -2.479 -1.181) 3.243 6.765 ( -1.157 0.782 -1.970) 2.414 6.935 ( 0.900 -4.640 -3.271) 5.748 7.524 ( -1.833 -3.274 3.713) 5.279 7.950 ( 1.724 -3.349 -1.461) 4.040 8.074 ( 0.618 -2.967 -1.718) 3.483 8.288 ( -0.390 -4.015 -3.075) 5.073 8.422 ( -3.891 -5.971 3.321) 7.863 8.498 ( -1.028 -6.699 0.113) 6.778 8.687 ( 0.665 -3.826 0.514) 3.917 9.087 ( -2.443 -0.668 0.530) 2.588 9.248 ( 4.087 -0.663 -0.335) 4.154 9.370 ( -5.640 1.939 2.522) 6.475 9.636 ( -2.770 0.691 0.106) 2.856 9.714 ( -6.138 1.131 3.549) 7.180 10.136 ( 3.818 2.358 1.274) 4.665 10.313 ( -3.712 -1.660 0.827) 4.150 10.440 ( 2.734 3.068 0.632) 4.158 10.516 ( -4.547 -2.436 0.967) 5.248 10.689 ( 6.005 -1.104 -3.442) 7.009 10.946 ( 4.768 -7.230 -8.392) 12.060 11.180 ( -2.842 1.910 -0.321) 3.439 11.240 ( -4.568 -0.127 -0.301) 4.579 11.447 ( -0.190 6.136 4.153) 7.412 11.654 ( -8.705 -1.949 0.464) 8.933 11.774 ( -2.343 4.746 1.704) 5.561 11.987 ( 11.487 6.220 -1.506) 13.150 12.082 ( 3.126 4.647 4.309) 7.067 12.184 ( 1.589 1.948 -1.364) 2.860 12.436 ( 2.295 -1.636 -2.096) 3.512 12.485 ( -3.087 -0.557 -0.256) 3.148 13.152 ( 4.017 9.593 4.558) 11.355 13.368 ( -1.849 3.758 -3.634) 5.546 15.879 ( 9.745 -0.395 0.317) 9.758 16.008 ( 0.477 0.269 -4.095) 4.131 16.169 ( -0.297 -1.376 1.882) 2.350 16.526 ( 6.735 -2.097 -7.288) 10.142 ======================= Grid point 107 (34/172) ======================= q-point: ( 0.20 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 12.571 -23.974 18.148) 32.591 1.759 ( 10.049 -25.222 21.795) 34.816 2.721 ( 21.486 -27.331 16.266) 38.383 3.071 ( 4.135 -6.083 -6.051) 9.525 3.439 ( 4.291 -3.643 -17.896) 18.760 3.954 ( -3.906 4.595 5.097) 7.896 4.179 ( -8.427 0.018 2.553) 8.805 4.495 ( -11.456 8.614 2.590) 14.565 4.725 ( 1.101 11.204 5.961) 12.739 4.903 ( -1.009 10.080 -0.008) 10.131 5.352 ( 2.781 5.735 -0.678) 6.409 5.534 ( -0.389 1.273 -5.666) 5.820 5.873 ( 2.877 5.409 -2.311) 6.548 6.169 ( 4.959 0.253 2.904) 5.752 6.289 ( -2.943 3.195 3.957) 5.876 6.400 ( -2.669 -10.853 -4.050) 11.887 6.564 ( -3.277 -3.633 -4.764) 6.828 6.706 ( -2.417 -4.035 -4.725) 6.667 6.816 ( 1.657 -5.098 0.506) 5.384 7.022 ( 2.233 -5.055 -1.242) 5.664 7.600 ( -0.060 -4.818 3.253) 5.814 7.993 ( -1.914 -1.950 1.553) 3.143 8.199 ( 1.630 -10.134 -1.924) 10.443 8.352 ( -0.636 -5.206 -0.530) 5.271 8.530 ( -3.303 -8.883 2.860) 9.899 8.613 ( -2.306 -8.936 -0.467) 9.241 8.777 ( 0.514 -5.407 -0.668) 5.472 9.057 ( -5.762 -0.349 -1.313) 5.920 9.292 ( 2.510 -0.945 -0.969) 2.852 9.359 ( 0.738 -0.635 0.998) 1.395 9.623 ( -1.116 0.826 3.766) 4.014 9.673 ( -0.871 -1.994 0.368) 2.207 10.143 ( 2.777 -0.179 -0.377) 2.808 10.287 ( -1.136 2.302 -2.748) 3.761 10.434 ( 1.504 0.780 2.404) 2.941 10.514 ( -6.090 -2.105 0.565) 6.468 10.764 ( 4.302 -2.094 -1.551) 5.030 10.987 ( -0.070 1.825 -0.716) 1.962 11.124 ( -2.297 1.805 -4.019) 4.969 11.196 ( -2.900 1.187 -1.174) 3.346 11.358 ( 0.026 6.907 2.825) 7.462 11.588 ( -5.154 2.882 -0.298) 5.913 11.681 ( 0.767 5.414 2.920) 6.199 11.900 ( 5.080 10.795 -1.696) 12.050 12.047 ( 5.206 5.302 4.322) 8.596 12.125 ( -0.313 3.640 0.563) 3.697 12.420 ( -0.868 2.535 0.383) 2.707 12.528 ( 4.582 -2.769 -4.924) 7.273 13.028 ( -1.958 7.571 4.076) 8.818 13.277 ( 1.648 4.716 -3.907) 6.342 15.965 ( 1.947 -2.087 -2.302) 3.667 15.998 ( 4.861 -0.032 -1.103) 4.985 16.230 ( 2.624 -3.422 1.819) 4.680 16.543 ( 2.124 0.697 -5.619) 6.047 ======================= Grid point 108 (35/172) ======================= q-point: ( 0.30 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( 10.836 -24.304 12.026) 29.202 2.305 ( 6.880 -24.309 15.046) 29.405 2.989 ( 2.344 -4.382 -9.189) 10.447 3.322 ( 2.326 -6.000 -8.279) 10.486 3.571 ( 8.508 -5.385 1.769) 10.224 3.903 ( 0.496 -1.564 5.764) 5.993 4.147 ( -3.812 0.491 5.921) 7.059 4.300 ( -3.600 5.370 5.566) 8.530 4.584 ( 1.577 6.729 2.979) 7.526 4.749 ( 0.079 6.852 0.292) 6.859 5.241 ( 0.404 8.202 -0.285) 8.217 5.475 ( -0.162 2.690 -7.673) 8.133 5.786 ( 0.489 5.110 -0.786) 5.193 6.129 ( -2.999 5.481 3.925) 7.378 6.260 ( -0.743 -0.772 3.276) 3.447 6.525 ( -3.869 -5.065 -4.983) 8.090 6.620 ( 0.974 -5.331 -3.441) 6.419 6.765 ( -2.665 -7.469 -3.726) 8.762 6.919 ( 2.618 -4.400 -0.495) 5.144 7.130 ( 2.452 -5.079 0.102) 5.641 7.696 ( 2.184 -4.246 4.007) 6.233 7.999 ( -6.133 -1.681 2.743) 6.925 8.372 ( 0.333 -7.758 -0.411) 7.776 8.450 ( 0.516 -6.581 -1.204) 6.710 8.657 ( -2.654 -7.669 0.648) 8.141 8.810 ( 1.121 -9.787 -0.560) 9.867 8.863 ( -2.609 -10.178 0.285) 10.511 9.027 ( -6.052 -3.414 -1.710) 7.156 9.279 ( -0.030 2.594 -0.796) 2.714 9.411 ( 1.946 -4.222 -1.155) 4.790 9.638 ( 7.623 0.419 0.495) 7.651 9.782 ( 0.494 -8.902 2.570) 9.279 10.163 ( -0.725 1.099 -0.683) 1.484 10.213 ( 1.154 3.396 -4.181) 5.509 10.395 ( 0.161 5.668 1.621) 5.897 10.521 ( -4.943 -3.573 -0.412) 6.113 10.767 ( 0.671 5.249 0.348) 5.303 10.921 ( -2.714 3.575 2.008) 4.917 11.050 ( -3.442 2.492 -4.643) 6.294 11.158 ( 1.847 3.259 -1.488) 4.031 11.233 ( -2.464 4.202 2.346) 5.407 11.505 ( -1.888 4.027 0.871) 4.532 11.587 ( 2.078 8.602 -0.255) 8.853 11.726 ( 2.009 10.735 1.209) 10.988 11.966 ( 0.051 6.951 1.378) 7.086 12.121 ( 4.314 -0.268 3.730) 5.709 12.369 ( -0.576 2.479 -0.478) 2.590 12.593 ( 5.571 -1.621 -4.553) 7.375 12.892 ( -4.848 5.555 1.603) 7.545 13.215 ( 2.564 3.721 -2.851) 5.343 15.954 ( -0.015 0.604 -2.433) 2.507 16.088 ( 4.358 -3.354 -0.332) 5.509 16.321 ( 3.495 -3.609 1.645) 5.286 16.527 ( 0.934 0.831 -4.295) 4.474 ======================= Grid point 109 (36/172) ======================= q-point: ( 0.40 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.627 ( 5.881 -16.469 10.090) 20.189 2.766 ( 4.684 -20.550 6.204) 21.971 3.068 ( 1.635 -6.505 -3.676) 7.649 3.308 ( -0.781 3.865 -4.878) 6.272 3.540 ( -6.471 4.446 1.667) 8.026 3.936 ( -3.779 1.838 4.929) 6.477 4.069 ( -3.000 6.588 10.199) 12.507 4.367 ( 11.100 -2.116 4.306) 12.093 4.544 ( -3.815 -1.267 -6.230) 7.414 4.713 ( 8.811 1.427 1.584) 9.065 5.094 ( -0.005 7.824 -2.735) 8.288 5.401 ( 0.514 2.977 -9.816) 10.270 5.732 ( -2.652 0.240 3.477) 4.379 6.056 ( -1.330 0.907 2.305) 2.812 6.262 ( -1.304 1.544 4.714) 5.129 6.499 ( -3.116 1.138 -3.180) 4.595 6.714 ( 1.807 -4.494 -2.486) 5.445 6.865 ( -0.988 -5.106 -1.552) 5.427 7.000 ( 1.972 -3.349 -1.524) 4.174 7.214 ( 1.036 -2.558 0.158) 2.764 7.795 ( 3.503 -2.734 5.192) 6.834 7.969 ( -8.387 -0.805 2.944) 8.925 8.443 ( -1.509 -1.963 1.475) 2.882 8.575 ( 2.767 -6.065 -2.662) 7.178 8.747 ( 0.248 -3.508 -0.743) 3.595 8.817 ( -2.818 0.580 -2.420) 3.760 9.072 ( -5.656 -6.624 -2.636) 9.101 9.164 ( 1.751 -13.426 0.697) 13.558 9.281 ( 0.653 -7.251 -0.528) 7.299 9.504 ( 0.235 -5.344 0.179) 5.352 9.708 ( 11.762 1.706 -2.094) 12.068 9.920 ( 0.692 -1.709 -1.165) 2.180 10.080 ( -1.656 0.955 3.222) 3.746 10.198 ( -0.431 0.033 -4.370) 4.391 10.258 ( 1.555 11.179 -1.086) 11.339 10.516 ( -5.413 -0.536 -2.183) 5.861 10.634 ( -1.628 6.674 2.269) 7.234 10.851 ( -0.791 3.859 3.480) 5.257 11.000 ( -3.749 -2.149 -4.898) 6.532 11.104 ( 2.025 3.157 -1.539) 4.055 11.205 ( -3.026 -0.384 1.419) 3.364 11.403 ( 1.821 8.443 0.569) 8.656 11.458 ( -0.926 3.547 1.140) 3.839 11.608 ( 2.307 6.098 2.454) 6.966 11.854 ( -2.369 4.687 1.095) 5.365 12.178 ( 4.354 0.030 3.162) 5.381 12.331 ( 0.414 1.410 -0.467) 1.542 12.644 ( 4.546 -0.847 -2.814) 5.413 12.793 ( -3.516 1.806 -0.398) 3.973 13.168 ( 0.550 2.372 -2.334) 3.373 15.948 ( -0.412 -0.583 -0.512) 0.879 16.157 ( 2.581 -1.616 -0.608) 3.105 16.408 ( 3.054 -2.733 0.592) 4.141 16.505 ( 0.141 0.981 -3.352) 3.496 ======================= Grid point 110 (37/172) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -2.684 3.924 3.864) 6.126 3.042 ( 0.110 5.667 0.632) 5.703 3.172 ( 0.528 -8.337 0.532) 8.371 3.276 ( 0.397 -5.365 6.033) 8.083 3.465 ( -3.130 -3.365 5.759) 7.368 3.910 ( -1.602 -1.484 5.886) 6.278 3.995 ( -1.846 1.940 9.473) 9.845 4.371 ( -6.366 3.472 -3.531) 8.065 4.555 ( -1.307 -2.326 -4.890) 5.570 4.725 ( 8.118 6.827 -2.571) 10.914 4.983 ( -0.032 2.742 -6.167) 6.749 5.376 ( 5.522 -0.881 -7.240) 9.148 5.749 ( -2.036 -3.258 4.091) 5.612 6.030 ( -4.330 3.228 -0.007) 5.400 6.241 ( 0.643 0.852 5.233) 5.341 6.488 ( 3.156 -1.773 0.079) 3.621 6.775 ( 1.711 -1.344 -0.998) 2.394 6.899 ( 1.189 0.425 -1.562) 2.009 7.047 ( -0.338 -1.320 -1.042) 1.716 7.225 ( -0.691 1.391 -0.563) 1.652 7.832 ( -3.611 1.102 5.131) 6.370 7.948 ( 0.116 -0.415 2.990) 3.021 8.452 ( 0.224 0.505 1.494) 1.593 8.640 ( 1.836 0.655 -3.435) 3.950 8.776 ( -0.433 0.187 -1.870) 1.929 8.805 ( 0.260 -2.516 -0.316) 2.549 9.084 ( -2.066 -1.152 -3.462) 4.193 9.312 ( 1.561 -2.190 0.492) 2.734 9.406 ( -0.739 0.300 -0.116) 0.806 9.536 ( 0.536 8.600 -2.366) 8.935 9.748 ( 2.895 -6.493 0.449) 7.124 9.890 ( -0.651 0.182 -4.141) 4.196 10.011 ( -2.474 7.206 0.096) 7.620 10.169 ( -0.451 1.141 -1.867) 2.234 10.231 ( 8.188 -4.604 -2.022) 9.609 10.494 ( -3.546 -0.646 0.700) 3.672 10.552 ( 2.374 1.717 1.125) 3.139 10.823 ( -4.867 -1.879 2.928) 5.982 11.015 ( -2.359 -3.188 -3.032) 4.992 11.066 ( 4.193 3.997 -3.218) 6.627 11.204 ( -3.174 -3.287 1.666) 4.864 11.334 ( 0.101 -0.298 1.424) 1.458 11.434 ( 0.950 1.137 0.555) 1.582 11.575 ( 0.321 -0.602 3.277) 3.347 11.796 ( -3.422 -0.590 1.514) 3.788 12.181 ( 1.834 2.995 0.742) 3.589 12.323 ( 1.444 0.889 0.294) 1.721 12.678 ( 2.822 -0.421 1.081) 3.051 12.777 ( -0.223 -1.343 -2.393) 2.753 13.137 ( -1.770 -0.642 -2.778) 3.356 15.964 ( -1.748 -2.221 0.891) 2.963 16.184 ( 2.348 0.527 -0.099) 2.409 16.420 ( -0.858 2.628 -2.920) 4.021 16.508 ( 1.442 -1.668 -0.875) 2.372 ======================= Grid point 111 (38/172) ======================= q-point: (-0.40 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( -8.916 18.898 4.603) 21.397 2.714 ( -7.842 22.928 3.407) 24.470 3.223 ( -1.341 2.998 3.729) 4.969 3.418 ( 1.485 -5.965 -3.190) 6.925 3.675 ( 1.757 -13.228 11.263) 17.462 3.953 ( -7.724 -0.404 -1.020) 7.802 4.005 ( -0.343 -1.246 9.612) 9.699 4.247 ( -6.302 0.815 5.577) 8.455 4.468 ( -5.673 3.911 -8.625) 11.039 4.669 ( 7.849 4.154 -2.597) 9.253 5.001 ( 0.557 -6.318 -6.649) 9.189 5.446 ( 6.388 -2.460 -4.806) 8.364 5.827 ( -0.548 -4.522 2.347) 5.124 5.919 ( -3.335 2.714 0.322) 4.311 6.232 ( -1.312 0.996 -0.220) 1.662 6.602 ( 8.754 -3.431 3.546) 10.049 6.782 ( 1.362 1.629 -0.344) 2.151 6.866 ( 2.782 4.770 -1.497) 5.721 7.023 ( -2.351 2.551 -0.791) 3.558 7.160 ( -1.826 4.377 -1.458) 4.961 7.771 ( -6.324 1.951 4.847) 8.203 7.959 ( 4.784 3.008 1.867) 5.951 8.442 ( 1.884 2.315 1.349) 3.276 8.585 ( 0.368 4.880 -2.798) 5.637 8.730 ( -0.373 3.747 -0.667) 3.824 8.870 ( 2.940 -1.600 -1.377) 3.620 9.072 ( -1.515 5.396 -4.577) 7.236 9.148 ( 1.220 11.864 0.037) 11.926 9.259 ( 1.925 14.215 1.896) 14.469 9.452 ( -1.578 -0.781 -0.955) 2.003 9.774 ( -7.690 4.021 -1.273) 8.770 9.892 ( -1.552 1.416 -0.512) 2.162 9.987 ( 1.655 -5.792 -1.115) 6.127 10.141 ( 6.848 1.719 -4.032) 8.131 10.398 ( 3.233 -4.952 -1.093) 6.014 10.501 ( -1.552 -5.802 -0.030) 6.006 10.636 ( 5.294 -4.610 2.206) 7.358 10.821 ( -5.753 -1.679 3.334) 6.858 11.006 ( 2.146 1.474 -1.402) 2.957 11.094 ( 3.683 -4.379 -2.556) 6.267 11.290 ( -1.711 -7.636 1.231) 7.922 11.367 ( -1.613 -1.617 -0.304) 2.305 11.461 ( -0.518 -5.588 0.213) 5.616 11.641 ( -1.210 -6.225 1.092) 6.435 11.831 ( -4.568 -5.915 2.719) 7.953 12.128 ( 1.239 4.312 1.020) 4.601 12.320 ( 1.287 0.382 -0.910) 1.622 12.717 ( 2.686 -0.482 3.336) 4.310 12.789 ( -0.127 -0.744 -2.788) 2.888 13.161 ( -2.800 -5.333 -3.210) 6.826 15.995 ( -3.481 -3.244 0.944) 4.851 16.173 ( 1.836 2.977 0.635) 3.555 16.331 ( -2.764 4.276 -3.415) 6.131 16.542 ( 1.308 -1.144 -1.445) 2.260 ======================= Grid point 112 (39/172) ======================= q-point: (-0.30 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( -12.773 26.610 7.483) 30.451 2.204 ( -12.083 28.631 7.276) 31.916 3.121 ( -10.427 16.444 2.945) 19.693 3.246 ( -7.561 12.108 -5.544) 15.313 3.840 ( -4.059 -2.147 1.938) 4.984 3.889 ( -3.856 -0.370 -0.784) 3.953 4.063 ( 0.565 -6.882 9.522) 11.762 4.346 ( 4.575 -7.696 10.126) 13.516 4.455 ( -0.761 -7.817 -2.539) 8.254 4.715 ( 7.416 -3.358 -1.398) 8.260 5.133 ( 1.237 -9.027 -4.410) 10.122 5.511 ( 3.883 -1.940 -4.737) 6.425 5.842 ( -2.307 -1.482 -3.213) 4.224 5.955 ( 0.159 -4.097 0.839) 4.185 6.218 ( 0.387 -0.858 -0.511) 1.071 6.686 ( 5.142 3.365 3.522) 7.083 6.736 ( 0.515 4.604 -0.740) 4.691 6.772 ( 2.684 7.600 -2.091) 8.327 6.946 ( -0.593 3.497 -0.128) 3.549 7.054 ( -2.243 5.087 -2.127) 5.953 7.701 ( -5.495 2.476 4.675) 7.628 7.935 ( 5.253 4.231 0.028) 6.745 8.374 ( 0.043 8.414 -0.730) 8.446 8.483 ( 1.018 5.955 -0.797) 6.094 8.663 ( 1.097 4.020 1.022) 4.291 8.744 ( 0.239 13.801 -1.511) 13.886 8.910 ( 3.881 7.710 -1.400) 8.745 9.065 ( -0.146 7.247 -0.607) 7.273 9.161 ( 3.768 -1.845 -1.006) 4.314 9.448 ( -2.415 -0.775 1.040) 2.741 9.652 ( -2.093 4.104 -0.455) 4.629 9.794 ( -4.034 4.477 2.353) 6.469 10.057 ( 0.314 -1.471 -3.228) 3.561 10.240 ( 7.695 -4.718 -1.371) 9.130 10.422 ( -4.189 -1.566 -0.379) 4.488 10.562 ( 1.155 1.001 0.142) 1.535 10.761 ( 1.011 -3.624 1.498) 4.049 10.824 ( 2.180 -1.374 0.444) 2.615 11.088 ( 1.903 -7.812 -0.512) 8.056 11.190 ( 3.643 -3.628 0.197) 5.145 11.360 ( -0.333 -1.640 -3.065) 3.492 11.434 ( -1.547 -7.405 3.635) 8.393 11.579 ( -2.356 -8.720 -1.310) 9.127 11.759 ( -1.942 -8.638 -1.739) 9.022 11.913 ( -5.970 -6.815 3.461) 9.699 12.085 ( 2.104 1.826 1.526) 3.176 12.334 ( 1.510 -1.283 -1.370) 2.409 12.735 ( -1.239 0.066 1.819) 2.202 12.799 ( 2.111 -0.519 -1.328) 2.548 13.248 ( -3.056 -7.913 -2.547) 8.857 16.006 ( -4.181 -0.560 -1.423) 4.452 16.113 ( -2.913 3.102 1.025) 4.377 16.239 ( -0.861 3.358 -1.489) 3.773 16.559 ( 1.338 -0.313 -3.055) 3.350 ======================= Grid point 113 (40/172) ======================= q-point: (-0.20 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -14.582 28.994 12.312) 34.711 1.608 ( -16.054 30.614 12.276) 36.683 2.394 ( -23.197 42.180 14.209) 50.192 3.167 ( -1.514 0.088 -6.947) 7.110 3.680 ( -7.211 6.692 -11.055) 14.799 3.978 ( 0.842 -6.428 2.911) 7.107 4.217 ( 1.032 -4.122 11.629) 12.381 4.556 ( 3.689 -9.440 7.490) 12.602 4.659 ( 4.428 -12.373 0.728) 13.162 4.866 ( 5.726 -7.439 -0.527) 9.403 5.266 ( 1.873 -5.252 -4.453) 7.136 5.561 ( 3.778 -2.193 -3.882) 5.844 5.854 ( -2.717 -3.682 -4.814) 6.642 6.014 ( 0.169 -3.024 -1.107) 3.224 6.256 ( 1.579 -0.676 1.291) 2.149 6.552 ( -2.146 9.617 -2.436) 10.150 6.647 ( 2.754 8.229 0.702) 8.707 6.685 ( 0.764 3.057 -0.140) 3.154 6.879 ( -0.621 6.059 1.872) 6.372 6.971 ( 0.462 2.114 -3.651) 4.244 7.623 ( -4.506 3.616 4.468) 7.304 7.912 ( 5.632 3.130 -1.334) 6.580 8.185 ( -0.226 10.042 -1.907) 10.224 8.405 ( -0.546 3.984 0.536) 4.057 8.539 ( 1.209 8.847 0.349) 8.936 8.651 ( 3.622 3.070 0.778) 4.811 8.739 ( 0.082 10.896 -2.029) 11.084 9.011 ( 3.151 1.900 -0.795) 3.765 9.204 ( 3.823 0.586 -1.829) 4.279 9.453 ( -4.594 -2.426 5.109) 7.286 9.616 ( 2.129 -0.183 -1.245) 2.473 9.741 ( -2.554 -0.406 4.567) 5.248 10.066 ( -1.346 -1.580 -2.068) 2.930 10.320 ( 5.839 1.818 0.357) 6.126 10.422 ( -5.124 -2.419 -0.257) 5.672 10.532 ( 3.378 2.958 0.434) 4.511 10.764 ( -2.492 0.863 -0.700) 2.729 10.907 ( 2.560 -3.736 -0.553) 4.562 11.171 ( 3.146 0.246 -1.485) 3.487 11.288 ( 0.844 -3.724 1.224) 4.010 11.381 ( -1.672 -2.872 -3.700) 4.973 11.572 ( 2.490 -7.540 4.146) 8.958 11.696 ( -1.078 -6.755 -1.164) 6.939 11.881 ( -3.603 -7.798 1.615) 8.741 11.974 ( -5.873 -5.155 1.119) 7.894 12.113 ( 2.933 -1.852 -0.327) 3.484 12.377 ( 1.344 -2.432 -0.974) 2.944 12.716 ( -6.249 -1.623 -4.721) 7.999 12.832 ( 5.366 -0.065 5.101) 7.404 13.351 ( -2.950 -7.220 -1.896) 8.026 15.922 ( -5.090 4.277 -2.436) 7.081 16.057 ( -4.442 0.310 -1.380) 4.662 16.197 ( -0.796 1.143 1.694) 2.193 16.552 ( 2.021 1.600 -5.969) 6.501 ======================= Grid point 114 (41/172) ======================= q-point: (-0.10 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.958 ( -14.525 23.499 23.360) 36.178 1.026 ( -14.400 25.877 24.361) 38.346 1.578 ( -16.151 38.679 38.333) 56.801 3.136 ( -2.295 -0.681 -8.913) 9.229 3.506 ( -2.925 4.164 -15.265) 16.091 4.103 ( -0.850 -6.756 3.667) 7.734 4.267 ( -1.486 1.347 9.212) 9.428 4.758 ( 2.335 -8.639 4.617) 10.070 4.863 ( 1.864 -6.179 3.103) 7.161 5.042 ( 4.635 -9.363 -3.076) 10.890 5.296 ( 3.521 2.123 -5.850) 7.150 5.609 ( 2.285 -0.896 -4.175) 4.843 5.918 ( 0.211 -6.182 -2.602) 6.710 6.046 ( 0.172 0.044 -2.262) 2.269 6.214 ( 0.307 4.964 4.301) 6.575 6.399 ( -1.877 5.134 -4.015) 6.782 6.584 ( 3.051 2.879 2.112) 4.696 6.643 ( 0.533 2.023 -1.406) 2.521 6.782 ( -0.547 2.587 1.727) 3.159 6.929 ( 1.260 3.149 -2.944) 4.491 7.539 ( -3.391 3.379 4.629) 6.660 7.901 ( 5.739 2.948 -3.048) 7.135 8.075 ( 0.347 2.265 -1.478) 2.727 8.318 ( 0.099 6.393 -3.608) 7.342 8.434 ( 0.482 4.628 1.854) 5.008 8.533 ( -2.953 7.797 -0.331) 8.344 8.659 ( 1.965 1.958 0.804) 2.888 9.024 ( 5.737 1.143 2.546) 6.380 9.197 ( 3.572 1.860 -2.605) 4.796 9.501 ( -6.647 -6.490 1.887) 9.479 9.670 ( -1.160 -5.225 1.996) 5.713 9.777 ( -2.370 -3.559 5.034) 6.604 10.093 ( -0.260 -2.793 -0.338) 2.826 10.317 ( 2.907 2.009 1.351) 3.783 10.404 ( 1.091 1.046 0.798) 1.709 10.529 ( 1.139 0.573 0.032) 1.275 10.700 ( -5.834 1.946 -2.476) 6.629 10.911 ( 4.099 7.694 -7.565) 11.542 11.187 ( 2.078 -1.651 0.857) 2.789 11.304 ( -1.200 1.276 -0.160) 1.759 11.430 ( -1.244 -5.123 0.881) 5.345 11.738 ( 4.836 -6.434 3.531) 8.789 11.791 ( 3.390 -3.725 0.702) 5.085 11.933 ( -13.569 -3.948 -0.157) 14.133 12.032 ( 0.349 -4.593 2.111) 5.067 12.157 ( 3.699 0.182 -2.821) 4.655 12.415 ( 0.571 -0.908 -0.598) 1.229 12.639 ( -12.894 0.104 -8.065) 15.209 12.969 ( 11.828 -7.112 11.010) 17.655 13.421 ( -2.254 -3.518 -2.245) 4.744 15.805 ( -4.941 3.300 -1.680) 6.174 16.027 ( -1.121 -0.319 -1.570) 1.956 16.182 ( -2.691 -0.220 2.101) 3.421 16.478 ( 4.198 8.321 -8.759) 12.790 ======================= Grid point 116 (42/172) ======================= q-point: ( 0.10 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( 22.351 0.000 29.978) 37.393 1.239 ( 18.984 0.000 34.145) 39.067 1.984 ( 41.269 0.000 45.671) 61.555 3.023 ( 1.504 0.000 -13.316) 13.401 3.359 ( 6.121 0.000 -21.650) 22.499 4.082 ( -5.306 -0.000 -2.284) 5.777 4.149 ( -12.169 -0.000 8.560) 14.878 4.661 ( -15.545 -0.000 0.083) 15.545 4.984 ( 1.577 0.000 4.865) 5.114 5.263 ( 0.213 0.000 1.593) 1.607 5.323 ( 3.605 0.000 -3.893) 5.306 5.516 ( 0.302 0.000 -8.303) 8.308 5.866 ( -4.911 -0.000 -3.921) 6.284 6.209 ( 10.619 0.000 3.045) 11.047 6.303 ( 1.191 0.000 -2.052) 2.373 6.336 ( 0.658 0.000 1.188) 1.359 6.470 ( -6.666 -0.000 1.026) 6.745 6.639 ( 0.347 0.000 -0.807) 0.878 6.786 ( -3.582 -0.000 -5.543) 6.600 6.852 ( 1.365 0.000 -3.373) 3.639 7.489 ( -1.941 -0.000 2.444) 3.121 7.908 ( -0.088 -0.000 -1.004) 1.008 8.053 ( -0.825 -0.000 -1.581) 1.784 8.246 ( 3.504 0.000 -5.742) 6.727 8.346 ( -5.279 -0.000 8.327) 9.859 8.438 ( -0.486 -0.000 0.547) 0.731 8.639 ( -2.496 -0.000 1.670) 3.003 9.048 ( -4.322 -0.000 -2.270) 4.882 9.275 ( 2.651 0.000 1.900) 3.262 9.349 ( -4.019 -0.000 0.939) 4.127 9.623 ( -2.694 -0.000 1.156) 2.932 9.689 ( -2.836 -0.000 3.236) 4.302 10.189 ( 1.983 0.000 0.132) 1.987 10.238 ( -9.156 -0.000 0.516) 9.170 10.454 ( -2.500 -0.000 1.928) 3.157 10.515 ( 2.837 0.000 0.767) 2.939 10.742 ( 1.661 0.000 -4.693) 4.978 10.854 ( 10.474 0.000 -9.248) 13.973 11.183 ( -4.190 -0.000 0.407) 4.210 11.209 ( -1.876 -0.000 3.319) 3.812 11.505 ( -6.772 -0.000 2.137) 7.101 11.587 ( 2.413 0.000 4.071) 4.732 11.798 ( -3.309 -0.000 1.399) 3.593 12.106 ( 4.408 0.000 -2.494) 5.065 12.155 ( 2.065 0.000 0.632) 2.159 12.249 ( 9.741 0.000 0.281) 9.745 12.413 ( 1.820 0.000 0.635) 1.928 12.490 ( 0.654 0.000 1.190) 1.358 13.278 ( 0.521 0.000 0.197) 0.557 13.364 ( -3.144 -0.000 -4.443) 5.443 15.987 ( -0.058 -0.000 -5.089) 5.090 15.992 ( 12.196 0.000 -2.313) 12.414 16.143 ( -2.069 -0.000 0.619) 2.160 16.570 ( 9.867 0.000 -6.404) 11.763 ======================= Grid point 117 (43/172) ======================= q-point: ( 0.20 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 23.454 -8.667 24.151) 34.763 1.609 ( 19.027 -13.078 28.377) 36.583 2.614 ( 37.684 -17.789 28.295) 50.370 3.018 ( 4.865 -1.706 -10.518) 11.714 3.379 ( 8.176 -2.791 -20.705) 22.435 3.998 ( -7.463 3.785 4.975) 9.735 4.092 ( -8.783 -1.804 0.217) 8.969 4.498 ( -16.062 3.613 0.718) 16.479 4.923 ( 0.636 8.684 4.879) 9.981 5.088 ( -1.715 11.957 1.862) 12.222 5.432 ( 1.369 -1.562 -1.712) 2.692 5.490 ( -0.870 -0.463 -5.008) 5.104 5.887 ( -1.136 -5.086 -5.703) 7.726 6.222 ( -0.448 3.726 0.156) 3.756 6.270 ( 0.686 1.485 -1.463) 2.194 6.352 ( 1.931 0.224 2.630) 3.270 6.461 ( -3.230 -3.271 -0.565) 4.632 6.652 ( -1.351 -0.422 -2.653) 3.007 6.752 ( 1.349 -3.286 -2.140) 4.147 6.932 ( 1.425 -6.087 -2.808) 6.853 7.522 ( 0.098 -4.265 1.642) 4.571 7.936 ( -3.288 -2.978 1.014) 4.551 8.068 ( -0.472 -4.357 -1.476) 4.624 8.283 ( 1.851 -2.881 -3.750) 5.078 8.378 ( -4.818 -5.717 6.281) 9.765 8.476 ( -1.862 -4.789 0.157) 5.141 8.674 ( -2.783 -5.590 0.505) 6.265 9.008 ( -3.420 0.249 -3.764) 5.092 9.288 ( -0.444 -0.156 1.672) 1.737 9.342 ( -2.291 -1.815 -0.209) 2.930 9.607 ( -1.267 0.292 2.870) 3.151 9.684 ( 0.944 0.493 1.662) 1.973 10.135 ( -6.076 0.789 -2.700) 6.696 10.235 ( -4.292 -3.453 -0.172) 5.512 10.443 ( -2.437 -0.185 2.855) 3.758 10.536 ( 6.450 2.583 1.303) 7.069 10.750 ( 3.268 -2.005 -4.186) 5.676 10.953 ( 2.127 -3.752 -6.622) 7.902 11.134 ( -1.765 1.901 0.540) 2.650 11.199 ( -2.482 1.302 2.892) 4.027 11.456 ( 0.625 3.034 2.330) 3.876 11.585 ( -3.828 1.970 0.812) 4.381 11.757 ( -0.999 2.460 3.307) 4.241 12.067 ( 1.072 5.727 -2.259) 6.249 12.146 ( 0.079 2.648 0.252) 2.661 12.253 ( 7.866 6.466 3.402) 10.736 12.460 ( 2.086 1.112 1.540) 2.821 12.514 ( 5.515 -2.609 -2.555) 6.615 13.175 ( -1.738 9.268 1.134) 9.498 13.331 ( 0.408 1.380 -4.647) 4.864 15.965 ( 1.718 0.676 -4.026) 4.429 16.050 ( 6.913 1.369 -1.229) 7.153 16.188 ( 2.344 -4.340 0.342) 4.944 16.589 ( 5.559 2.663 -5.011) 7.944 ======================= Grid point 118 (44/172) ======================= q-point: ( 0.30 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 20.352 -15.459 16.766) 30.566 2.079 ( 14.839 -17.133 21.533) 31.264 2.952 ( 7.601 -1.444 -10.171) 12.780 3.241 ( 13.287 -7.409 -2.140) 15.363 3.535 ( 13.815 -9.224 -1.571) 16.685 3.877 ( -10.842 1.026 6.343) 12.603 4.101 ( 1.294 -2.684 -1.093) 3.174 4.340 ( -8.663 2.020 5.037) 10.223 4.764 ( -0.883 10.763 5.190) 11.981 4.895 ( -0.082 9.482 2.901) 9.916 5.348 ( -3.450 6.487 -0.886) 7.400 5.485 ( -1.406 1.114 -6.111) 6.369 5.892 ( 1.312 3.918 -3.742) 5.574 6.141 ( -8.616 1.304 2.697) 9.122 6.289 ( 1.694 2.556 -2.606) 4.024 6.355 ( -1.318 -7.739 -1.912) 8.080 6.559 ( 4.344 -5.683 0.662) 7.184 6.645 ( -1.251 -1.984 -4.024) 4.658 6.856 ( 2.901 -5.592 -0.830) 6.354 7.045 ( 1.555 -6.268 -1.367) 6.602 7.631 ( 2.501 -6.175 1.378) 6.803 7.932 ( -7.372 -1.101 3.388) 8.187 8.203 ( -0.493 -10.789 -0.401) 10.808 8.353 ( 1.417 -4.836 -2.075) 5.450 8.484 ( -3.970 -8.601 2.989) 9.933 8.588 ( -1.584 -10.686 1.426) 10.897 8.758 ( -2.497 -6.122 -0.647) 6.643 8.959 ( -3.851 0.880 -3.950) 5.587 9.293 ( -1.496 -0.387 0.128) 1.551 9.357 ( -1.460 -2.623 -2.107) 3.667 9.629 ( -0.482 -3.384 3.573) 4.945 9.718 ( 4.884 -1.706 1.215) 5.314 10.091 ( -6.298 -2.505 -4.756) 8.280 10.255 ( -3.088 -2.181 -1.084) 3.933 10.420 ( -1.990 2.406 2.930) 4.282 10.539 ( 6.474 3.136 0.677) 7.226 10.803 ( 1.494 -1.854 -3.058) 3.875 10.943 ( -3.313 2.157 -1.044) 4.089 11.089 ( -1.882 4.488 1.512) 5.096 11.162 ( -0.497 -0.351 -2.014) 2.103 11.364 ( -1.761 8.982 2.975) 9.624 11.526 ( -0.934 1.162 -0.505) 1.574 11.718 ( 0.745 3.882 3.190) 5.079 11.917 ( -1.476 10.469 -1.612) 10.695 12.064 ( -1.940 5.670 -0.109) 5.994 12.233 ( 8.612 4.480 5.907) 11.364 12.427 ( 1.518 3.643 0.579) 3.989 12.600 ( 6.140 -1.980 -3.379) 7.283 12.991 ( -3.307 9.307 0.307) 9.882 13.291 ( 2.935 3.465 -4.014) 6.061 15.957 ( 1.099 0.615 -3.785) 3.989 16.091 ( 5.100 -1.074 -0.035) 5.212 16.290 ( 3.991 -4.001 0.928) 5.727 16.563 ( 3.750 2.866 -3.935) 6.145 ======================= Grid point 119 (45/172) ======================= q-point: ( 0.40 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 15.577 -17.033 11.842) 25.942 2.522 ( 9.956 -16.945 14.746) 24.571 2.999 ( 5.088 -2.541 -8.195) 9.976 3.345 ( 7.379 0.152 -7.052) 10.208 3.561 ( -8.386 4.266 0.926) 9.454 3.889 ( -8.316 -3.477 2.174) 9.272 4.142 ( -0.761 0.721 4.766) 4.880 4.393 ( 6.636 -2.162 3.985) 8.037 4.601 ( 0.490 7.694 4.823) 9.094 4.816 ( 6.286 2.917 2.852) 7.494 5.184 ( -6.254 6.928 -1.465) 9.447 5.420 ( -0.676 2.029 -7.136) 7.450 5.795 ( 1.194 6.063 -1.488) 6.356 6.059 ( -5.073 1.318 0.137) 5.243 6.280 ( 1.416 -0.233 3.872) 4.129 6.455 ( -2.581 -3.661 -4.019) 6.018 6.665 ( 4.872 -3.150 -1.094) 5.904 6.728 ( 0.669 -8.335 -1.728) 8.538 6.960 ( 2.966 -3.921 -1.373) 5.104 7.153 ( 0.633 -5.220 -0.474) 5.279 7.765 ( 3.900 -5.469 2.237) 7.080 7.891 ( -9.344 -1.044 4.557) 10.448 8.353 ( -3.086 -6.828 1.555) 7.653 8.471 ( 3.029 -7.645 -2.150) 8.499 8.623 ( -1.536 -9.186 0.659) 9.337 8.793 ( -2.131 -7.668 -1.706) 8.139 8.848 ( 0.052 -8.942 -1.444) 9.058 8.936 ( -4.016 -7.232 -0.164) 8.274 9.266 ( -0.464 1.336 -2.245) 2.653 9.414 ( -0.661 -4.844 -1.616) 5.149 9.734 ( 2.277 -6.412 1.075) 6.889 9.824 ( 3.885 -5.873 1.373) 7.175 10.083 ( -5.192 -2.773 -4.449) 7.378 10.233 ( 0.353 4.009 -1.316) 4.234 10.348 ( -3.640 2.576 0.152) 4.462 10.525 ( 3.979 4.460 0.648) 6.012 10.762 ( -2.009 7.817 -1.365) 8.186 10.873 ( -3.925 0.568 1.141) 4.127 10.981 ( -2.588 4.018 -0.722) 4.834 11.174 ( 1.015 0.764 -1.990) 2.361 11.209 ( -2.421 5.684 3.394) 7.049 11.490 ( -0.216 3.207 0.258) 3.224 11.613 ( 1.900 10.523 -1.568) 10.808 11.737 ( -2.499 6.895 3.432) 8.098 11.934 ( -2.443 7.161 -0.067) 7.567 12.260 ( 6.774 2.231 5.925) 9.272 12.381 ( 2.458 3.106 0.098) 3.962 12.657 ( 4.531 -1.027 -3.048) 5.556 12.833 ( -2.215 5.908 -0.809) 6.361 13.232 ( 2.261 4.691 -3.425) 6.233 15.942 ( 0.313 0.666 -2.030) 2.159 16.154 ( 3.734 -1.853 -0.147) 4.171 16.386 ( 3.633 -3.321 1.086) 5.041 16.532 ( 2.522 2.574 -3.657) 5.134 ======================= Grid point 120 (46/172) ======================= q-point: ( 0.50 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( 7.427 -5.828 9.727) 13.555 2.904 ( 8.386 -16.674 4.827) 19.278 3.102 ( 4.410 -7.288 -0.892) 8.565 3.296 ( -0.354 7.658 0.020) 7.666 3.457 ( -3.729 1.494 1.303) 4.223 3.872 ( -7.008 -2.303 3.437) 8.138 4.079 ( -1.900 6.338 9.243) 11.368 4.357 ( -7.056 2.452 -3.966) 8.457 4.547 ( 1.128 3.682 0.561) 3.892 4.824 ( 0.460 2.246 -3.803) 4.440 5.050 ( -0.420 5.664 -1.381) 5.845 5.395 ( 5.054 -0.144 -6.447) 8.193 5.737 ( 1.129 1.448 2.018) 2.728 6.038 ( -0.240 -0.310 -2.456) 2.487 6.291 ( -0.490 3.138 7.312) 7.972 6.473 ( 2.370 -3.172 -0.992) 4.082 6.754 ( 3.281 -3.016 -1.297) 4.641 6.854 ( 1.177 -5.241 -1.685) 5.630 7.026 ( 2.144 -1.920 -1.716) 3.351 7.216 ( -0.547 -1.907 -0.129) 1.988 7.809 ( -7.520 0.056 4.793) 8.917 7.928 ( 3.818 -4.752 2.779) 6.699 8.418 ( -2.799 -3.646 1.892) 4.971 8.611 ( 3.020 -5.400 -2.061) 6.521 8.735 ( -1.063 -4.521 -0.562) 4.678 8.788 ( 0.730 1.373 -2.925) 3.313 8.981 ( -3.964 -8.536 -1.944) 9.610 9.194 ( 1.864 -13.395 0.215) 13.525 9.288 ( 1.542 -7.622 -2.055) 8.044 9.479 ( -3.206 -4.885 -1.036) 5.934 9.847 ( 1.764 -3.284 -2.282) 4.371 9.896 ( 1.650 5.766 -0.308) 6.006 10.079 ( -0.081 -1.949 -0.628) 2.049 10.160 ( -0.430 1.028 -2.920) 3.125 10.282 ( 0.164 7.058 0.796) 7.105 10.433 ( -2.582 1.427 -2.682) 3.987 10.615 ( -2.680 4.016 3.357) 5.881 10.838 ( -2.921 3.190 -0.523) 4.357 10.928 ( -1.389 -0.447 -1.492) 2.087 11.096 ( -2.516 2.554 0.844) 3.683 11.191 ( 1.010 0.377 -0.964) 1.446 11.415 ( -0.479 5.529 0.500) 5.572 11.471 ( 1.653 4.720 0.686) 5.048 11.641 ( -0.484 4.915 3.879) 6.280 11.799 ( -3.925 5.008 0.827) 6.417 12.262 ( 2.836 3.252 1.492) 4.566 12.370 ( 3.217 1.964 1.837) 4.193 12.697 ( 3.119 -0.855 0.081) 3.235 12.766 ( 1.441 0.998 -2.750) 3.262 13.152 ( -0.114 4.323 -3.201) 5.380 15.932 ( -0.970 -0.202 -0.221) 1.015 16.207 ( 3.372 -0.966 0.212) 3.515 16.455 ( 2.596 0.129 -0.545) 2.656 16.493 ( 0.616 0.936 -2.833) 3.046 ======================= Grid point 121 (47/172) ======================= q-point: (-0.40 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( 1.018 11.977 3.628) 12.556 3.021 ( -2.613 15.609 -0.043) 15.827 3.243 ( 6.881 -9.106 3.447) 11.922 3.304 ( 0.146 -3.409 3.617) 4.972 3.481 ( -0.940 -9.611 8.138) 12.629 3.863 ( -8.179 -1.813 2.642) 8.784 4.034 ( -0.709 0.325 8.911) 8.945 4.244 ( -4.185 3.359 1.424) 5.552 4.460 ( -7.267 3.360 -4.881) 9.377 4.762 ( -0.707 1.062 -7.485) 7.593 4.952 ( 1.473 4.056 -4.557) 6.276 5.450 ( 6.734 -1.374 -6.093) 9.185 5.777 ( 2.950 -3.017 3.270) 5.339 5.980 ( -2.309 5.639 0.364) 6.104 6.233 ( -3.282 1.743 2.526) 4.494 6.612 ( 8.749 -5.368 3.540) 10.858 6.800 ( 1.674 -0.550 -1.334) 2.210 6.913 ( 2.293 -0.871 -2.329) 3.382 7.043 ( 0.377 0.970 -1.061) 1.486 7.203 ( -1.470 2.299 -0.464) 2.768 7.756 ( -6.720 0.712 5.104) 8.469 8.027 ( 5.420 -0.814 1.663) 5.728 8.453 ( -1.129 -1.833 1.417) 2.577 8.649 ( 1.430 2.320 -2.083) 3.430 8.750 ( -1.468 0.104 -1.049) 1.807 8.830 ( 3.036 -4.456 -1.489) 5.594 9.049 ( 0.418 -2.618 -2.781) 3.842 9.342 ( 1.609 -3.613 -1.117) 4.110 9.377 ( -1.826 2.751 0.247) 3.311 9.526 ( 0.008 5.342 -2.310) 5.820 9.731 ( -6.457 3.401 1.730) 7.500 9.864 ( 1.076 -0.613 -3.673) 3.876 9.993 ( 0.402 6.991 -0.837) 7.052 10.164 ( 1.465 -3.384 -2.824) 4.645 10.308 ( 1.432 -5.875 -0.897) 6.113 10.460 ( -0.175 -1.947 0.248) 1.971 10.609 ( 2.160 -3.014 2.950) 4.738 10.742 ( -4.684 1.183 0.965) 4.926 10.947 ( -3.828 -4.528 -1.609) 6.143 11.098 ( 1.909 -2.101 -3.641) 4.617 11.193 ( 0.836 -0.450 0.568) 1.107 11.337 ( -0.860 1.790 1.458) 2.463 11.450 ( 1.178 0.922 -0.812) 1.702 11.590 ( -1.275 1.101 4.700) 4.993 11.733 ( -4.615 -1.169 2.343) 5.306 12.219 ( 1.717 3.970 0.338) 4.339 12.353 ( 1.506 2.149 0.163) 2.629 12.747 ( 3.934 -0.749 2.721) 4.841 12.775 ( 2.033 -0.676 -3.439) 4.051 13.085 ( -2.070 0.629 -3.268) 3.919 15.934 ( -2.096 -1.417 0.755) 2.640 16.236 ( 3.382 1.048 0.735) 3.616 16.385 ( -0.972 5.271 -3.684) 6.504 16.523 ( 0.995 -1.727 -0.861) 2.171 ======================= Grid point 122 (48/172) ======================= q-point: (-0.30 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( -3.370 24.345 5.946) 25.286 2.628 ( -4.886 26.248 3.147) 26.884 3.233 ( 0.358 5.279 0.163) 5.294 3.394 ( -1.882 4.203 -1.122) 4.740 3.705 ( -6.208 -9.764 2.937) 11.937 3.837 ( -3.342 -4.098 7.347) 9.052 4.034 ( -1.543 2.455 5.709) 6.403 4.247 ( -2.933 -5.431 8.254) 10.307 4.360 ( -0.864 -2.023 -4.813) 5.292 4.745 ( 4.260 1.294 -3.256) 5.516 4.972 ( 0.835 -7.691 -5.545) 9.518 5.487 ( 2.470 -0.862 -6.963) 7.439 5.841 ( 1.269 2.023 -0.478) 2.436 5.912 ( 0.376 -2.389 5.156) 5.695 6.204 ( -1.271 -0.146 0.331) 1.321 6.748 ( 4.182 -1.904 2.182) 5.086 6.793 ( 1.105 1.980 -1.596) 2.773 6.902 ( 3.378 4.440 -1.950) 5.910 6.995 ( -0.546 3.340 -0.853) 3.491 7.122 ( -1.751 5.022 -0.990) 5.410 7.708 ( -4.668 1.466 5.126) 7.087 8.043 ( 4.441 3.390 0.211) 5.591 8.460 ( -0.057 1.589 -0.081) 1.592 8.581 ( 0.558 5.297 -1.120) 5.443 8.717 ( -0.877 2.173 0.274) 2.360 8.919 ( 4.009 -0.543 -1.512) 4.319 9.040 ( 0.530 7.785 -3.863) 8.707 9.181 ( 3.370 8.268 0.453) 8.940 9.307 ( 2.379 13.274 1.595) 13.579 9.421 ( -1.417 -0.092 -0.753) 1.608 9.605 ( -12.468 -0.111 0.490) 12.478 9.877 ( -0.026 4.601 -0.973) 4.703 10.022 ( 3.506 -5.224 -1.753) 6.531 10.214 ( 4.553 -1.890 -2.820) 5.680 10.351 ( -6.556 -1.961 2.244) 7.201 10.550 ( 5.553 -4.559 -2.261) 7.532 10.685 ( -2.034 -5.722 1.673) 6.299 10.798 ( 2.626 -5.436 2.470) 6.523 11.006 ( -1.425 -4.005 -0.829) 4.331 11.126 ( 2.836 -2.753 -4.513) 5.999 11.274 ( -1.075 -7.423 1.864) 7.728 11.339 ( -1.322 -1.612 -0.511) 2.147 11.458 ( 0.267 -2.950 -0.798) 3.067 11.617 ( -3.163 -4.900 2.286) 6.264 11.773 ( -3.405 -5.533 3.651) 7.452 12.160 ( 1.212 4.064 0.438) 4.263 12.339 ( 1.716 0.537 -0.837) 1.983 12.738 ( -1.707 1.740 -3.687) 4.420 12.826 ( 5.212 -0.819 3.081) 6.109 13.099 ( -2.183 -5.079 -2.854) 6.221 15.949 ( -2.427 -2.019 0.521) 3.200 16.197 ( 0.268 6.387 -0.927) 6.460 16.288 ( -0.049 3.254 -1.418) 3.550 16.548 ( 0.653 -0.954 -2.077) 2.377 ======================= Grid point 123 (49/172) ======================= q-point: (-0.20 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -4.799 30.509 9.229) 32.234 2.096 ( -5.572 31.925 7.925) 33.363 2.987 ( -5.867 31.688 8.296) 33.277 3.175 ( 0.065 4.850 -5.804) 7.564 3.694 ( -7.276 3.461 -10.665) 13.366 3.883 ( -0.884 -3.888 3.087) 5.042 4.137 ( -0.311 -8.928 12.165) 15.093 4.405 ( -2.202 -11.454 8.563) 14.470 4.485 ( 2.756 -9.733 0.682) 10.138 4.789 ( 2.425 -4.432 -1.732) 5.340 5.146 ( 3.301 -10.075 -2.977) 11.012 5.500 ( 0.825 -2.497 -7.270) 7.731 5.813 ( -0.391 -0.138 -2.113) 2.153 5.994 ( 3.787 -2.084 3.491) 5.557 6.230 ( 0.560 -2.757 1.909) 3.400 6.695 ( -2.445 7.742 -3.794) 8.961 6.742 ( -0.974 4.736 -1.950) 5.213 6.814 ( 3.117 7.426 0.908) 8.105 6.947 ( -1.570 2.519 -0.953) 3.117 7.023 ( 1.449 4.566 -1.336) 4.973 7.658 ( -3.119 2.564 4.748) 6.232 8.006 ( 3.638 3.914 -0.091) 5.345 8.363 ( 0.272 9.350 -2.467) 9.674 8.484 ( -0.894 5.784 0.375) 5.865 8.673 ( -0.181 3.818 1.017) 3.956 8.760 ( 1.721 11.485 0.345) 11.618 8.951 ( 1.427 10.048 -2.443) 10.439 9.069 ( 1.771 4.135 0.895) 4.586 9.242 ( 6.152 0.746 -1.014) 6.279 9.402 ( -3.557 -0.452 0.131) 3.588 9.579 ( -6.747 -4.459 2.982) 8.620 9.767 ( -0.750 5.996 0.927) 6.114 10.064 ( 2.348 1.041 -1.057) 2.778 10.301 ( 0.383 -3.343 -3.495) 4.851 10.362 ( -1.850 -4.052 2.051) 4.904 10.592 ( 1.824 0.722 1.135) 2.267 10.771 ( 0.185 -0.889 -1.413) 1.679 10.883 ( 3.607 -1.985 1.412) 4.352 11.108 ( 1.108 -8.183 -1.341) 8.366 11.206 ( -0.942 -4.948 -2.419) 5.588 11.307 ( -3.642 -1.762 -0.385) 4.064 11.465 ( 2.777 -9.328 2.165) 9.971 11.548 ( -0.534 -7.135 -1.021) 7.228 11.711 ( -3.324 -8.228 0.779) 8.908 11.866 ( -1.369 -5.774 3.358) 6.818 12.118 ( 0.766 1.268 -0.289) 1.510 12.360 ( 2.274 -1.232 -0.567) 2.648 12.669 ( -4.320 1.772 -5.907) 7.530 12.887 ( 4.965 -0.551 4.751) 6.894 13.189 ( -1.955 -7.586 -2.378) 8.187 15.958 ( -0.959 0.057 -0.783) 1.240 16.061 ( -2.342 6.170 -1.552) 6.780 16.242 ( 0.809 3.134 0.760) 3.324 16.557 ( 0.895 -0.357 -4.027) 4.140 ======================= Grid point 124 (50/172) ======================= q-point: (-0.10 0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( -2.867 31.075 14.707) 34.498 1.551 ( 0.290 31.542 18.152) 36.393 2.358 ( 4.579 42.133 24.195) 48.801 3.103 ( -0.446 1.608 -9.799) 9.941 3.528 ( -2.435 5.181 -15.990) 16.983 3.980 ( -2.194 -6.556 2.850) 7.477 4.253 ( -4.290 -2.971 9.086) 10.478 4.604 ( -3.087 -10.339 6.468) 12.580 4.694 ( -0.643 -12.515 1.607) 12.634 4.911 ( 1.019 -8.432 -1.577) 8.638 5.297 ( 4.485 -4.515 -2.726) 6.923 5.558 ( 0.839 -4.109 -5.515) 6.928 5.841 ( 2.246 -3.706 -2.097) 4.814 6.059 ( 5.279 -0.487 1.864) 5.620 6.286 ( 0.178 -0.945 3.804) 3.924 6.479 ( -3.596 10.648 -4.973) 12.290 6.647 ( -2.653 3.000 -3.296) 5.187 6.717 ( 2.742 6.386 0.037) 6.949 6.839 ( -3.984 5.362 -0.411) 6.693 6.989 ( 3.012 2.874 -1.997) 4.617 7.595 ( -2.102 3.898 4.299) 6.172 7.978 ( 2.992 2.521 -0.104) 3.914 8.184 ( 1.417 9.824 -2.199) 10.166 8.378 ( -2.192 4.883 -0.037) 5.353 8.551 ( -0.703 7.732 1.032) 7.832 8.657 ( -1.785 6.677 -2.014) 7.199 8.754 ( 2.059 8.324 0.786) 8.611 9.083 ( 3.683 0.057 0.973) 3.810 9.251 ( 3.059 1.911 -2.120) 4.184 9.379 ( -5.775 -0.866 3.226) 6.671 9.629 ( -0.739 -2.311 1.462) 2.832 9.710 ( -3.921 -1.222 2.910) 5.034 10.074 ( 3.266 -0.470 0.870) 3.413 10.324 ( -1.329 -2.309 -3.543) 4.433 10.403 ( 0.662 0.308 2.109) 2.232 10.590 ( -0.415 1.759 1.542) 2.375 10.719 ( 0.309 3.960 -2.332) 4.606 10.957 ( 3.302 -2.141 -0.050) 3.935 11.178 ( -0.646 -1.272 -3.548) 3.824 11.265 ( -3.701 -2.994 -2.274) 5.276 11.344 ( -0.404 -4.661 1.134) 4.814 11.630 ( 0.321 -7.174 1.924) 7.435 11.687 ( -0.951 -8.455 0.607) 8.530 11.825 ( 0.425 -5.998 0.664) 6.049 11.962 ( 1.640 -4.961 3.966) 6.560 12.136 ( 0.567 -2.702 -1.759) 3.274 12.406 ( 2.535 -1.799 -0.536) 3.155 12.575 ( -5.846 2.411 -6.682) 9.200 12.973 ( 5.398 -3.781 6.810) 9.477 13.295 ( -1.852 -6.982 -2.658) 7.697 15.894 ( 2.963 6.102 -0.243) 6.788 16.005 ( -1.275 -0.794 -2.114) 2.594 16.197 ( 0.152 2.666 1.593) 3.109 16.548 ( 1.882 1.047 -6.527) 6.873 ======================= Grid point 127 (51/172) ======================= q-point: ( 0.20 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 27.415 0.000 22.267) 35.318 1.751 ( 23.161 0.000 28.600) 36.802 2.838 ( 29.778 0.000 15.232) 33.447 3.057 ( 19.511 0.000 1.852) 19.599 3.362 ( 9.134 0.000 -21.560) 23.414 3.953 ( -17.507 -0.000 7.154) 18.912 4.040 ( 2.668 0.000 -2.228) 3.476 4.381 ( -19.464 -0.000 -0.693) 19.476 5.021 ( -0.888 -0.000 4.569) 4.654 5.261 ( -2.157 -0.000 4.412) 4.911 5.293 ( -4.430 -0.000 -0.937) 4.528 5.517 ( 4.886 0.000 -10.015) 11.143 5.779 ( -3.492 -0.000 -4.367) 5.591 6.221 ( -10.429 -0.000 -3.247) 10.923 6.307 ( 1.657 0.000 -1.612) 2.312 6.385 ( 8.313 0.000 1.784) 8.503 6.444 ( -2.373 -0.000 5.413) 5.911 6.617 ( -1.925 -0.000 -1.998) 2.775 6.721 ( -0.326 -0.000 -3.962) 3.976 6.878 ( 4.348 0.000 -3.675) 5.693 7.491 ( 1.425 0.000 0.672) 1.575 7.876 ( -4.341 -0.000 1.202) 4.504 8.022 ( -2.014 -0.000 -1.145) 2.316 8.256 ( 1.209 0.000 -4.121) 4.294 8.318 ( -3.183 -0.000 6.274) 7.035 8.423 ( -1.988 -0.000 1.335) 2.395 8.590 ( -4.888 -0.000 2.014) 5.286 8.984 ( -0.772 -0.000 -5.965) 6.015 9.271 ( -6.461 -0.000 -2.052) 6.779 9.296 ( -1.397 -0.000 3.123) 3.421 9.619 ( -0.168 -0.000 3.622) 3.626 9.705 ( 2.437 0.000 1.819) 3.041 10.053 ( -12.548 -0.000 -0.847) 12.577 10.178 ( -1.300 -0.000 -3.144) 3.402 10.435 ( -1.523 -0.000 2.055) 2.558 10.616 ( 7.568 0.000 2.075) 7.847 10.732 ( 0.536 0.000 -4.276) 4.310 10.941 ( 6.345 0.000 -5.615) 8.473 11.139 ( -1.813 -0.000 0.593) 1.908 11.205 ( -2.376 -0.000 4.867) 5.416 11.496 ( 3.656 0.000 0.445) 3.683 11.584 ( -4.572 -0.000 2.118) 5.039 11.773 ( -2.094 -0.000 4.203) 4.696 12.108 ( -0.661 -0.000 -2.696) 2.775 12.161 ( -2.176 -0.000 1.096) 2.437 12.396 ( 6.367 0.000 0.835) 6.421 12.502 ( 8.497 0.000 1.666) 8.659 12.516 ( 1.946 0.000 -0.009) 1.946 13.282 ( -3.109 -0.000 -6.134) 6.877 13.295 ( 2.058 0.000 -0.179) 2.066 15.972 ( 1.490 0.000 -4.173) 4.431 16.127 ( 0.116 0.000 -0.568) 0.580 16.157 ( 10.178 0.000 -1.259) 10.255 16.650 ( 5.158 0.000 -4.527) 6.863 ======================= Grid point 128 (52/172) ======================= q-point: ( 0.30 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( 25.737 -4.573 18.411) 31.973 2.084 ( 22.088 -7.215 24.344) 33.654 2.963 ( 6.823 -1.340 -11.927) 13.806 3.319 ( 20.145 1.005 -2.221) 20.292 3.488 ( 17.621 -8.553 1.586) 19.651 3.811 ( -16.295 2.081 6.913) 17.823 4.090 ( 5.922 -2.044 -2.081) 6.602 4.253 ( -12.608 -3.069 2.869) 13.290 4.933 ( -2.888 8.659 3.804) 9.889 5.077 ( -1.036 10.458 3.644) 11.123 5.362 ( -6.471 -1.742 -1.689) 6.911 5.488 ( 1.550 2.711 -5.784) 6.573 5.832 ( -1.759 -7.547 -5.975) 9.786 6.104 ( -7.753 1.534 -0.676) 7.932 6.308 ( 0.836 4.426 0.206) 4.509 6.345 ( -1.685 1.918 -1.814) 3.132 6.500 ( 3.854 -3.880 2.815) 6.151 6.623 ( -0.165 -1.819 -1.530) 2.382 6.772 ( 2.384 -5.519 -2.365) 6.461 6.954 ( 3.574 -4.913 -3.320) 6.923 7.555 ( 3.585 -4.861 -0.111) 6.041 7.857 ( -8.086 -1.636 3.023) 8.786 8.045 ( -1.638 -5.556 -0.491) 5.814 8.291 ( 1.705 -3.511 -4.113) 5.670 8.346 ( -3.502 -4.562 6.405) 8.608 8.448 ( -2.230 -4.611 1.389) 5.308 8.612 ( -5.225 -6.005 1.097) 8.036 8.952 ( -0.739 1.249 -6.174) 6.343 9.234 ( -6.144 -2.578 -2.229) 7.026 9.301 ( -1.734 -1.119 1.581) 2.600 9.621 ( -0.154 0.542 3.738) 3.780 9.734 ( 2.991 -0.627 1.018) 3.221 9.974 ( -10.049 -2.058 -1.720) 10.401 10.178 ( -1.941 -2.156 -3.082) 4.232 10.432 ( -1.204 -0.207 2.174) 2.494 10.666 ( 7.529 2.060 -0.135) 7.807 10.744 ( 0.356 -2.077 -2.913) 3.595 10.961 ( 2.244 1.398 -2.925) 3.943 11.127 ( 0.072 0.294 -0.835) 0.888 11.175 ( -2.963 2.616 4.693) 6.136 11.485 ( -2.171 5.725 2.176) 6.497 11.547 ( 2.673 0.460 0.550) 2.768 11.756 ( -3.106 0.977 4.820) 5.816 12.039 ( -2.015 6.094 -2.766) 6.989 12.121 ( -2.346 2.597 0.233) 3.507 12.388 ( 4.762 4.213 2.951) 7.009 12.504 ( 2.446 2.874 1.092) 3.928 12.607 ( 7.046 -2.122 -0.323) 7.365 13.134 ( -2.036 9.477 -3.245) 10.222 13.340 ( 3.576 -0.121 -3.462) 4.979 15.973 ( 2.211 0.445 -3.082) 3.820 16.118 ( 2.645 0.633 -0.782) 2.830 16.265 ( 6.914 -3.316 -0.530) 7.686 16.645 ( 4.533 3.174 -3.544) 6.571 ======================= Grid point 129 (53/172) ======================= q-point: ( 0.40 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 21.961 -9.141 12.031) 26.657 2.449 ( 16.975 -9.636 20.285) 28.151 2.997 ( 6.055 -0.824 -9.611) 11.389 3.409 ( 12.742 0.201 -6.865) 14.475 3.552 ( -11.241 2.963 1.626) 11.738 3.737 ( -11.596 -3.365 0.923) 12.110 4.145 ( 1.845 -0.903 0.761) 2.190 4.410 ( 10.929 -7.363 7.492) 15.159 4.753 ( -3.470 9.093 5.574) 11.216 4.947 ( 3.908 6.819 3.145) 8.465 5.242 ( -6.981 6.146 -3.355) 9.887 5.426 ( -1.926 2.317 -5.605) 6.364 5.865 ( -1.948 0.940 -2.946) 3.654 6.046 ( -3.698 1.639 1.112) 4.195 6.282 ( -0.681 -2.191 -4.118) 4.714 6.340 ( 1.330 -3.785 0.587) 4.054 6.604 ( 0.639 -4.495 -2.391) 5.131 6.680 ( 5.628 -3.120 2.043) 6.751 6.892 ( 2.508 -6.121 -1.689) 6.827 7.058 ( 1.692 -5.555 -2.390) 6.280 7.692 ( 4.613 -6.710 -0.676) 8.170 7.814 ( -9.969 -0.872 5.244) 11.298 8.178 ( -2.806 -10.340 1.182) 10.779 8.367 ( 1.791 -5.621 -2.203) 6.297 8.461 ( -0.932 -8.702 3.202) 9.320 8.563 ( -2.810 -10.726 1.111) 11.143 8.699 ( -4.467 -8.604 0.460) 9.705 8.898 ( -0.735 2.189 -5.793) 6.237 9.238 ( -4.164 -2.824 -2.736) 5.727 9.328 ( -0.793 -3.155 0.291) 3.266 9.641 ( -0.655 -2.887 2.288) 3.742 9.788 ( 1.906 -3.192 1.061) 3.866 9.955 ( -6.803 -3.976 -2.817) 8.367 10.195 ( -1.829 -2.327 -3.255) 4.399 10.423 ( -0.343 2.008 2.072) 2.906 10.657 ( 6.906 5.380 -0.496) 8.768 10.766 ( -1.519 -1.300 -5.310) 5.674 10.915 ( -0.732 3.893 1.502) 4.237 11.060 ( -3.218 6.482 2.701) 7.724 11.156 ( 0.953 -1.000 -2.053) 2.474 11.339 ( -3.225 8.446 4.178) 9.960 11.555 ( 3.070 2.932 0.658) 4.296 11.721 ( -2.970 1.712 3.831) 5.141 11.864 ( -2.654 10.597 -1.927) 11.093 12.038 ( -1.196 5.538 -0.380) 5.679 12.367 ( 2.545 3.102 4.748) 6.217 12.467 ( 3.267 3.874 0.595) 5.103 12.673 ( 4.960 -0.512 -0.714) 5.037 12.944 ( -1.361 9.138 -2.851) 9.668 13.330 ( 4.658 3.955 -3.553) 7.068 15.968 ( 2.319 1.552 -1.922) 3.388 16.145 ( 2.134 -1.635 -0.484) 2.732 16.365 ( 4.805 -2.948 0.110) 5.638 16.609 ( 4.165 3.870 -3.142) 6.496 ======================= Grid point 130 (54/172) ======================= q-point: ( 0.50 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.748 ( 14.279 -11.516 7.434) 19.794 2.775 ( 11.734 -8.654 15.706) 21.430 3.050 ( 5.267 -3.056 -3.946) 7.256 3.396 ( -8.256 4.075 1.717) 9.366 3.464 ( 4.226 1.554 -2.089) 4.964 3.735 ( -7.725 -6.132 -1.154) 9.930 4.155 ( -0.536 0.968 2.573) 2.801 4.408 ( -3.547 9.369 2.608) 10.352 4.652 ( -1.746 5.553 4.078) 7.108 4.857 ( -3.642 6.749 -3.181) 8.302 5.137 ( 2.598 3.298 -0.194) 4.203 5.391 ( 1.440 -1.565 -5.184) 5.603 5.802 ( 1.070 3.596 -1.203) 3.940 6.017 ( -0.245 -0.326 -0.459) 0.614 6.346 ( 3.229 -3.111 2.539) 5.153 6.410 ( 0.074 -2.488 -0.602) 2.561 6.681 ( 0.840 -5.991 -4.677) 7.647 6.801 ( 5.621 -4.040 1.801) 7.153 6.989 ( 1.850 -3.662 -1.984) 4.557 7.152 ( -0.003 -4.842 -0.950) 4.935 7.751 ( -8.364 -0.918 4.688) 9.632 7.864 ( 4.528 -6.964 1.340) 8.414 8.303 ( -4.520 -6.943 2.703) 8.714 8.509 ( 2.697 -8.169 -1.424) 8.720 8.617 ( 0.004 -8.195 0.650) 8.220 8.738 ( -3.351 -10.770 -0.808) 11.308 8.841 ( 1.661 0.032 -4.953) 5.224 8.897 ( -2.162 -16.575 1.633) 16.795 9.249 ( 0.765 -1.705 -3.346) 3.833 9.380 ( -2.288 -3.643 -0.773) 4.370 9.713 ( -5.281 -6.102 1.119) 8.147 9.883 ( 1.431 -6.473 -0.068) 6.630 9.991 ( -2.452 -5.669 -3.167) 6.941 10.204 ( -0.420 -0.500 -3.665) 3.723 10.349 ( 1.917 7.311 0.969) 7.620 10.589 ( 1.645 8.345 1.032) 8.568 10.693 ( -2.062 7.014 -4.787) 8.738 10.825 ( -3.151 3.038 0.909) 4.470 10.965 ( -0.184 2.373 1.064) 2.607 11.165 ( -0.648 2.896 -0.576) 3.023 11.203 ( -1.110 3.919 3.547) 5.401 11.492 ( -0.308 5.139 0.746) 5.202 11.635 ( 1.725 9.928 -0.879) 10.115 11.698 ( -4.264 3.326 4.581) 7.087 11.910 ( -0.802 8.335 -0.164) 8.375 12.335 ( 0.369 3.095 1.926) 3.664 12.439 ( 2.444 2.733 1.674) 4.030 12.710 ( 3.548 -0.346 0.631) 3.620 12.814 ( 1.075 4.460 -3.500) 5.770 13.259 ( 3.424 6.913 -2.999) 8.277 15.947 ( 1.116 1.975 -0.205) 2.277 16.197 ( 1.947 -2.508 -0.261) 3.186 16.442 ( 2.726 -2.527 0.133) 3.720 16.558 ( 2.949 4.473 -3.405) 6.348 ======================= Grid point 131 (55/172) ======================= q-point: ( 0.60 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.936 ( 3.702 1.763 5.968) 7.241 3.040 ( 5.070 -9.741 4.709) 11.948 3.196 ( 2.576 -7.602 7.047) 10.681 3.297 ( 3.142 2.481 0.131) 4.006 3.448 ( 0.342 2.169 2.379) 3.237 3.769 ( -6.306 -2.372 0.704) 6.775 4.097 ( -3.373 5.786 8.477) 10.803 4.267 ( -0.395 1.991 -1.645) 2.613 4.487 ( -8.958 8.145 0.913) 12.141 4.718 ( -4.293 2.110 -7.393) 8.805 5.065 ( 1.602 6.523 -2.358) 7.119 5.447 ( 4.140 -2.535 -8.173) 9.506 5.789 ( 3.992 0.079 3.148) 5.085 6.024 ( -0.029 0.331 -2.420) 2.442 6.296 ( -2.580 6.902 5.801) 9.378 6.556 ( 5.104 -8.364 0.670) 9.822 6.769 ( 1.172 -4.001 -3.885) 5.698 6.899 ( 4.228 -2.610 -0.337) 4.980 7.040 ( 0.910 -1.591 -1.461) 2.344 7.203 ( -0.837 -1.376 -0.193) 1.622 7.720 ( -6.210 -0.708 5.465) 8.302 8.018 ( 5.129 -5.316 0.831) 7.433 8.377 ( -3.909 -5.089 2.084) 6.746 8.638 ( 1.151 -4.666 -0.888) 4.887 8.717 ( -0.140 -3.590 -1.381) 3.849 8.791 ( 1.491 -0.735 -3.025) 3.452 8.941 ( -0.282 -9.334 0.573) 9.356 9.225 ( 1.771 -15.514 -0.054) 15.615 9.325 ( 5.186 -6.403 -2.880) 8.728 9.405 ( -3.992 -4.286 -1.423) 6.027 9.718 ( -11.531 -1.591 -0.151) 11.641 9.984 ( 5.510 2.270 -2.122) 6.326 10.079 ( 1.329 -4.295 -2.909) 5.355 10.156 ( 1.268 4.173 -2.716) 5.138 10.264 ( -2.594 6.010 -0.017) 6.546 10.386 ( -2.495 2.087 -0.837) 3.359 10.608 ( 0.151 2.293 2.482) 3.383 10.785 ( -1.427 0.758 -2.172) 2.707 10.928 ( 0.567 4.521 1.211) 4.715 11.061 ( -2.303 1.872 1.000) 3.132 11.206 ( 0.920 -0.576 -0.396) 1.155 11.406 ( -0.294 4.884 -0.322) 4.903 11.504 ( 1.538 5.562 1.403) 5.939 11.641 ( -2.482 2.554 5.632) 6.664 11.758 ( -1.960 7.188 0.820) 7.496 12.286 ( 0.171 3.063 0.008) 3.068 12.404 ( 0.113 2.699 0.471) 2.742 12.753 ( 1.352 -1.329 -0.038) 1.896 12.783 ( 3.671 0.330 -2.332) 4.362 13.146 ( 1.661 7.029 -1.996) 7.494 15.924 ( -0.128 1.074 1.131) 1.564 16.251 ( 1.792 -1.759 0.032) 2.511 16.476 ( 1.605 5.808 -3.361) 6.900 16.496 ( 0.840 -1.937 -0.747) 2.240 ======================= Grid point 132 (56/172) ======================= q-point: (-0.30 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( -0.137 15.263 4.116) 15.809 3.003 ( 0.491 16.578 2.650) 16.796 3.286 ( -1.379 -0.800 -2.266) 2.770 3.414 ( 3.926 -1.726 7.484) 8.626 3.486 ( -1.015 -9.611 4.212) 10.543 3.743 ( -6.382 -3.273 6.669) 9.794 4.046 ( -2.868 -0.830 8.661) 9.161 4.254 ( -5.640 6.966 0.136) 8.964 4.312 ( 0.151 -1.824 -3.830) 4.245 4.720 ( 2.642 -5.018 -5.397) 7.829 4.954 ( 1.178 5.623 -4.563) 7.337 5.472 ( 1.900 -0.980 -10.623) 10.836 5.869 ( 4.171 -3.200 5.749) 7.790 5.950 ( -1.715 6.756 1.064) 7.051 6.207 ( -1.733 1.859 4.069) 4.797 6.695 ( -0.800 -5.255 -1.590) 5.549 6.813 ( 1.617 -0.913 -2.046) 2.763 6.957 ( 3.519 -0.625 -1.633) 3.929 7.040 ( 0.057 2.057 -0.379) 2.093 7.182 ( -0.634 2.785 -0.295) 2.871 7.705 ( -3.406 0.057 5.576) 6.534 8.103 ( 3.049 -0.308 -0.007) 3.065 8.433 ( -2.028 -3.564 0.925) 4.204 8.657 ( 0.284 2.516 -1.331) 2.860 8.731 ( 0.145 0.277 -0.410) 0.515 8.867 ( 2.368 -5.557 -2.103) 6.396 9.075 ( 3.344 -4.236 0.249) 5.403 9.320 ( -0.994 1.773 -0.623) 2.126 9.398 ( 2.180 -2.111 -1.847) 3.553 9.510 ( -0.094 5.997 -1.941) 6.304 9.614 ( -7.305 3.899 1.341) 8.389 9.871 ( 1.049 3.556 -0.663) 3.766 10.006 ( 2.174 2.917 -2.835) 4.612 10.173 ( 1.050 -4.339 -2.479) 5.106 10.283 ( -2.600 -5.007 -1.507) 5.840 10.450 ( -1.704 -5.559 -0.570) 5.842 10.637 ( 0.539 -3.338 2.303) 4.091 10.751 ( 3.342 0.891 2.628) 4.344 10.889 ( -2.193 -3.234 -0.640) 3.959 11.097 ( 0.471 -4.618 -2.649) 5.345 11.218 ( 1.849 0.204 -0.512) 1.930 11.328 ( -0.442 2.463 -0.005) 2.502 11.466 ( 1.158 1.632 -0.271) 2.020 11.577 ( -4.230 2.988 5.100) 7.269 11.701 ( -1.198 -1.711 3.643) 4.199 12.231 ( -0.207 3.524 -0.204) 3.536 12.367 ( 0.494 1.605 -0.414) 1.729 12.738 ( -1.462 1.280 -6.613) 6.892 12.839 ( 2.316 -2.232 2.673) 4.182 13.067 ( 2.000 2.520 -0.532) 3.261 15.918 ( -0.583 -0.283 1.488) 1.623 16.268 ( -0.187 1.317 -1.222) 1.807 16.369 ( 1.771 6.252 -1.955) 6.786 16.526 ( 0.145 -1.408 -1.504) 2.065 ======================= Grid point 133 (57/172) ======================= q-point: (-0.20 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.462 ( -1.323 25.836 6.650) 26.711 2.618 ( 0.360 28.227 6.145) 28.890 3.181 ( -3.961 5.575 -6.447) 9.399 3.430 ( 4.708 9.798 3.863) 11.537 3.584 ( -6.640 -5.337 -2.200) 8.798 3.866 ( -0.447 -3.426 7.451) 8.213 4.025 ( -3.402 -2.305 6.403) 7.608 4.213 ( -4.160 -8.935 5.525) 11.299 4.399 ( 5.122 -3.983 0.884) 6.548 4.769 ( 0.607 1.566 -3.869) 4.218 4.984 ( 4.341 -9.778 -3.748) 11.335 5.469 ( 1.913 -0.722 -9.572) 9.788 5.826 ( -3.631 3.870 2.939) 6.066 5.984 ( 3.165 -3.989 5.685) 7.633 6.211 ( 1.230 -0.804 2.268) 2.702 6.715 ( -4.055 -0.595 -4.482) 6.073 6.796 ( -1.563 3.022 -2.764) 4.384 6.947 ( 1.722 4.216 -2.825) 5.359 6.975 ( -1.843 4.006 1.322) 4.604 7.119 ( 2.554 4.450 -0.113) 5.132 7.688 ( -1.512 1.493 5.373) 5.778 8.089 ( 1.085 3.022 0.079) 3.212 8.450 ( -0.407 1.279 -0.685) 1.507 8.578 ( -0.493 5.679 -0.983) 5.785 8.718 ( 0.693 1.645 0.929) 2.012 8.945 ( -0.788 -0.446 -1.696) 1.923 9.056 ( 3.936 10.041 -1.464) 10.883 9.247 ( 2.600 10.323 1.971) 10.827 9.337 ( -2.794 5.064 -3.852) 6.949 9.398 ( 1.349 3.611 0.868) 3.951 9.457 ( -2.946 -0.764 2.617) 4.014 9.876 ( 0.924 3.767 -1.589) 4.192 10.073 ( 3.848 -4.101 -1.855) 5.921 10.229 ( -3.034 -6.031 0.907) 6.812 10.286 ( -0.671 1.337 -0.894) 1.743 10.597 ( 1.333 -8.693 -1.800) 8.977 10.658 ( -1.052 -2.861 1.675) 3.478 10.860 ( 0.843 -5.473 2.619) 6.126 10.981 ( 0.864 -7.055 -1.031) 7.182 11.132 ( 1.177 -0.630 -5.358) 5.521 11.270 ( -0.932 -2.570 0.962) 2.898 11.331 ( 0.774 -5.029 0.019) 5.088 11.470 ( 1.355 -2.513 1.266) 3.123 11.568 ( -4.188 -4.974 2.214) 6.869 11.777 ( 0.910 -5.302 4.137) 6.786 12.163 ( -0.663 3.645 -0.573) 3.749 12.360 ( 0.961 -0.235 -0.132) 0.998 12.662 ( -2.942 2.740 -7.399) 8.421 12.893 ( -0.500 -2.391 2.839) 3.746 13.093 ( 3.107 -2.734 -0.621) 4.185 15.932 ( -0.220 -1.244 0.770) 1.479 16.171 ( -1.131 6.971 -3.222) 7.763 16.311 ( 2.232 3.441 1.020) 4.226 16.540 ( 0.134 -0.873 -2.839) 2.973 ======================= Grid point 134 (58/172) ======================= q-point: (-0.10 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.996 ( 1.994 30.034 9.940) 31.699 2.144 ( 3.146 30.232 13.109) 33.102 3.004 ( 1.723 14.414 -3.093) 14.843 3.220 ( 8.410 18.011 5.221) 20.552 3.532 ( -2.931 2.304 -13.752) 14.249 3.888 ( -1.220 -3.055 4.650) 5.696 4.166 ( -3.517 -6.237 9.631) 12.001 4.378 ( -6.632 -11.841 4.876) 14.421 4.528 ( 2.133 -7.666 3.602) 8.734 4.777 ( -1.436 -5.414 -2.564) 6.160 5.199 ( 4.300 -9.747 -1.143) 10.714 5.493 ( 2.689 -2.824 -6.978) 7.994 5.793 ( -0.786 -2.000 -0.950) 2.349 6.089 ( 3.610 -3.205 5.774) 7.526 6.250 ( -0.066 -1.960 3.092) 3.661 6.621 ( -3.548 7.755 -4.917) 9.844 6.675 ( -4.020 5.019 -5.093) 8.202 6.834 ( -1.408 6.746 -4.007) 7.972 6.896 ( -1.239 4.441 1.070) 4.733 7.076 ( 4.129 4.233 -0.029) 5.913 7.657 ( -0.356 3.047 4.707) 5.619 8.039 ( -0.254 3.019 1.057) 3.209 8.362 ( 1.286 8.593 -2.217) 8.967 8.464 ( -1.478 6.289 0.083) 6.461 8.677 ( -0.443 5.182 1.205) 5.339 8.787 ( 1.167 11.714 1.033) 11.818 8.919 ( -3.197 9.882 -1.518) 10.497 9.099 ( -0.756 2.459 0.038) 2.573 9.287 ( -0.068 -0.092 -2.358) 2.361 9.378 ( 1.779 2.478 0.180) 3.056 9.543 ( 1.385 -5.752 3.290) 6.770 9.769 ( 0.157 7.403 0.890) 7.458 10.115 ( 3.972 0.318 0.431) 4.008 10.257 ( -1.855 -1.839 -3.743) 4.564 10.371 ( 0.796 -6.477 1.348) 6.664 10.598 ( -3.042 2.310 1.422) 4.076 10.761 ( 0.185 -2.101 -1.573) 2.631 10.928 ( 0.705 -3.274 1.647) 3.732 11.107 ( 0.215 -4.967 -3.913) 6.327 11.159 ( -1.753 -5.056 -2.263) 5.809 11.261 ( -2.568 -2.339 1.175) 3.666 11.512 ( 1.020 -9.731 1.248) 9.864 11.558 ( 1.067 -5.272 1.721) 5.648 11.688 ( 0.927 -9.983 0.044) 10.026 11.904 ( 3.150 -5.979 3.991) 7.848 12.109 ( -1.029 0.980 -0.840) 1.651 12.384 ( 0.084 -1.837 0.223) 1.853 12.577 ( -0.770 2.756 -6.951) 7.517 12.940 ( -2.008 -3.700 3.806) 5.675 13.182 ( 2.652 -4.974 -2.235) 6.063 15.959 ( 0.754 -1.573 -0.762) 1.903 16.042 ( 1.547 6.802 -1.836) 7.214 16.268 ( 1.889 3.732 1.500) 4.444 16.543 ( 0.440 -0.404 -4.540) 4.579 ======================= Grid point 138 (59/172) ======================= q-point: ( 0.30 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( 22.858 0.000 24.187) 33.279 2.289 ( 27.677 0.000 16.428) 32.186 2.961 ( 5.574 0.000 -12.594) 13.773 3.397 ( 8.430 0.000 -16.504) 18.532 3.597 ( -1.158 -0.000 8.252) 8.332 3.815 ( 16.461 0.000 16.273) 23.147 4.010 ( -17.677 -0.000 -4.541) 18.251 4.186 ( 7.386 0.000 1.683) 7.576 4.997 ( -5.001 -0.000 4.009) 6.410 5.203 ( -5.524 -0.000 -1.853) 5.827 5.248 ( -2.317 -0.000 2.580) 3.468 5.529 ( 3.555 0.000 -10.190) 10.793 5.698 ( -4.088 -0.000 -2.670) 4.883 6.070 ( -6.523 -0.000 0.417) 6.536 6.316 ( 0.385 0.000 -1.548) 1.595 6.410 ( -5.080 -0.000 4.928) 7.078 6.492 ( 4.230 0.000 0.547) 4.265 6.570 ( -1.439 -0.000 -2.921) 3.256 6.723 ( 2.199 0.000 -3.060) 3.769 6.946 ( 7.094 0.000 -4.455) 8.377 7.544 ( 5.135 0.000 -0.481) 5.158 7.781 ( -9.042 -0.000 2.915) 9.500 7.984 ( -2.176 -0.000 -0.191) 2.184 8.250 ( -0.160 -0.000 0.409) 0.439 8.310 ( -1.121 -0.000 1.774) 2.098 8.395 ( -2.823 -0.000 2.250) 3.610 8.519 ( -5.229 -0.000 2.190) 5.669 8.939 ( -0.929 -0.000 -7.049) 7.110 9.150 ( -6.141 -0.000 -2.124) 6.498 9.286 ( -1.253 -0.000 1.767) 2.166 9.633 ( -1.151 -0.000 3.748) 3.921 9.752 ( 1.909 0.000 0.385) 1.947 9.872 ( -9.411 -0.000 -0.390) 9.419 10.144 ( -0.165 -0.000 -3.545) 3.549 10.422 ( -1.526 -0.000 1.564) 2.185 10.662 ( 0.451 0.000 -8.780) 8.791 10.798 ( 6.941 0.000 6.428) 9.460 10.996 ( 4.146 0.000 -4.598) 6.191 11.123 ( -0.455 -0.000 -0.854) 0.968 11.191 ( -2.664 -0.000 5.450) 6.066 11.517 ( -4.700 -0.000 3.255) 5.717 11.592 ( 7.171 0.000 0.881) 7.225 11.742 ( -5.771 -0.000 5.208) 7.774 12.072 ( -1.655 -0.000 -3.130) 3.540 12.119 ( -2.897 -0.000 0.153) 2.901 12.434 ( -1.376 -0.000 0.124) 1.381 12.554 ( 2.725 0.000 0.231) 2.735 12.655 ( 7.585 0.000 3.228) 8.243 13.219 ( 0.250 0.000 -6.115) 6.120 13.340 ( 4.049 0.000 -1.585) 4.349 15.983 ( 1.648 0.000 -1.300) 2.099 16.145 ( 2.802 0.000 -0.986) 2.971 16.294 ( 7.974 0.000 -1.494) 8.112 16.697 ( 3.682 0.000 -3.460) 5.052 ======================= Grid point 139 (60/172) ======================= q-point: ( 0.40 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( 22.042 -2.291 16.592) 27.684 2.561 ( 23.256 -2.519 16.570) 28.666 2.986 ( 3.804 -2.178 -9.779) 10.717 3.451 ( 6.727 -3.291 -10.775) 13.122 3.494 ( -14.468 1.745 3.684) 15.032 3.693 ( -11.907 9.382 1.493) 15.232 4.157 ( 8.836 -2.892 2.929) 9.748 4.357 ( 13.926 -10.774 5.750) 18.522 4.883 ( -5.513 8.078 3.560) 10.408 5.093 ( 1.205 5.667 0.501) 5.815 5.236 ( -7.020 1.157 -4.203) 8.264 5.458 ( -0.675 4.734 -5.853) 7.558 5.777 ( -2.045 -8.032 -1.301) 8.389 6.020 ( -2.521 0.128 -0.229) 2.534 6.293 ( -3.228 5.628 2.910) 7.111 6.327 ( 0.836 -0.620 -2.265) 2.493 6.549 ( 1.719 -3.047 0.353) 3.516 6.629 ( 0.857 -5.756 -0.469) 5.838 6.792 ( 1.625 -6.045 -2.577) 6.769 7.012 ( 6.473 -2.197 -4.505) 8.187 7.628 ( 5.725 -4.511 -1.207) 7.388 7.727 ( -10.328 -1.406 4.408) 11.317 8.016 ( -1.986 -5.778 0.813) 6.164 8.294 ( 0.817 -3.839 -1.313) 4.138 8.336 ( -1.877 -4.801 4.318) 6.725 8.418 ( -2.556 -4.634 1.340) 5.459 8.536 ( -4.831 -5.550 1.364) 7.483 8.904 ( -0.823 0.858 -6.645) 6.751 9.132 ( -4.385 -3.125 -1.408) 5.566 9.293 ( -0.470 -1.261 0.752) 1.541 9.629 ( -1.055 0.252 2.523) 2.746 9.752 ( -1.787 -0.398 0.046) 1.832 9.845 ( -4.616 -3.187 -0.610) 5.642 10.148 ( 0.480 -1.331 -3.477) 3.753 10.422 ( -1.321 -0.763 1.450) 2.104 10.660 ( -0.599 -2.128 -8.813) 9.086 10.845 ( 7.490 3.210 4.810) 9.463 10.978 ( 1.215 3.307 -1.858) 3.983 11.110 ( -0.965 1.337 -2.023) 2.610 11.170 ( -0.801 1.723 3.857) 4.300 11.444 ( -3.642 5.411 4.254) 7.787 11.633 ( 3.808 2.259 2.205) 4.946 11.707 ( -4.774 -0.263 4.490) 6.559 11.993 ( -1.488 6.333 -2.843) 7.099 12.085 ( -2.048 1.861 -0.640) 2.840 12.407 ( -2.528 0.938 0.745) 2.797 12.552 ( 2.665 2.642 0.590) 3.799 12.712 ( 4.280 0.033 1.969) 4.711 13.106 ( 1.741 10.065 -3.384) 10.761 13.392 ( 4.857 -0.525 -3.088) 5.779 15.999 ( 2.072 -0.187 -0.268) 2.097 16.153 ( 2.681 1.082 -0.534) 2.940 16.364 ( 5.642 -1.838 -1.356) 6.086 16.690 ( 3.368 2.672 -3.211) 5.366 ======================= Grid point 140 (61/172) ======================= q-point: ( 0.50 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.760 ( 15.455 -3.831 5.915) 16.986 2.822 ( 15.601 -4.266 16.122) 22.837 3.036 ( 4.040 -1.978 -1.675) 4.800 3.361 ( -9.628 1.583 1.930) 9.946 3.438 ( -17.925 -0.426 1.753) 18.015 3.633 ( 10.262 -4.586 -4.509) 12.111 4.187 ( 2.942 2.675 -1.036) 4.109 4.545 ( 1.483 3.317 3.081) 4.764 4.712 ( -6.459 6.300 3.719) 9.759 4.994 ( -0.515 9.768 -1.283) 9.865 5.174 ( 1.983 -1.705 -3.278) 4.194 5.363 ( -2.093 2.173 -5.535) 6.304 5.832 ( -0.886 -0.441 1.125) 1.498 6.037 ( 2.119 0.015 -0.323) 2.144 6.237 ( -2.456 -4.202 -0.614) 4.906 6.400 ( 4.197 -4.240 0.644) 6.001 6.603 ( 1.117 -2.189 -2.103) 3.234 6.745 ( 1.314 -6.685 -0.001) 6.812 6.913 ( 1.302 -6.697 -1.779) 7.051 7.083 ( 3.649 -2.731 -3.415) 5.695 7.676 ( -8.482 -1.665 5.031) 10.001 7.783 ( 5.117 -6.781 -0.476) 8.508 8.135 ( -3.888 -8.854 2.698) 10.040 8.385 ( 1.470 -7.157 -0.894) 7.361 8.476 ( -0.015 -9.532 2.433) 9.837 8.519 ( -2.453 -9.486 0.575) 9.815 8.634 ( -3.905 -10.301 0.642) 11.035 8.866 ( 1.127 1.353 -5.940) 6.196 9.173 ( -2.048 -4.809 -0.950) 5.313 9.324 ( -0.101 -2.302 -0.084) 2.306 9.628 ( -1.688 -0.820 0.282) 1.898 9.768 ( -4.034 -4.612 1.479) 6.303 9.883 ( -1.059 -4.240 -2.123) 4.859 10.173 ( 1.438 -1.804 -4.342) 4.917 10.424 ( -0.794 0.608 1.751) 2.016 10.658 ( -0.781 -0.345 -7.902) 7.948 10.809 ( 5.761 8.044 -0.083) 9.895 10.915 ( -0.632 5.075 2.795) 5.829 11.024 ( -2.219 5.488 -0.249) 5.925 11.165 ( 1.153 -0.201 -0.679) 1.353 11.320 ( -2.784 7.256 5.532) 9.540 11.576 ( -2.905 4.365 3.608) 6.365 11.700 ( -0.588 1.396 3.507) 3.820 11.838 ( 0.715 9.935 -1.949) 10.150 12.015 ( -1.389 4.563 -0.884) 4.851 12.371 ( -2.464 1.373 0.913) 2.965 12.514 ( 1.599 3.861 0.516) 4.211 12.734 ( 1.402 0.240 0.438) 1.488 12.940 ( 3.046 9.487 -1.162) 10.031 13.388 ( 4.545 4.503 -2.997) 7.065 16.005 ( 2.577 2.151 0.702) 3.430 16.166 ( 1.138 -1.482 -0.111) 1.872 16.426 ( 2.867 -1.767 -1.013) 3.517 16.647 ( 2.788 4.016 -3.328) 5.914 ======================= Grid point 141 (62/172) ======================= q-point: ( 0.60 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.915 ( 0.535 -5.557 1.772) 5.857 2.998 ( 3.546 -3.079 9.043) 10.190 3.136 ( 5.588 -3.944 10.462) 12.499 3.310 ( -2.179 -0.157 2.627) 3.417 3.395 ( -7.989 -6.718 0.077) 10.439 3.775 ( 10.909 -0.682 -1.790) 11.076 4.143 ( -2.346 2.351 1.082) 3.493 4.387 ( -0.545 10.910 3.067) 11.346 4.541 ( -11.567 7.074 -0.303) 13.562 4.793 ( -0.526 9.889 -2.977) 10.340 5.171 ( 1.934 4.964 -2.141) 5.742 5.367 ( -0.897 -5.064 -9.307) 10.633 5.842 ( 3.708 0.541 2.533) 4.523 6.019 ( -0.192 1.156 0.793) 1.415 6.368 ( 0.373 -4.971 -1.268) 5.144 6.452 ( 0.937 -1.681 2.564) 3.206 6.678 ( 2.431 -5.917 -4.122) 7.610 6.855 ( 0.184 -5.238 -1.897) 5.574 7.009 ( 2.029 -3.351 -0.150) 3.920 7.148 ( 0.423 -3.654 -1.546) 3.990 7.667 ( -5.290 -2.002 5.841) 8.130 7.946 ( 4.776 -7.242 -0.072) 8.675 8.240 ( -5.331 -7.020 2.837) 9.261 8.531 ( 0.504 -7.776 -0.767) 7.830 8.622 ( 0.595 -6.865 0.204) 6.894 8.700 ( -0.721 -11.159 -0.688) 11.204 8.840 ( 0.544 -5.924 -3.277) 6.792 8.892 ( 1.443 -14.785 0.750) 14.874 9.263 ( 2.887 -6.342 -1.261) 7.081 9.353 ( -0.318 -1.102 -0.832) 1.417 9.610 ( -6.458 -0.319 -0.001) 6.466 9.876 ( -0.972 -10.062 -0.502) 10.121 9.964 ( -0.037 -6.436 -2.789) 7.015 10.193 ( 1.498 0.033 -5.741) 5.933 10.386 ( 1.535 4.700 1.910) 5.300 10.553 ( -2.592 12.033 -2.397) 12.541 10.703 ( 2.467 6.831 -2.190) 7.586 10.792 ( -0.240 4.746 0.170) 4.755 10.969 ( -0.122 0.596 0.093) 0.615 11.158 ( -0.942 5.346 1.657) 5.676 11.204 ( -0.759 2.480 2.817) 3.829 11.489 ( -1.019 4.682 2.653) 5.477 11.645 ( -1.080 6.305 3.586) 7.333 11.688 ( 0.827 6.242 1.136) 6.398 11.897 ( -0.798 8.140 -0.130) 8.180 12.325 ( -1.644 2.086 -0.337) 2.677 12.452 ( -0.939 3.544 -0.099) 3.668 12.735 ( -0.783 -0.352 -1.388) 1.632 12.850 ( 4.200 4.375 0.500) 6.085 13.300 ( 3.205 8.101 -2.021) 8.943 15.974 ( 1.646 3.303 1.979) 4.188 16.216 ( 0.676 -2.980 -0.098) 3.058 16.465 ( 0.430 -1.717 -1.163) 2.118 16.578 ( 1.829 5.125 -3.532) 6.487 ======================= Grid point 142 (63/172) ======================= q-point: (-0.30 -0.70 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.955 ( -3.855 0.881 3.224) 5.102 3.110 ( -1.289 -7.044 4.833) 8.640 3.210 ( -4.035 -1.328 8.702) 9.683 3.365 ( 0.523 -0.559 1.245) 1.462 3.468 ( 0.707 -4.499 4.109) 6.134 3.769 ( 6.413 6.984 1.668) 9.627 4.077 ( -4.631 3.388 9.848) 11.397 4.283 ( -4.418 3.790 -2.505) 6.337 4.336 ( 0.590 4.791 -2.759) 5.560 4.695 ( 4.370 1.170 -4.160) 6.146 5.065 ( 0.116 7.080 -3.102) 7.731 5.403 ( -1.159 -3.600 -12.491) 13.051 5.877 ( 1.729 -0.118 5.946) 6.193 6.021 ( 2.190 0.306 -0.942) 2.404 6.286 ( -3.303 7.159 4.869) 9.267 6.565 ( -2.659 -6.961 -2.887) 7.992 6.774 ( 1.525 -3.941 -3.142) 5.266 6.920 ( -1.325 -3.916 -3.058) 5.142 7.065 ( 2.480 -0.633 1.292) 2.867 7.191 ( -0.256 -1.339 -0.677) 1.522 7.688 ( -1.772 -1.516 5.874) 6.320 8.075 ( 0.818 -4.441 0.185) 4.519 8.327 ( -2.702 -6.491 1.503) 7.189 8.631 ( -0.979 -4.153 -1.168) 4.424 8.728 ( 2.270 -3.591 -1.205) 4.416 8.797 ( 1.062 -2.569 -2.524) 3.755 8.971 ( 2.419 -9.170 2.866) 9.908 9.230 ( -1.270 -18.159 -1.019) 18.232 9.348 ( 0.585 -0.260 -1.462) 1.596 9.459 ( 9.882 -9.012 -0.902) 13.405 9.539 ( -8.724 0.424 -0.828) 8.773 10.037 ( 3.210 -2.970 -3.393) 5.535 10.060 ( -2.050 -3.764 -2.022) 4.740 10.143 ( -1.926 0.000 -5.942) 6.246 10.220 ( -0.288 17.009 -0.113) 17.012 10.374 ( 1.053 -0.261 0.964) 1.451 10.629 ( 0.604 2.447 1.117) 2.757 10.783 ( 2.045 -1.649 -0.621) 2.699 10.952 ( 1.409 6.309 1.703) 6.685 11.034 ( -1.944 1.030 1.039) 2.433 11.216 ( 0.668 -1.146 0.418) 1.390 11.411 ( 0.923 5.204 -0.494) 5.308 11.526 ( -0.438 6.050 2.324) 6.496 11.634 ( -1.936 2.787 5.062) 6.094 11.745 ( -0.374 7.340 1.545) 7.510 12.275 ( -1.200 2.410 -0.791) 2.806 12.392 ( -1.460 1.924 -0.816) 2.550 12.720 ( -1.838 0.245 -4.671) 5.026 12.840 ( 1.741 0.601 1.438) 2.337 13.179 ( 2.820 7.277 -0.260) 7.809 15.942 ( 1.036 2.194 2.626) 3.575 16.257 ( -0.755 -1.352 -0.857) 1.770 16.476 ( 0.322 2.934 -2.692) 3.994 16.500 ( 0.763 1.044 -1.732) 2.161 ======================= Grid point 143 (64/172) ======================= q-point: (-0.20 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.821 ( -2.013 13.732 5.559) 14.951 3.055 ( 1.539 18.056 5.628) 18.975 3.221 ( -3.910 5.087 -4.175) 7.655 3.320 ( -8.907 -10.574 0.760) 13.846 3.567 ( -1.554 -2.975 7.086) 7.841 3.808 ( 6.706 -4.867 9.491) 12.598 4.024 ( -7.792 2.086 4.435) 9.205 4.140 ( 2.285 3.483 1.893) 4.576 4.404 ( 8.226 -3.300 -1.789) 9.042 4.772 ( 4.480 -3.547 -4.703) 7.401 4.936 ( 1.018 4.097 -5.311) 6.785 5.418 ( 0.387 -2.918 -12.299) 12.646 5.871 ( -6.815 2.287 7.268) 10.222 6.004 ( 4.823 3.422 3.086) 6.671 6.219 ( -0.524 -0.272 3.963) 4.006 6.612 ( -5.790 -4.331 -4.858) 8.711 6.805 ( -1.003 0.070 -2.924) 3.091 6.943 ( -2.301 -1.262 -2.963) 3.958 7.060 ( 0.772 3.358 1.157) 3.634 7.192 ( 2.074 1.429 0.044) 2.519 7.713 ( 0.430 0.044 5.908) 5.924 8.107 ( -2.963 -0.579 0.383) 3.044 8.416 ( -0.222 -4.163 0.813) 4.248 8.642 ( -0.416 1.763 -2.130) 2.797 8.750 ( 1.998 1.123 -0.555) 2.358 8.868 ( -0.974 -4.829 -1.466) 5.140 9.129 ( 1.882 -4.665 1.915) 5.382 9.326 ( -0.381 -0.043 -0.440) 0.583 9.373 ( -0.117 4.271 -2.901) 5.164 9.519 ( 0.293 -3.604 -1.105) 3.781 9.584 ( 4.130 9.376 0.507) 10.258 9.888 ( 1.534 5.571 -0.681) 5.818 10.029 ( 3.386 -1.399 -3.700) 5.207 10.153 ( -2.811 -2.638 -0.240) 3.862 10.232 ( -1.836 -6.577 -3.060) 7.483 10.437 ( 1.438 -4.976 -1.055) 5.286 10.644 ( -1.765 -3.246 1.275) 3.908 10.813 ( 0.903 2.953 4.787) 5.697 10.899 ( 4.491 -4.306 -1.089) 6.316 11.088 ( 0.147 -4.626 -2.369) 5.199 11.242 ( 1.221 -0.789 0.197) 1.467 11.329 ( 0.781 3.803 -1.005) 4.010 11.470 ( -2.519 -0.092 2.247) 3.377 11.533 ( -2.242 5.288 2.759) 6.372 11.731 ( 1.710 -2.396 4.456) 5.341 12.215 ( -1.322 3.246 -0.706) 3.576 12.360 ( -1.249 0.355 -0.886) 1.572 12.668 ( -1.573 2.119 -6.478) 6.995 12.848 ( -1.911 -1.110 1.202) 2.516 13.123 ( 3.495 2.213 0.712) 4.198 15.933 ( 0.998 0.666 2.172) 2.481 16.229 ( -2.415 2.522 -2.854) 4.509 16.405 ( 2.712 4.570 -0.284) 5.322 16.513 ( -0.375 -1.428 -2.264) 2.703 ======================= Grid point 144 (65/172) ======================= q-point: (-0.10 0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 2.294 23.688 8.486) 25.267 2.680 ( 1.752 26.011 8.047) 27.284 3.095 ( -1.661 5.226 -6.208) 8.283 3.394 ( -5.124 -3.455 -7.437) 9.670 3.587 ( 0.408 1.544 4.104) 4.403 3.919 ( 3.487 4.549 3.109) 6.521 4.027 ( -1.487 -10.502 11.956) 15.983 4.209 ( 0.618 -5.030 7.174) 8.783 4.510 ( 8.048 -0.564 0.340) 8.074 4.711 ( -3.839 1.902 -5.714) 7.142 5.055 ( 5.831 -10.191 -2.902) 12.095 5.445 ( 1.511 -2.855 -9.781) 10.300 5.775 ( -5.028 2.394 4.378) 7.083 6.042 ( 0.154 -3.325 5.809) 6.695 6.252 ( 1.011 -0.862 3.019) 3.298 6.602 ( -6.258 -1.564 -5.419) 8.424 6.736 ( -1.976 4.906 -4.211) 6.761 6.903 ( -2.694 3.632 -1.985) 4.938 6.983 ( 0.996 5.255 -0.381) 5.362 7.177 ( 3.352 3.252 0.618) 4.711 7.721 ( 1.661 2.063 5.593) 6.188 8.067 ( -4.672 1.606 1.407) 5.137 8.448 ( 0.001 1.102 0.477) 1.200 8.564 ( 0.292 6.078 -2.007) 6.407 8.738 ( 1.100 2.039 -0.106) 2.319 8.889 ( -4.156 0.062 -1.830) 4.541 9.119 ( 3.415 11.517 0.262) 12.016 9.193 ( -7.599 6.207 -2.935) 10.241 9.273 ( -0.165 8.248 1.600) 8.404 9.477 ( 2.268 4.063 1.375) 4.852 9.531 ( 11.243 -0.690 -1.249) 11.333 9.894 ( 2.498 3.018 -1.495) 4.193 10.098 ( -0.903 -2.519 0.796) 2.792 10.196 ( 0.395 -6.284 -0.504) 6.317 10.273 ( -0.704 -2.276 -2.428) 3.401 10.586 ( -1.560 -8.038 -1.502) 8.324 10.650 ( -1.638 -1.507 1.213) 2.535 10.852 ( -2.110 -5.187 3.441) 6.573 11.027 ( 3.599 -4.692 -1.369) 6.070 11.102 ( -0.379 0.254 -6.076) 6.093 11.247 ( -2.950 1.628 1.968) 3.902 11.362 ( 2.598 -8.428 0.400) 8.828 11.481 ( -2.769 -3.835 3.163) 5.690 11.554 ( 2.517 -5.945 0.739) 6.498 11.832 ( 2.577 -5.698 3.637) 7.234 12.145 ( -0.727 3.389 0.016) 3.466 12.352 ( -1.671 -0.978 -0.739) 2.072 12.609 ( 1.882 2.309 -5.711) 6.441 12.858 ( -4.338 -2.707 1.256) 5.266 13.149 ( 3.076 -1.753 -0.752) 3.620 15.943 ( 0.820 -0.449 0.437) 1.032 16.144 ( 0.075 4.462 -2.453) 5.093 16.357 ( 2.765 3.940 1.084) 4.934 16.523 ( -0.041 -0.841 -3.306) 3.411 ======================= Grid point 149 (66/172) ======================= q-point: ( 0.40 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( 18.105 0.000 19.215) 26.401 2.766 ( 20.899 0.000 9.863) 23.110 2.940 ( -1.623 -0.000 -7.598) 7.769 3.409 ( -12.262 -0.000 4.688) 13.127 3.420 ( 2.295 0.000 -10.461) 10.710 3.704 ( -13.355 -0.000 -0.189) 13.356 4.248 ( 16.046 0.000 6.602) 17.351 4.350 ( 8.489 0.000 0.362) 8.497 4.921 ( -6.298 -0.000 1.997) 6.607 5.114 ( -2.954 -0.000 -5.282) 6.052 5.200 ( -3.818 -0.000 -2.826) 4.750 5.514 ( 1.715 0.000 -9.568) 9.721 5.651 ( -1.785 -0.000 4.909) 5.224 6.025 ( -0.992 -0.000 3.244) 3.392 6.297 ( -0.649 -0.000 -2.898) 2.970 6.353 ( -5.332 -0.000 4.904) 7.245 6.516 ( -0.286 -0.000 0.294) 0.410 6.574 ( 3.183 0.000 -2.215) 3.878 6.742 ( 2.154 0.000 -2.628) 3.398 7.041 ( 7.938 0.000 -5.959) 9.926 7.633 ( 5.947 0.000 -1.122) 6.052 7.641 ( -10.324 -0.000 4.201) 11.146 7.957 ( -1.464 -0.000 1.115) 1.840 8.260 ( 0.093 0.000 2.920) 2.922 8.296 ( -1.227 -0.000 -0.118) 1.232 8.358 ( -3.322 -0.000 2.273) 4.025 8.460 ( -3.336 -0.000 1.690) 3.739 8.884 ( -0.698 -0.000 -5.579) 5.623 9.077 ( -2.122 -0.000 -0.771) 2.258 9.278 ( -0.629 -0.000 0.081) 0.634 9.625 ( -1.821 -0.000 2.705) 3.261 9.762 ( -4.474 -0.000 0.130) 4.476 9.763 ( 0.039 0.000 -1.241) 1.242 10.135 ( 1.180 0.000 -3.175) 3.387 10.404 ( -1.574 -0.000 1.005) 1.868 10.616 ( 0.525 0.000 -8.504) 8.520 10.936 ( 5.342 0.000 5.679) 7.797 11.013 ( 1.025 0.000 -4.621) 4.733 11.118 ( 1.418 0.000 -2.227) 2.640 11.189 ( -1.068 -0.000 4.581) 4.704 11.477 ( -3.940 -0.000 5.169) 6.500 11.657 ( -7.649 -0.000 5.030) 9.155 11.710 ( 6.064 0.000 2.110) 6.420 12.026 ( -1.773 -0.000 -3.190) 3.649 12.084 ( -1.388 -0.000 -0.420) 1.451 12.385 ( -3.625 -0.000 -1.218) 3.824 12.596 ( 2.120 0.000 1.052) 2.367 12.738 ( 1.054 0.000 1.244) 1.631 13.238 ( 4.856 0.000 -2.241) 5.348 13.392 ( 3.467 0.000 -2.500) 4.275 16.005 ( 1.133 0.000 1.191) 1.643 16.197 ( 3.599 0.000 0.306) 3.612 16.382 ( 4.402 0.000 -2.504) 5.065 16.726 ( 2.331 0.000 -3.356) 4.086 ======================= Grid point 150 (67/172) ======================= q-point: ( 0.50 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( -5.784 -0.138 -0.209) 5.789 2.940 ( 12.015 -2.138 9.940) 15.740 3.014 ( 6.242 -5.436 5.654) 10.024 3.341 ( -4.709 1.197 3.411) 5.937 3.357 ( -5.846 6.366 1.275) 8.736 3.639 ( 6.102 -1.507 -0.112) 6.287 4.276 ( 3.464 4.259 -1.909) 5.812 4.512 ( 0.330 -7.317 1.394) 7.456 4.806 ( -5.508 7.380 0.759) 9.240 5.092 ( -3.500 1.330 -3.976) 5.462 5.128 ( 0.200 0.632 -6.331) 6.366 5.424 ( 0.805 6.234 -4.880) 7.958 5.758 ( -1.401 -7.236 3.773) 8.280 6.028 ( 3.231 -0.773 1.660) 3.714 6.254 ( -3.757 5.507 2.947) 7.289 6.336 ( 1.604 -4.328 -1.473) 4.845 6.573 ( 0.816 -4.188 1.069) 4.398 6.636 ( 1.179 -4.565 -1.589) 4.975 6.797 ( 1.213 -5.388 -2.711) 6.152 7.087 ( 5.786 -0.674 -6.049) 8.398 7.593 ( -8.060 -1.672 5.057) 9.661 7.717 ( 4.758 -4.989 -1.077) 6.978 7.995 ( -1.569 -5.003 2.073) 5.638 8.298 ( -0.488 -3.099 0.654) 3.205 8.328 ( -1.410 -5.888 2.180) 6.435 8.392 ( -1.151 -5.483 1.655) 5.842 8.484 ( -2.472 -4.682 0.915) 5.373 8.871 ( 1.410 0.023 -5.015) 5.209 9.092 ( -0.251 -2.912 0.407) 2.951 9.286 ( -0.701 -1.622 -0.628) 1.875 9.622 ( -0.975 -0.138 1.115) 1.488 9.707 ( -2.254 0.667 0.693) 2.451 9.807 ( -0.801 -3.506 -1.610) 3.940 10.147 ( 1.515 -1.187 -3.542) 4.031 10.408 ( -1.289 -1.232 0.979) 2.035 10.614 ( 1.101 -1.393 -7.825) 8.024 10.954 ( 1.717 4.236 -1.784) 4.906 10.980 ( 0.698 1.723 2.364) 3.007 11.096 ( 1.887 3.875 -1.673) 4.624 11.186 ( 0.488 1.075 2.362) 2.641 11.414 ( -4.213 4.760 5.598) 8.471 11.600 ( -5.793 1.745 5.311) 8.051 11.748 ( 3.236 1.176 2.571) 4.297 11.967 ( 0.237 4.800 -2.418) 5.380 12.051 ( -1.488 2.244 -1.129) 2.919 12.356 ( -3.011 -0.107 -1.254) 3.263 12.589 ( 1.336 2.951 1.049) 3.405 12.738 ( -0.927 0.035 -0.453) 1.032 13.153 ( 4.207 10.790 0.514) 11.593 13.443 ( 3.351 -1.063 -2.761) 4.470 16.031 ( 1.377 -1.098 1.887) 2.581 16.196 ( 2.406 2.645 0.897) 3.686 16.415 ( 1.928 -1.325 -2.444) 3.383 16.711 ( 1.576 2.348 -3.558) 4.545 ======================= Grid point 151 (68/172) ======================= q-point: (-0.40 -0.60 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( -14.714 -6.151 0.072) 15.948 2.990 ( -14.381 -1.941 1.257) 14.565 3.164 ( 5.971 -3.789 4.656) 8.467 3.270 ( 6.443 2.782 15.089) 16.641 3.346 ( 7.075 0.183 2.789) 7.607 3.791 ( 9.245 -6.192 1.386) 11.213 4.201 ( -0.401 4.746 -3.317) 5.804 4.512 ( -7.167 2.005 -1.346) 7.563 4.609 ( -4.943 10.904 1.042) 12.017 4.940 ( -4.475 8.132 -4.174) 10.178 5.195 ( 2.358 -3.987 -5.718) 7.359 5.318 ( 1.653 4.879 -5.255) 7.359 5.842 ( -0.224 -3.464 3.528) 4.950 6.084 ( 1.251 3.993 2.052) 4.661 6.215 ( 0.820 -7.305 -0.113) 7.352 6.434 ( 0.168 -4.343 -0.454) 4.370 6.624 ( 2.293 -1.657 -0.783) 2.935 6.735 ( -1.242 -6.446 -2.077) 6.885 6.916 ( 0.457 -7.808 -1.768) 8.018 7.116 ( 2.135 -0.903 -3.833) 4.479 7.603 ( -3.624 -2.997 5.490) 7.229 7.857 ( 3.526 -7.093 -0.206) 7.924 8.090 ( -3.142 -6.729 2.906) 7.975 8.390 ( -0.795 -7.969 -0.410) 8.019 8.466 ( -1.261 -10.935 0.734) 11.032 8.527 ( 2.144 -8.019 1.561) 8.446 8.592 ( -1.498 -10.865 -0.070) 10.968 8.880 ( 4.008 -0.106 -4.025) 5.682 9.175 ( 2.254 -5.618 1.646) 6.273 9.313 ( -1.213 -2.442 -1.204) 2.981 9.604 ( -0.699 1.557 -1.170) 2.069 9.732 ( -0.975 -4.858 1.720) 5.245 9.864 ( 0.091 -4.487 -2.851) 5.317 10.173 ( 1.356 -1.468 -4.637) 5.049 10.423 ( -0.279 -0.610 1.531) 1.672 10.622 ( 1.483 0.117 -6.402) 6.572 10.832 ( -1.477 8.129 -2.991) 8.787 10.958 ( 1.482 4.923 4.538) 6.858 10.997 ( 1.474 6.933 -2.930) 7.670 11.181 ( 0.639 0.608 0.641) 1.090 11.303 ( -3.465 6.032 5.597) 8.928 11.545 ( -2.651 2.505 5.538) 6.631 11.726 ( 0.605 3.815 3.226) 5.033 11.855 ( 1.963 8.825 -0.944) 9.090 11.986 ( -1.321 3.677 -1.671) 4.249 12.328 ( -2.428 0.592 -1.299) 2.817 12.520 ( -1.055 5.215 0.078) 5.321 12.725 ( -0.951 0.243 -1.488) 1.783 13.003 ( 2.902 9.465 2.378) 10.182 13.429 ( 2.368 4.517 -2.270) 5.582 16.051 ( 1.877 1.926 2.896) 3.952 16.182 ( 0.666 -0.458 0.605) 1.009 16.435 ( -0.676 -1.237 -2.165) 2.584 16.655 ( 0.671 3.885 -3.880) 5.532 ======================= Grid point 152 (69/172) ======================= q-point: (-0.30 -0.60 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.793 ( -14.072 -11.018 3.305) 18.176 2.923 ( -16.502 -6.368 3.182) 17.972 3.220 ( -0.796 0.311 5.882) 5.944 3.380 ( 6.392 -2.337 10.656) 12.644 3.440 ( 9.104 -1.032 1.831) 9.343 3.924 ( 5.124 0.969 1.566) 5.445 4.105 ( -3.198 2.939 3.566) 5.620 4.374 ( -3.741 9.563 -0.015) 10.269 4.432 ( 2.581 4.658 -3.176) 6.200 4.770 ( -1.442 5.861 -5.374) 8.081 5.159 ( -2.941 5.194 -2.434) 6.446 5.309 ( 3.740 -2.076 -9.616) 10.525 5.906 ( 0.791 -0.793 2.845) 3.058 6.024 ( -0.691 0.312 3.778) 3.853 6.312 ( -5.287 -1.532 -4.234) 6.945 6.476 ( 1.851 -1.514 1.925) 3.070 6.699 ( 1.872 -4.931 -2.974) 6.056 6.806 ( -3.365 -5.311 -2.748) 6.861 7.036 ( 0.451 -5.363 0.125) 5.383 7.146 ( 0.451 -2.569 -1.574) 3.047 7.658 ( 0.092 -2.941 5.343) 6.100 7.982 ( -2.010 -5.761 1.425) 6.265 8.199 ( 0.176 -7.224 1.502) 7.380 8.518 ( -0.975 -7.425 -1.251) 7.593 8.635 ( 0.004 -7.767 0.597) 7.790 8.705 ( 2.181 -10.276 -1.441) 10.603 8.837 ( 0.891 -15.287 -0.541) 15.322 8.931 ( 2.525 -5.818 -0.294) 6.349 9.319 ( -0.189 -3.526 -1.234) 3.741 9.348 ( 2.825 -6.887 2.390) 7.818 9.566 ( 2.804 2.328 -2.911) 4.664 9.854 ( -1.336 -9.554 -0.582) 9.664 9.954 ( 1.292 -6.515 -3.753) 7.629 10.167 ( -0.557 1.824 -5.318) 5.650 10.425 ( 2.448 2.054 1.494) 3.528 10.519 ( -0.773 13.073 -1.827) 13.222 10.701 ( 0.691 3.681 -3.383) 5.047 10.832 ( 2.882 8.080 2.092) 8.830 10.963 ( 0.487 -0.850 -1.378) 1.690 11.138 ( -3.602 5.777 3.847) 7.820 11.225 ( 1.872 1.683 1.625) 2.996 11.492 ( -0.666 4.078 2.959) 5.082 11.661 ( 0.129 6.325 4.177) 7.581 11.709 ( 1.061 7.496 0.931) 7.628 11.884 ( -0.708 7.164 -0.262) 7.203 12.289 ( -2.303 1.342 -1.211) 2.928 12.416 ( -2.905 3.956 -1.305) 5.079 12.707 ( -0.701 0.639 -2.118) 2.321 12.901 ( 0.655 4.958 1.975) 5.377 13.328 ( 1.403 7.704 -1.244) 7.929 16.017 ( 1.672 3.872 3.786) 5.668 16.216 ( -0.776 -2.279 -0.330) 2.430 16.441 ( -2.181 -1.703 -2.225) 3.551 16.575 ( 0.459 4.380 -3.579) 5.674 ======================= Grid point 153 (70/172) ======================= q-point: (-0.20 -0.60 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.861 ( -10.907 -5.096 5.147) 13.093 3.004 ( -12.021 -14.369 1.529) 18.796 3.220 ( -0.649 0.731 6.700) 6.771 3.362 ( 0.426 9.338 0.994) 9.401 3.531 ( 1.520 -0.740 7.288) 7.482 3.871 ( 2.160 4.311 5.389) 7.231 4.031 ( -5.867 4.856 6.246) 9.850 4.296 ( 9.222 3.523 2.222) 10.119 4.408 ( 6.842 -0.058 -4.758) 8.333 4.726 ( 0.869 -2.501 -7.958) 8.387 5.024 ( -1.953 6.356 -3.788) 7.653 5.342 ( 3.087 -1.917 -10.235) 10.861 5.873 ( -4.594 2.337 4.655) 6.945 6.097 ( 4.426 -2.750 3.512) 6.283 6.205 ( -8.611 3.650 0.123) 9.353 6.507 ( -1.309 -1.467 -2.223) 2.968 6.770 ( 0.237 -2.688 -2.466) 3.655 6.864 ( -2.357 -4.733 -2.478) 5.839 7.089 ( -0.673 -0.698 0.755) 1.229 7.194 ( 0.803 -2.341 -0.779) 2.595 7.725 ( 2.126 -1.863 5.561) 6.238 8.030 ( -6.507 -3.718 1.789) 7.705 8.335 ( 2.583 -6.159 0.794) 6.726 8.608 ( -0.311 -4.109 -2.493) 4.816 8.752 ( 0.420 -5.199 -0.612) 5.251 8.804 ( 2.066 -0.564 -1.853) 2.832 9.037 ( 3.342 -8.516 3.558) 9.816 9.193 ( -2.029 -17.632 -1.808) 17.840 9.319 ( -4.268 -4.407 -2.614) 6.669 9.450 ( 0.047 1.383 1.278) 1.883 9.665 ( 13.912 -6.010 -2.321) 15.332 9.989 ( -4.254 -6.062 -2.126) 7.705 10.048 ( -1.508 4.707 -4.980) 7.017 10.074 ( 0.087 -4.268 -3.676) 5.633 10.246 ( 3.068 14.937 -0.732) 15.266 10.423 ( 4.511 1.030 0.780) 4.693 10.625 ( -2.030 3.599 0.806) 4.210 10.834 ( 3.918 -3.624 0.549) 5.365 10.979 ( -0.582 6.567 2.971) 7.232 11.018 ( 0.466 -0.938 -0.616) 1.215 11.243 ( 2.276 -0.218 1.139) 2.555 11.415 ( -0.422 4.140 -0.252) 4.169 11.512 ( -2.643 8.379 2.162) 9.048 11.641 ( -0.062 5.635 2.215) 6.055 11.768 ( 1.621 4.364 3.650) 5.916 12.239 ( -3.112 1.701 -0.978) 3.679 12.349 ( -2.510 0.953 -2.040) 3.372 12.676 ( -0.549 1.552 -2.756) 3.210 12.845 ( -1.425 1.891 0.635) 2.452 13.213 ( 1.230 5.878 -0.335) 6.015 15.982 ( 1.590 2.830 3.664) 4.895 16.220 ( -2.693 -0.076 -1.914) 3.304 16.449 ( -1.911 -1.473 -2.302) 3.335 16.509 ( 1.609 2.881 -2.008) 3.863 ======================= Grid point 154 (71/172) ======================= q-point: (-0.10 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.806 ( -4.494 6.487 6.318) 10.109 3.052 ( -2.389 10.623 -0.385) 10.895 3.180 ( -0.442 5.639 0.178) 5.659 3.244 ( -1.656 -3.246 3.674) 5.175 3.520 ( -6.699 -1.753 5.025) 8.556 3.900 ( -2.237 -2.940 8.245) 9.035 3.971 ( -0.960 -1.172 6.331) 6.510 4.311 ( 12.461 4.593 3.015) 13.619 4.525 ( 7.811 -4.967 -2.211) 9.516 4.722 ( -4.334 1.647 -8.223) 9.440 4.969 ( 5.098 -2.556 -4.516) 7.274 5.371 ( 2.026 -2.563 -10.624) 11.115 5.795 ( -6.654 3.118 5.567) 9.219 6.073 ( -0.151 4.212 4.537) 6.193 6.209 ( -2.000 -4.719 3.033) 5.956 6.507 ( -3.304 -1.844 -3.529) 5.174 6.773 ( -0.325 1.449 -2.589) 2.985 6.901 ( -0.811 -1.377 -1.656) 2.301 7.060 ( -0.629 3.090 -0.275) 3.165 7.224 ( 1.224 -0.219 -0.076) 1.246 7.778 ( 3.129 0.174 5.892) 6.674 8.023 ( -7.688 -1.317 2.031) 8.060 8.432 ( 1.124 -2.829 1.108) 3.240 8.632 ( 1.180 1.009 -3.227) 3.581 8.774 ( 1.519 1.599 -1.406) 2.616 8.832 ( -2.475 -2.267 -0.606) 3.410 9.133 ( -1.773 -1.280 -1.089) 2.443 9.297 ( -0.125 1.948 -0.704) 2.075 9.399 ( 1.284 0.254 0.796) 1.532 9.527 ( 2.073 -7.677 -2.326) 8.285 9.675 ( 5.924 11.222 -0.611) 12.704 9.904 ( 1.116 3.199 -2.249) 4.067 10.056 ( -1.481 -5.048 -0.061) 5.261 10.126 ( 4.378 -0.309 -3.067) 5.355 10.194 ( -1.305 -4.349 -1.811) 4.889 10.476 ( 3.501 -2.671 -0.565) 4.439 10.591 ( -5.032 -2.750 0.591) 5.764 10.842 ( -0.585 4.362 4.481) 6.280 10.982 ( 5.977 -4.846 -1.746) 7.890 11.071 ( -0.650 -2.789 -2.832) 4.027 11.247 ( -1.890 0.538 1.507) 2.476 11.330 ( -0.266 4.388 -0.136) 4.398 11.429 ( -2.137 -1.115 2.200) 3.263 11.547 ( 1.108 3.005 2.077) 3.817 11.790 ( 2.048 -2.035 3.550) 4.576 12.183 ( -1.958 1.670 -0.306) 2.592 12.325 ( -1.433 -0.300 -1.310) 1.964 12.644 ( 1.706 1.382 -2.547) 3.363 12.810 ( -2.657 0.443 -0.366) 2.719 13.158 ( 0.719 1.371 -0.821) 1.752 15.963 ( 0.822 1.604 2.077) 2.749 16.181 ( -1.235 1.417 -2.118) 2.832 16.433 ( 0.892 1.874 -0.955) 2.285 16.498 ( 0.468 -0.537 -2.115) 2.231 ======================= Grid point 160 (72/172) ======================= q-point: (-0.50 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( -20.905 -0.000 -0.442) 20.910 2.837 ( -17.112 -0.000 -3.507) 17.467 3.146 ( 16.607 0.000 12.747) 20.935 3.350 ( 0.134 0.000 6.178) 6.179 3.471 ( 13.405 0.000 0.452) 13.413 3.690 ( 6.631 0.000 5.656) 8.715 4.314 ( -9.362 -0.000 -3.066) 9.851 4.404 ( -1.612 -0.000 -0.774) 1.788 4.838 ( -3.729 -0.000 -2.074) 4.267 5.040 ( -2.148 -0.000 -8.304) 8.577 5.112 ( -4.172 -0.000 -4.206) 5.924 5.493 ( 2.641 0.000 -8.985) 9.366 5.696 ( 2.456 0.000 8.857) 9.192 6.062 ( 2.438 0.000 4.865) 5.442 6.292 ( 2.521 0.000 -3.427) 4.255 6.304 ( -3.903 -0.000 4.617) 6.046 6.519 ( 0.066 0.000 1.218) 1.220 6.613 ( 2.850 0.000 -1.706) 3.322 6.763 ( 2.062 0.000 -2.209) 3.022 7.099 ( 3.253 0.000 -7.652) 8.314 7.537 ( -4.751 -0.000 4.465) 6.520 7.693 ( 1.360 0.000 -0.069) 1.362 7.957 ( 0.801 0.000 1.575) 1.767 8.269 ( -1.629 -0.000 2.335) 2.847 8.289 ( 1.231 0.000 0.430) 1.304 8.325 ( -2.033 -0.000 1.767) 2.694 8.436 ( -0.835 -0.000 1.722) 1.914 8.871 ( 2.179 0.000 -3.892) 4.461 9.078 ( 2.611 0.000 0.966) 2.784 9.260 ( -1.379 -0.000 -1.245) 1.858 9.613 ( -1.128 -0.000 1.009) 1.513 9.733 ( 0.503 0.000 1.361) 1.451 9.747 ( -0.657 -0.000 -2.426) 2.514 10.140 ( 1.696 0.000 -3.164) 3.590 10.386 ( -1.288 -0.000 0.482) 1.376 10.595 ( 2.255 0.000 -6.837) 7.199 10.978 ( -1.779 -0.000 -4.768) 5.089 10.995 ( -0.748 -0.000 1.695) 1.853 11.166 ( 5.394 0.000 -0.081) 5.395 11.204 ( 0.010 0.000 3.132) 3.132 11.434 ( -5.610 -0.000 6.349) 8.473 11.593 ( -3.117 -0.000 4.574) 5.536 11.784 ( 0.745 0.000 2.883) 2.978 11.995 ( 0.642 0.000 -2.876) 2.946 12.070 ( -0.134 -0.000 -0.690) 0.703 12.328 ( -1.915 -0.000 -2.504) 3.152 12.633 ( 1.546 0.000 1.960) 2.496 12.719 ( -2.758 -0.000 -1.255) 3.030 13.318 ( 4.581 0.000 1.576) 4.845 13.410 ( 0.625 0.000 -3.053) 3.116 16.032 ( 0.875 0.000 2.590) 2.734 16.250 ( 1.860 0.000 2.381) 3.021 16.401 ( 0.096 0.000 -3.537) 3.538 16.729 ( 0.567 0.000 -3.906) 3.947 ======================= Grid point 161 (73/172) ======================= q-point: (-0.40 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.514 ( -24.184 -3.399 1.143) 24.449 2.708 ( -27.056 -6.184 -3.072) 27.923 3.263 ( 9.264 2.093 2.801) 9.902 3.381 ( 5.891 1.365 13.111) 14.438 3.540 ( 14.437 5.760 5.700) 16.556 3.778 ( 8.798 -2.531 5.505) 10.682 4.209 ( -11.460 -0.786 -5.227) 12.620 4.391 ( -11.553 -2.769 -1.730) 12.005 4.737 ( -1.802 6.852 -3.781) 8.031 4.982 ( -5.560 4.629 -3.839) 8.190 5.120 ( 2.128 -5.946 -7.760) 10.004 5.434 ( 3.722 5.858 -5.845) 9.073 5.786 ( 2.238 -3.168 5.991) 7.137 6.112 ( 3.880 -1.894 3.177) 5.360 6.220 ( -0.987 4.434 1.575) 4.808 6.362 ( 2.065 -3.764 0.469) 4.319 6.582 ( -0.774 -5.271 1.336) 5.492 6.647 ( 1.074 -2.069 -2.129) 3.157 6.803 ( 1.330 -4.127 -2.817) 5.171 7.096 ( -0.462 -0.837 -6.115) 6.189 7.551 ( -0.006 -2.396 3.620) 4.341 7.750 ( -1.132 -6.214 1.349) 6.459 8.003 ( 1.712 -3.369 1.691) 4.139 8.276 ( -2.655 -2.688 1.362) 4.017 8.329 ( 1.232 -5.040 -0.291) 5.197 8.407 ( 1.402 -7.800 1.548) 8.074 8.472 ( 0.149 -3.658 1.902) 4.126 8.890 ( 3.680 -0.874 -3.944) 5.464 9.135 ( 4.807 -2.574 2.403) 5.959 9.259 ( -1.821 -1.751 -1.811) 3.108 9.605 ( -1.244 0.092 -0.541) 1.359 9.714 ( 1.915 0.524 0.347) 2.015 9.793 ( 0.802 -3.253 -1.002) 3.497 10.153 ( 1.866 -0.801 -3.404) 3.964 10.395 ( -0.779 -1.831 0.515) 2.055 10.607 ( 2.460 -1.076 -5.687) 6.289 10.913 ( -2.214 4.129 -4.340) 6.386 10.978 ( -2.459 0.715 -0.371) 2.588 11.160 ( 3.928 5.194 2.320) 6.914 11.209 ( 1.322 1.184 1.284) 2.190 11.371 ( -4.848 4.035 5.980) 8.692 11.580 ( -0.398 1.361 4.823) 5.028 11.777 ( -1.822 1.072 3.184) 3.822 11.976 ( 2.339 3.262 -2.065) 4.514 12.030 ( -0.263 3.703 -1.507) 4.006 12.310 ( -1.311 -0.002 -2.728) 3.027 12.600 ( -1.010 4.608 0.948) 4.811 12.708 ( -1.474 -0.976 -0.733) 1.914 13.207 ( 1.168 11.012 1.432) 11.166 13.463 ( 0.916 -1.620 -1.861) 2.632 16.062 ( 0.820 -1.567 2.865) 3.366 16.231 ( 0.638 3.450 2.511) 4.315 16.397 ( -2.159 -1.167 -3.150) 3.993 16.698 ( -0.408 2.326 -4.394) 4.989 ======================= Grid point 162 (74/172) ======================= q-point: (-0.30 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -22.422 -11.339 3.765) 25.407 2.616 ( -27.237 -9.274 0.883) 28.786 3.257 ( 1.255 2.537 1.172) 3.063 3.452 ( 6.607 0.764 7.859) 10.295 3.576 ( 11.475 3.887 11.094) 16.427 3.919 ( 4.012 -4.369 4.148) 7.238 4.130 ( -5.058 1.082 -1.428) 5.366 4.342 ( -10.807 -4.126 -5.049) 12.622 4.585 ( 1.429 9.185 -2.493) 9.624 4.813 ( -6.934 6.712 -4.898) 10.823 5.195 ( 2.128 0.196 -4.404) 4.896 5.359 ( 5.890 3.723 -5.657) 8.975 5.862 ( 1.264 -3.223 3.770) 5.118 6.065 ( -3.600 5.131 2.067) 6.600 6.267 ( 4.507 -1.760 -2.057) 5.258 6.442 ( 1.091 -4.761 2.316) 5.405 6.641 ( -0.121 -2.480 -1.337) 2.820 6.695 ( -2.020 -4.197 -1.473) 4.885 6.907 ( -0.257 -7.800 -2.290) 8.133 7.100 ( -1.370 -2.227 -2.948) 3.940 7.625 ( 2.829 -3.365 3.196) 5.435 7.858 ( -4.476 -6.657 3.082) 8.594 8.105 ( 3.734 -5.932 1.372) 7.142 8.359 ( -2.171 -8.691 -0.777) 8.992 8.466 ( 1.339 -9.465 -0.595) 9.578 8.565 ( -0.363 -7.468 1.805) 7.691 8.604 ( 4.066 -11.429 0.355) 12.136 8.928 ( 4.037 -0.760 -3.015) 5.096 9.250 ( 1.983 -4.529 2.328) 5.465 9.281 ( 1.531 -3.608 -1.191) 4.097 9.590 ( -0.184 0.166 -1.857) 1.874 9.755 ( 2.318 -3.102 -0.503) 3.905 9.866 ( 2.889 -4.222 -1.642) 5.373 10.167 ( 1.146 -0.133 -3.767) 3.940 10.434 ( 0.850 -2.310 0.834) 2.598 10.620 ( 0.815 0.971 -3.343) 3.575 10.784 ( -0.975 7.286 -3.744) 8.250 10.945 ( -1.664 0.670 -1.414) 2.284 11.062 ( 3.494 9.923 3.031) 10.948 11.185 ( -0.595 2.909 1.155) 3.186 11.285 ( -1.539 3.349 4.145) 5.547 11.560 ( 0.262 2.907 4.125) 5.053 11.748 ( -0.466 2.307 4.246) 4.855 11.879 ( 1.492 9.221 -0.272) 9.345 11.960 ( -0.344 3.631 -2.734) 4.558 12.285 ( -1.960 0.841 -2.124) 3.010 12.483 ( -3.342 6.545 -0.325) 7.356 12.710 ( -0.094 0.096 -0.487) 0.506 13.028 ( -1.444 9.446 1.512) 9.675 13.437 ( 0.093 4.346 -1.387) 4.563 16.091 ( 0.736 0.868 3.765) 3.933 16.189 ( -0.648 1.100 1.149) 1.718 16.384 ( -3.775 -1.328 -2.841) 4.908 16.628 ( -1.007 3.379 -4.432) 5.664 ======================= Grid point 163 (75/172) ======================= q-point: (-0.20 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( -18.311 -16.100 6.120) 25.139 2.632 ( -20.139 -15.043 3.099) 25.327 3.230 ( -1.543 0.715 2.717) 3.205 3.479 ( 1.760 2.175 0.606) 2.863 3.626 ( 7.718 3.983 11.862) 14.701 3.955 ( -0.350 2.412 7.092) 7.499 4.100 ( -0.422 2.618 1.774) 3.191 4.338 ( -5.410 -4.708 -3.403) 7.938 4.473 ( 5.839 5.136 -2.116) 8.060 4.660 ( -6.021 1.831 -8.350) 10.456 5.116 ( 0.853 7.000 -2.217) 7.392 5.367 ( 7.349 1.153 -6.750) 10.045 5.901 ( -1.573 1.944 2.129) 3.285 6.005 ( -4.102 -2.902 1.951) 5.390 6.240 ( -0.979 3.468 -1.318) 3.837 6.521 ( 2.868 0.284 -0.045) 2.882 6.704 ( 1.381 -5.242 -2.221) 5.858 6.749 ( -2.353 -5.038 -0.267) 5.566 7.020 ( -1.807 -5.991 -0.748) 6.302 7.136 ( -0.973 -3.604 -1.632) 4.074 7.716 ( 3.471 -3.026 3.742) 5.934 7.911 ( -7.085 -4.462 3.425) 9.046 8.261 ( 5.380 -6.533 1.073) 8.531 8.496 ( -0.441 -8.020 -2.395) 8.382 8.629 ( -0.571 -8.243 0.510) 8.279 8.742 ( 3.083 -10.792 -2.206) 11.439 8.854 ( 0.737 -15.119 0.557) 15.147 8.969 ( 2.781 -2.875 0.575) 4.041 9.250 ( -4.150 -0.066 -3.272) 5.285 9.432 ( 2.887 -5.057 3.231) 6.659 9.629 ( 5.103 -5.880 -3.176) 8.408 9.844 ( 1.216 -5.755 -1.792) 6.148 9.973 ( 4.405 -5.187 -3.348) 7.584 10.134 ( -0.531 4.018 -3.101) 5.104 10.470 ( 2.337 3.849 -2.078) 4.960 10.502 ( -0.056 7.049 1.091) 7.133 10.711 ( 2.081 2.967 -1.449) 3.903 10.854 ( -1.886 6.374 1.740) 6.871 11.003 ( 5.532 1.049 -0.603) 5.663 11.096 ( -3.826 5.340 3.447) 7.419 11.275 ( 3.499 0.299 0.744) 3.589 11.491 ( -1.427 5.528 1.883) 6.012 11.667 ( -1.974 9.267 2.028) 9.689 11.750 ( 3.143 6.224 1.282) 7.089 11.877 ( 0.100 4.970 0.864) 5.045 12.230 ( -5.205 2.095 -0.515) 5.634 12.360 ( -2.339 3.566 -2.102) 4.754 12.698 ( 0.456 1.331 -0.609) 1.533 12.888 ( -2.907 4.949 0.647) 5.776 13.328 ( -0.505 7.038 -1.172) 7.153 16.065 ( 1.178 3.713 4.853) 6.223 16.181 ( -3.159 -1.020 -1.492) 3.640 16.379 ( -3.681 -2.604 -2.848) 5.333 16.559 ( 0.197 2.614 -3.109) 4.067 ======================= Grid point 164 (76/172) ======================= q-point: (-0.10 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( -13.681 -11.794 4.663) 18.655 2.836 ( -9.959 -18.609 2.425) 21.245 3.230 ( -2.208 -1.000 5.112) 5.658 3.392 ( 2.472 9.466 -0.292) 9.787 3.590 ( 1.354 8.510 8.398) 12.033 3.935 ( 1.110 2.737 10.211) 10.629 4.006 ( -1.915 5.186 4.228) 6.959 4.378 ( -4.833 -2.614 -2.237) 5.932 4.521 ( 10.789 -4.595 -1.372) 11.807 4.612 ( -5.665 -3.219 -10.051) 11.978 5.008 ( 2.279 4.926 -4.699) 7.178 5.376 ( 6.213 1.770 -7.108) 9.605 5.830 ( -2.913 4.276 4.126) 6.618 6.023 ( -8.924 -4.011 -1.343) 9.876 6.209 ( 3.043 0.916 4.186) 5.255 6.504 ( 2.478 2.569 -1.128) 3.743 6.767 ( 0.727 -1.619 -0.898) 1.989 6.841 ( 0.823 -5.202 -1.175) 5.396 7.065 ( -2.252 -1.392 -0.210) 2.655 7.189 ( -0.755 -3.525 -1.309) 3.835 7.796 ( 1.740 -2.162 4.751) 5.502 7.934 ( -5.402 -3.163 3.003) 6.943 8.392 ( 3.371 -4.113 1.147) 5.440 8.595 ( 0.539 -4.433 -3.333) 5.572 8.741 ( -0.661 -5.089 -0.671) 5.175 8.836 ( 2.622 1.269 -1.333) 3.203 9.101 ( 1.953 -4.274 1.556) 4.950 9.144 ( -2.147 -16.256 -2.365) 16.567 9.251 ( -1.651 -10.848 -1.208) 11.039 9.467 ( 0.459 0.930 -0.460) 1.135 9.821 ( 5.094 -7.246 -2.692) 9.257 9.920 ( -2.555 1.344 -0.444) 2.920 10.001 ( -2.103 4.305 -1.360) 4.981 10.071 ( 3.758 -4.806 -5.353) 8.117 10.313 ( 6.440 10.401 -2.350) 12.458 10.511 ( 4.581 1.186 1.333) 4.916 10.583 ( -3.107 6.768 1.739) 7.648 10.875 ( -1.493 -3.847 2.482) 4.816 10.976 ( 0.708 2.749 0.705) 2.924 11.046 ( 3.339 0.892 -1.385) 3.724 11.287 ( 1.805 3.263 0.831) 3.821 11.395 ( -1.835 2.462 0.026) 3.071 11.480 ( -2.385 9.412 1.294) 9.795 11.647 ( -0.278 7.000 0.725) 7.043 11.828 ( 2.184 3.187 4.065) 5.608 12.160 ( -5.208 -0.423 -0.587) 5.258 12.316 ( -0.206 0.475 -1.531) 1.616 12.676 ( 1.275 1.497 0.271) 1.985 12.816 ( -1.857 1.839 -0.787) 2.729 13.208 ( -1.157 5.201 -1.779) 5.617 16.018 ( -0.245 3.521 3.333) 4.855 16.169 ( -1.595 -0.888 -1.652) 2.462 16.395 ( -2.888 -3.052 -3.032) 5.182 16.526 ( 1.662 1.718 -1.408) 2.774 ======================= Grid point 171 (77/172) ======================= q-point: (-0.40 -0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -29.540 -0.000 3.185) 29.711 2.408 ( -30.778 -0.000 -3.614) 30.989 3.333 ( 2.611 0.000 0.172) 2.617 3.505 ( 7.543 0.000 16.433) 18.082 3.678 ( 10.822 0.000 0.388) 10.829 3.907 ( 13.204 0.000 6.385) 14.667 3.947 ( -30.944 -0.000 -4.661) 31.293 4.311 ( -8.634 -0.000 0.648) 8.658 4.802 ( 2.631 0.000 -6.013) 6.564 4.982 ( 2.586 0.000 -8.319) 8.712 5.028 ( -4.100 -0.000 -3.062) 5.117 5.498 ( 4.057 0.000 -9.087) 9.951 5.819 ( 6.719 0.000 7.398) 9.994 6.142 ( 3.966 0.000 5.843) 7.062 6.290 ( -1.143 -0.000 4.291) 4.441 6.321 ( 2.536 0.000 -3.012) 3.937 6.516 ( -1.985 -0.000 0.807) 2.143 6.642 ( 1.954 0.000 -1.531) 2.482 6.773 ( 0.603 0.000 -2.549) 2.619 7.054 ( -3.019 -0.000 -6.211) 6.906 7.551 ( 3.605 0.000 1.106) 3.771 7.674 ( -4.127 -0.000 3.131) 5.181 8.001 ( 3.267 0.000 1.379) 3.546 8.251 ( -1.638 -0.000 0.775) 1.812 8.317 ( 0.277 0.000 0.509) 0.580 8.326 ( 3.363 0.000 -0.158) 3.366 8.455 ( 1.081 0.000 4.035) 4.177 8.898 ( 3.751 0.000 -3.992) 5.478 9.173 ( 7.554 0.000 3.058) 8.150 9.221 ( -2.112 -0.000 -2.335) 3.148 9.598 ( -0.666 -0.000 -1.056) 1.248 9.718 ( -1.110 -0.000 -2.905) 3.110 9.793 ( 5.294 0.000 3.145) 6.157 10.157 ( 2.676 0.000 -2.911) 3.954 10.370 ( -0.878 -0.000 0.115) 0.885 10.601 ( 1.969 0.000 -4.637) 5.038 10.920 ( -1.690 -0.000 -4.788) 5.077 10.951 ( -4.335 -0.000 -1.224) 4.505 11.219 ( -0.087 -0.000 2.298) 2.300 11.250 ( 2.911 0.000 3.651) 4.669 11.395 ( -2.354 -0.000 4.933) 5.466 11.610 ( 1.859 0.000 3.844) 4.270 11.762 ( -4.678 -0.000 3.059) 5.589 12.013 ( 2.700 0.000 -2.613) 3.758 12.068 ( 0.489 0.000 -1.132) 1.233 12.297 ( -0.181 -0.000 -3.607) 3.612 12.653 ( -4.296 -0.000 -1.554) 4.569 12.667 ( 0.917 0.000 3.013) 3.149 13.373 ( -3.006 -0.000 -3.901) 4.925 13.383 ( 2.146 0.000 2.590) 3.364 16.060 ( 0.603 0.000 3.073) 3.132 16.277 ( -0.700 -0.000 4.035) 4.095 16.349 ( -3.798 -0.000 -4.034) 5.540 16.700 ( -1.100 -0.000 -5.248) 5.362 ======================= Grid point 172 (78/172) ======================= q-point: (-0.30 -0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -29.590 -7.077 5.176) 30.862 2.224 ( -32.250 -8.189 -0.433) 33.276 3.306 ( -3.278 2.496 -0.262) 4.128 3.488 ( -15.806 1.038 4.305) 16.415 3.735 ( 5.988 1.821 10.804) 12.486 3.842 ( -1.632 -6.609 0.677) 6.841 4.040 ( 3.642 -3.928 -2.791) 6.041 4.243 ( -5.918 1.557 4.816) 7.787 4.717 ( 3.978 7.729 -8.029) 11.834 4.902 ( -3.114 7.487 -0.248) 8.112 5.129 ( 5.747 -8.396 -7.196) 12.462 5.458 ( 3.507 4.675 -6.862) 9.014 5.898 ( 6.914 0.129 5.297) 8.710 6.150 ( 0.137 5.771 1.921) 6.083 6.261 ( 3.943 -1.796 0.824) 4.410 6.393 ( 0.133 -3.026 1.846) 3.547 6.551 ( -3.780 -5.502 0.656) 6.707 6.646 ( 0.521 -0.370 -2.320) 2.406 6.798 ( -0.015 -3.723 -2.883) 4.709 7.032 ( -3.017 -2.152 -4.145) 5.560 7.610 ( 5.115 -2.447 -0.031) 5.671 7.711 ( -5.044 -6.441 4.447) 9.312 8.057 ( 3.240 -3.277 1.334) 4.798 8.249 ( -0.722 -2.166 0.102) 2.286 8.360 ( 2.734 -5.020 -0.922) 5.790 8.434 ( 1.535 -6.912 0.429) 7.093 8.514 ( 2.782 -4.438 3.663) 6.392 8.930 ( 3.799 -1.296 -3.974) 5.648 9.208 ( -1.716 -1.212 -1.879) 2.819 9.264 ( 7.538 -2.083 2.915) 8.346 9.586 ( -0.339 0.418 -1.344) 1.448 9.719 ( -0.361 -1.957 -2.377) 3.100 9.862 ( 7.108 -1.282 2.300) 7.580 10.171 ( 2.546 0.045 -2.856) 3.826 10.389 ( -0.290 -2.722 0.349) 2.759 10.611 ( 0.409 -0.928 -2.935) 3.105 10.864 ( -0.442 3.707 -4.232) 5.644 10.919 ( -3.391 -0.761 -1.995) 4.007 11.190 ( -1.812 3.950 3.543) 5.607 11.255 ( 1.446 2.216 3.593) 4.462 11.355 ( 0.952 4.573 2.086) 5.116 11.621 ( 1.613 2.155 3.717) 4.589 11.747 ( -3.564 -1.343 4.062) 5.568 12.003 ( 2.226 2.678 -2.853) 4.502 12.024 ( 0.579 5.091 -1.226) 5.268 12.279 ( -0.749 0.689 -3.478) 3.623 12.560 ( -4.039 5.212 0.085) 6.594 12.700 ( -0.102 -1.176 1.820) 2.170 13.190 ( -3.551 10.947 -1.316) 11.583 13.459 ( -0.302 -1.504 -0.520) 1.620 16.084 ( -0.137 -1.283 2.529) 2.839 16.241 ( -1.466 3.336 3.253) 4.885 16.320 ( -5.111 -1.183 -2.842) 5.966 16.651 ( -1.822 2.240 -5.884) 6.554 ======================= Grid point 173 (79/172) ======================= q-point: (-0.20 -0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.119 ( -24.361 -17.307 7.873) 30.902 2.187 ( -27.886 -15.553 3.392) 32.110 3.232 ( -6.434 0.376 -0.335) 6.454 3.402 ( -16.887 -6.869 -0.973) 18.256 3.786 ( 6.060 2.856 11.750) 13.526 3.957 ( 0.959 -4.633 4.102) 6.262 4.094 ( -3.491 -3.308 -4.569) 6.634 4.204 ( 1.557 2.565 5.925) 6.642 4.608 ( 4.444 5.429 -8.231) 10.815 4.718 ( -2.520 10.632 1.339) 11.009 5.229 ( 4.652 2.452 -3.564) 6.352 5.410 ( 5.097 0.736 -6.240) 8.091 5.944 ( 5.050 1.736 3.532) 6.403 6.027 ( -1.292 6.221 -0.750) 6.398 6.281 ( -1.443 2.655 -2.695) 4.049 6.487 ( 2.125 -7.111 2.462) 7.819 6.618 ( -0.452 -4.393 -0.520) 4.447 6.674 ( -0.239 -2.971 -0.372) 3.004 6.883 ( -1.043 -7.028 -1.924) 7.361 7.053 ( -2.406 -3.605 -2.528) 5.017 7.700 ( 3.728 -3.228 0.923) 5.017 7.790 ( -4.973 -5.275 4.307) 8.433 8.185 ( 3.786 -7.828 1.371) 8.803 8.334 ( 0.688 -7.542 -1.839) 7.794 8.500 ( 3.285 -7.815 -0.587) 8.497 8.558 ( -1.467 -8.372 1.947) 8.720 8.679 ( 4.442 -9.668 -0.111) 10.640 8.969 ( 3.154 -1.080 -2.274) 4.035 9.208 ( -2.316 -0.967 -3.228) 4.089 9.382 ( 5.171 -4.399 3.782) 7.771 9.579 ( 0.306 -0.852 -1.799) 2.014 9.764 ( -0.134 -4.053 -1.459) 4.310 9.962 ( 9.123 -2.447 -0.548) 9.462 10.171 ( 1.373 1.231 -2.459) 3.073 10.456 ( 1.280 -4.102 0.574) 4.335 10.590 ( -2.874 2.880 -1.094) 4.214 10.777 ( 1.497 4.616 -1.697) 5.141 10.913 ( -0.721 0.969 -2.632) 2.896 11.095 ( -1.528 4.184 4.169) 6.101 11.207 ( 3.094 7.191 0.598) 7.851 11.310 ( 2.761 1.637 1.437) 3.516 11.572 ( -1.688 4.449 3.241) 5.757 11.756 ( -1.532 1.346 3.027) 3.650 11.908 ( 2.548 8.111 -0.591) 8.523 11.947 ( 0.713 4.268 -1.743) 4.665 12.233 ( -3.922 2.397 -1.349) 4.790 12.423 ( -3.541 6.382 -0.462) 7.314 12.714 ( 0.266 0.072 1.365) 1.392 12.973 ( -5.266 8.727 -1.540) 10.308 13.423 ( -0.984 4.609 -0.888) 4.796 16.102 ( -1.987 -1.276 1.155) 2.629 16.175 ( -2.056 3.935 3.186) 5.465 16.294 ( -5.240 -2.120 -3.354) 6.572 16.584 ( -0.870 1.904 -4.663) 5.111 ======================= Grid point 174 (80/172) ======================= q-point: (-0.10 -0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( -19.760 -19.957 5.999) 28.718 2.381 ( -15.347 -23.775 6.476) 29.030 3.201 ( -3.274 -0.985 0.982) 3.557 3.435 ( -7.381 -6.842 -3.302) 10.592 3.781 ( 3.272 5.887 11.962) 13.727 3.995 ( -2.811 0.939 2.918) 4.159 4.066 ( -6.015 1.227 0.605) 6.169 4.223 ( 0.385 -2.134 5.088) 5.531 4.527 ( -4.458 4.464 -4.830) 7.945 4.594 ( 8.285 2.586 -2.464) 9.022 5.135 ( 2.090 8.119 -3.581) 9.116 5.442 ( 6.863 0.982 -5.427) 8.805 5.900 ( -2.545 3.548 2.751) 5.160 5.954 ( -0.285 3.083 -2.804) 4.177 6.226 ( -0.818 0.364 -0.550) 1.050 6.580 ( 4.986 0.501 1.483) 5.226 6.727 ( 0.956 -4.511 -0.156) 4.614 6.736 ( 1.896 -6.637 -0.417) 6.915 6.980 ( -2.629 -5.535 -0.695) 6.167 7.100 ( -2.024 -4.658 -2.099) 5.495 7.760 ( -3.235 -2.588 3.827) 5.639 7.860 ( 1.458 -4.277 2.221) 5.035 8.345 ( 3.588 -5.878 1.580) 7.065 8.479 ( 0.467 -8.412 -3.103) 8.978 8.636 ( 1.063 -6.316 0.904) 6.469 8.757 ( 0.360 -14.416 -2.507) 14.637 8.869 ( 1.802 -8.737 -0.634) 8.944 9.029 ( 3.423 -5.187 2.132) 6.570 9.173 ( -2.449 1.337 -4.525) 5.316 9.463 ( -0.470 -1.074 1.895) 2.228 9.660 ( 1.188 -8.542 -1.848) 8.820 9.842 ( -1.905 -5.825 0.255) 6.134 10.055 ( 5.837 -0.412 -5.397) 7.960 10.129 ( 3.342 5.067 0.005) 6.070 10.464 ( -0.297 5.944 -2.843) 6.595 10.538 ( 2.004 -1.921 1.227) 3.035 10.737 ( 0.574 5.911 2.534) 6.457 10.821 ( -1.752 1.990 0.042) 2.652 11.069 ( 0.403 6.728 -0.136) 6.742 11.107 ( 5.476 2.498 1.742) 6.266 11.335 ( 3.869 -0.112 -1.108) 4.026 11.465 ( -3.346 6.617 2.552) 7.842 11.629 ( -3.172 9.660 -0.116) 10.168 11.783 ( 0.692 8.676 -2.208) 8.979 11.917 ( 2.631 2.478 4.063) 5.438 12.121 ( -7.508 2.826 0.908) 8.073 12.331 ( -0.036 2.144 -1.903) 2.867 12.712 ( 0.853 1.068 1.777) 2.242 12.833 ( -3.170 3.054 -1.630) 4.694 13.300 ( -1.937 7.213 -1.880) 7.701 16.085 ( -3.816 3.718 1.622) 5.569 16.123 ( -0.952 -1.841 0.747) 2.203 16.298 ( -4.072 -3.635 -3.433) 6.448 16.554 ( 1.068 0.912 -2.569) 2.928 ======================= Grid point 182 (81/172) ======================= q-point: (-0.30 -0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( -34.041 -0.000 7.804) 34.924 1.874 ( -35.304 -0.000 0.143) 35.305 3.101 ( -47.662 -0.000 -3.634) 47.800 3.379 ( -7.342 -0.000 4.111) 8.415 3.818 ( 4.163 0.000 -0.291) 4.173 3.835 ( 9.571 0.000 10.537) 14.235 4.013 ( -0.443 -0.000 -4.163) 4.187 4.292 ( 6.529 0.000 9.968) 11.915 4.855 ( 8.499 0.000 -8.735) 12.188 4.956 ( -3.118 -0.000 0.107) 3.120 5.056 ( 10.825 0.000 -5.157) 11.990 5.508 ( 3.375 0.000 -8.900) 9.519 5.951 ( 4.472 0.000 5.149) 6.820 6.255 ( 4.776 0.000 3.984) 6.220 6.314 ( 2.291 0.000 5.290) 5.765 6.316 ( -1.254 -0.000 -4.736) 4.899 6.451 ( -5.901 -0.000 -0.064) 5.901 6.650 ( -0.094 -0.000 -1.911) 1.914 6.751 ( -1.053 -0.000 -3.157) 3.328 6.977 ( -2.506 -0.000 -3.707) 4.474 7.620 ( -5.520 -0.000 5.663) 7.908 7.632 ( 6.611 0.000 -2.340) 7.013 8.057 ( 2.436 0.000 1.468) 2.844 8.227 ( -1.300 -0.000 -0.567) 1.419 8.345 ( 3.521 0.000 -0.507) 3.558 8.388 ( 4.136 0.000 -0.277) 4.145 8.507 ( 1.946 0.000 5.319) 5.664 8.933 ( 3.295 0.000 -4.427) 5.519 9.176 ( -1.278 -0.000 -3.347) 3.583 9.327 ( 8.679 0.000 4.394) 9.728 9.590 ( 1.012 0.000 -1.336) 1.676 9.688 ( -0.781 -0.000 -1.443) 1.640 9.926 ( 9.005 0.000 3.194) 9.554 10.187 ( 2.722 0.000 -2.634) 3.788 10.359 ( -0.651 -0.000 0.219) 0.687 10.590 ( -1.197 -0.000 -1.723) 2.098 10.867 ( -4.334 -0.000 -2.678) 5.095 10.885 ( 0.584 0.000 -4.069) 4.111 11.225 ( -0.608 -0.000 1.222) 1.365 11.277 ( -3.041 -0.000 7.678) 8.258 11.429 ( 4.176 0.000 -0.119) 4.178 11.676 ( 3.370 0.000 3.345) 4.748 11.697 ( -5.573 -0.000 4.410) 7.107 12.030 ( 1.191 0.000 -3.217) 3.431 12.074 ( 1.242 0.000 -1.311) 1.805 12.273 ( -0.355 -0.000 -4.052) 4.067 12.572 ( -5.146 -0.000 -0.512) 5.171 12.696 ( 0.342 0.000 4.478) 4.491 13.273 ( -6.086 -0.000 -5.832) 8.429 13.418 ( 0.833 0.000 1.854) 2.032 16.082 ( 0.055 0.000 2.539) 2.540 16.246 ( -6.082 -0.000 -3.867) 7.207 16.274 ( -2.662 -0.000 4.838) 5.522 16.635 ( -2.548 -0.000 -8.236) 8.621 ======================= Grid point 183 (82/172) ======================= q-point: (-0.20 -0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.664 ( -31.234 -12.386 10.932) 35.334 1.707 ( -33.916 -12.287 4.466) 36.348 2.807 ( -50.520 -15.062 -1.330) 52.735 3.308 ( -5.134 2.999 0.724) 5.989 3.841 ( -4.178 -3.802 -5.850) 8.132 3.922 ( 5.852 1.360 7.802) 9.847 4.049 ( 4.573 -1.815 6.097) 7.834 4.360 ( 11.474 3.692 7.599) 14.249 4.769 ( 6.723 10.198 -7.821) 14.504 4.881 ( 0.795 7.370 2.088) 7.701 5.228 ( 9.682 -6.377 -4.917) 12.593 5.469 ( 3.049 3.704 -6.194) 7.835 6.008 ( 2.857 -0.342 3.223) 4.320 6.150 ( -0.756 7.974 -3.129) 8.600 6.291 ( -2.776 1.519 -2.665) 4.137 6.397 ( 1.701 -4.426 5.136) 6.990 6.507 ( -1.657 -7.346 0.217) 7.533 6.637 ( 0.022 -0.804 -2.143) 2.289 6.778 ( -0.550 -4.292 -1.602) 4.614 6.974 ( -1.698 -2.415 -2.914) 4.148 7.636 ( -5.021 -4.344 4.860) 8.228 7.715 ( 6.163 -3.748 -1.751) 7.422 8.093 ( 0.321 -3.153 0.477) 3.205 8.266 ( 2.578 -4.209 -0.122) 4.937 8.394 ( 1.962 -4.394 -0.407) 4.830 8.476 ( 3.219 -4.407 1.302) 5.611 8.579 ( 3.009 -5.226 2.059) 6.373 8.957 ( 2.253 -1.513 -3.922) 4.770 9.171 ( -0.322 -1.028 -3.542) 3.702 9.403 ( 6.385 -0.108 4.848) 8.018 9.588 ( 1.723 1.126 -1.197) 2.381 9.707 ( 0.167 -2.313 0.358) 2.347 10.012 ( 9.789 -0.557 1.451) 9.912 10.191 ( 1.338 0.639 -2.413) 2.832 10.389 ( -0.203 -3.693 0.765) 3.776 10.583 ( -2.559 -0.420 0.093) 2.595 10.838 ( -1.926 1.517 -2.131) 3.248 10.886 ( 2.576 -2.133 -4.416) 5.540 11.163 ( -3.127 5.106 2.178) 6.371 11.279 ( -0.510 0.209 4.146) 4.182 11.414 ( 4.308 4.642 -0.069) 6.333 11.641 ( -1.687 3.634 3.952) 5.628 11.737 ( -0.459 -2.385 3.941) 4.630 11.999 ( -0.231 3.190 -3.038) 4.411 12.048 ( 2.996 3.985 -0.977) 5.080 12.238 ( -2.410 1.964 -3.150) 4.426 12.490 ( -4.630 4.465 0.485) 6.450 12.718 ( 0.254 -0.424 4.477) 4.504 13.083 ( -7.404 10.427 -5.554) 13.942 13.454 ( -0.100 -0.412 -0.169) 0.456 16.073 ( -2.762 0.839 0.574) 2.943 16.203 ( -5.311 -1.676 -3.245) 6.445 16.236 ( -3.611 2.960 4.191) 6.274 16.579 ( -2.145 0.577 -8.289) 8.582 ======================= Grid point 184 (83/172) ======================= q-point: (-0.10 -0.30 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -25.193 -21.825 7.948) 34.267 1.838 ( -21.314 -24.978 11.057) 34.648 2.852 ( -35.155 -28.660 0.777) 45.364 3.232 ( -3.722 0.719 -3.043) 4.861 3.856 ( -6.301 -4.377 -4.777) 9.038 3.926 ( 0.659 2.566 4.337) 5.082 4.113 ( 3.502 2.624 10.344) 11.232 4.382 ( 11.508 6.824 7.198) 15.193 4.616 ( 2.011 9.657 -4.105) 10.684 4.763 ( 5.877 8.565 1.007) 10.436 5.266 ( 2.049 5.747 -3.900) 7.242 5.480 ( 7.634 -1.249 -4.253) 8.828 5.947 ( -4.175 5.713 -2.092) 7.379 6.038 ( 0.294 4.711 -2.483) 5.334 6.236 ( -0.146 1.647 -1.651) 2.337 6.538 ( 1.917 -8.166 4.444) 9.492 6.625 ( 1.512 -7.190 -2.316) 7.704 6.674 ( 0.430 -3.175 -0.572) 3.254 6.867 ( -0.074 -5.761 0.665) 5.800 7.004 ( -1.752 -3.468 -2.917) 4.858 7.681 ( -5.682 -3.749 4.414) 8.113 7.824 ( 5.826 -3.757 -0.797) 6.977 8.205 ( -0.787 -10.136 -0.723) 10.193 8.373 ( 3.765 -4.672 0.078) 6.001 8.533 ( -0.047 -10.336 -0.430) 10.345 8.576 ( 3.515 -4.020 2.646) 5.960 8.730 ( 2.759 -9.168 -2.110) 9.804 8.995 ( 1.391 -2.288 -2.206) 3.470 9.174 ( 0.982 0.259 -3.088) 3.251 9.454 ( 0.630 -0.554 5.061) 5.130 9.587 ( 2.147 -1.003 -1.961) 3.076 9.751 ( -1.379 -2.896 1.922) 3.739 10.083 ( 4.303 0.471 -3.687) 5.686 10.200 ( 5.319 -0.595 0.996) 5.444 10.475 ( -0.020 -4.954 0.850) 5.026 10.531 ( -3.387 3.528 -0.617) 4.929 10.786 ( -0.374 1.750 0.550) 1.873 10.894 ( 0.368 4.434 -2.662) 5.185 11.114 ( 2.745 -0.570 1.357) 3.115 11.257 ( 2.030 5.255 1.431) 5.812 11.374 ( 4.433 2.558 -2.084) 5.527 11.552 ( -2.762 5.775 4.626) 7.898 11.730 ( -2.383 4.179 -0.102) 4.812 11.910 ( -0.854 6.097 -1.560) 6.351 11.999 ( 4.314 4.242 0.776) 6.100 12.139 ( -7.182 4.612 0.673) 8.562 12.380 ( -1.244 4.341 -0.773) 4.581 12.735 ( 0.448 0.398 4.580) 4.619 12.863 ( -5.535 5.486 -5.205) 9.371 13.397 ( -1.697 5.786 -1.254) 6.159 16.032 ( -5.851 -1.272 -2.129) 6.355 16.151 ( -5.524 2.395 1.810) 6.288 16.205 ( -1.976 -1.984 -1.119) 3.016 16.557 ( 0.878 -0.401 -4.958) 5.051 ======================= Grid point 193 (84/172) ======================= q-point: (-0.20 -0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( -35.155 -0.000 16.289) 38.746 1.317 ( -37.158 -0.000 7.509) 37.909 2.199 ( -62.397 -0.000 5.641) 62.651 3.299 ( -5.787 -0.000 -0.755) 5.836 3.714 ( -7.904 -0.000 -11.508) 13.961 4.038 ( 8.124 0.000 9.374) 12.405 4.089 ( 5.808 0.000 7.138) 9.202 4.515 ( 14.037 0.000 6.685) 15.548 4.886 ( 0.204 0.000 -3.409) 3.415 5.005 ( 8.764 0.000 -1.693) 8.926 5.209 ( 9.449 0.000 -4.503) 10.467 5.514 ( 4.001 0.000 -6.567) 7.690 6.016 ( 1.412 0.000 3.402) 3.683 6.200 ( -8.543 -0.000 -7.637) 11.459 6.255 ( -4.113 -0.000 0.685) 4.170 6.375 ( -3.130 -0.000 -0.681) 3.203 6.451 ( 7.520 0.000 4.834) 8.940 6.623 ( -1.352 -0.000 -1.818) 2.266 6.724 ( 0.016 0.000 -1.836) 1.836 6.934 ( -1.138 -0.000 -2.365) 2.625 7.567 ( -5.332 -0.000 6.084) 8.089 7.728 ( 7.672 0.000 -3.752) 8.540 8.086 ( 0.600 0.000 0.410) 0.727 8.206 ( -0.455 -0.000 -1.834) 1.889 8.419 ( 5.399 0.000 -0.175) 5.401 8.433 ( 0.437 0.000 1.934) 1.982 8.569 ( 2.669 0.000 3.379) 4.306 8.946 ( 1.442 0.000 -3.726) 3.996 9.151 ( 0.855 0.000 -4.089) 4.177 9.478 ( 6.906 0.000 4.008) 7.985 9.635 ( 5.551 0.000 2.147) 5.952 9.690 ( 0.964 0.000 2.242) 2.440 10.099 ( 10.754 0.000 1.472) 10.854 10.193 ( -0.742 -0.000 -2.536) 2.642 10.353 ( -0.448 -0.000 0.777) 0.897 10.555 ( -2.401 -0.000 1.312) 2.736 10.795 ( -2.426 -0.000 -4.008) 4.685 10.883 ( 0.994 0.000 -4.201) 4.317 11.209 ( -1.539 -0.000 -0.346) 1.577 11.268 ( -2.194 -0.000 5.629) 6.041 11.486 ( 2.288 0.000 -0.254) 2.302 11.658 ( -2.997 -0.000 7.736) 8.297 11.740 ( 2.694 0.000 2.223) 3.493 12.017 ( -0.029 -0.000 -2.890) 2.890 12.095 ( 1.964 0.000 -0.717) 2.091 12.235 ( -1.902 -0.000 -4.182) 4.594 12.492 ( -4.815 -0.000 0.694) 4.865 12.738 ( 1.557 0.000 7.293) 7.457 13.118 ( -8.303 -0.000 -9.696) 12.765 13.435 ( 0.657 0.000 0.437) 0.789 16.086 ( -0.843 -0.000 0.978) 1.291 16.124 ( -6.570 -0.000 -4.463) 7.942 16.251 ( -3.539 -0.000 4.657) 5.849 16.515 ( -5.540 -0.000 -13.953) 15.012 ======================= Grid point 194 (85/172) ======================= q-point: (-0.10 -0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -30.466 -17.542 12.774) 37.404 1.288 ( -27.734 -20.148 18.241) 38.831 2.001 ( -50.495 -28.577 12.215) 59.292 3.224 ( -4.273 2.056 -4.100) 6.269 3.668 ( -7.662 -4.940 -11.653) 14.795 4.048 ( 4.264 5.256 5.738) 8.873 4.188 ( 4.238 -1.323 10.115) 11.047 4.601 ( 12.695 5.079 6.340) 15.072 4.807 ( 2.394 8.242 -0.758) 8.616 4.962 ( 7.049 8.952 -1.056) 11.443 5.304 ( 2.714 -2.263 -6.867) 7.723 5.525 ( 7.685 0.894 -2.372) 8.092 6.005 ( -4.801 5.514 -2.884) 7.860 6.077 ( -2.702 1.903 -4.075) 5.247 6.220 ( -2.808 -2.347 0.385) 3.679 6.447 ( -1.739 -6.931 0.663) 7.176 6.510 ( 3.870 -2.193 0.209) 4.453 6.634 ( 0.823 -2.226 -0.400) 2.407 6.774 ( 0.130 -5.108 1.084) 5.223 6.942 ( -0.493 -2.183 -2.969) 3.718 7.581 ( -5.158 -3.875 5.179) 8.273 7.812 ( 7.518 -3.189 -3.391) 8.842 8.084 ( -0.681 -2.252 -0.883) 2.513 8.307 ( 2.545 -8.145 -1.223) 8.621 8.417 ( 0.370 -1.838 2.020) 2.756 8.535 ( 2.743 -5.711 0.524) 6.358 8.625 ( 2.120 -3.566 0.220) 4.155 8.963 ( 1.636 -1.612 -1.934) 3.002 9.167 ( 2.311 -1.475 -3.619) 4.541 9.503 ( 2.448 2.957 4.752) 6.109 9.631 ( 3.487 3.828 1.221) 5.320 9.737 ( 1.853 -0.319 4.359) 4.747 10.123 ( 0.623 2.847 -2.353) 3.746 10.217 ( 6.107 -2.355 1.062) 6.631 10.391 ( -0.033 -4.242 1.026) 4.364 10.546 ( -2.339 0.906 0.890) 2.661 10.789 ( -2.994 -0.047 -1.688) 3.438 10.910 ( 2.793 -3.819 -6.848) 8.323 11.144 ( 0.516 2.973 1.516) 3.377 11.294 ( 0.352 -0.917 2.181) 2.392 11.453 ( 0.134 3.717 -0.402) 3.741 11.649 ( 0.629 3.756 5.608) 6.779 11.759 ( 0.825 0.775 2.339) 2.598 11.981 ( -0.338 3.497 0.562) 3.558 12.097 ( 3.337 2.306 -1.759) 4.421 12.157 ( -6.036 4.070 -2.662) 7.751 12.432 ( -2.737 3.006 0.508) 4.097 12.777 ( 3.644 0.705 8.486) 9.262 12.899 ( -10.723 8.657 -9.635) 16.815 13.449 ( -0.314 1.299 -1.089) 1.724 15.984 ( -9.015 3.883 -3.405) 10.390 16.085 ( -5.343 -1.333 -3.479) 6.513 16.213 ( -2.926 1.634 3.763) 5.040 16.503 ( -0.427 -5.075 -10.015) 11.235 ======================= Grid point 204 (86/172) ======================= q-point: (-0.10 -0.10 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.848 ( -29.728 -0.000 23.390) 37.826 0.906 ( -31.940 -0.000 25.605) 40.936 1.355 ( -49.737 -0.000 34.758) 60.678 3.195 ( -4.372 -0.000 -6.187) 7.576 3.537 ( -4.591 -0.000 -14.512) 15.221 4.181 ( 2.969 0.000 9.599) 10.048 4.187 ( 1.403 0.000 5.088) 5.278 4.769 ( 11.784 0.000 5.591) 13.043 4.886 ( 0.960 0.000 1.615) 1.878 5.131 ( 7.835 0.000 -2.253) 8.153 5.240 ( 0.308 0.000 -8.516) 8.521 5.589 ( 7.012 0.000 -3.540) 7.855 6.026 ( -6.218 -0.000 -5.243) 8.134 6.039 ( -0.451 -0.000 -0.735) 0.862 6.182 ( -3.903 -0.000 5.048) 6.381 6.332 ( -1.307 -0.000 -2.554) 2.869 6.553 ( 3.049 0.000 1.738) 3.510 6.606 ( 0.234 0.000 -0.626) 0.668 6.742 ( 2.507 0.000 2.669) 3.662 6.903 ( -1.204 -0.000 -2.615) 2.879 7.522 ( -4.076 -0.000 5.142) 6.561 7.826 ( 7.022 0.000 -3.810) 7.989 8.085 ( -0.430 -0.000 -0.966) 1.057 8.197 ( 1.256 0.000 -2.913) 3.173 8.424 ( -3.515 -0.000 4.712) 5.879 8.474 ( 0.724 0.000 -1.040) 1.267 8.621 ( 2.081 0.000 1.500) 2.565 8.968 ( 3.514 0.000 1.531) 3.833 9.160 ( 3.132 0.000 -3.712) 4.857 9.562 ( 3.037 0.000 -2.944) 4.229 9.733 ( 0.783 0.000 5.550) 5.605 9.825 ( 13.019 0.000 5.943) 14.311 10.143 ( -3.030 -0.000 -1.289) 3.293 10.251 ( 7.342 0.000 -0.990) 7.408 10.362 ( 1.582 0.000 2.134) 2.656 10.536 ( -1.494 -0.000 1.324) 1.996 10.750 ( -0.210 -0.000 -4.274) 4.279 10.788 ( -10.812 -0.000 -8.164) 13.548 11.208 ( 1.860 0.000 2.355) 3.000 11.273 ( -0.741 -0.000 3.193) 3.278 11.491 ( -0.801 -0.000 0.117) 0.810 11.715 ( 5.649 0.000 8.579) 10.272 11.792 ( 2.439 0.000 1.950) 3.122 12.035 ( 3.906 0.000 1.685) 4.253 12.116 ( 0.875 0.000 -0.346) 0.941 12.136 ( -8.990 -0.000 -7.822) 11.917 12.436 ( -2.905 -0.000 1.185) 3.137 12.795 ( -8.689 -0.000 -8.738) 12.323 12.957 ( 5.002 0.000 5.751) 7.622 13.441 ( 0.115 0.000 -1.070) 1.076 15.931 ( -15.554 -0.000 -12.863) 20.184 16.065 ( -1.637 -0.000 -1.282) 2.080 16.217 ( -3.592 -0.000 3.562) 5.059 16.327 ( -5.310 -0.000 -7.870) 9.494 ======================= Grid point 205 (87/172) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( 2.433 0.000 32.415) 32.507 1.580 ( 3.844 0.000 34.864) 35.075 2.359 ( 6.549 0.000 36.722) 37.302 2.852 ( -4.154 -0.000 -3.386) 5.360 2.957 ( -1.677 -0.000 -25.335) 25.391 4.030 ( -5.712 -0.000 -16.819) 17.763 4.485 ( -6.311 -0.000 13.860) 15.229 4.888 ( -7.802 -0.000 0.701) 7.833 5.021 ( 3.251 0.000 4.649) 5.673 5.087 ( 8.352 0.000 -6.564) 10.623 5.187 ( 5.602 0.000 -2.451) 6.115 5.383 ( -0.831 -0.000 -11.038) 11.070 5.945 ( -6.887 -0.000 1.355) 7.019 6.061 ( 10.381 0.000 -0.565) 10.396 6.279 ( 0.465 0.000 0.701) 0.841 6.333 ( 1.330 0.000 1.533) 2.030 6.561 ( -3.289 -0.000 0.415) 3.315 6.604 ( 1.470 0.000 -1.413) 2.039 6.760 ( -2.031 -0.000 -2.323) 3.086 6.797 ( 0.270 0.000 -3.216) 3.227 7.601 ( -5.519 -0.000 4.944) 7.409 7.809 ( 6.266 0.000 -4.792) 7.888 8.036 ( 0.147 0.000 -1.189) 1.198 8.114 ( 1.593 0.000 -4.922) 5.173 8.501 ( -2.145 -0.000 3.629) 4.215 8.557 ( -1.343 -0.000 6.568) 6.704 8.695 ( -2.062 -0.000 5.005) 5.413 9.078 ( 2.078 0.000 -3.846) 4.371 9.202 ( 8.161 0.000 1.253) 8.256 9.359 ( -8.152 -0.000 -6.359) 10.338 9.738 ( -3.992 -0.000 1.658) 4.323 9.830 ( -5.838 -0.000 2.159) 6.224 10.172 ( 3.175 0.000 3.323) 4.596 10.360 ( -2.260 -0.000 0.910) 2.436 10.474 ( 6.702 0.000 -0.378) 6.712 10.514 ( -2.585 -0.000 0.514) 2.635 10.582 ( 0.265 0.000 -3.795) 3.804 10.634 ( 2.070 0.000 -5.457) 5.837 11.264 ( 0.194 0.000 0.864) 0.885 11.269 ( -4.792 -0.000 0.647) 4.835 11.574 ( 6.181 0.000 3.421) 7.064 11.686 ( -13.616 -0.000 -2.448) 13.835 11.860 ( -2.227 -0.000 1.288) 2.572 11.910 ( 9.952 0.000 -1.516) 10.067 12.128 ( 0.364 0.000 0.967) 1.033 12.170 ( 2.863 0.000 0.184) 2.868 12.439 ( -1.516 -0.000 1.702) 2.279 12.513 ( -1.792 -0.000 -1.109) 2.107 13.230 ( 5.851 0.000 1.037) 5.942 13.350 ( -2.847 -0.000 -3.916) 4.841 15.811 ( 7.386 0.000 1.657) 7.569 15.941 ( -3.775 -0.000 -4.199) 5.647 16.225 ( -5.027 -0.000 2.429) 5.583 16.340 ( 8.616 0.000 -2.820) 9.065 ======================= Grid point 206 (88/172) ======================= q-point: ( 0.10 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( 7.428 -7.791 28.828) 30.773 1.856 ( 8.955 -13.240 30.481) 34.417 2.562 ( 9.419 -3.995 0.925) 10.273 2.867 ( 3.192 -3.792 -8.447) 9.794 3.011 ( 4.678 -11.973 5.991) 14.182 3.940 ( -2.164 0.122 -16.208) 16.352 4.418 ( -12.871 3.710 11.334) 17.546 4.764 ( -11.754 4.169 2.487) 12.717 4.990 ( 3.112 7.643 2.590) 8.649 5.046 ( 3.051 6.974 1.380) 7.736 5.260 ( 7.207 -1.748 -6.387) 9.788 5.407 ( 1.018 -3.568 -9.185) 9.906 5.882 ( -4.799 1.132 -0.200) 4.935 6.096 ( 8.562 2.983 -2.694) 9.458 6.296 ( -0.827 -1.835 1.489) 2.504 6.377 ( 1.267 -3.469 1.470) 3.975 6.519 ( -5.242 2.101 -1.041) 5.743 6.609 ( 1.086 0.081 -2.484) 2.712 6.751 ( -2.662 -3.507 0.440) 4.425 6.863 ( 1.905 -5.954 -3.099) 6.978 7.606 ( -4.813 -3.958 4.175) 7.501 7.885 ( 5.322 -4.186 -4.373) 8.060 8.059 ( 0.421 -3.957 0.706) 4.041 8.177 ( 0.670 -6.628 -5.905) 8.902 8.530 ( -1.794 -4.323 3.672) 5.949 8.596 ( -3.535 -3.627 7.720) 9.233 8.708 ( -1.699 -2.413 2.771) 4.048 9.051 ( -4.583 0.320 -4.879) 6.701 9.265 ( 6.154 0.542 2.025) 6.502 9.302 ( -2.722 -1.055 -5.920) 6.601 9.708 ( -1.045 0.751 5.773) 5.914 9.780 ( -6.744 1.192 1.667) 7.049 10.144 ( -1.817 4.070 -0.093) 4.458 10.308 ( -0.902 2.968 -1.808) 3.590 10.460 ( 2.803 0.698 2.428) 3.773 10.547 ( -5.569 -3.660 1.263) 6.782 10.624 ( 5.477 -3.530 -2.714) 7.059 10.761 ( 5.306 -7.651 -7.545) 11.984 11.201 ( -3.560 3.474 1.568) 5.216 11.258 ( -0.342 1.633 1.017) 1.954 11.536 ( -2.550 4.539 3.898) 6.504 11.648 ( -3.376 -0.165 -0.544) 3.423 11.808 ( -1.378 3.695 1.367) 4.174 11.939 ( 7.845 4.655 -2.654) 9.501 12.117 ( 1.291 2.639 0.238) 2.948 12.186 ( 5.036 1.705 0.193) 5.320 12.425 ( 0.569 0.885 1.033) 1.475 12.482 ( -0.297 2.456 -0.609) 2.547 13.207 ( 1.770 5.860 1.904) 6.411 13.282 ( -2.774 3.510 -4.280) 6.192 15.887 ( 4.963 -0.905 -0.045) 5.045 15.921 ( 1.582 -1.187 -3.244) 3.800 16.211 ( -2.234 -1.951 2.209) 3.698 16.405 ( 6.540 -0.398 -4.761) 8.099 ======================= Grid point 207 (89/172) ======================= q-point: ( 0.20 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 8.902 -14.537 21.317) 27.294 2.277 ( 8.096 -17.765 24.678) 31.466 2.656 ( 6.599 -4.425 -13.387) 15.568 2.943 ( 4.387 -7.273 -19.603) 21.364 3.410 ( 13.954 -14.841 19.636) 28.294 3.934 ( 4.192 -3.241 -11.392) 12.565 4.240 ( -15.273 5.248 7.933) 17.993 4.613 ( -11.283 4.039 7.026) 13.892 4.850 ( 4.751 11.903 1.127) 12.866 4.939 ( -3.489 7.433 8.642) 11.920 5.277 ( 6.091 3.897 -7.594) 10.486 5.382 ( -0.269 4.439 -8.488) 9.583 5.839 ( -1.708 1.165 -0.401) 2.106 6.137 ( 4.373 -2.968 -6.663) 8.504 6.330 ( -6.111 -4.149 0.980) 7.451 6.404 ( -3.917 2.302 2.090) 5.000 6.495 ( 4.467 -4.612 0.051) 6.421 6.614 ( -1.192 -1.996 -2.760) 3.609 6.824 ( -0.699 -5.539 0.277) 5.590 6.988 ( 2.880 -6.940 -1.750) 7.715 7.676 ( -2.783 -6.084 3.948) 7.768 7.974 ( 2.879 -3.377 -3.284) 5.521 8.197 ( 0.870 -10.109 2.176) 10.377 8.296 ( -0.243 -8.481 -4.511) 9.609 8.620 ( -4.626 -6.395 2.014) 8.146 8.673 ( -2.147 -7.497 7.824) 11.047 8.770 ( -0.878 -4.690 0.414) 4.790 8.989 ( -6.169 -0.546 -5.253) 8.121 9.284 ( 0.841 0.490 -4.692) 4.792 9.306 ( 2.170 -0.375 0.671) 2.302 9.698 ( -3.746 2.388 1.902) 4.833 9.749 ( 0.509 -2.964 6.553) 7.210 10.068 ( -3.710 -0.007 -5.677) 6.781 10.251 ( 4.771 5.676 -0.748) 7.453 10.496 ( 0.807 -1.220 3.599) 3.885 10.546 ( -7.217 -1.284 1.828) 7.555 10.717 ( 2.293 -3.466 -3.947) 5.732 10.878 ( 5.222 -3.382 -5.838) 8.532 11.105 ( -3.011 5.178 1.688) 6.223 11.207 ( -0.899 4.129 0.737) 4.289 11.442 ( -1.647 6.681 4.316) 8.122 11.573 ( -5.146 2.717 -1.473) 6.003 11.731 ( 1.394 7.421 0.841) 7.597 11.883 ( 4.737 6.160 1.003) 7.835 12.060 ( 0.678 4.646 -1.203) 4.847 12.182 ( 6.580 3.993 2.258) 8.021 12.407 ( -0.116 3.040 -1.599) 3.436 12.460 ( 4.779 0.187 -0.748) 4.841 13.074 ( -5.256 7.451 0.304) 9.123 13.207 ( 1.941 3.756 -2.236) 4.783 15.901 ( -0.884 -1.353 -2.813) 3.244 15.994 ( 6.701 -2.004 0.142) 6.995 16.269 ( 1.294 -3.954 2.010) 4.621 16.426 ( 3.719 0.543 -5.185) 6.404 ======================= Grid point 208 (90/172) ======================= q-point: ( 0.30 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 8.648 -17.228 12.824) 23.153 2.674 ( 3.385 -14.793 12.310) 19.540 2.788 ( 6.010 -10.055 -5.320) 12.865 3.091 ( 7.447 -9.097 -8.875) 14.731 3.667 ( 1.117 -1.910 4.779) 5.266 3.999 ( 0.701 -2.414 -3.210) 4.077 4.168 ( -1.726 -4.887 3.082) 6.030 4.492 ( -6.774 4.886 11.134) 13.918 4.695 ( 4.552 11.367 3.331) 12.689 4.782 ( -1.588 9.148 6.177) 11.152 5.183 ( 3.876 9.766 -5.532) 11.874 5.250 ( 0.661 5.653 -12.742) 13.956 5.815 ( -4.337 -0.830 2.404) 5.028 6.121 ( -5.495 2.222 -4.417) 7.392 6.347 ( -2.415 -3.722 3.293) 5.525 6.450 ( 0.232 -5.061 -0.908) 5.147 6.587 ( 2.687 -2.117 0.482) 3.455 6.682 ( 0.944 -7.381 -2.830) 7.961 6.911 ( 0.302 -4.483 -0.369) 4.509 7.120 ( 2.414 -5.943 -0.922) 6.481 7.783 ( -0.309 -6.249 3.997) 7.425 8.028 ( -0.608 -2.378 -0.641) 2.537 8.374 ( 0.138 -8.244 0.592) 8.266 8.430 ( 0.047 -7.919 -0.659) 7.946 8.683 ( -3.644 -4.658 1.343) 6.065 8.800 ( -3.565 -1.157 -0.348) 3.764 8.868 ( -2.167 -12.958 -0.177) 13.139 8.997 ( -2.718 -7.477 -0.582) 7.977 9.230 ( -1.596 2.514 -3.367) 4.495 9.367 ( 2.341 -4.513 -1.911) 5.431 9.672 ( 3.770 1.230 2.237) 4.553 9.843 ( 1.065 -4.519 2.457) 5.253 10.065 ( -3.305 -4.569 -6.174) 8.362 10.172 ( 4.098 7.313 -0.605) 8.405 10.461 ( -2.694 5.984 4.470) 7.940 10.526 ( -5.084 -1.150 0.340) 5.223 10.740 ( 0.201 0.776 -3.677) 3.764 10.911 ( 2.287 2.302 -3.589) 4.838 10.986 ( -2.579 5.602 1.610) 6.374 11.136 ( 0.312 3.125 -0.267) 3.152 11.317 ( -2.126 6.125 3.806) 7.518 11.494 ( -0.361 4.697 -2.361) 5.269 11.577 ( -1.453 8.285 -0.199) 8.414 11.812 ( 2.532 6.979 5.672) 9.343 11.967 ( -1.669 5.120 -0.402) 5.400 12.186 ( 8.256 3.342 0.390) 8.915 12.353 ( 0.960 2.184 -0.427) 2.423 12.510 ( 6.482 -0.748 -1.844) 6.781 12.913 ( -6.653 5.234 0.426) 8.476 13.157 ( 1.609 3.145 -2.473) 4.312 15.918 ( -0.334 -1.837 -0.843) 2.049 16.078 ( 5.093 -2.284 -0.442) 5.599 16.356 ( 2.705 -3.257 1.909) 4.644 16.426 ( 1.755 0.147 -5.002) 5.303 ======================= Grid point 209 (91/172) ======================= q-point: ( 0.40 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( 4.724 -8.941 0.402) 10.120 2.895 ( 4.032 -11.174 4.540) 12.717 3.050 ( 4.308 -10.527 0.433) 11.382 3.301 ( 3.266 -9.952 8.667) 13.595 3.625 ( -7.375 0.470 5.648) 9.302 4.027 ( -2.332 -0.552 2.107) 3.191 4.237 ( -3.377 -1.964 -1.461) 4.171 4.393 ( -2.367 4.368 6.342) 8.056 4.524 ( 1.379 9.692 3.544) 10.412 4.704 ( 6.015 5.642 -2.711) 8.681 4.998 ( 1.636 11.554 -6.986) 13.601 5.175 ( 6.694 1.756 -9.369) 11.647 5.792 ( -5.181 -0.454 0.626) 5.239 6.056 ( -6.325 -1.374 -1.328) 6.607 6.403 ( 1.736 -0.141 8.060) 8.247 6.487 ( -2.226 -1.472 2.235) 3.481 6.669 ( 2.687 -4.735 -2.579) 6.024 6.800 ( 1.685 -4.832 -3.118) 5.993 6.977 ( 0.279 -3.376 -0.831) 3.488 7.207 ( 1.095 -2.479 -0.854) 2.841 7.894 ( 1.185 -4.364 3.907) 5.976 8.036 ( -4.168 -0.671 2.483) 4.898 8.473 ( -1.299 -3.668 0.449) 3.917 8.538 ( 1.656 -3.780 0.221) 4.132 8.716 ( 0.067 -0.455 -1.948) 2.001 8.778 ( -3.590 -1.766 -1.228) 4.186 9.007 ( -3.410 -4.559 -3.594) 6.733 9.170 ( 0.995 -9.242 -0.364) 9.303 9.258 ( -1.294 -11.171 -0.326) 11.251 9.473 ( 0.421 -6.812 -2.873) 7.405 9.704 ( 7.557 2.256 1.332) 7.998 9.874 ( 2.426 4.158 -2.360) 5.361 10.074 ( 0.245 0.252 -3.884) 3.899 10.132 ( -2.239 -2.285 -1.299) 3.453 10.316 ( 0.059 11.910 5.587) 13.155 10.460 ( -5.956 0.178 -2.686) 6.537 10.684 ( -0.004 4.583 1.438) 4.804 10.853 ( -2.582 0.622 -3.391) 4.307 10.937 ( -0.524 0.168 0.971) 1.117 11.071 ( 3.261 6.229 -1.191) 7.131 11.244 ( -4.004 0.486 1.283) 4.232 11.392 ( 3.121 5.977 -1.156) 6.841 11.476 ( -2.607 2.843 0.424) 3.881 11.731 ( 1.267 5.401 6.862) 8.824 11.876 ( -3.430 2.867 2.007) 4.900 12.174 ( 5.187 3.493 -3.746) 7.290 12.352 ( 3.015 0.901 1.162) 3.354 12.576 ( 6.857 -1.379 -1.414) 7.136 12.809 ( -5.634 1.279 1.352) 5.933 13.107 ( -0.355 2.384 -3.368) 4.142 15.951 ( -0.893 -2.466 0.873) 2.764 16.146 ( 4.351 -1.332 -0.198) 4.555 16.391 ( 0.784 1.287 -3.437) 3.753 16.449 ( 1.560 -2.471 -0.407) 2.950 ======================= Grid point 210 (92/172) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.796 ( -1.565 3.914 -0.759) 4.283 3.065 ( -1.258 6.725 1.125) 6.933 3.177 ( 3.277 -10.757 -0.266) 11.249 3.463 ( -3.147 -0.423 11.560) 11.988 3.681 ( -1.994 -10.357 12.993) 16.735 3.998 ( -1.726 1.430 1.889) 2.932 4.188 ( -4.206 1.527 3.307) 5.564 4.348 ( -4.981 -1.061 4.354) 6.700 4.456 ( -0.229 2.892 -3.108) 4.252 4.622 ( 3.719 5.035 -6.217) 8.822 4.824 ( 2.296 5.580 -8.102) 10.102 5.225 ( 7.937 -2.093 -7.067) 10.832 5.786 ( -1.119 -1.875 -0.388) 2.218 6.018 ( -4.567 0.780 -1.208) 4.788 6.366 ( -2.715 5.382 7.831) 9.883 6.567 ( 5.451 -3.983 5.733) 8.857 6.738 ( 1.131 -2.071 -3.531) 4.247 6.846 ( 2.001 -0.051 -2.083) 2.888 7.017 ( -0.772 -1.275 -1.993) 2.488 7.212 ( -0.457 1.717 -0.628) 1.884 7.938 ( -2.650 0.450 4.453) 5.202 8.023 ( -1.437 0.313 3.495) 3.792 8.491 ( -0.627 0.247 1.852) 1.971 8.579 ( 2.824 1.480 -1.620) 3.577 8.721 ( 0.874 -1.253 -3.291) 3.628 8.789 ( -0.458 -1.276 -0.994) 1.681 8.999 ( -1.257 -0.130 -4.176) 4.363 9.315 ( 0.855 -3.564 0.185) 3.670 9.394 ( -1.051 -1.209 -1.077) 1.930 9.488 ( 0.140 8.146 -1.981) 8.385 9.738 ( 4.954 -4.684 -2.413) 7.233 9.812 ( -1.506 0.190 -1.084) 1.865 10.023 ( -2.415 7.630 0.933) 8.057 10.130 ( -0.446 -1.156 -1.763) 2.155 10.210 ( 5.224 -0.982 -0.209) 5.319 10.474 ( -1.141 -3.124 -1.636) 3.706 10.615 ( 2.327 3.194 3.475) 5.262 10.844 ( -4.907 -3.142 -1.843) 6.111 10.950 ( 0.620 -1.877 -0.755) 2.116 11.022 ( 1.053 0.702 -1.546) 1.998 11.244 ( -3.575 -3.744 1.853) 5.498 11.339 ( 3.070 2.488 -1.532) 4.238 11.419 ( -1.210 2.244 0.166) 2.555 11.703 ( -0.674 0.389 5.843) 5.895 11.847 ( -4.471 -2.466 4.242) 6.638 12.144 ( 3.727 2.651 -3.711) 5.890 12.345 ( 1.139 2.216 0.498) 2.541 12.652 ( 5.535 -2.181 -2.098) 6.308 12.787 ( -2.454 -1.140 2.653) 3.789 13.062 ( -2.013 -0.033 -4.108) 4.575 15.987 ( -2.334 -2.597 1.061) 3.649 16.190 ( 3.895 0.198 0.926) 4.009 16.338 ( -1.670 2.868 -4.487) 5.581 16.493 ( 1.262 -1.169 -0.493) 1.790 ======================= Grid point 211 (93/172) ======================= q-point: (-0.40 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( -6.401 14.046 3.929) 15.928 2.807 ( -9.656 17.268 4.914) 20.386 3.219 ( -2.816 6.756 -4.966) 8.845 3.472 ( 0.557 -1.456 9.340) 9.469 3.842 ( -7.153 -0.950 -2.522) 7.644 3.967 ( 0.325 1.133 3.685) 3.869 4.165 ( -2.638 -0.453 6.653) 7.171 4.309 ( -1.605 -1.189 -1.426) 2.454 4.476 ( -4.585 -9.138 11.173) 15.145 4.608 ( 7.415 1.402 -0.641) 7.574 4.846 ( 1.535 -8.303 -7.896) 11.560 5.305 ( 4.644 -3.446 -8.660) 10.413 5.800 ( -1.295 -0.467 -2.483) 2.839 5.983 ( 1.339 1.272 2.769) 3.328 6.270 ( -2.395 4.599 5.857) 7.823 6.682 ( 7.560 -0.636 1.263) 7.691 6.740 ( 0.207 0.737 -4.033) 4.105 6.826 ( 2.254 3.681 -0.710) 4.375 6.982 ( -2.092 3.090 -3.015) 4.797 7.150 ( -1.735 4.086 0.663) 4.488 7.891 ( -5.178 2.412 5.819) 8.154 7.996 ( 1.399 3.874 1.383) 4.345 8.468 ( -0.592 3.130 0.493) 3.224 8.541 ( 3.235 4.471 -0.229) 5.523 8.723 ( 0.783 1.449 -0.214) 1.661 8.809 ( 3.429 1.098 -3.961) 5.353 8.977 ( -0.908 2.686 -3.686) 4.651 9.146 ( 1.876 12.986 0.016) 13.121 9.304 ( 2.044 13.107 1.650) 13.367 9.425 ( -1.656 -1.816 -1.893) 3.102 9.741 ( -3.393 3.482 -1.237) 5.017 9.878 ( -2.705 -4.747 -0.949) 5.545 9.970 ( 0.151 -1.411 -0.285) 1.448 10.094 ( 5.834 2.220 -0.172) 6.244 10.376 ( 5.545 -7.215 -0.222) 9.102 10.500 ( -1.504 -3.443 -0.677) 3.817 10.665 ( 3.837 -3.686 0.036) 5.321 10.855 ( -2.368 -2.099 -0.678) 3.236 10.992 ( 0.265 -0.427 0.026) 0.504 11.055 ( 0.268 -6.156 -0.416) 6.176 11.314 ( 0.039 -4.493 -0.568) 4.529 11.348 ( -2.017 -2.472 -1.424) 3.494 11.422 ( 0.239 -5.263 0.216) 5.273 11.726 ( -1.927 -2.591 4.625) 5.640 11.905 ( -5.602 -6.801 4.459) 9.875 12.120 ( 2.222 2.158 -2.138) 3.764 12.315 ( 0.494 1.435 0.363) 1.561 12.707 ( -1.021 -1.912 -3.976) 4.529 12.802 ( 2.806 -0.017 3.522) 4.503 13.077 ( -1.863 -5.091 -4.062) 6.774 16.000 ( -3.181 -1.147 -0.512) 3.420 16.190 ( -0.847 2.534 0.142) 2.675 16.264 ( -0.231 2.289 -1.508) 2.751 16.504 ( 0.619 0.349 -2.003) 2.125 ======================= Grid point 212 (94/172) ======================= q-point: (-0.30 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.254 ( -10.309 21.802 10.670) 26.372 2.392 ( -13.043 22.110 10.583) 27.767 3.040 ( -4.860 7.233 -9.767) 13.089 3.337 ( -9.773 17.628 11.618) 23.264 3.682 ( -10.999 8.043 -11.964) 18.133 3.883 ( 1.150 -0.851 -2.396) 2.791 4.336 ( 2.738 -9.008 12.247) 15.448 4.429 ( 3.589 -10.019 2.052) 10.838 4.610 ( 1.858 -3.129 11.240) 11.814 4.727 ( 2.464 -9.461 4.797) 10.890 5.023 ( 2.449 -10.623 -6.234) 12.558 5.360 ( -0.130 -4.624 -9.659) 10.710 5.787 ( 1.443 1.088 -0.621) 1.911 5.985 ( 1.756 1.198 1.403) 2.547 6.242 ( 2.243 -0.261 3.433) 4.110 6.633 ( 1.171 8.109 -6.198) 10.273 6.712 ( -0.066 2.804 -3.537) 4.515 6.779 ( 1.355 4.636 0.782) 4.893 6.898 ( 1.479 3.405 -2.665) 4.570 7.055 ( -2.835 5.473 1.694) 6.392 7.815 ( -4.671 3.524 5.544) 8.061 7.934 ( 2.710 5.041 -0.315) 5.733 8.348 ( -1.701 9.583 -0.814) 9.767 8.483 ( 2.204 5.411 0.359) 5.854 8.689 ( 2.720 7.275 0.582) 7.788 8.721 ( 1.720 5.692 0.232) 5.951 8.862 ( 2.841 7.305 -2.099) 8.114 9.062 ( 1.156 6.668 0.922) 6.830 9.153 ( 4.103 2.520 -1.278) 4.982 9.437 ( -2.070 -2.902 -2.323) 4.255 9.657 ( -0.278 4.169 1.424) 4.414 9.850 ( -3.008 2.153 3.003) 4.765 9.984 ( 2.423 -0.305 -3.718) 4.448 10.212 ( 2.751 -7.736 -1.279) 8.309 10.438 ( -0.316 -0.068 2.346) 2.368 10.564 ( 2.568 -0.391 0.385) 2.626 10.758 ( 1.767 -4.162 -3.058) 5.458 10.847 ( -0.746 1.372 0.809) 1.759 11.068 ( 0.750 -6.652 -1.175) 6.797 11.153 ( 2.582 -4.611 -1.834) 5.594 11.343 ( -1.046 -2.182 0.926) 2.590 11.460 ( 0.526 -9.363 -1.191) 9.453 11.548 ( -1.715 -8.249 0.011) 8.426 11.799 ( -1.821 -6.513 4.038) 7.877 11.989 ( -6.353 -6.493 3.915) 9.892 12.096 ( 0.362 0.883 -0.925) 1.329 12.321 ( 1.224 -1.111 0.181) 1.663 12.669 ( -6.488 0.265 -5.177) 8.305 12.864 ( 6.065 -1.269 4.148) 7.456 13.169 ( -1.556 -7.956 -4.139) 9.102 15.964 ( -2.695 2.315 -2.319) 4.243 16.102 ( -5.444 2.881 -1.595) 6.363 16.252 ( 0.510 0.695 2.639) 2.776 16.481 ( 0.341 1.756 -3.942) 4.329 ======================= Grid point 213 (95/172) ======================= q-point: (-0.20 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -11.672 21.154 18.405) 30.373 1.950 ( -11.903 21.762 20.476) 32.164 2.762 ( -11.178 19.308 6.774) 23.316 3.018 ( -5.630 8.897 2.120) 10.740 3.391 ( -10.906 9.671 -14.508) 20.566 3.978 ( 2.047 -6.780 -3.480) 7.891 4.466 ( -0.632 -1.769 10.133) 10.305 4.653 ( 5.914 -9.620 -1.574) 11.401 4.754 ( 3.003 -8.662 9.012) 12.856 4.900 ( -0.348 -6.899 5.432) 8.788 5.150 ( 3.292 -3.253 -5.612) 7.274 5.439 ( 0.786 -6.135 -8.437) 10.461 5.793 ( 2.863 -0.959 0.155) 3.023 5.991 ( 2.208 -0.273 -1.100) 2.482 6.292 ( 4.173 0.479 1.627) 4.505 6.472 ( -2.381 6.487 -2.762) 7.442 6.623 ( -2.379 4.058 -3.901) 6.111 6.686 ( -0.230 5.036 -0.815) 5.107 6.876 ( 4.046 2.432 -3.185) 5.694 6.927 ( -3.391 6.715 1.265) 7.628 7.735 ( -4.145 3.564 5.624) 7.843 7.871 ( 4.535 5.145 -2.623) 7.343 8.158 ( -0.314 9.774 -0.011) 9.779 8.370 ( -0.537 8.200 -3.985) 9.132 8.570 ( 3.167 6.723 3.372) 8.161 8.690 ( 0.692 3.752 3.275) 5.028 8.742 ( 1.341 6.621 1.237) 6.868 9.001 ( 4.422 1.882 -0.430) 4.825 9.161 ( 3.941 1.503 -2.740) 5.030 9.475 ( -3.251 -2.489 -3.132) 5.154 9.623 ( 2.730 -0.408 2.766) 3.908 9.843 ( -1.311 -1.462 4.821) 5.206 10.005 ( 2.703 -1.726 -3.870) 5.026 10.308 ( -2.049 -3.375 -1.989) 4.421 10.445 ( -0.400 -0.170 3.291) 3.319 10.551 ( 3.854 3.788 1.340) 5.567 10.756 ( -2.528 2.784 -1.693) 4.124 10.843 ( 1.195 0.911 -5.288) 5.498 11.133 ( 2.038 -2.406 0.069) 3.154 11.267 ( -0.043 -5.299 -2.149) 5.718 11.396 ( -0.577 -3.963 3.579) 5.371 11.622 ( 2.664 -8.159 -2.008) 8.814 11.676 ( -0.420 -7.875 1.849) 8.100 11.916 ( -5.231 -6.951 1.618) 8.849 12.034 ( -2.442 -2.783 2.974) 4.749 12.104 ( -0.744 -1.825 0.305) 1.994 12.364 ( 0.538 -2.904 -0.134) 2.957 12.594 ( -7.329 -0.051 -5.445) 9.130 12.961 ( 6.666 -3.027 5.399) 9.096 13.280 ( -1.709 -7.278 -4.319) 8.634 15.876 ( -2.434 4.310 -1.674) 5.225 16.024 ( -4.204 1.173 -1.402) 4.584 16.245 ( -2.127 0.354 2.764) 3.506 16.428 ( 0.819 3.430 -5.241) 6.317 ======================= Grid point 214 (96/172) ======================= q-point: (-0.10 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( -6.766 11.187 28.864) 31.687 1.629 ( -5.095 14.827 31.285) 34.993 2.402 ( -5.805 16.557 30.564) 35.242 2.905 ( -4.604 0.568 -8.033) 9.277 3.126 ( -6.754 7.359 -18.868) 21.349 4.068 ( -2.872 -4.880 -9.851) 11.363 4.482 ( -2.691 0.447 11.173) 11.502 4.832 ( 3.437 -7.204 -1.447) 8.112 4.952 ( 3.648 -8.422 3.083) 9.682 4.981 ( -0.988 -2.518 2.902) 3.967 5.184 ( 5.496 1.410 -4.062) 6.978 5.453 ( 0.393 2.082 -10.412) 10.626 5.896 ( 4.028 -6.378 0.799) 7.586 6.010 ( 0.945 -0.338 -1.364) 1.693 6.274 ( 1.765 2.207 1.273) 3.099 6.375 ( -1.938 4.107 1.632) 4.825 6.585 ( 0.854 -1.153 -2.806) 3.152 6.607 ( -1.641 2.922 -0.842) 3.455 6.799 ( -3.075 3.811 0.344) 4.908 6.847 ( 2.647 3.582 -4.157) 6.092 7.657 ( -5.284 2.965 6.187) 8.659 7.816 ( 6.558 4.693 -5.034) 9.506 8.049 ( 0.559 2.910 -0.490) 3.003 8.203 ( 0.186 8.190 -5.586) 9.916 8.520 ( 0.062 2.471 4.619) 5.239 8.599 ( -0.706 5.337 3.922) 6.661 8.704 ( -0.599 1.293 4.701) 4.912 9.041 ( 6.731 -0.684 -2.178) 7.108 9.159 ( 5.469 1.627 -1.119) 5.814 9.436 ( -6.210 0.199 -4.528) 7.688 9.707 ( -1.153 -5.267 1.159) 5.515 9.862 ( -2.986 -0.503 2.580) 3.978 10.089 ( 5.108 -4.439 0.638) 6.798 10.328 ( 1.109 -1.713 -1.355) 2.450 10.433 ( -0.211 1.469 2.812) 3.180 10.533 ( 2.080 1.523 0.452) 2.618 10.657 ( -5.577 3.716 -2.056) 7.010 10.750 ( 1.771 8.280 -6.826) 10.876 11.212 ( 1.132 -4.062 1.239) 4.395 11.300 ( -3.412 -1.273 -0.735) 3.715 11.483 ( 2.553 -4.043 3.587) 5.977 11.753 ( 0.095 -4.548 -3.378) 5.666 11.802 ( 1.487 -5.243 2.217) 5.883 11.893 ( -7.648 0.769 -1.287) 7.794 12.104 ( 0.510 -2.943 2.730) 4.046 12.132 ( 1.409 -1.413 0.264) 2.013 12.418 ( -0.676 -2.922 0.918) 3.136 12.537 ( -5.495 -0.770 -3.288) 6.449 13.108 ( 7.768 -5.344 4.183) 10.315 13.350 ( -2.038 -3.708 -4.090) 5.885 15.798 ( 0.987 3.033 0.790) 3.286 15.982 ( -3.683 -0.010 -2.592) 4.504 16.233 ( -2.417 -0.652 2.675) 3.664 16.354 ( 2.623 4.730 -4.049) 6.756 ======================= Grid point 216 (97/172) ======================= q-point: ( 0.10 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.815 ( 13.314 0.000 27.895) 30.909 1.903 ( 13.252 0.000 27.337) 30.380 2.620 ( 9.141 0.000 -9.985) 13.537 2.848 ( 7.117 0.000 -26.907) 27.833 3.017 ( 17.829 0.000 38.235) 42.188 3.874 ( 0.164 0.000 -18.854) 18.855 4.380 ( -15.581 -0.000 12.763) 20.141 4.680 ( -17.290 -0.000 0.624) 17.301 5.087 ( 1.344 0.000 4.768) 4.954 5.185 ( 7.613 0.000 -8.695) 11.557 5.259 ( 4.675 0.000 -1.750) 4.992 5.319 ( -0.097 -0.000 -9.184) 9.185 5.837 ( -7.252 -0.000 1.016) 7.323 6.194 ( 6.361 0.000 -4.198) 7.622 6.312 ( -4.930 -0.000 -1.922) 5.291 6.319 ( 4.568 0.000 3.055) 5.495 6.529 ( -0.777 -0.000 2.682) 2.792 6.612 ( 0.083 0.000 -1.394) 1.396 6.702 ( -3.077 -0.000 -1.420) 3.389 6.793 ( 1.019 0.000 -2.097) 2.332 7.541 ( -4.435 -0.000 2.864) 5.279 7.871 ( 3.949 0.000 -2.179) 4.510 8.030 ( -0.460 -0.000 -0.349) 0.578 8.112 ( 2.251 0.000 -6.481) 6.861 8.485 ( -2.182 -0.000 3.269) 3.931 8.557 ( -4.550 -0.000 8.783) 9.891 8.671 ( -3.543 -0.000 3.133) 4.729 8.987 ( -7.459 -0.000 -4.375) 8.648 9.247 ( -2.015 -0.000 -7.846) 8.101 9.334 ( 4.917 0.000 3.974) 6.323 9.726 ( -1.355 -0.000 6.933) 7.065 9.746 ( -4.486 -0.000 1.095) 4.618 10.182 ( -3.174 -0.000 0.164) 3.178 10.232 ( -11.571 -0.000 -1.835) 11.715 10.478 ( -1.306 -0.000 0.938) 1.608 10.539 ( 3.843 0.000 0.130) 3.845 10.647 ( 3.712 0.000 -2.884) 4.700 10.708 ( 11.580 0.000 -4.731) 12.509 11.204 ( -3.888 -0.000 1.210) 4.072 11.284 ( 0.905 0.000 3.272) 3.395 11.524 ( -5.698 -0.000 0.162) 5.700 11.664 ( -0.075 -0.000 3.204) 3.205 11.834 ( 0.350 0.000 2.096) 2.125 12.022 ( 4.489 0.000 -4.629) 6.448 12.163 ( 2.670 0.000 0.070) 2.671 12.242 ( 7.264 0.000 -1.463) 7.410 12.444 ( 1.789 0.000 2.397) 2.991 12.512 ( 1.337 0.000 0.182) 1.349 13.261 ( -4.982 -0.000 -5.147) 7.163 13.284 ( 1.123 0.000 1.065) 1.547 15.883 ( 0.089 0.000 -4.619) 4.620 15.971 ( 10.779 0.000 0.083) 10.779 16.165 ( -3.668 -0.000 1.475) 3.953 16.459 ( 8.452 0.000 -4.696) 9.669 ======================= Grid point 217 (98/172) ======================= q-point: ( 0.20 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( 14.307 -4.294 21.229) 25.957 2.191 ( 14.046 -10.181 22.085) 28.083 2.658 ( 9.113 -0.673 -10.133) 13.644 2.868 ( 12.225 -2.558 -21.968) 25.270 3.384 ( 19.898 -9.405 27.668) 35.354 3.874 ( 6.092 -3.339 -15.088) 16.611 4.235 ( -16.992 4.787 11.549) 21.095 4.544 ( -16.800 -0.443 2.716) 17.024 5.027 ( -1.259 5.840 3.866) 7.116 5.094 ( 2.116 10.614 -0.169) 10.825 5.312 ( 4.240 -2.603 -8.711) 10.031 5.372 ( -0.428 -2.238 -6.657) 7.036 5.794 ( -4.546 -1.629 -2.036) 5.241 6.174 ( 2.816 4.753 -5.885) 8.072 6.247 ( -4.409 -0.998 1.175) 4.671 6.402 ( -0.555 -1.008 2.300) 2.571 6.496 ( 2.836 1.639 1.841) 3.757 6.596 ( -0.841 0.109 -0.539) 1.005 6.733 ( 0.042 -4.974 -0.204) 4.978 6.873 ( 1.324 -7.167 -2.457) 7.691 7.562 ( -2.696 -4.856 2.387) 6.045 7.927 ( 1.665 -3.381 -1.323) 3.994 8.065 ( -0.501 -5.335 1.448) 5.551 8.163 ( 2.205 -5.479 -6.784) 8.995 8.507 ( -3.222 -3.421 2.544) 5.344 8.571 ( -5.562 -3.868 8.343) 10.748 8.685 ( -2.584 -3.720 2.117) 4.999 8.921 ( -5.926 0.059 -4.806) 7.631 9.226 ( -2.178 -2.036 -7.521) 8.090 9.355 ( 0.261 1.228 3.597) 3.810 9.701 ( -2.115 1.645 1.850) 3.256 9.748 ( -0.116 -0.737 6.028) 6.074 10.051 ( -6.461 4.027 -4.159) 8.675 10.238 ( -6.911 -4.640 0.464) 8.337 10.489 ( -2.282 -1.778 2.052) 3.547 10.564 ( 5.565 2.042 0.010) 5.928 10.656 ( 3.373 -0.977 -4.326) 5.572 10.838 ( 6.961 -4.569 -3.123) 8.893 11.154 ( -2.983 2.713 1.142) 4.191 11.274 ( -0.416 2.993 3.246) 4.434 11.495 ( -0.631 0.750 1.191) 1.542 11.608 ( -3.854 4.854 1.719) 6.433 11.835 ( 1.642 2.514 3.422) 4.553 11.993 ( 1.197 4.022 -3.658) 5.567 12.142 ( 0.685 3.796 -0.818) 3.943 12.285 ( 7.161 1.334 -1.048) 7.359 12.474 ( 5.481 1.859 0.427) 5.803 12.506 ( 3.320 1.409 1.327) 3.843 13.150 ( -5.597 6.047 -3.458) 8.936 13.271 ( 1.212 2.445 -0.316) 2.747 15.883 ( 2.106 -0.255 -3.291) 3.915 16.037 ( 7.306 0.684 -0.224) 7.342 16.200 ( 0.451 -4.932 0.999) 5.052 16.486 ( 6.678 2.258 -4.774) 8.514 ======================= Grid point 218 (99/172) ======================= q-point: ( 0.30 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( 13.396 -10.926 13.552) 21.966 2.525 ( 10.575 -11.148 10.411) 18.560 2.746 ( 10.556 -2.794 -1.481) 11.019 3.020 ( 16.051 -6.949 -10.180) 20.238 3.654 ( 3.712 -3.253 5.174) 7.151 3.924 ( -2.959 -0.865 -7.726) 8.318 4.138 ( -1.375 -1.461 10.820) 11.004 4.482 ( -7.120 -2.656 7.328) 10.557 4.905 ( -0.906 7.624 0.261) 7.682 4.937 ( -0.413 9.652 8.434) 12.825 5.285 ( -3.669 4.743 -5.938) 8.439 5.312 ( 1.293 3.940 -9.042) 9.948 5.801 ( -0.763 -0.503 -4.093) 4.194 6.096 ( -3.884 1.633 -7.376) 8.494 6.258 ( -1.823 -2.104 2.471) 3.722 6.381 ( -1.107 -2.522 2.112) 3.470 6.562 ( -0.563 -2.801 -1.325) 3.150 6.624 ( 5.933 -2.209 3.482) 7.225 6.833 ( 1.568 -5.585 -1.568) 6.009 7.009 ( 1.020 -7.918 -1.632) 8.148 7.665 ( -0.514 -7.484 1.957) 7.753 7.978 ( -1.728 -2.567 0.788) 3.193 8.214 ( -0.364 -10.715 1.559) 10.834 8.280 ( 1.805 -7.953 -4.247) 9.195 8.555 ( -4.469 -5.581 1.797) 7.372 8.658 ( -4.076 -8.249 4.133) 10.087 8.757 ( -1.539 -4.862 2.122) 5.524 8.869 ( -5.142 -1.557 -4.308) 6.886 9.223 ( -2.698 -0.998 -6.896) 7.472 9.340 ( -0.119 -0.072 1.968) 1.973 9.684 ( -0.261 -1.193 0.900) 1.517 9.795 ( 1.039 -2.095 5.091) 5.602 9.967 ( -4.074 -0.910 -5.755) 7.110 10.248 ( -5.374 -1.490 0.640) 5.613 10.482 ( -2.357 2.506 2.678) 4.360 10.559 ( 5.189 2.652 1.081) 5.927 10.688 ( -1.181 -2.651 -7.024) 7.600 10.929 ( 2.983 -1.551 -0.604) 3.416 11.083 ( -0.760 4.061 0.238) 4.138 11.188 ( -2.718 5.721 1.935) 6.623 11.441 ( -1.437 7.104 4.048) 8.302 11.520 ( 0.255 2.098 -0.494) 2.171 11.753 ( 1.181 9.216 -0.935) 9.339 11.920 ( -1.709 3.407 2.911) 4.797 12.049 ( -1.181 6.024 -1.128) 6.241 12.312 ( 7.519 2.358 -0.678) 7.909 12.432 ( 3.381 4.810 -0.025) 5.879 12.556 ( 7.718 0.094 0.973) 7.779 12.974 ( -5.905 7.579 -1.571) 9.735 13.228 ( 2.254 3.746 -1.754) 4.710 15.902 ( 2.564 -0.466 -1.265) 2.897 16.085 ( 4.563 -1.243 -0.424) 4.749 16.308 ( 2.822 -5.006 0.960) 5.826 16.472 ( 5.031 3.018 -4.481) 7.383 ======================= Grid point 219 (100/172) ======================= q-point: ( 0.40 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.658 ( 12.527 -12.773 6.967) 19.199 2.783 ( 8.479 -8.859 -1.106) 12.312 2.922 ( 9.405 -7.753 7.507) 14.315 3.254 ( 13.010 -6.101 3.397) 14.766 3.596 ( -10.051 3.023 1.606) 10.618 3.931 ( -6.406 -5.152 -1.118) 8.296 4.176 ( -2.626 -1.816 1.759) 3.646 4.487 ( -0.047 4.223 4.334) 6.051 4.742 ( -2.335 12.187 4.947) 13.358 4.827 ( 2.862 5.800 -0.120) 6.469 5.125 ( -4.036 6.434 -5.717) 9.506 5.251 ( 4.748 3.336 -6.532) 8.738 5.771 ( -0.795 1.051 -1.144) 1.745 6.012 ( -3.436 1.541 -3.563) 5.184 6.339 ( -0.182 -7.266 1.500) 7.422 6.467 ( 0.233 -3.049 4.909) 5.784 6.581 ( -0.615 -3.719 -5.368) 6.559 6.746 ( 5.478 -4.143 2.634) 7.356 6.925 ( 1.914 -3.943 -2.088) 4.855 7.136 ( 0.437 -6.198 -0.970) 6.288 7.805 ( 1.019 -7.475 1.809) 7.758 7.991 ( -5.133 -1.467 3.877) 6.597 8.371 ( -0.427 -7.185 -0.396) 7.209 8.441 ( 1.493 -8.819 -0.267) 8.948 8.642 ( -1.827 -6.680 0.403) 6.936 8.752 ( -1.628 0.264 -2.114) 2.681 8.806 ( -4.102 -10.026 -1.330) 10.914 8.969 ( -2.300 -13.167 2.790) 13.655 9.178 ( -0.980 0.986 -5.382) 5.558 9.383 ( 0.269 -3.617 -0.686) 3.691 9.746 ( 3.287 -3.568 0.170) 4.855 9.847 ( -0.801 -3.169 -0.404) 3.293 9.987 ( -2.754 -5.578 -3.572) 7.173 10.195 ( -2.005 4.420 -0.805) 4.920 10.388 ( -3.635 4.694 2.229) 6.341 10.541 ( 2.660 5.814 0.474) 6.411 10.684 ( -3.542 -1.548 -4.543) 5.965 10.894 ( -2.698 6.820 0.525) 7.353 10.989 ( 0.602 4.314 1.647) 4.656 11.133 ( -0.214 -0.447 -1.175) 1.275 11.303 ( -2.009 8.362 4.062) 9.511 11.482 ( 0.758 3.286 -1.353) 3.633 11.581 ( 1.876 9.958 -0.895) 10.173 11.856 ( -1.455 4.389 5.840) 7.449 11.926 ( -2.520 6.145 0.557) 6.664 12.285 ( 4.528 5.179 -3.722) 7.821 12.410 ( 4.429 1.964 0.198) 4.849 12.623 ( 8.238 -0.130 2.328) 8.562 12.816 ( -5.241 4.779 -0.713) 7.128 13.166 ( 1.909 4.717 -2.730) 5.774 15.928 ( 1.629 -0.642 0.765) 1.911 16.148 ( 3.810 -2.203 -0.163) 4.404 16.405 ( 2.398 -3.465 0.578) 4.254 16.440 ( 3.256 3.028 -4.639) 6.426 ======================= Grid point 220 (101/172) ======================= q-point: ( 0.50 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.867 ( 8.977 0.431 -2.232) 9.260 3.024 ( 7.662 -11.488 5.379) 14.819 3.136 ( 6.087 -2.911 1.070) 6.832 3.388 ( -0.096 -4.113 11.045) 11.786 3.566 ( -3.927 -5.615 8.552) 10.958 3.965 ( -6.596 -4.268 3.174) 8.473 4.168 ( -4.140 -0.182 -0.152) 4.147 4.371 ( -4.000 7.116 5.226) 9.693 4.550 ( 0.377 8.543 -1.803) 8.739 4.692 ( -5.076 7.148 -5.157) 10.171 4.968 ( 1.492 8.838 -7.351) 11.592 5.244 ( 5.174 0.352 -7.455) 9.081 5.766 ( 0.822 -0.466 0.425) 1.036 5.995 ( 0.903 -0.772 -0.644) 1.352 6.445 ( -3.044 2.445 7.204) 8.194 6.506 ( 3.291 -7.125 3.417) 8.559 6.665 ( 0.955 -5.710 -6.806) 8.936 6.841 ( 3.411 -2.173 0.559) 4.083 6.988 ( 1.912 -2.217 -1.681) 3.376 7.207 ( -0.324 -2.054 -0.860) 2.250 7.906 ( -3.227 -2.514 3.969) 5.700 8.000 ( -1.281 -2.988 3.532) 4.800 8.456 ( -1.683 -3.545 1.468) 4.190 8.568 ( 2.584 -4.946 -2.002) 5.929 8.707 ( 0.063 -0.193 -2.297) 2.306 8.737 ( -0.936 -2.835 -1.197) 3.217 8.955 ( -1.108 -6.645 -0.588) 6.762 9.176 ( 1.609 -8.023 -2.603) 8.587 9.252 ( 0.401 -13.558 0.527) 13.574 9.439 ( -2.797 -4.623 -2.423) 5.922 9.791 ( 1.823 1.932 -2.677) 3.771 9.887 ( 1.895 1.996 -0.496) 2.796 10.051 ( -2.431 -4.293 -1.955) 5.306 10.095 ( 0.337 2.012 -2.255) 3.041 10.315 ( -4.159 9.243 0.232) 10.138 10.386 ( -0.811 1.148 -0.440) 1.473 10.681 ( -1.303 -0.319 1.737) 2.195 10.779 ( -3.917 1.794 -2.351) 4.908 10.954 ( 0.775 2.296 2.940) 3.810 11.095 ( -0.074 6.002 -0.522) 6.025 11.196 ( -1.463 0.763 0.663) 1.778 11.413 ( -0.821 4.071 -0.670) 4.206 11.476 ( 3.053 4.756 0.048) 5.651 11.777 ( 0.352 5.899 4.569) 7.470 11.826 ( -4.744 2.333 4.852) 7.175 12.225 ( 3.781 4.002 -4.140) 6.888 12.397 ( 1.685 2.470 -1.426) 3.313 12.675 ( 3.960 1.508 -0.981) 4.349 12.761 ( 0.421 -1.714 2.603) 3.145 13.086 ( 0.662 4.584 -2.901) 5.465 15.951 ( -0.066 -0.785 2.036) 2.183 16.213 ( 3.527 -1.639 0.548) 3.928 16.380 ( 1.370 4.089 -5.304) 6.836 16.472 ( 1.137 -2.188 -0.018) 2.466 ======================= Grid point 221 (102/172) ======================= q-point: (-0.40 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.822 ( 3.879 10.098 0.804) 10.847 3.034 ( -1.387 13.005 1.385) 13.152 3.229 ( 2.372 -3.503 -2.877) 5.117 3.507 ( 0.755 -1.289 12.518) 12.607 3.698 ( -5.601 -8.612 10.167) 14.454 3.975 ( -3.905 -1.572 6.039) 7.361 4.148 ( -1.084 -0.557 2.716) 2.977 4.297 ( -3.811 -0.323 1.014) 3.957 4.398 ( -6.475 5.811 0.883) 8.745 4.592 ( 0.030 -3.425 -5.903) 6.824 4.833 ( 2.931 5.819 -6.524) 9.220 5.260 ( 2.274 -1.489 -11.718) 12.029 5.797 ( 3.751 -0.908 -0.493) 3.891 6.023 ( 2.825 0.148 3.615) 4.590 6.358 ( -3.990 5.733 9.124) 11.491 6.659 ( 1.610 -5.611 -1.963) 6.159 6.729 ( 2.334 -2.521 -3.931) 5.220 6.882 ( 2.992 0.460 -0.774) 3.124 7.008 ( 1.320 1.046 -1.620) 2.337 7.196 ( -1.281 2.246 -0.288) 2.601 7.888 ( -5.946 0.632 6.923) 9.148 8.051 ( 2.351 -0.082 0.231) 2.364 8.483 ( -1.486 -0.815 1.426) 2.215 8.615 ( 2.149 1.617 -1.038) 2.882 8.724 ( 1.202 -1.735 -2.018) 2.920 8.783 ( 1.054 -3.794 -2.077) 4.452 8.997 ( 3.574 0.667 -1.917) 4.110 9.323 ( -0.498 -1.747 -0.402) 1.861 9.372 ( -0.262 -2.248 -0.472) 2.312 9.478 ( -0.027 3.110 -1.706) 3.547 9.731 ( -4.107 2.620 -2.340) 5.404 9.811 ( 1.865 1.321 -0.765) 2.410 9.995 ( -1.666 7.270 1.022) 7.528 10.117 ( 0.280 -3.764 -1.444) 4.041 10.253 ( 1.035 -7.868 -3.244) 8.573 10.457 ( -0.183 -4.080 -0.618) 4.131 10.675 ( 2.082 1.247 1.666) 2.944 10.754 ( -3.901 -3.315 0.572) 5.151 10.938 ( -1.954 -1.922 1.101) 2.953 11.035 ( 1.611 1.331 -2.294) 3.104 11.209 ( -1.369 -2.909 0.762) 3.304 11.347 ( -1.492 1.795 -1.423) 2.734 11.439 ( 3.286 2.885 1.685) 4.687 11.711 ( -2.173 1.794 4.323) 5.161 11.804 ( -3.747 -1.902 5.559) 6.968 12.182 ( 2.928 3.188 -3.781) 5.748 12.354 ( 0.432 2.494 -0.785) 2.650 12.659 ( -1.899 -0.290 -5.682) 5.998 12.836 ( 4.914 -1.720 4.376) 6.801 13.025 ( 0.223 1.437 -2.233) 2.664 15.964 ( -1.425 -0.753 2.065) 2.619 16.241 ( 0.861 2.112 -1.401) 2.676 16.303 ( 1.515 3.117 -2.472) 4.257 16.500 ( 0.197 -0.658 -1.286) 1.458 ======================= Grid point 222 (103/172) ======================= q-point: (-0.30 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.588 ( -1.850 19.226 5.693) 20.136 2.733 ( -1.881 21.230 7.180) 22.490 3.129 ( -4.357 8.954 -7.854) 12.682 3.514 ( -3.288 5.815 6.399) 9.251 3.693 ( -7.757 2.764 -0.375) 8.243 3.946 ( -1.607 8.177 -1.377) 8.447 4.204 ( -1.162 -8.893 9.602) 13.139 4.299 ( 0.854 -7.597 3.196) 8.286 4.481 ( -3.438 -11.342 12.191) 17.002 4.679 ( 2.700 -2.363 -2.474) 4.358 4.842 ( 3.013 -8.745 -6.784) 11.471 5.260 ( -0.291 -2.387 -14.028) 14.233 5.843 ( 6.275 1.027 1.521) 6.538 6.043 ( 1.910 1.449 6.169) 6.618 6.277 ( -1.213 2.540 6.943) 7.492 6.684 ( -2.305 0.034 -6.456) 6.856 6.754 ( 0.794 1.851 -3.966) 4.448 6.854 ( 1.425 4.297 -4.647) 6.488 6.981 ( 3.714 3.317 1.141) 5.109 7.121 ( -2.477 4.517 0.890) 5.228 7.842 ( -4.880 2.115 7.160) 8.920 8.034 ( 2.954 3.739 -1.491) 4.993 8.455 ( -0.657 3.954 0.297) 4.019 8.577 ( 0.516 3.796 0.295) 3.842 8.734 ( 0.275 0.577 1.215) 1.372 8.857 ( 5.147 -0.752 -4.092) 6.618 8.975 ( 2.393 6.309 -1.519) 6.917 9.193 ( 3.536 8.302 -0.082) 9.024 9.326 ( -0.202 12.153 0.312) 12.158 9.399 ( -0.017 1.531 -0.921) 1.787 9.636 ( -9.181 -1.994 2.539) 9.732 9.831 ( -1.489 -1.035 -3.700) 4.121 10.000 ( 3.180 -1.380 0.136) 3.470 10.165 ( 3.995 -1.234 -1.831) 4.565 10.383 ( -4.181 -6.152 1.706) 7.631 10.523 ( 3.657 -5.003 -0.896) 6.261 10.711 ( 1.391 -2.525 0.283) 2.896 10.823 ( 0.331 -5.278 -0.155) 5.291 10.991 ( -1.004 -1.916 -0.993) 2.380 11.046 ( 0.195 -5.754 -2.605) 6.319 11.292 ( -1.910 -7.187 0.396) 7.447 11.317 ( -0.440 -0.901 -2.042) 2.275 11.467 ( 3.440 -2.561 3.935) 5.821 11.707 ( -4.075 -2.733 4.215) 6.469 11.855 ( -3.050 -5.125 4.466) 7.451 12.132 ( 0.826 3.114 -3.399) 4.683 12.333 ( 1.780 0.697 -0.101) 1.914 12.612 ( -5.496 0.415 -7.032) 8.935 12.909 ( 5.561 -0.857 3.642) 6.703 13.043 ( -0.028 -3.918 -1.892) 4.351 15.964 ( -1.542 0.002 0.912) 1.792 16.140 ( -2.496 5.732 -3.800) 7.316 16.294 ( 2.341 1.693 1.751) 3.379 16.492 ( -0.212 0.712 -2.983) 3.074 ======================= Grid point 223 (104/172) ======================= q-point: (-0.20 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.199 ( -5.016 24.215 12.502) 27.709 2.359 ( -0.141 24.302 16.568) 29.413 2.902 ( -4.173 9.677 -12.624) 16.445 3.280 ( -4.536 15.745 0.888) 16.409 3.474 ( -7.562 13.325 -0.288) 15.324 3.903 ( 2.804 -2.397 -2.087) 4.238 4.376 ( -4.416 -7.982 6.619) 11.270 4.507 ( 2.454 -11.563 5.796) 13.166 4.645 ( -4.058 -6.389 8.326) 11.252 4.766 ( -0.297 -9.236 3.624) 9.926 5.055 ( 5.684 -10.606 -5.875) 13.391 5.296 ( 2.172 -6.111 -11.648) 13.332 5.841 ( 1.195 3.160 5.174) 6.180 6.054 ( 5.984 1.956 1.815) 6.552 6.305 ( 2.285 -2.444 4.773) 5.829 6.585 ( -2.178 7.746 -5.922) 9.991 6.653 ( -3.885 4.896 -5.763) 8.501 6.755 ( -1.011 4.781 -6.370) 8.028 6.960 ( 3.119 3.836 1.638) 5.208 7.014 ( -1.606 5.854 0.512) 6.092 7.780 ( -3.711 3.363 6.566) 8.258 7.981 ( 4.007 4.546 -2.887) 6.712 8.336 ( 0.207 9.521 0.769) 9.555 8.483 ( -1.223 6.702 -1.230) 6.923 8.723 ( -0.097 2.177 3.818) 4.396 8.778 ( 4.042 10.991 1.870) 11.859 8.886 ( 1.725 5.599 -3.127) 6.641 9.089 ( 0.878 6.570 -0.361) 6.638 9.206 ( 3.607 2.143 -1.451) 4.439 9.385 ( -2.581 -1.790 -2.297) 3.891 9.654 ( -2.031 -2.994 4.064) 5.441 9.796 ( -3.852 1.132 1.621) 4.330 10.026 ( 4.749 0.332 -2.140) 5.219 10.207 ( -0.627 -2.062 -4.834) 5.293 10.441 ( -1.962 -3.555 5.457) 6.802 10.621 ( 3.329 -1.109 1.216) 3.713 10.759 ( -1.109 -1.197 -0.420) 1.684 10.843 ( 2.530 1.380 -5.610) 6.307 11.073 ( -0.124 -6.223 -0.588) 6.252 11.149 ( -0.783 -6.806 -2.386) 7.255 11.328 ( -1.812 -3.845 2.723) 5.049 11.467 ( 1.924 -10.733 -2.679) 11.229 11.579 ( 3.318 -5.305 4.584) 7.757 11.763 ( -5.123 -6.391 2.808) 8.659 11.944 ( -1.379 -5.709 3.933) 7.068 12.086 ( -0.298 0.781 -2.551) 2.684 12.352 ( 2.820 -0.701 -0.370) 2.930 12.532 ( -6.352 0.731 -6.330) 8.997 12.981 ( 4.754 -1.901 3.709) 6.322 13.128 ( -0.981 -6.695 -2.905) 7.364 15.941 ( 0.771 2.484 -0.679) 2.688 16.020 ( -3.432 3.886 -1.924) 5.530 16.275 ( 0.733 2.523 2.397) 3.556 16.460 ( 0.197 1.703 -4.820) 5.115 ======================= Grid point 224 (105/172) ======================= q-point: (-0.10 0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -0.610 19.128 22.484) 29.526 2.030 ( 3.591 21.564 26.024) 33.988 2.673 ( -0.487 10.448 -8.443) 13.442 3.005 ( 0.526 12.566 -1.557) 12.673 3.209 ( -2.316 12.703 0.395) 12.918 3.959 ( 0.285 -2.783 -7.758) 8.247 4.421 ( -11.215 -3.876 7.555) 14.067 4.702 ( -0.460 -8.196 -0.610) 8.231 4.788 ( -1.208 -10.994 6.988) 13.083 4.927 ( -0.692 -6.860 7.113) 9.907 5.205 ( 7.145 -3.418 -6.204) 10.061 5.410 ( 2.052 -5.475 -8.924) 10.669 5.842 ( 0.743 -2.252 2.815) 3.680 6.061 ( 7.156 3.358 -2.631) 8.331 6.356 ( 1.989 3.216 0.632) 3.834 6.427 ( -2.416 3.945 3.062) 5.547 6.540 ( -4.452 0.999 -6.228) 7.720 6.653 ( -1.171 3.799 -4.982) 6.374 6.861 ( -4.224 6.010 1.772) 7.557 6.941 ( 4.338 5.113 -2.317) 7.095 7.703 ( -3.833 4.355 5.634) 8.087 7.931 ( 5.102 4.338 -4.504) 8.071 8.170 ( 1.013 9.720 1.534) 9.892 8.331 ( -1.049 8.613 -4.251) 9.662 8.628 ( 1.209 8.094 4.652) 9.414 8.685 ( -3.774 4.345 4.973) 7.606 8.768 ( 0.818 5.787 0.737) 5.891 9.063 ( 2.193 -0.276 -3.707) 4.316 9.213 ( 4.547 0.384 -0.493) 4.590 9.364 ( -5.723 -0.247 -4.124) 7.059 9.690 ( 2.402 0.738 4.716) 5.344 9.788 ( -7.252 -3.645 3.217) 8.731 10.076 ( 5.699 -1.845 -0.265) 5.997 10.225 ( -2.234 -4.781 -5.630) 7.717 10.472 ( -0.277 1.225 4.733) 4.897 10.632 ( 1.341 2.098 1.806) 3.076 10.684 ( -2.482 5.286 -1.010) 5.926 10.846 ( 4.150 2.320 -8.818) 10.018 11.144 ( -1.762 -4.407 1.129) 4.879 11.229 ( -1.966 -3.640 -1.793) 4.508 11.425 ( 0.430 -6.075 5.533) 8.229 11.638 ( -0.278 -7.156 -2.585) 7.614 11.717 ( 1.234 -6.613 3.096) 7.405 11.822 ( -1.764 -4.224 -0.772) 4.642 12.047 ( 0.639 -4.914 2.900) 5.742 12.105 ( 1.906 -3.005 -0.695) 3.626 12.392 ( 2.957 -1.166 -0.387) 3.202 12.472 ( -4.718 -1.016 -3.447) 5.931 13.079 ( 3.698 -4.636 3.755) 7.020 13.224 ( -2.090 -6.550 -3.904) 7.907 15.893 ( 4.473 4.498 0.295) 6.350 15.955 ( -3.136 0.630 -2.493) 4.055 16.243 ( -0.030 2.128 2.795) 3.513 16.416 ( 1.706 2.238 -5.763) 6.413 ======================= Grid point 227 (106/172) ======================= q-point: ( 0.20 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 18.314 0.000 19.293) 26.602 2.263 ( 17.323 0.000 11.791) 20.955 2.698 ( 9.223 0.000 -2.780) 9.633 2.896 ( 15.898 0.000 -21.886) 27.051 3.575 ( 22.200 0.000 27.661) 35.467 3.855 ( 9.696 0.000 -15.654) 18.413 4.178 ( -17.079 -0.000 14.262) 22.251 4.385 ( -19.439 -0.000 -0.059) 19.439 5.108 ( -1.791 -0.000 3.224) 3.688 5.182 ( -1.705 -0.000 -10.270) 10.410 5.287 ( -0.846 -0.000 -1.476) 1.702 5.295 ( 3.502 0.000 -8.718) 9.395 5.747 ( -4.313 -0.000 1.687) 4.631 6.200 ( -6.938 -0.000 0.839) 6.988 6.233 ( 3.189 0.000 -4.936) 5.876 6.431 ( 6.222 0.000 1.802) 6.478 6.539 ( -1.252 -0.000 3.657) 3.866 6.584 ( -2.718 -0.000 -0.988) 2.892 6.669 ( -0.366 -0.000 -0.233) 0.434 6.803 ( 2.315 0.000 -3.317) 4.045 7.509 ( -0.801 -0.000 1.402) 1.615 7.897 ( -1.011 -0.000 1.601) 1.894 8.017 ( -1.204 -0.000 0.737) 1.412 8.121 ( 4.285 0.000 -7.744) 8.851 8.468 ( -2.124 -0.000 2.604) 3.360 8.501 ( -7.752 -0.000 6.550) 10.149 8.634 ( -3.726 -0.000 4.366) 5.739 8.872 ( -3.723 -0.000 -4.999) 6.233 9.162 ( -3.378 -0.000 -6.682) 7.487 9.360 ( -3.465 -0.000 2.739) 4.417 9.726 ( 0.948 0.000 -0.275) 0.987 9.743 ( -2.081 -0.000 6.531) 6.855 10.035 ( -11.376 -0.000 -0.898) 11.411 10.121 ( -2.978 -0.000 -1.363) 3.275 10.465 ( -1.365 -0.000 1.355) 1.924 10.548 ( -0.180 -0.000 -5.838) 5.841 10.756 ( 8.225 0.000 3.541) 8.955 10.834 ( 7.568 0.000 -4.382) 8.745 11.156 ( -3.131 -0.000 0.900) 3.258 11.304 ( -1.473 -0.000 3.812) 4.087 11.517 ( 4.018 0.000 1.397) 4.254 11.630 ( -3.728 -0.000 2.929) 4.741 11.870 ( -0.498 -0.000 4.528) 4.555 12.020 ( -0.061 -0.000 -5.294) 5.294 12.167 ( -2.235 -0.000 -0.515) 2.293 12.334 ( 5.147 0.000 -5.000) 7.176 12.550 ( 2.884 0.000 1.063) 3.074 12.559 ( 10.058 0.000 3.959) 10.810 13.153 ( -3.989 -0.000 -5.949) 7.163 13.299 ( 0.439 0.000 1.134) 1.216 15.902 ( 4.685 0.000 -2.132) 5.147 16.130 ( 9.444 0.000 -1.186) 9.518 16.133 ( -1.124 -0.000 1.181) 1.630 16.548 ( 6.329 0.000 -5.131) 8.148 ======================= Grid point 228 (107/172) ======================= q-point: ( 0.30 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( 17.519 -0.893 7.521) 19.087 2.513 ( 16.720 -6.587 5.914) 18.919 2.805 ( 11.579 -1.810 7.813) 14.085 3.026 ( 18.558 -5.461 -13.078) 23.351 3.700 ( 3.840 3.884 7.138) 8.988 3.896 ( -2.965 1.866 -5.322) 6.371 4.129 ( -2.222 -0.960 10.129) 10.415 4.341 ( -5.221 -9.474 6.246) 12.491 5.000 ( -3.893 6.841 0.566) 7.891 5.080 ( -2.894 5.912 -2.751) 7.134 5.279 ( -5.129 0.217 -4.374) 6.744 5.327 ( 2.074 -0.836 -9.129) 9.399 5.747 ( 0.070 -2.585 -0.363) 2.612 6.110 ( -4.711 4.621 -0.558) 6.622 6.248 ( 2.339 -0.817 -1.838) 3.085 6.396 ( -2.126 5.046 3.128) 6.306 6.530 ( 0.065 -0.065 0.634) 0.641 6.628 ( 3.545 -4.655 2.152) 6.234 6.730 ( 0.112 -5.776 -1.835) 6.061 6.879 ( 1.763 -6.629 -3.394) 7.653 7.558 ( 1.218 -4.983 0.691) 5.176 7.913 ( -4.250 -2.855 2.855) 5.862 8.059 ( -1.203 -5.958 1.807) 6.341 8.181 ( 4.787 -4.816 -6.511) 9.408 8.456 ( -4.798 -2.169 2.175) 5.697 8.519 ( -4.822 -5.250 3.713) 8.038 8.653 ( -4.152 -4.215 5.082) 7.799 8.828 ( -2.605 0.645 -5.346) 5.982 9.143 ( -3.013 -2.471 -5.338) 6.609 9.334 ( -3.323 -0.055 1.385) 3.601 9.688 ( -1.558 2.400 0.837) 2.981 9.777 ( -0.154 -2.304 2.929) 3.730 9.931 ( -6.369 1.474 -1.309) 6.667 10.139 ( -4.876 -3.775 -0.402) 6.180 10.467 ( -1.898 -1.187 1.590) 2.746 10.561 ( -1.383 -3.281 -6.177) 7.130 10.756 ( 8.078 6.125 0.223) 10.140 10.918 ( 4.561 -2.726 -1.030) 5.413 11.115 ( -2.438 2.013 0.088) 3.163 11.267 ( -2.473 3.838 3.390) 5.687 11.537 ( 2.010 3.562 2.503) 4.795 11.585 ( 1.248 2.845 2.953) 4.286 11.855 ( -1.831 2.118 3.761) 4.689 11.961 ( -1.882 4.163 -3.666) 5.857 12.114 ( -2.759 3.177 -0.800) 4.283 12.356 ( 2.930 -0.600 -5.235) 6.029 12.541 ( 3.231 3.859 1.017) 5.135 12.645 ( 9.520 0.845 3.997) 10.360 13.055 ( -2.590 6.362 -3.640) 7.774 13.294 ( 2.272 1.765 -0.540) 2.927 15.935 ( 5.377 0.556 -0.159) 5.408 16.109 ( 2.736 1.022 -0.159) 2.925 16.253 ( 5.286 -4.777 -0.195) 7.127 16.555 ( 5.409 2.668 -4.868) 7.750 ======================= Grid point 229 (108/172) ======================= q-point: ( 0.40 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.579 ( 14.030 -8.303 1.440) 16.366 2.757 ( 16.327 -6.014 1.447) 17.460 2.965 ( 12.252 -2.214 11.937) 17.249 3.273 ( 17.026 -7.477 -0.986) 18.621 3.586 ( -11.141 5.327 1.975) 12.506 3.811 ( -9.622 -0.510 2.892) 10.060 4.131 ( -2.427 -0.891 -0.505) 2.634 4.531 ( 4.669 -3.047 3.272) 6.464 4.862 ( -4.388 5.701 0.758) 7.234 4.962 ( -0.934 6.339 -0.215) 6.411 5.165 ( -5.915 4.600 -3.094) 8.107 5.292 ( 0.347 1.943 -6.317) 6.618 5.799 ( 3.267 0.149 -2.020) 3.844 6.009 ( -1.702 1.698 -3.176) 3.983 6.266 ( 0.059 -0.384 1.750) 1.792 6.385 ( 0.091 -5.392 2.186) 5.819 6.547 ( 0.676 -0.477 -1.141) 1.409 6.729 ( 3.089 -3.673 1.694) 5.090 6.847 ( 2.415 -6.554 -2.407) 7.388 7.007 ( 0.232 -7.905 -2.116) 8.186 7.687 ( 2.492 -7.624 0.299) 8.026 7.924 ( -6.979 -2.314 5.054) 8.922 8.206 ( -0.979 -10.672 1.146) 10.778 8.309 ( 3.878 -7.502 -2.947) 8.944 8.507 ( -2.303 -6.668 -0.158) 7.057 8.602 ( -4.639 -7.785 1.659) 9.213 8.734 ( -4.084 -6.483 3.195) 8.301 8.787 ( -1.875 -1.199 -3.184) 3.884 9.153 ( -1.228 -1.785 -4.676) 5.154 9.335 ( -1.227 -1.961 0.534) 2.374 9.669 ( -2.108 -2.518 0.223) 3.292 9.821 ( -0.068 -1.812 -0.722) 1.951 9.891 ( -3.269 -2.066 -0.527) 3.903 10.148 ( -5.618 -2.067 -0.992) 6.068 10.467 ( -1.673 1.109 2.143) 2.936 10.583 ( -2.185 -2.741 -5.440) 6.472 10.692 ( 6.285 7.449 -1.555) 9.869 10.961 ( 0.728 1.161 1.190) 1.815 11.061 ( -2.341 2.725 -0.673) 3.655 11.160 ( -1.279 5.839 1.334) 6.124 11.440 ( -1.879 7.211 5.156) 9.061 11.567 ( 4.571 4.347 -0.103) 6.309 11.766 ( 1.454 8.894 -0.658) 9.036 11.875 ( -5.456 1.458 3.945) 6.889 12.024 ( -1.371 5.098 -0.511) 5.304 12.355 ( 0.639 1.308 -5.538) 5.726 12.494 ( 3.484 4.306 0.437) 5.557 12.703 ( 6.472 0.723 3.340) 7.319 12.902 ( -0.655 8.588 0.009) 8.613 13.265 ( 3.916 4.232 -2.451) 6.265 15.963 ( 4.689 1.207 1.504) 5.070 16.136 ( 2.514 -1.607 -0.217) 2.992 16.363 ( 3.388 -3.894 0.037) 5.162 16.523 ( 4.464 3.927 -4.864) 7.681 ======================= Grid point 230 (109/172) ======================= q-point: ( 0.50 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.842 ( 8.537 -10.184 -0.893) 13.319 2.988 ( 15.691 -5.131 3.264) 16.828 3.136 ( 9.834 -3.897 9.901) 14.489 3.432 ( -8.983 2.586 4.242) 10.265 3.484 ( 9.483 -2.963 5.594) 11.402 3.797 ( -10.919 -6.608 5.170) 13.770 4.122 ( -2.691 -1.081 -2.708) 3.967 4.496 ( -1.227 6.861 0.517) 6.989 4.682 ( -7.605 9.463 -0.925) 12.175 4.807 ( -3.035 10.724 1.333) 11.225 5.064 ( 0.788 3.882 -8.142) 9.055 5.254 ( -1.292 0.648 -6.463) 6.622 5.792 ( 3.637 1.639 0.190) 3.994 6.011 ( 4.128 -0.003 0.800) 4.205 6.349 ( 0.310 -8.469 0.453) 8.486 6.490 ( -1.464 -2.532 2.171) 3.643 6.566 ( 3.288 -3.426 -2.984) 5.608 6.813 ( 1.266 -3.853 -1.225) 4.237 6.957 ( 3.766 -3.784 -0.498) 5.362 7.127 ( -0.691 -6.349 -1.414) 6.542 7.831 ( 0.129 -5.662 2.316) 6.118 7.929 ( -4.454 -3.666 4.713) 7.449 8.356 ( -2.194 -6.957 1.862) 7.529 8.467 ( 2.475 -7.761 -2.504) 8.522 8.625 ( -0.660 -7.009 -0.439) 7.054 8.715 ( -1.997 -3.962 -1.925) 4.836 8.759 ( 0.033 -8.094 -1.429) 8.219 8.948 ( -2.470 -15.898 3.200) 16.404 9.163 ( 2.858 -0.727 -4.175) 5.112 9.367 ( -1.818 -2.355 0.087) 2.976 9.732 ( -5.417 -5.965 0.849) 8.102 9.835 ( 1.143 -2.532 -5.047) 5.761 9.948 ( -0.827 -5.447 -0.766) 5.562 10.121 ( -4.132 -0.251 -2.904) 5.057 10.392 ( 0.699 7.611 2.558) 8.060 10.540 ( -1.680 6.794 -5.101) 8.660 10.649 ( 1.964 -0.437 0.409) 2.053 10.836 ( -4.977 9.397 0.313) 10.638 11.000 ( -0.698 1.452 2.366) 2.862 11.129 ( 1.260 -0.016 -2.056) 2.411 11.301 ( -1.603 8.858 4.588) 10.103 11.497 ( 1.604 6.313 -0.887) 6.574 11.623 ( 3.429 8.658 0.534) 9.327 11.825 ( -4.833 1.592 4.472) 6.774 11.918 ( -0.614 6.689 3.042) 7.374 12.297 ( 0.434 3.310 -5.071) 6.071 12.452 ( 1.816 3.315 -1.262) 3.984 12.718 ( -2.327 1.498 -3.236) 4.258 12.806 ( 7.050 4.099 6.708) 10.560 13.195 ( 3.698 6.358 -3.040) 7.959 15.975 ( 2.848 1.522 2.862) 4.315 16.195 ( 2.095 -2.784 0.176) 3.489 16.435 ( 1.458 -2.068 -1.012) 2.725 16.467 ( 3.110 4.132 -4.620) 6.935 ======================= Grid point 231 (110/172) ======================= q-point: (-0.40 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.976 ( 4.631 1.361 -0.203) 4.831 3.172 ( 6.788 -2.764 4.310) 8.503 3.228 ( 4.768 2.998 -2.045) 5.992 3.462 ( 2.510 -5.985 13.095) 14.615 3.578 ( -2.671 -4.076 9.515) 10.690 3.866 ( -8.290 -7.129 6.784) 12.868 4.138 ( 1.711 -2.392 -1.945) 3.526 4.338 ( -3.505 8.208 4.959) 10.210 4.454 ( -10.803 7.506 -5.384) 14.214 4.608 ( -0.957 8.050 0.729) 8.139 4.958 ( 2.474 7.424 -8.401) 11.481 5.215 ( -1.476 -0.628 -12.770) 12.870 5.824 ( 6.747 -0.645 0.921) 6.840 6.053 ( 2.590 -0.242 4.850) 5.503 6.425 ( -4.004 2.039 5.233) 6.898 6.538 ( -0.189 -7.015 -3.501) 7.842 6.672 ( 3.472 -4.951 -3.019) 6.759 6.873 ( 0.769 -2.880 -2.866) 4.135 7.029 ( 3.850 -0.958 0.816) 4.051 7.190 ( -1.114 -2.017 -1.097) 2.552 7.860 ( -5.399 -0.993 7.342) 9.167 8.026 ( 2.614 -4.827 -0.469) 5.509 8.427 ( -3.540 -4.000 2.739) 6.002 8.593 ( 2.269 -5.414 -3.721) 6.951 8.692 ( -0.731 -2.068 -0.854) 2.354 8.731 ( 1.386 -2.198 -2.276) 3.454 8.973 ( 2.396 -9.381 2.240) 9.938 9.206 ( 3.268 -8.476 -2.725) 9.484 9.275 ( 2.864 -14.004 -0.169) 14.295 9.374 ( -3.097 -1.785 -0.981) 3.707 9.717 ( -8.703 -0.061 0.320) 8.709 9.919 ( 2.653 -1.293 -4.582) 5.451 10.018 ( 0.858 -2.381 -3.323) 4.177 10.093 ( -0.533 -1.499 -2.117) 2.648 10.239 ( -3.052 11.578 -0.515) 11.984 10.382 ( -0.494 1.947 -0.377) 2.044 10.667 ( -2.267 0.274 2.328) 3.261 10.729 ( 0.241 -0.879 -2.316) 2.489 10.981 ( 0.018 2.608 3.434) 4.312 11.078 ( -1.129 5.586 0.279) 5.706 11.203 ( 1.225 1.630 0.413) 2.080 11.388 ( -0.820 5.703 -1.526) 5.960 11.541 ( 3.642 4.932 2.103) 6.482 11.759 ( -3.639 3.456 0.246) 5.024 11.820 ( -1.611 4.596 9.552) 10.722 12.239 ( 0.973 2.654 -4.441) 5.265 12.401 ( 0.398 2.994 -1.156) 3.234 12.644 ( -2.220 2.247 -6.504) 7.231 12.857 ( 4.435 -0.709 6.291) 7.730 13.104 ( 3.287 5.980 -2.325) 7.209 15.974 ( 1.002 1.318 3.578) 3.943 16.246 ( 0.388 -1.237 -0.775) 1.511 16.387 ( 3.069 4.786 -4.299) 7.127 16.478 ( -0.185 -1.491 -1.050) 1.833 ======================= Grid point 232 (111/172) ======================= q-point: (-0.30 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.883 ( 2.233 12.598 2.896) 13.118 3.101 ( 6.751 15.737 5.885) 18.107 3.194 ( -2.760 4.460 -5.875) 7.876 3.512 ( -11.156 -0.739 1.884) 11.338 3.687 ( 0.999 -2.552 13.388) 13.665 3.966 ( -2.144 -6.504 9.384) 11.617 4.169 ( -4.610 6.003 0.141) 7.570 4.220 ( 0.591 -2.444 0.956) 2.690 4.332 ( -3.455 -5.115 7.488) 9.704 4.605 ( 4.812 -5.476 -4.700) 8.674 4.823 ( 0.539 5.982 -7.652) 9.727 5.184 ( -0.284 -1.781 -16.475) 16.573 5.914 ( 9.439 -0.911 2.084) 9.709 6.074 ( -1.728 0.225 7.154) 7.363 6.348 ( -3.240 4.370 8.375) 9.987 6.605 ( -3.393 -3.994 -5.935) 7.918 6.745 ( 0.798 -1.679 -4.171) 4.566 6.895 ( 0.462 0.290 -5.152) 5.181 7.057 ( 3.715 1.545 2.240) 4.605 7.173 ( -0.951 2.439 -0.622) 2.691 7.851 ( -3.794 0.398 7.841) 8.720 8.084 ( 2.324 -0.017 -2.260) 3.241 8.467 ( -1.645 -1.972 2.542) 3.614 8.622 ( -0.384 1.387 -2.050) 2.505 8.727 ( 0.076 -1.789 0.093) 1.794 8.805 ( 3.172 -5.055 -3.571) 6.954 9.081 ( 6.528 0.588 0.469) 6.571 9.290 ( -1.850 2.063 -3.006) 4.088 9.378 ( -0.464 -5.300 1.626) 5.563 9.482 ( 2.107 0.605 -0.818) 2.340 9.640 ( -6.057 5.281 1.273) 8.136 9.818 ( 1.046 5.555 -5.031) 7.567 9.984 ( -0.354 1.159 1.089) 1.629 10.122 ( 1.507 -5.964 -2.963) 6.827 10.240 ( -0.571 -7.248 -0.452) 7.285 10.428 ( -2.594 -5.801 -2.033) 6.672 10.682 ( -0.480 -2.796 1.885) 3.406 10.772 ( 3.842 -2.222 -0.893) 4.527 10.914 ( -1.973 1.650 2.790) 3.794 11.042 ( 0.990 0.167 -2.451) 2.649 11.212 ( 1.358 -1.233 0.013) 1.835 11.307 ( -1.576 1.416 -2.061) 2.956 11.513 ( 3.165 2.419 4.597) 6.083 11.672 ( -5.141 2.032 2.843) 6.216 11.803 ( -0.925 -0.803 7.024) 7.130 12.184 ( 0.525 3.246 -4.507) 5.579 12.364 ( 0.887 1.492 -0.160) 1.744 12.569 ( -3.156 1.728 -8.521) 9.249 12.914 ( 0.467 -1.787 4.722) 5.071 13.053 ( 4.257 2.564 -1.364) 5.153 15.968 ( -0.016 0.959 3.265) 3.403 16.203 ( -1.809 4.169 -4.769) 6.587 16.353 ( 3.695 2.125 0.648) 4.312 16.484 ( -0.816 -0.371 -2.308) 2.476 ======================= Grid point 233 (112/172) ======================= q-point: (-0.20 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( 0.531 21.670 7.826) 23.046 2.826 ( 3.769 22.425 12.390) 25.896 3.011 ( -3.198 9.984 -8.818) 13.699 3.372 ( -9.438 5.735 -9.597) 14.631 3.680 ( -0.642 8.197 10.133) 13.049 3.939 ( 1.267 3.479 0.417) 3.726 4.223 ( -0.648 -8.548 6.842) 10.968 4.353 ( -0.181 -8.590 9.707) 12.963 4.491 ( -2.327 -10.359 7.166) 12.809 4.665 ( -2.070 -0.720 -3.088) 3.787 4.872 ( 6.175 -12.341 -6.959) 15.455 5.200 ( 3.408 -4.226 -15.702) 16.614 5.942 ( 0.251 5.193 7.569) 9.182 6.097 ( 1.877 -2.300 4.052) 5.023 6.310 ( 0.237 0.812 7.189) 7.238 6.597 ( -3.965 -0.426 -5.869) 7.095 6.700 ( -3.024 4.207 -5.461) 7.527 6.831 ( 1.073 5.496 -7.786) 9.590 7.034 ( -2.008 3.639 3.216) 5.255 7.116 ( 3.596 4.331 -0.463) 5.648 7.826 ( -2.221 2.339 7.272) 7.955 8.065 ( 2.438 2.942 -2.917) 4.807 8.461 ( 0.493 3.632 2.057) 4.203 8.560 ( -1.846 4.055 -1.094) 4.588 8.743 ( -0.542 -0.095 1.717) 1.803 8.890 ( 1.018 -2.686 -3.854) 4.806 9.034 ( 5.225 10.281 0.393) 11.539 9.205 ( -1.823 5.523 -5.596) 8.071 9.322 ( -0.911 10.096 2.620) 10.470 9.416 ( 2.435 6.413 -0.173) 6.862 9.537 ( -4.078 -4.400 5.259) 7.978 9.801 ( 1.507 -1.562 -5.558) 5.967 10.055 ( 2.963 -1.261 0.626) 3.280 10.196 ( 1.839 -1.137 -4.534) 5.023 10.322 ( -5.195 -6.320 5.387) 9.796 10.554 ( 1.724 -9.579 -2.749) 10.113 10.717 ( -1.964 -1.398 3.252) 4.049 10.853 ( 3.174 -2.188 -3.354) 5.110 10.966 ( -0.345 -6.781 -0.223) 6.793 11.032 ( -0.048 -1.718 -3.660) 4.044 11.278 ( -0.239 -2.314 0.378) 2.357 11.314 ( 1.505 -6.246 -1.347) 6.565 11.556 ( 3.300 -2.455 6.796) 7.944 11.643 ( -6.069 -3.225 3.269) 7.611 11.863 ( 0.467 -4.263 4.497) 6.214 12.115 ( 0.380 3.272 -4.244) 5.372 12.362 ( 0.914 -0.321 0.156) 0.981 12.492 ( -2.672 1.689 -7.918) 8.525 12.955 ( -2.617 -2.990 3.281) 5.153 13.071 ( 4.369 -0.873 -1.623) 4.742 15.959 ( -0.333 0.763 1.949) 2.120 16.092 ( -0.406 5.503 -4.078) 6.861 16.341 ( 2.123 2.794 1.925) 4.002 16.468 ( -0.378 0.698 -3.825) 3.906 ======================= Grid point 234 (113/172) ======================= q-point: (-0.10 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( 2.799 22.296 14.933) 26.981 2.514 ( 4.407 22.305 20.694) 30.744 2.794 ( 0.453 9.589 -13.382) 16.469 3.142 ( -3.367 9.656 -16.736) 19.613 3.527 ( 6.103 13.437 13.191) 19.794 3.950 ( 4.637 0.409 -2.124) 5.117 4.275 ( -10.395 -1.879 2.781) 10.923 4.541 ( -5.053 -9.825 10.185) 15.027 4.627 ( 1.237 -8.767 1.137) 8.927 4.778 ( -2.367 -10.768 8.031) 13.640 5.124 ( 6.949 -10.755 -6.624) 14.416 5.289 ( 3.715 -6.768 -12.120) 14.370 5.855 ( -3.425 3.383 6.515) 8.101 6.154 ( 4.086 0.208 -0.772) 4.164 6.351 ( -0.607 -2.608 5.852) 6.436 6.505 ( -4.364 6.740 -5.619) 9.801 6.567 ( -1.096 5.132 -3.408) 6.258 6.707 ( 0.050 6.111 -6.900) 9.218 6.934 ( -3.689 5.340 1.880) 6.757 7.068 ( 4.732 5.527 -0.779) 7.317 7.772 ( -1.860 4.380 5.851) 7.541 8.020 ( 2.889 3.591 -3.316) 5.678 8.356 ( 0.918 9.296 2.030) 9.559 8.450 ( -1.432 6.927 -1.909) 7.327 8.724 ( -2.476 2.377 2.900) 4.493 8.835 ( -0.243 9.726 4.420) 10.686 8.878 ( 0.041 8.586 -2.748) 9.015 9.063 ( -2.600 3.492 -4.195) 6.045 9.242 ( 1.279 0.045 -0.124) 1.286 9.351 ( 0.714 3.107 -3.113) 4.456 9.638 ( -2.246 -6.036 5.107) 8.219 9.797 ( 2.442 3.622 1.344) 4.570 10.096 ( 4.864 -1.823 -1.258) 5.345 10.153 ( -2.125 1.248 -6.043) 6.526 10.446 ( -1.175 -6.406 5.774) 8.704 10.631 ( -4.802 0.836 0.983) 4.972 10.735 ( 0.724 -0.785 -1.587) 1.913 10.874 ( 5.021 -0.365 -6.192) 7.980 11.039 ( -3.662 -4.793 0.145) 6.034 11.134 ( 0.247 -6.413 -1.167) 6.523 11.323 ( -1.381 -5.249 3.766) 6.606 11.491 ( 2.466 -10.101 -2.832) 10.776 11.627 ( -3.631 -4.008 3.696) 6.551 11.731 ( 2.375 -6.825 3.395) 7.984 11.969 ( 1.072 -5.676 1.797) 6.050 12.086 ( 3.088 -0.421 -1.000) 3.273 12.381 ( -1.579 -1.958 -0.739) 2.621 12.442 ( 2.305 1.247 -4.780) 5.451 13.001 ( -4.393 -4.970 2.040) 6.940 13.132 ( 3.079 -3.171 -2.355) 5.008 15.942 ( -1.561 0.948 -0.693) 1.953 16.006 ( 3.779 4.571 -1.355) 6.084 16.307 ( 1.786 3.267 2.389) 4.424 16.437 ( 0.602 1.254 -5.164) 5.348 ======================= Grid point 238 (114/172) ======================= q-point: ( 0.30 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 16.362 0.000 -8.750) 18.555 2.587 ( 20.037 0.000 8.530) 21.777 2.924 ( 12.925 0.000 18.819) 22.830 3.071 ( 16.985 0.000 -11.840) 20.704 3.743 ( -13.459 -0.000 6.741) 15.053 3.911 ( -4.104 -0.000 -5.758) 7.070 4.172 ( 2.156 0.000 -3.213) 3.870 4.207 ( 8.671 0.000 18.666) 20.582 5.045 ( -7.578 -0.000 -1.338) 7.695 5.056 ( -5.615 -0.000 -11.333) 12.647 5.228 ( -4.008 -0.000 -1.742) 4.370 5.300 ( 3.474 0.000 -10.207) 10.782 5.740 ( 0.570 0.000 6.548) 6.572 6.135 ( -3.232 -0.000 4.950) 5.911 6.245 ( 1.194 0.000 -5.038) 5.177 6.501 ( 0.971 0.000 -1.679) 1.940 6.524 ( -3.980 -0.000 6.370) 7.511 6.539 ( -0.639 -0.000 1.105) 1.277 6.676 ( 1.257 0.000 -1.320) 1.823 6.834 ( 4.951 0.000 -6.160) 7.903 7.534 ( 3.428 0.000 -0.134) 3.431 7.849 ( -6.806 -0.000 4.183) 7.988 8.007 ( -1.017 -0.000 2.357) 2.567 8.163 ( 5.795 0.000 -6.645) 8.817 8.406 ( -6.722 -0.000 2.348) 7.120 8.442 ( -2.944 -0.000 1.739) 3.420 8.597 ( -5.050 -0.000 6.854) 8.514 8.804 ( -1.417 -0.000 -5.409) 5.592 9.087 ( -2.111 -0.000 -3.205) 3.837 9.304 ( -3.448 -0.000 -0.039) 3.448 9.722 ( -4.014 -0.000 3.319) 5.209 9.733 ( 0.263 0.000 -2.369) 2.384 9.883 ( -8.084 -0.000 2.156) 8.366 10.083 ( -0.893 -0.000 -1.835) 2.041 10.447 ( -1.792 -0.000 1.308) 2.218 10.500 ( -0.809 -0.000 -6.458) 6.509 10.895 ( 6.468 0.000 2.112) 6.805 10.904 ( 4.405 0.000 -4.011) 5.957 11.120 ( -1.469 -0.000 1.110) 1.841 11.288 ( -2.773 -0.000 3.527) 4.486 11.605 ( -2.753 -0.000 5.160) 5.849 11.627 ( 7.614 0.000 1.607) 7.781 11.850 ( -4.941 -0.000 4.869) 6.937 11.982 ( -0.680 -0.000 -5.054) 5.100 12.114 ( -3.305 -0.000 -0.441) 3.334 12.339 ( 0.313 0.000 -7.206) 7.213 12.601 ( 2.339 0.000 1.791) 2.947 12.725 ( 5.550 0.000 3.310) 6.462 13.112 ( 3.775 0.000 -3.772) 5.336 13.320 ( 1.795 0.000 0.381) 1.835 15.986 ( 5.016 0.000 1.706) 5.298 16.152 ( 2.809 0.000 1.888) 3.384 16.248 ( 6.771 0.000 -2.742) 7.306 16.604 ( 4.541 0.000 -5.149) 6.865 ======================= Grid point 239 (115/172) ======================= q-point: ( 0.40 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( 14.626 -0.463 -6.564) 16.038 2.808 ( 17.700 -4.847 0.403) 18.356 3.083 ( 12.258 -0.217 18.763) 22.413 3.245 ( 13.176 -7.313 -4.040) 15.601 3.590 ( -15.008 4.549 5.205) 16.524 3.781 ( -11.445 3.626 5.724) 13.301 4.154 ( 6.859 3.819 -3.153) 8.460 4.471 ( 7.342 -10.043 4.388) 13.192 4.909 ( -6.488 4.685 -3.214) 8.624 4.985 ( -4.066 0.825 -9.177) 10.071 5.163 ( -6.407 2.659 -1.160) 7.033 5.310 ( 1.366 0.593 -8.011) 8.148 5.793 ( 3.485 -2.714 4.411) 6.242 6.067 ( -1.294 5.754 3.167) 6.694 6.262 ( 0.435 -2.573 -2.822) 3.844 6.380 ( -1.850 5.346 4.074) 6.971 6.546 ( 2.045 -1.118 -0.112) 2.333 6.649 ( -2.787 -6.381 1.807) 7.193 6.736 ( 2.047 -6.583 -2.355) 7.286 6.900 ( 4.208 -4.607 -5.750) 8.485 7.606 ( 4.722 -4.566 -0.637) 6.600 7.829 ( -8.799 -2.828 5.380) 10.694 8.057 ( -0.711 -5.922 2.940) 6.650 8.229 ( 4.927 -4.461 -5.028) 8.334 8.392 ( -3.702 -3.636 0.474) 5.211 8.463 ( -4.072 -4.608 1.240) 6.273 8.608 ( -5.544 -3.770 6.370) 9.248 8.777 ( -0.109 0.492 -4.630) 4.657 9.092 ( -0.637 -2.489 -1.869) 3.177 9.292 ( -2.022 -1.387 -0.728) 2.558 9.656 ( -2.331 2.269 -0.283) 3.265 9.765 ( -1.821 -2.922 -1.355) 3.700 9.842 ( -5.234 -0.699 2.833) 5.992 10.085 ( -1.376 -1.250 -2.381) 3.021 10.446 ( -1.672 -1.084 0.837) 2.161 10.504 ( -0.917 -2.475 -5.510) 6.109 10.860 ( 5.113 5.481 -1.997) 7.758 10.968 ( 2.034 -1.273 -1.413) 2.785 11.092 ( -0.246 2.894 1.695) 3.363 11.244 ( -2.425 3.817 2.724) 5.279 11.546 ( -2.307 5.162 5.207) 7.687 11.673 ( 5.761 2.511 0.853) 6.342 11.825 ( -4.894 -0.203 6.272) 7.958 11.921 ( -0.045 5.008 -3.206) 5.947 12.066 ( -2.589 2.425 -1.028) 3.694 12.329 ( -1.216 -1.128 -7.155) 7.345 12.592 ( 2.215 3.479 1.600) 4.423 12.748 ( 0.543 0.777 1.066) 1.427 13.077 ( 6.351 7.684 1.169) 10.037 13.336 ( 3.593 0.894 -1.814) 4.123 16.026 ( 4.311 0.279 2.886) 5.195 16.158 ( 3.717 1.952 0.938) 4.301 16.327 ( 4.162 -3.526 -1.603) 5.686 16.599 ( 3.693 2.544 -5.239) 6.897 ======================= Grid point 240 (116/172) ======================= q-point: ( 0.50 0.30 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.763 ( 9.704 -6.311 -2.827) 11.916 3.029 ( 14.158 -5.951 -1.405) 15.422 3.201 ( 3.864 0.378 14.480) 14.991 3.378 ( -0.383 -0.551 2.180) 2.281 3.500 ( -5.745 -4.736 4.537) 8.719 3.715 ( 0.846 0.974 12.001) 12.070 4.108 ( 0.580 2.889 -5.796) 6.502 4.560 ( -1.022 2.217 -3.754) 4.478 4.763 ( -8.808 6.917 1.428) 11.290 4.940 ( 1.928 3.647 -4.818) 6.343 5.060 ( -5.950 0.580 -4.998) 7.792 5.247 ( -1.278 3.515 -5.297) 6.484 5.859 ( 3.484 0.904 1.328) 3.837 6.044 ( 6.022 -1.193 2.220) 6.528 6.258 ( -2.525 -0.528 1.121) 2.812 6.400 ( 0.947 -5.228 -0.993) 5.405 6.574 ( 2.699 0.071 0.133) 2.703 6.720 ( -2.168 -5.536 -2.399) 6.411 6.889 ( 2.159 -8.101 -0.030) 8.384 7.004 ( 1.923 -6.023 -3.812) 7.383 7.743 ( 3.591 -6.319 0.558) 7.289 7.833 ( -7.112 -3.978 5.490) 9.826 8.200 ( -1.794 -9.423 3.301) 10.144 8.350 ( 2.917 -6.981 -2.868) 8.092 8.480 ( -0.174 -8.358 -1.802) 8.552 8.542 ( -3.661 -8.212 0.963) 9.043 8.667 ( -4.697 -6.342 1.489) 8.031 8.780 ( 1.566 -2.244 -0.722) 2.830 9.144 ( 2.135 -3.168 -1.300) 4.035 9.313 ( -1.441 -2.507 -0.658) 2.966 9.629 ( -2.851 -1.410 0.022) 3.180 9.785 ( -1.826 -2.101 -3.950) 4.832 9.851 ( -3.037 -3.555 2.833) 5.467 10.082 ( -0.956 -0.529 -4.047) 4.192 10.452 ( -1.235 -0.131 0.821) 1.489 10.525 ( -0.692 -2.020 -4.469) 4.953 10.778 ( 4.657 7.848 -1.534) 9.254 10.945 ( -2.903 4.743 -2.171) 5.970 11.032 ( -0.738 3.920 3.083) 5.041 11.163 ( 0.894 3.355 -0.052) 3.472 11.437 ( -2.227 7.067 5.492) 9.223 11.628 ( 2.458 6.227 0.050) 6.695 11.799 ( 2.172 6.825 1.582) 7.335 11.822 ( -3.530 1.915 4.884) 6.323 11.996 ( -1.913 3.187 -0.493) 3.750 12.305 ( -1.792 0.381 -6.869) 7.109 12.538 ( 1.544 4.793 1.165) 5.169 12.717 ( -2.249 1.699 -2.157) 3.549 12.993 ( 6.304 8.318 6.314) 12.198 13.317 ( 4.481 4.429 -3.762) 7.339 16.052 ( 4.361 2.131 3.691) 6.098 16.171 ( 1.874 -0.994 0.545) 2.190 16.400 ( 1.357 -2.666 -1.029) 3.163 16.552 ( 2.796 4.081 -5.609) 7.479 ======================= Grid point 241 (117/172) ======================= q-point: (-0.40 -0.70 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.936 ( 2.625 -7.154 0.992) 7.685 3.145 ( -5.216 -3.938 -0.931) 6.602 3.285 ( 9.489 -1.470 6.361) 11.518 3.429 ( 1.111 -4.158 12.574) 13.290 3.561 ( -5.006 -3.260 9.686) 11.380 3.770 ( 7.359 0.456 2.022) 7.645 4.092 ( 1.886 -2.715 -3.385) 4.732 4.435 ( -5.534 6.356 -6.863) 10.869 4.538 ( -8.981 11.054 5.926) 15.426 4.782 ( -2.880 11.298 3.346) 12.130 5.045 ( 4.063 0.748 -12.551) 13.214 5.155 ( -4.383 2.298 -7.900) 9.323 5.882 ( 6.327 0.316 2.170) 6.697 6.095 ( 2.854 1.321 5.562) 6.390 6.325 ( -4.120 -7.703 -3.252) 9.322 6.465 ( 0.391 -2.597 -2.812) 3.848 6.622 ( 2.891 -3.073 0.671) 4.272 6.789 ( -1.289 -5.005 -3.712) 6.364 7.021 ( 3.026 -4.595 1.004) 5.592 7.106 ( -0.242 -5.647 -2.195) 6.063 7.809 ( -5.072 -2.613 7.083) 9.095 7.941 ( 3.698 -7.192 -0.699) 8.117 8.314 ( -5.173 -6.077 4.213) 9.024 8.486 ( 2.042 -7.226 -3.769) 8.402 8.617 ( 0.407 -5.818 -0.627) 5.866 8.678 ( -1.422 -6.817 -1.866) 7.210 8.784 ( 3.492 -11.419 -0.375) 11.946 8.928 ( -1.768 -14.940 1.377) 15.107 9.231 ( 7.790 -3.476 -1.233) 8.619 9.335 ( -2.135 -1.556 -0.306) 2.660 9.623 ( -7.821 -1.351 1.565) 8.090 9.829 ( 1.851 -5.507 -5.654) 8.107 9.924 ( -2.521 -6.748 0.256) 7.208 10.066 ( 0.196 0.559 -5.331) 5.364 10.410 ( 0.388 5.970 0.818) 6.038 10.500 ( 0.225 5.734 -2.796) 6.383 10.686 ( -0.277 4.062 0.640) 4.122 10.772 ( 0.003 7.881 -2.169) 8.174 10.995 ( -1.726 0.709 2.875) 3.427 11.145 ( 1.797 1.325 -2.134) 3.088 11.304 ( -1.394 8.073 5.585) 9.916 11.514 ( 1.057 8.150 -1.109) 8.293 11.682 ( 2.709 7.937 1.897) 8.598 11.780 ( -3.465 2.487 3.620) 5.594 11.924 ( -1.308 4.506 4.369) 6.411 12.259 ( -0.772 1.335 -5.839) 6.039 12.462 ( -0.911 4.539 1.143) 4.769 12.654 ( -1.272 2.496 -5.434) 6.114 12.941 ( 3.419 4.605 7.451) 9.403 13.239 ( 3.947 6.797 -4.029) 8.833 16.043 ( 2.983 3.297 4.432) 6.278 16.215 ( 0.365 -2.234 -0.081) 2.265 16.434 ( -0.804 -1.495 -1.551) 2.300 16.482 ( 2.324 4.084 -5.137) 6.962 ======================= Grid point 242 (118/172) ======================= q-point: (-0.30 -0.70 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.014 ( -0.736 -0.006 2.782) 2.878 3.172 ( -5.065 -3.742 -2.563) 6.799 3.329 ( 2.668 3.265 6.476) 7.728 3.493 ( -7.874 7.044 7.702) 13.074 3.617 ( 2.152 -8.597 9.623) 13.083 3.877 ( 6.118 -5.289 7.222) 10.842 4.190 ( 3.656 -5.362 -2.560) 6.976 4.232 ( -7.319 7.416 -4.763) 11.456 4.350 ( -1.936 7.646 9.747) 12.538 4.618 ( 0.473 4.692 -0.758) 4.777 4.950 ( 1.746 9.303 -8.037) 12.417 5.099 ( -0.373 -2.130 -16.031) 16.176 5.956 ( 5.182 -1.971 3.918) 6.789 6.099 ( 1.099 1.715 5.161) 5.549 6.353 ( -7.597 -2.622 0.449) 8.049 6.503 ( -1.575 -2.422 -2.050) 3.542 6.701 ( 2.011 -3.289 -2.277) 4.478 6.846 ( -0.968 -3.641 -3.986) 5.485 7.095 ( 2.297 -1.012 1.513) 2.931 7.167 ( -0.294 -2.262 -1.577) 2.773 7.836 ( -2.820 -1.753 7.686) 8.372 8.060 ( 2.173 -3.727 -2.124) 4.809 8.387 ( -3.415 -5.626 4.329) 7.877 8.585 ( -0.728 -4.055 -3.434) 5.363 8.693 ( 1.843 -2.878 -1.350) 3.675 8.745 ( 1.873 -3.468 -2.624) 4.735 9.036 ( 3.128 -10.600 3.323) 11.541 9.194 ( -2.226 -14.862 -2.971) 15.318 9.324 ( -0.317 -1.097 -0.102) 1.147 9.396 ( 8.301 -5.070 -3.263) 10.260 9.588 ( -6.284 -3.327 4.616) 8.477 9.911 ( 1.306 -0.637 -9.319) 9.431 10.017 ( -0.867 -4.373 -1.478) 4.697 10.048 ( -1.197 -0.739 -2.016) 2.459 10.237 ( 0.316 11.355 2.179) 11.567 10.371 ( 1.238 4.108 -1.857) 4.675 10.646 ( -1.434 -0.674 1.142) 1.953 10.754 ( 3.949 -1.531 -2.418) 4.877 10.989 ( -0.791 0.425 2.442) 2.601 11.072 ( -0.408 6.893 1.168) 7.003 11.231 ( 1.496 1.143 1.494) 2.404 11.374 ( 0.622 7.752 -3.114) 8.377 11.594 ( -0.144 4.513 3.979) 6.018 11.703 ( -2.703 4.018 0.262) 4.850 11.854 ( -0.769 4.201 9.441) 10.362 12.216 ( -0.164 1.809 -5.039) 5.356 12.390 ( -2.392 2.295 0.935) 3.444 12.583 ( 0.659 3.380 -7.646) 8.386 12.920 ( -0.959 1.455 5.933) 6.183 13.149 ( 3.597 5.337 -3.014) 7.107 16.020 ( 1.739 2.957 4.726) 5.839 16.219 ( -1.982 1.001 -3.129) 3.837 16.421 ( 2.725 2.193 -1.845) 3.954 16.455 ( -1.119 -0.894 -2.372) 2.771 ======================= Grid point 243 (119/172) ======================= q-point: (-0.20 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.938 ( 0.827 10.712 5.248) 11.957 3.082 ( -4.605 9.027 -5.124) 11.355 3.240 ( -3.878 11.856 5.093) 13.474 3.341 ( -1.185 3.292 3.080) 4.661 3.734 ( -5.646 -1.884 9.138) 10.905 4.006 ( 0.945 1.132 2.572) 2.965 4.117 ( 0.532 -4.544 9.187) 10.263 4.294 ( 1.653 -1.014 9.414) 9.612 4.359 ( 4.554 -7.110 -1.019) 8.505 4.638 ( -0.006 -3.072 -5.299) 6.125 4.792 ( 3.579 3.629 -8.106) 9.575 5.113 ( 3.754 -3.235 -16.501) 17.229 5.990 ( -7.289 0.128 3.853) 8.246 6.110 ( 6.248 1.110 4.967) 8.058 6.336 ( -4.630 -0.400 6.520) 8.007 6.516 ( -3.624 -2.710 -2.604) 5.221 6.722 ( 0.075 1.341 -3.507) 3.755 6.864 ( -0.003 -0.155 -5.296) 5.299 7.084 ( -1.852 3.041 1.294) 3.788 7.185 ( 2.798 0.580 -0.902) 2.997 7.859 ( -0.576 0.225 7.447) 7.472 8.093 ( 0.306 -0.191 -2.263) 2.292 8.466 ( -0.823 -3.426 3.990) 5.323 8.590 ( -1.384 1.067 -2.721) 3.233 8.729 ( 0.378 -0.836 -0.989) 1.349 8.823 ( 1.116 -4.188 -2.919) 5.225 9.142 ( -1.632 0.090 -0.620) 1.748 9.256 ( 2.275 2.479 -3.995) 5.223 9.394 ( 1.090 -1.460 3.337) 3.802 9.502 ( -0.664 -5.355 -0.899) 5.470 9.600 ( 1.333 7.256 1.414) 7.512 9.811 ( 2.740 7.907 -5.992) 10.293 9.998 ( 1.516 -4.764 0.977) 5.094 10.119 ( 0.469 -6.280 -4.099) 7.514 10.221 ( -3.353 -4.200 3.264) 6.287 10.404 ( 2.500 -5.706 -2.253) 6.625 10.667 ( -3.219 -2.705 1.148) 4.359 10.835 ( 5.468 -4.123 -3.099) 7.516 10.916 ( -0.221 4.376 3.387) 5.539 11.038 ( 0.203 0.423 -2.544) 2.587 11.245 ( 2.427 -0.055 0.371) 2.456 11.284 ( 0.601 0.564 -2.993) 3.105 11.552 ( -4.551 -0.452 4.477) 6.400 11.622 ( -0.518 3.505 4.470) 5.704 11.841 ( 0.282 -0.242 7.090) 7.100 12.160 ( -0.030 2.784 -5.251) 5.943 12.352 ( -2.701 0.221 0.280) 2.725 12.517 ( 3.099 3.235 -6.956) 8.274 12.905 ( -4.207 -0.459 4.077) 5.876 13.107 ( 2.964 1.795 -2.338) 4.180 15.996 ( 0.710 2.495 3.846) 4.639 16.151 ( -1.122 3.259 -4.426) 5.610 16.405 ( 1.813 2.084 0.393) 2.790 16.455 ( -0.398 -0.534 -2.916) 2.991 ======================= Grid point 244 (120/172) ======================= q-point: (-0.10 0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 2.704 20.012 7.770) 21.637 2.867 ( -2.248 11.141 2.528) 11.643 3.001 ( 2.063 15.483 1.734) 15.716 3.241 ( 0.240 8.358 -4.227) 9.369 3.694 ( -4.149 1.838 5.567) 7.182 3.994 ( 3.572 1.001 3.279) 4.952 4.264 ( 1.029 -0.343 1.900) 2.188 4.379 ( -3.617 -6.421 12.238) 14.286 4.495 ( 0.806 -7.472 0.049) 7.515 4.634 ( 0.620 -4.932 1.406) 5.166 4.950 ( 7.747 -12.445 -6.753) 16.140 5.175 ( 3.799 -5.260 -15.210) 16.536 5.899 ( -8.521 3.191 4.934) 10.351 6.135 ( -1.766 -0.172 2.345) 2.941 6.349 ( 0.070 -0.938 5.995) 6.068 6.517 ( -2.618 -0.150 -1.185) 2.878 6.648 ( 0.355 5.388 -3.035) 6.194 6.809 ( 1.267 5.486 -6.610) 8.683 6.996 ( -2.775 4.564 1.233) 5.482 7.177 ( 3.323 3.182 -0.661) 4.648 7.850 ( 0.320 3.241 6.226) 7.026 8.072 ( -0.277 1.769 -1.646) 2.432 8.482 ( -0.165 3.400 2.582) 4.272 8.527 ( -0.650 3.888 -1.169) 4.111 8.732 ( -1.144 0.004 -0.147) 1.153 8.850 ( -3.532 -0.279 -2.062) 4.100 9.086 ( -1.893 4.447 -4.422) 6.551 9.140 ( 1.346 9.851 -0.439) 9.952 9.295 ( -3.207 10.116 0.975) 10.657 9.461 ( 2.885 7.680 -2.210) 8.497 9.580 ( 4.903 -3.524 4.750) 7.682 9.827 ( 4.929 -3.420 -4.360) 7.417 10.087 ( 0.773 -1.413 -0.779) 1.789 10.171 ( -0.932 1.479 -4.876) 5.180 10.296 ( -2.419 -9.434 6.980) 11.982 10.547 ( -1.732 -7.378 -2.667) 8.034 10.686 ( -2.295 -2.795 1.580) 3.947 10.873 ( 1.251 -0.673 -1.748) 2.252 10.965 ( -0.960 -1.649 -2.324) 3.007 11.026 ( 2.519 -5.148 -1.664) 5.968 11.276 ( -0.846 -0.991 0.650) 1.456 11.348 ( 3.281 -7.048 -1.315) 7.885 11.542 ( -6.281 -2.407 2.398) 7.141 11.660 ( 2.677 -4.739 7.294) 9.101 11.894 ( -0.171 -3.742 2.763) 4.655 12.119 ( 3.333 0.882 -3.263) 4.747 12.337 ( -1.808 -0.643 -0.385) 1.957 12.491 ( 5.517 1.925 -4.239) 7.219 12.896 ( -6.094 -2.427 2.278) 6.944 13.114 ( 1.928 -1.040 -2.524) 3.342 15.961 ( -0.804 2.341 1.261) 2.778 16.093 ( 2.778 2.930 -2.228) 4.612 16.379 ( 1.588 2.426 0.969) 3.057 16.444 ( 0.358 0.769 -3.671) 3.767 ======================= Grid point 249 (121/172) ======================= q-point: ( 0.40 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( 10.585 0.000 -9.015) 13.904 2.866 ( 9.764 0.000 -2.459) 10.068 3.234 ( 7.718 0.000 22.052) 23.363 3.264 ( 11.322 0.000 -2.887) 11.685 3.533 ( -11.412 -0.000 6.820) 13.294 3.749 ( -5.833 -0.000 4.714) 7.500 4.323 ( 10.574 0.000 -3.712) 11.207 4.371 ( 0.647 0.000 5.507) 5.545 4.882 ( -8.908 -0.000 -5.904) 10.687 4.911 ( -3.210 -0.000 -12.997) 13.388 5.158 ( -4.472 -0.000 0.034) 4.473 5.293 ( 3.019 0.000 -10.292) 10.726 5.814 ( 1.750 0.000 9.877) 10.031 6.143 ( -0.527 -0.000 7.459) 7.478 6.207 ( -1.159 -0.000 -5.649) 5.766 6.487 ( -5.631 -0.000 8.075) 9.845 6.495 ( 2.076 0.000 -2.999) 3.647 6.560 ( 0.769 0.000 0.899) 1.183 6.689 ( 1.786 0.000 -2.352) 2.953 6.881 ( 5.885 0.000 -8.971) 10.729 7.608 ( 5.988 0.000 -0.874) 6.052 7.745 ( -9.228 -0.000 5.425) 10.704 8.008 ( -1.197 -0.000 3.658) 3.849 8.212 ( 4.054 0.000 -5.464) 6.804 8.336 ( -2.901 -0.000 0.914) 3.042 8.397 ( -3.300 -0.000 0.963) 3.438 8.555 ( -5.003 -0.000 7.445) 8.969 8.771 ( 1.007 0.000 -4.766) 4.871 9.066 ( 0.579 0.000 0.050) 0.581 9.260 ( -1.776 -0.000 -1.651) 2.425 9.666 ( -3.972 -0.000 0.470) 3.999 9.711 ( -0.565 -0.000 -3.696) 3.738 9.807 ( -4.001 -0.000 4.709) 6.179 10.064 ( 0.127 0.000 -3.512) 3.515 10.424 ( -2.034 -0.000 1.103) 2.314 10.469 ( 1.295 0.000 -5.227) 5.385 10.928 ( 1.168 0.000 -3.307) 3.508 10.959 ( 1.911 0.000 -2.754) 3.352 11.144 ( 2.556 0.000 3.670) 4.473 11.262 ( -2.399 -0.000 2.454) 3.432 11.585 ( -3.551 -0.000 5.275) 6.359 11.745 ( 6.051 0.000 -0.205) 6.054 11.794 ( -6.010 -0.000 7.999) 10.005 11.953 ( 0.103 0.000 -2.881) 2.883 12.071 ( -1.714 -0.000 -0.731) 1.864 12.283 ( -1.604 -0.000 -7.810) 7.973 12.644 ( 1.811 0.000 2.077) 2.756 12.749 ( -2.103 -0.000 0.095) 2.105 13.220 ( 8.897 0.000 0.201) 8.899 13.350 ( 1.660 0.000 -0.716) 1.808 16.057 ( 2.211 0.000 3.579) 4.207 16.238 ( 5.108 0.000 3.980) 6.476 16.308 ( 3.341 0.000 -4.336) 5.474 16.631 ( 2.506 0.000 -5.548) 6.088 ======================= Grid point 250 (122/172) ======================= q-point: (-0.50 -0.60 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( 2.584 -1.647 -2.496) 3.952 2.947 ( -4.017 -6.742 -4.701) 9.148 3.273 ( -1.181 1.757 9.997) 10.219 3.376 ( 4.491 -3.777 -0.524) 5.891 3.490 ( 6.190 4.355 12.604) 14.701 3.780 ( 5.888 -1.158 12.706) 14.052 4.200 ( -0.450 8.287 -4.867) 9.621 4.517 ( -2.782 -5.817 -1.958) 6.738 4.758 ( -9.500 2.803 -4.323) 10.807 4.905 ( 2.169 -3.681 -12.512) 13.221 5.073 ( -4.952 5.078 1.310) 7.213 5.286 ( 1.581 1.513 -7.686) 7.992 5.867 ( 1.515 -1.875 6.398) 6.837 6.111 ( 3.388 3.019 4.592) 6.456 6.228 ( -2.053 -1.809 -3.003) 4.063 6.390 ( 0.154 3.234 4.313) 5.393 6.582 ( 1.750 -2.809 -1.510) 3.638 6.608 ( -1.284 -4.071 0.000) 4.269 6.745 ( 0.366 -6.867 -1.232) 6.986 6.935 ( 4.513 -3.797 -7.960) 9.907 7.687 ( 3.447 -3.514 0.849) 4.995 7.722 ( -5.666 -3.859 4.202) 8.041 8.059 ( -1.803 -5.897 4.022) 7.362 8.265 ( 2.866 -4.571 -4.529) 7.044 8.353 ( -2.211 -4.126 0.929) 4.773 8.413 ( -2.130 -4.194 -0.052) 4.705 8.565 ( -3.557 -2.910 6.273) 7.776 8.775 ( 2.533 -0.470 -3.968) 4.731 9.103 ( 2.372 -2.739 1.013) 3.763 9.258 ( -1.701 -1.845 -1.953) 3.180 9.620 ( -1.936 1.381 -0.540) 2.438 9.716 ( -2.122 -2.058 -3.029) 4.232 9.807 ( -1.570 -0.996 4.391) 4.768 10.060 ( 0.688 -0.495 -4.614) 4.691 10.424 ( -1.695 -1.365 0.732) 2.296 10.485 ( 2.143 -1.528 -4.412) 5.137 10.892 ( 0.532 3.459 -2.276) 4.175 10.954 ( -1.119 0.745 -3.660) 3.899 11.137 ( 3.266 4.430 3.267) 6.400 11.226 ( -1.154 3.039 1.178) 3.457 11.532 ( -3.197 4.366 5.714) 7.870 11.723 ( -1.029 3.786 2.238) 4.516 11.811 ( -0.639 -1.172 5.659) 5.814 11.926 ( 1.612 3.408 -0.288) 3.781 12.025 ( -1.603 3.086 -1.436) 3.762 12.260 ( -1.620 -1.008 -7.633) 7.868 12.629 ( 1.013 3.731 2.055) 4.378 12.721 ( -2.236 0.967 -1.067) 2.660 13.195 ( 4.799 7.991 3.567) 9.981 13.378 ( 3.444 -0.031 -3.245) 4.732 16.092 ( 1.851 -1.016 3.769) 4.320 16.229 ( 3.604 4.002 1.536) 5.600 16.360 ( 1.235 -2.785 -1.498) 3.394 16.609 ( 1.379 2.382 -6.013) 6.613 ======================= Grid point 251 (123/172) ======================= q-point: (-0.40 -0.60 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -7.275 -7.291 4.049) 11.067 2.974 ( -14.042 -6.595 -2.697) 15.746 3.293 ( -2.261 -3.551 7.195) 8.336 3.427 ( 6.099 1.418 4.117) 7.494 3.585 ( 12.810 -0.466 11.808) 17.428 3.872 ( 4.338 1.307 6.375) 7.821 4.089 ( 2.865 1.498 -4.807) 5.793 4.467 ( -6.315 4.151 -5.632) 9.425 4.613 ( -11.272 4.330 0.855) 12.105 4.910 ( -7.634 6.419 0.544) 9.989 4.997 ( 7.523 -2.587 -9.161) 12.133 5.218 ( 1.583 5.422 -5.434) 7.838 5.921 ( 1.927 -1.198 4.314) 4.874 6.159 ( 3.874 -2.574 1.366) 4.848 6.182 ( -4.926 1.461 -0.067) 5.139 6.416 ( 2.559 -2.563 -1.797) 4.043 6.604 ( 0.453 -1.375 -0.643) 1.584 6.686 ( 0.136 -4.734 -2.322) 5.275 6.894 ( -1.147 -9.827 0.296) 9.898 7.023 ( 2.812 -4.836 -4.697) 7.305 7.728 ( -5.485 -3.987 5.804) 8.926 7.852 ( 5.759 -7.048 -0.464) 9.114 8.172 ( -4.412 -7.238 4.812) 9.747 8.368 ( 1.285 -6.546 -2.473) 7.115 8.464 ( -3.013 -11.083 -0.735) 11.508 8.512 ( 2.045 -7.671 -1.776) 8.135 8.639 ( -0.556 -6.721 3.861) 7.771 8.812 ( 3.478 -2.425 -2.757) 5.058 9.201 ( 4.689 -4.969 1.272) 6.949 9.280 ( -1.736 -2.840 -1.885) 3.825 9.587 ( -2.322 0.979 0.382) 2.548 9.738 ( -1.283 -3.720 -3.978) 5.596 9.838 ( -0.077 -2.255 3.207) 3.921 10.063 ( 1.859 -0.187 -5.715) 6.013 10.438 ( -0.915 -0.932 0.297) 1.340 10.523 ( 3.220 -1.413 -3.525) 4.979 10.794 ( -2.657 7.143 -0.167) 7.623 10.897 ( 0.729 4.140 -4.474) 6.139 11.059 ( 1.096 7.170 3.895) 8.233 11.177 ( 1.143 2.058 -1.237) 2.660 11.431 ( -2.898 6.299 6.472) 9.485 11.638 ( -0.827 5.771 0.302) 5.838 11.819 ( -0.598 2.155 6.073) 6.472 11.847 ( 1.877 7.660 1.253) 7.985 11.961 ( -1.901 1.703 -0.057) 2.553 12.241 ( -0.999 -0.350 -7.017) 7.097 12.547 ( -2.048 5.867 2.384) 6.656 12.680 ( 0.300 2.140 -2.896) 3.613 13.089 ( 0.662 7.917 5.967) 9.936 13.357 ( 3.501 4.495 -4.841) 7.476 16.128 ( 2.102 0.821 4.015) 4.606 16.200 ( 1.318 1.329 0.896) 2.075 16.391 ( -1.613 -1.563 -1.254) 2.573 16.547 ( 0.753 3.493 -6.175) 7.135 ======================= Grid point 252 (124/172) ======================= q-point: (-0.30 -0.60 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.895 ( -11.081 -9.785 5.344) 15.719 2.984 ( -12.557 -7.708 1.895) 14.855 3.367 ( -9.089 -6.436 7.619) 13.493 3.446 ( 4.623 3.636 3.560) 6.875 3.692 ( 8.766 3.067 11.617) 14.873 3.906 ( 9.293 -2.691 -3.244) 10.204 4.132 ( 1.176 -1.734 -0.648) 2.193 4.315 ( -0.505 6.695 -5.181) 8.480 4.466 ( -6.464 4.322 5.191) 9.350 4.715 ( -7.049 8.661 2.561) 11.457 5.050 ( 2.504 1.454 -8.816) 9.279 5.106 ( 6.340 6.570 -7.972) 12.121 5.964 ( 0.107 -0.781 4.105) 4.180 6.142 ( -4.608 -1.449 0.811) 4.898 6.210 ( -1.213 -2.245 -0.135) 2.555 6.466 ( 1.093 -1.655 -4.092) 4.547 6.656 ( 1.763 -3.575 0.695) 4.046 6.755 ( -0.824 -4.551 -2.533) 5.273 7.034 ( -1.512 -7.022 -0.143) 7.185 7.108 ( 1.402 -4.052 -1.887) 4.684 7.785 ( -2.380 -4.122 6.110) 7.745 7.996 ( 2.541 -5.067 -0.534) 5.694 8.265 ( -2.993 -6.684 4.773) 8.742 8.479 ( -0.795 -6.303 -2.571) 6.854 8.636 ( 0.909 -6.692 -0.769) 6.797 8.652 ( 1.277 -8.642 -2.624) 9.122 8.849 ( 2.715 -14.825 1.625) 15.159 8.913 ( 1.258 -9.173 -1.812) 9.434 9.268 ( -4.448 -1.686 -2.546) 5.395 9.393 ( 10.832 -7.323 -0.182) 13.077 9.543 ( -3.312 1.646 2.859) 4.675 9.811 ( -0.393 -6.724 -5.680) 8.811 9.902 ( 0.331 -4.015 1.110) 4.179 10.060 ( 2.313 0.776 -4.501) 5.120 10.415 ( 0.108 5.217 -0.705) 5.266 10.517 ( 2.745 6.853 -0.774) 7.423 10.649 ( -1.816 3.236 -0.576) 3.755 10.817 ( 5.170 5.615 -3.190) 8.272 10.986 ( -1.374 1.598 3.821) 4.363 11.152 ( 0.381 1.927 -2.446) 3.137 11.317 ( -1.415 6.547 6.360) 9.237 11.513 ( -0.003 7.947 -2.015) 8.198 11.710 ( -1.061 8.772 1.634) 8.986 11.765 ( -0.263 4.378 2.155) 4.887 11.933 ( -0.879 2.034 6.198) 6.582 12.219 ( -0.132 0.492 -5.581) 5.604 12.426 ( -4.679 5.174 2.277) 7.338 12.637 ( 2.513 3.079 -4.391) 5.923 12.982 ( -2.853 5.266 5.724) 8.285 13.266 ( 2.466 6.588 -4.867) 8.554 16.112 ( 2.319 3.746 4.990) 6.657 16.199 ( -1.964 -0.279 -1.494) 2.483 16.393 ( -3.109 -1.752 -1.964) 4.074 16.486 ( 1.630 2.484 -4.329) 5.250 ======================= Grid point 253 (125/172) ======================= q-point: (-0.20 -0.60 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.948 ( -10.811 -4.221 2.215) 11.815 3.047 ( -8.658 -7.481 2.740) 11.765 3.335 ( -2.242 7.683 0.378) 8.012 3.429 ( -5.401 -2.196 8.461) 10.275 3.723 ( 3.847 3.017 10.953) 11.994 4.015 ( 1.836 0.313 1.759) 2.562 4.119 ( 0.660 -0.607 3.048) 3.177 4.305 ( 9.542 -3.045 -3.819) 10.719 4.397 ( 0.390 4.223 6.867) 8.071 4.573 ( -4.758 0.790 -2.758) 5.556 4.901 ( -0.517 8.473 -8.363) 11.916 5.107 ( 9.813 1.543 -10.652) 14.565 5.942 ( -6.595 1.170 1.299) 6.822 6.151 ( -3.721 -2.924 -1.121) 4.864 6.259 ( -0.884 -3.214 6.976) 7.732 6.470 ( -0.394 -0.401 -0.937) 1.093 6.725 ( 1.953 -1.538 -0.358) 2.511 6.813 ( -0.439 -3.651 -3.082) 4.798 7.090 ( -2.259 -1.279 -0.618) 2.668 7.173 ( 0.952 -2.981 -0.973) 3.277 7.856 ( 0.174 -2.866 6.319) 6.940 8.058 ( -1.950 -2.493 0.106) 3.166 8.384 ( 0.376 -6.276 4.070) 7.489 8.548 ( -1.214 -3.532 -3.097) 4.851 8.716 ( 1.619 -2.316 -2.258) 3.617 8.761 ( 2.130 -3.514 -2.262) 4.690 9.090 ( 0.826 -6.111 0.530) 6.189 9.137 ( -1.797 -14.897 -2.627) 15.234 9.279 ( -3.348 -9.825 -0.789) 10.410 9.458 ( 1.421 4.108 -1.181) 4.504 9.655 ( 8.693 -6.202 2.047) 10.873 9.885 ( 2.478 -2.254 -7.037) 7.793 9.964 ( -2.920 -3.795 -0.585) 4.824 10.056 ( 0.253 0.173 -0.125) 0.331 10.235 ( -0.017 10.641 -0.057) 10.642 10.432 ( 6.401 4.546 -0.501) 7.866 10.626 ( -1.594 0.496 -0.002) 1.669 10.811 ( 4.582 -1.682 -2.792) 5.623 10.997 ( 0.501 -0.774 1.677) 1.913 11.065 ( -1.732 6.575 1.572) 6.979 11.265 ( 1.818 0.727 1.329) 2.367 11.370 ( 1.209 7.850 -3.843) 8.824 11.556 ( -5.803 5.830 2.019) 8.470 11.702 ( 0.569 3.790 2.660) 4.665 11.900 ( -0.040 3.630 9.042) 9.743 12.178 ( -1.283 2.029 -5.265) 5.786 12.339 ( -3.714 1.172 1.083) 4.042 12.593 ( 4.478 3.558 -4.500) 7.278 12.899 ( -4.838 2.468 4.307) 6.932 13.167 ( 0.940 4.630 -4.153) 6.290 16.074 ( 1.160 4.137 4.883) 6.504 16.162 ( -2.266 0.984 -3.563) 4.336 16.394 ( -3.075 -1.771 -2.891) 4.577 16.468 ( 2.583 0.980 -1.353) 3.076 ======================= Grid point 254 (126/172) ======================= q-point: (-0.10 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.881 ( -7.663 2.938 -0.500) 8.222 3.054 ( 0.741 6.365 1.784) 6.651 3.158 ( -0.880 7.457 -1.425) 7.643 3.432 ( 0.122 5.880 12.150) 13.498 3.673 ( -6.122 3.157 9.915) 12.072 4.010 ( -1.228 -1.268 2.279) 2.882 4.197 ( -0.040 -4.998 7.452) 8.973 4.367 ( 0.894 0.364 5.288) 5.375 4.448 ( 6.162 -0.780 -4.244) 7.523 4.571 ( 0.117 -4.832 -4.431) 6.558 4.831 ( 4.569 -4.040 -8.870) 10.765 5.133 ( 8.231 0.254 -10.307) 13.192 5.859 ( -7.940 1.162 -0.321) 8.031 6.136 ( -7.020 0.420 0.616) 7.060 6.333 ( 1.139 -3.023 7.668) 8.321 6.490 ( 0.101 -1.004 3.468) 3.612 6.724 ( 1.662 2.762 -1.280) 3.469 6.843 ( 0.804 -0.370 -4.338) 4.427 7.049 ( -2.189 3.169 -0.692) 3.913 7.213 ( 1.088 -0.819 -0.907) 1.636 7.906 ( 1.405 0.082 5.778) 5.947 8.063 ( -3.527 -0.657 1.048) 3.737 8.482 ( -0.143 -2.935 3.586) 4.636 8.563 ( 0.417 0.217 -2.872) 2.911 8.727 ( 0.636 0.517 -2.648) 2.772 8.809 ( -0.989 -1.560 -1.565) 2.421 9.066 ( -3.791 0.824 -4.433) 5.891 9.293 ( 2.139 2.393 0.062) 3.210 9.411 ( -0.571 1.192 -0.102) 1.326 9.492 ( 0.454 -9.285 -0.970) 9.346 9.660 ( 5.133 6.903 -0.488) 8.616 9.827 ( 1.602 4.971 -3.645) 6.369 10.040 ( 1.775 -5.611 -0.240) 5.890 10.107 ( 1.842 -2.298 -1.083) 3.138 10.183 ( -2.350 -5.206 1.029) 5.804 10.461 ( 4.030 -1.507 -0.580) 4.342 10.610 ( -3.543 -2.179 1.202) 4.330 10.888 ( 1.955 -1.229 -2.966) 3.759 10.931 ( 0.811 2.184 0.980) 2.528 11.024 ( -0.035 1.663 -1.987) 2.591 11.271 ( 0.089 2.032 0.069) 2.035 11.300 ( 2.786 -1.721 -1.690) 3.685 11.468 ( -5.847 -0.822 1.856) 6.190 11.669 ( 0.713 1.365 6.527) 6.707 11.872 ( -1.508 1.146 5.430) 5.751 12.131 ( 0.696 0.171 -4.992) 5.043 12.326 ( -0.124 -0.549 0.988) 1.137 12.568 ( 6.096 2.849 -3.480) 7.576 12.843 ( -5.571 0.622 3.020) 6.367 13.109 ( -0.512 0.983 -3.784) 3.943 16.012 ( -1.331 3.765 2.119) 4.520 16.138 ( 2.090 0.872 -1.446) 2.686 16.388 ( -1.752 -0.961 -3.291) 3.850 16.468 ( 2.058 1.266 -0.381) 2.446 ======================= Grid point 260 (127/172) ======================= q-point: (-0.50 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.708 ( -9.875 -0.000 2.497) 10.185 2.774 ( -17.668 -0.000 -2.129) 17.795 3.278 ( -1.494 -0.000 3.031) 3.379 3.431 ( 14.380 0.000 -3.541) 14.809 3.650 ( 9.330 0.000 18.072) 20.338 3.857 ( 8.874 0.000 8.322) 12.166 4.268 ( -15.047 -0.000 -0.768) 15.066 4.371 ( -0.482 -0.000 -2.774) 2.815 4.731 ( -5.672 -0.000 -6.477) 8.610 4.824 ( 0.245 0.000 -11.133) 11.135 5.092 ( -4.228 -0.000 1.365) 4.443 5.289 ( 3.613 0.000 -9.266) 9.945 5.880 ( 0.561 0.000 8.457) 8.475 6.188 ( 3.254 0.000 -6.288) 7.080 6.193 ( 1.233 0.000 7.756) 7.853 6.452 ( -4.481 -0.000 8.926) 9.987 6.526 ( 3.334 0.000 -4.252) 5.403 6.565 ( -0.074 -0.000 0.320) 0.329 6.703 ( 1.610 0.000 -3.127) 3.517 6.905 ( 3.700 0.000 -10.337) 10.979 7.641 ( -6.974 -0.000 4.668) 8.392 7.702 ( 5.561 0.000 0.814) 5.620 8.006 ( -1.350 -0.000 3.330) 3.593 8.223 ( 1.580 0.000 -5.207) 5.442 8.321 ( -0.575 -0.000 1.718) 1.812 8.357 ( -2.448 -0.000 0.910) 2.612 8.540 ( -1.592 -0.000 6.990) 7.168 8.779 ( 3.211 0.000 -4.601) 5.611 9.109 ( 4.182 0.000 1.941) 4.610 9.219 ( -2.197 -0.000 -2.649) 3.441 9.611 ( -2.861 -0.000 -0.344) 2.881 9.682 ( -0.404 -0.000 -3.416) 3.440 9.811 ( 0.856 0.000 5.448) 5.515 10.052 ( 1.661 0.000 -5.176) 5.436 10.398 ( -1.792 -0.000 0.771) 1.951 10.483 ( 3.497 0.000 -3.951) 5.276 10.905 ( -1.885 -0.000 -2.084) 2.810 10.947 ( -0.829 -0.000 -3.613) 3.707 11.216 ( 3.987 0.000 2.505) 4.709 11.246 ( -0.930 -0.000 0.966) 1.341 11.560 ( -3.507 -0.000 5.995) 6.945 11.759 ( -4.971 -0.000 10.659) 11.762 11.794 ( 1.336 0.000 -3.076) 3.354 11.962 ( 1.640 0.000 0.512) 1.718 12.050 ( -0.366 -0.000 -1.131) 1.189 12.220 ( -0.407 -0.000 -7.712) 7.722 12.684 ( 1.910 0.000 2.137) 2.867 12.700 ( -3.549 -0.000 -0.337) 3.565 13.343 ( 5.798 0.000 0.467) 5.817 13.351 ( -1.059 -0.000 -1.979) 2.244 16.102 ( 0.957 0.000 4.053) 4.164 16.306 ( -0.180 -0.000 -5.302) 5.305 16.330 ( 2.800 0.000 5.470) 6.145 16.617 ( -0.107 -0.000 -6.674) 6.675 ======================= Grid point 261 (128/172) ======================= q-point: (-0.40 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( -19.844 -3.697 6.199) 21.116 2.696 ( -22.042 -7.615 2.273) 23.430 3.283 ( 2.204 0.774 0.532) 2.396 3.540 ( 13.871 0.853 -0.344) 13.902 3.733 ( 9.428 1.941 12.552) 15.818 3.930 ( 0.627 1.287 4.804) 5.013 4.098 ( -9.321 0.705 -1.039) 9.405 4.395 ( -7.203 -2.373 0.270) 7.589 4.603 ( -5.158 5.342 -6.186) 9.665 4.892 ( 3.171 -5.250 -8.229) 10.263 5.025 ( -2.595 3.122 2.376) 4.703 5.284 ( 3.554 1.746 -7.526) 8.504 5.917 ( 1.118 -0.779 6.248) 6.394 6.156 ( 0.336 3.470 -3.995) 5.303 6.228 ( 2.949 0.341 4.914) 5.741 6.426 ( 1.014 0.963 2.581) 2.935 6.561 ( -0.731 -2.152 -3.740) 4.376 6.621 ( 0.282 -4.313 1.234) 4.495 6.741 ( 0.523 -5.432 -2.100) 5.847 6.942 ( 1.984 -4.398 -7.986) 9.330 7.635 ( -4.341 -3.238 3.608) 6.508 7.792 ( 4.619 -5.119 2.099) 7.207 8.049 ( -1.427 -4.735 3.023) 5.796 8.270 ( 0.248 -5.320 -4.524) 6.988 8.320 ( -1.623 -2.154 2.078) 3.405 8.406 ( 0.912 -5.744 -0.459) 5.834 8.576 ( 0.162 -2.611 6.079) 6.618 8.806 ( 4.269 -1.151 -4.221) 6.113 9.176 ( 5.207 -2.464 1.311) 5.908 9.211 ( -2.066 -2.294 -2.459) 3.947 9.587 ( -1.902 0.440 -0.091) 1.955 9.681 ( -0.106 -1.188 -2.893) 3.129 9.842 ( 2.597 -0.212 4.883) 5.535 10.059 ( 2.894 -0.517 -5.515) 6.250 10.403 ( -1.170 -1.682 0.359) 2.080 10.516 ( 4.133 -1.464 -3.476) 5.595 10.855 ( -3.066 3.261 -1.017) 4.591 10.920 ( -1.220 0.759 -2.926) 3.260 11.205 ( 2.045 5.134 0.885) 5.597 11.224 ( 1.944 2.495 0.415) 3.190 11.510 ( -4.280 4.099 6.862) 9.067 11.708 ( -1.827 3.630 3.438) 5.323 11.827 ( -1.362 -2.295 4.044) 4.845 11.954 ( 1.241 2.909 0.818) 3.267 12.006 ( 0.215 4.119 -0.729) 4.188 12.206 ( 0.152 -0.601 -7.387) 7.413 12.625 ( -2.977 4.458 1.380) 5.535 12.707 ( 1.248 0.586 0.151) 1.387 13.233 ( -2.152 7.822 1.578) 8.264 13.408 ( 2.616 -0.088 -3.522) 4.388 16.129 ( 0.196 -1.080 3.480) 3.649 16.261 ( 0.076 2.398 -2.134) 3.211 16.362 ( -0.920 -0.151 2.688) 2.845 16.574 ( -1.206 1.907 -7.246) 7.590 ======================= Grid point 262 (129/172) ======================= q-point: (-0.30 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.596 ( -20.522 -10.953 6.857) 24.252 2.695 ( -21.660 -11.353 7.295) 25.520 3.281 ( -1.985 -0.162 1.359) 2.411 3.562 ( 1.790 4.779 4.460) 6.778 3.838 ( 7.707 -0.658 -1.052) 7.806 3.892 ( 5.969 -1.239 2.912) 6.756 4.104 ( -4.462 -2.980 0.346) 5.376 4.350 ( -6.088 1.024 2.752) 6.759 4.470 ( -2.336 4.373 -3.534) 6.089 4.831 ( -3.847 8.264 4.527) 10.178 5.077 ( 6.621 -2.838 -4.598) 8.546 5.234 ( 4.301 5.207 -6.279) 9.222 5.948 ( -0.595 -0.715 3.191) 3.323 6.070 ( -4.045 2.511 -1.844) 5.105 6.250 ( 2.149 1.561 1.544) 3.073 6.438 ( 2.085 -1.675 -4.209) 4.987 6.607 ( 1.065 -3.770 0.669) 3.974 6.680 ( -0.294 -3.086 -0.992) 3.255 6.871 ( -1.362 -9.210 -0.525) 9.325 7.025 ( 0.348 -5.585 -3.878) 6.809 7.698 ( -1.354 -5.365 3.090) 6.337 7.926 ( 1.220 -5.434 2.805) 6.236 8.148 ( 0.163 -6.841 2.770) 7.383 8.343 ( -3.368 -6.857 -0.826) 7.684 8.437 ( 1.821 -9.795 -1.771) 10.119 8.551 ( 2.746 -8.549 -1.109) 9.048 8.668 ( 0.788 -6.867 3.517) 7.755 8.861 ( 5.086 -2.361 -3.389) 6.551 9.202 ( -3.309 -1.494 -3.509) 5.049 9.323 ( 6.498 -7.150 1.463) 9.771 9.563 ( -1.226 1.035 0.499) 1.680 9.713 ( 1.100 -3.186 -2.808) 4.387 9.887 ( 3.649 -0.877 3.220) 4.945 10.078 ( 3.691 -0.026 -4.730) 6.000 10.432 ( 0.304 -1.616 -0.395) 1.691 10.571 ( 3.974 -1.313 -2.487) 4.869 10.739 ( -2.362 7.126 -0.494) 7.523 10.894 ( 0.024 0.845 -1.798) 1.986 11.102 ( 2.213 8.386 1.140) 8.748 11.184 ( 0.890 3.288 -1.462) 3.707 11.412 ( -4.251 4.980 7.084) 9.646 11.628 ( -0.267 5.850 0.037) 5.856 11.828 ( -2.717 3.505 2.039) 4.881 11.871 ( 1.011 7.089 1.438) 7.303 11.958 ( 0.577 1.177 3.572) 3.805 12.201 ( 0.426 -0.666 -5.985) 6.037 12.504 ( -4.533 6.743 2.012) 8.370 12.696 ( 2.591 2.154 -1.038) 3.526 13.072 ( -5.829 7.496 3.066) 9.978 13.371 ( 1.748 4.802 -5.035) 7.174 16.148 ( -1.735 -0.757 1.188) 2.235 16.221 ( 0.552 2.620 0.634) 2.752 16.341 ( -4.146 0.164 0.359) 4.165 16.512 ( -0.494 1.628 -5.978) 6.215 ======================= Grid point 263 (130/172) ======================= q-point: (-0.20 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -18.272 -13.403 4.724) 23.147 2.788 ( -16.403 -13.702 9.948) 23.575 3.270 ( -6.637 -2.710 0.496) 7.186 3.487 ( -0.680 4.165 2.027) 4.682 3.870 ( 6.337 1.875 2.997) 7.256 4.016 ( 1.707 0.126 1.521) 2.289 4.107 ( 1.894 -3.359 -2.882) 4.814 4.317 ( -3.129 -2.096 3.511) 5.149 4.412 ( 2.100 1.919 -1.532) 3.231 4.655 ( -3.922 9.992 8.106) 13.451 5.043 ( 1.834 9.120 -4.841) 10.487 5.208 ( 9.943 2.053 -6.875) 12.261 5.933 ( -2.815 1.494 -1.917) 3.719 6.022 ( -7.016 -1.973 1.735) 7.492 6.241 ( -1.150 -1.193 1.038) 1.955 6.484 ( 5.429 -0.760 -2.352) 5.965 6.694 ( 1.871 -3.869 1.300) 4.490 6.732 ( -0.460 -4.131 -1.621) 4.461 6.996 ( -2.441 -6.712 -1.457) 7.290 7.105 ( -0.786 -4.708 -1.065) 4.891 7.801 ( 0.682 -5.414 3.649) 6.564 7.989 ( -4.249 -3.090 3.338) 6.225 8.301 ( 4.621 -6.809 2.555) 8.617 8.441 ( -2.087 -6.871 -2.159) 7.498 8.632 ( 0.562 -9.390 -0.405) 9.416 8.687 ( 3.000 -6.664 -2.368) 7.682 8.845 ( -1.075 -12.072 -1.977) 12.280 8.982 ( 5.760 -8.650 0.963) 10.437 9.168 ( -5.041 0.046 -3.930) 6.393 9.495 ( 0.585 -2.042 -0.812) 2.274 9.577 ( 5.442 -6.936 1.568) 8.955 9.795 ( 2.594 -5.832 -2.531) 6.866 9.934 ( 2.814 -0.352 -0.228) 2.845 10.086 ( 3.021 1.697 -1.392) 3.734 10.413 ( 0.687 6.767 -1.146) 6.898 10.541 ( -0.012 3.529 0.391) 3.550 10.668 ( 5.057 2.133 -2.446) 6.009 10.861 ( 1.334 3.977 -0.968) 4.305 11.008 ( 2.323 3.171 2.095) 4.454 11.128 ( -1.685 2.569 -1.697) 3.510 11.329 ( -0.900 3.867 4.925) 6.326 11.497 ( -0.408 8.255 -2.386) 8.603 11.674 ( -3.326 10.060 -0.962) 10.639 11.780 ( 0.065 4.775 2.434) 5.360 11.971 ( 0.772 1.034 7.287) 7.400 12.187 ( -1.035 1.345 -4.262) 4.587 12.358 ( -4.810 5.082 1.959) 7.266 12.674 ( 4.030 2.811 -1.573) 5.159 12.924 ( -6.962 4.386 2.869) 8.714 13.259 ( 0.218 6.870 -5.327) 8.696 16.133 ( -3.987 -0.099 -2.942) 4.956 16.171 ( 1.071 4.071 4.641) 6.265 16.317 ( -4.793 -2.138 -2.423) 5.780 16.489 ( 1.345 0.210 -3.060) 3.349 ======================= Grid point 264 (131/172) ======================= q-point: (-0.10 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.754 ( -12.689 -8.352 2.129) 15.339 2.934 ( -9.619 -12.076 5.849) 16.510 3.286 ( -2.721 -1.647 -3.698) 4.878 3.423 ( -1.161 2.286 8.354) 8.738 3.844 ( 2.288 10.412 13.509) 17.208 3.975 ( -2.058 -2.444 -5.748) 6.577 4.181 ( -0.072 -0.620 4.786) 4.827 4.367 ( -5.482 -4.283 -0.008) 6.957 4.454 ( 9.121 -0.025 -0.336) 9.127 4.512 ( -1.819 1.745 3.052) 3.958 4.869 ( 1.642 8.400 -8.288) 11.914 5.223 ( 9.596 3.181 -6.424) 11.978 5.853 ( -2.944 3.357 -2.539) 5.136 6.027 ( -8.087 -4.130 1.142) 9.152 6.284 ( -2.237 -4.230 3.908) 6.178 6.536 ( 7.296 0.878 3.800) 8.273 6.746 ( 0.942 -0.949 -1.123) 1.746 6.805 ( 1.309 -3.748 -2.021) 4.455 7.040 ( -2.905 -1.721 -2.182) 4.020 7.170 ( -0.799 -3.765 -0.314) 3.862 7.898 ( 0.738 -3.504 4.348) 5.633 8.009 ( -4.624 -2.556 3.486) 6.330 8.437 ( 2.933 -4.198 3.028) 5.949 8.521 ( 0.263 -4.233 -3.135) 5.274 8.718 ( 0.414 -2.307 -1.441) 2.752 8.785 ( 2.529 -1.638 -3.145) 4.355 9.037 ( -3.146 -3.082 -4.804) 6.517 9.134 ( 0.312 -13.430 -0.395) 13.440 9.263 ( 1.067 -14.182 1.780) 14.333 9.456 ( -0.756 2.996 -1.407) 3.395 9.752 ( 3.225 -3.832 -2.839) 5.758 9.905 ( 0.333 3.105 -1.382) 3.415 9.971 ( 4.396 -5.835 0.272) 7.311 10.028 ( -2.207 0.262 0.302) 2.242 10.277 ( 5.561 9.349 -0.472) 10.888 10.515 ( 2.865 2.583 -1.988) 4.340 10.613 ( 0.764 4.542 1.516) 4.849 10.858 ( 3.102 -2.077 -2.891) 4.722 11.008 ( -1.500 1.401 1.225) 2.390 11.045 ( -0.398 4.413 1.319) 4.623 11.299 ( 2.070 1.538 -0.644) 2.658 11.368 ( 0.407 5.250 -1.851) 5.582 11.468 ( -5.191 7.690 -0.249) 9.282 11.722 ( -0.679 2.858 4.225) 5.146 11.939 ( -1.683 5.293 6.909) 8.865 12.122 ( -1.433 0.893 -3.657) 4.029 12.311 ( -0.635 -0.829 0.917) 1.389 12.658 ( 5.598 2.933 -1.710) 6.547 12.833 ( -5.424 1.689 2.411) 6.171 13.134 ( -1.601 4.788 -4.998) 7.104 16.062 ( -3.669 3.166 -0.697) 4.896 16.160 ( 2.010 0.364 2.293) 3.071 16.321 ( -3.490 -2.912 -3.702) 5.862 16.495 ( 1.650 0.194 -1.295) 2.107 ======================= Grid point 271 (132/172) ======================= q-point: (-0.40 -0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -27.316 -0.000 3.255) 27.509 2.447 ( -25.534 -0.000 11.582) 28.038 3.314 ( 1.477 0.000 -1.852) 2.369 3.666 ( 16.147 0.000 -1.602) 16.227 3.816 ( -9.587 -0.000 9.825) 13.727 3.918 ( -4.122 -0.000 -5.791) 7.108 3.954 ( -14.940 -0.000 7.236) 16.600 4.392 ( 3.192 0.000 6.314) 7.075 4.651 ( 1.293 0.000 -5.661) 5.806 4.813 ( 6.661 0.000 -7.083) 9.723 5.039 ( -3.850 -0.000 2.710) 4.708 5.304 ( 4.302 0.000 -8.381) 9.420 5.952 ( 3.658 0.000 5.810) 6.866 6.209 ( 2.768 0.000 -7.387) 7.888 6.265 ( 2.896 0.000 6.512) 7.127 6.447 ( -2.806 -0.000 9.331) 9.744 6.494 ( -3.205 -0.000 -5.846) 6.667 6.598 ( 2.907 0.000 0.122) 2.910 6.698 ( 0.337 0.000 -3.809) 3.824 6.887 ( 1.362 0.000 -9.171) 9.271 7.587 ( -1.971 -0.000 1.531) 2.496 7.774 ( 0.726 0.000 5.734) 5.779 8.018 ( 1.716 0.000 0.656) 1.838 8.209 ( -0.092 -0.000 -4.550) 4.551 8.329 ( -1.319 -0.000 0.409) 1.381 8.338 ( 1.964 0.000 1.979) 2.788 8.577 ( 1.086 0.000 6.205) 6.300 8.818 ( 4.479 0.000 -3.844) 5.902 9.161 ( -2.884 -0.000 -3.472) 4.513 9.212 ( 7.432 0.000 0.666) 7.462 9.579 ( -0.954 -0.000 0.433) 1.047 9.666 ( 0.409 0.000 -1.517) 1.572 9.886 ( 4.590 0.000 5.085) 6.850 10.065 ( 3.852 0.000 -5.736) 6.909 10.379 ( -0.991 -0.000 0.593) 1.155 10.523 ( 3.763 0.000 -3.259) 4.978 10.864 ( -1.775 -0.000 -0.433) 1.827 10.894 ( -3.676 -0.000 -2.396) 4.388 11.238 ( -0.601 -0.000 -0.390) 0.717 11.296 ( 4.875 0.000 0.794) 4.940 11.533 ( -4.687 -0.000 7.120) 8.524 11.760 ( -2.152 -0.000 9.705) 9.941 11.773 ( -1.262 -0.000 -2.435) 2.743 11.988 ( 0.845 0.000 0.300) 0.896 12.047 ( 0.689 0.000 -0.403) 0.798 12.188 ( 1.317 0.000 -6.745) 6.872 12.640 ( -3.971 -0.000 0.271) 3.981 12.728 ( 2.027 0.000 2.313) 3.076 13.286 ( -5.290 -0.000 -3.711) 6.462 13.404 ( 2.258 0.000 -0.628) 2.343 16.131 ( -0.217 -0.000 3.748) 3.754 16.249 ( -3.141 -0.000 -5.291) 6.153 16.380 ( -0.508 -0.000 5.772) 5.794 16.550 ( -3.098 -0.000 -8.758) 9.289 ======================= Grid point 272 (133/172) ======================= q-point: (-0.30 -0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( -26.973 -7.606 7.010) 28.888 2.349 ( -26.672 -8.709 13.503) 31.138 3.273 ( -7.334 0.816 -2.243) 7.712 3.598 ( -21.421 3.771 6.306) 22.646 3.786 ( 1.097 -1.896 -6.574) 6.929 3.923 ( 4.127 -5.671 -4.277) 8.215 3.994 ( 0.597 -2.740 8.378) 8.835 4.411 ( 3.597 3.556 8.541) 9.926 4.565 ( 4.426 7.691 -3.124) 9.407 4.929 ( 3.596 1.464 -0.735) 3.952 5.025 ( 3.193 -4.830 0.366) 5.802 5.306 ( 4.119 1.561 -6.839) 8.134 5.989 ( 4.179 1.278 3.250) 5.446 6.122 ( -1.866 6.188 -4.627) 7.949 6.296 ( 0.769 2.159 2.501) 3.392 6.417 ( -0.723 -0.342 -2.661) 2.779 6.545 ( -0.468 -5.244 1.429) 5.455 6.618 ( -0.936 -2.291 0.378) 2.503 6.744 ( 1.348 -4.974 -1.544) 5.380 6.917 ( 0.207 -4.787 -6.473) 8.053 7.616 ( 0.503 -3.743 0.045) 3.777 7.839 ( -2.516 -5.359 7.259) 9.367 8.065 ( 2.252 -3.673 -0.797) 4.382 8.231 ( -0.990 -3.782 -2.524) 4.653 8.343 ( 2.507 -3.490 0.162) 4.300 8.430 ( 2.581 -6.384 0.336) 6.894 8.620 ( 1.077 -2.052 4.990) 5.502 8.857 ( 4.552 -1.568 -3.272) 5.821 9.143 ( -2.706 -1.422 -3.699) 4.799 9.295 ( 7.671 -2.764 -0.534) 8.171 9.569 ( -0.211 0.896 1.018) 1.373 9.686 ( 2.020 -1.541 -0.326) 2.561 9.934 ( 5.515 0.587 3.777) 6.710 10.090 ( 4.407 -0.729 -4.760) 6.527 10.395 ( -0.069 -2.159 0.249) 2.175 10.562 ( 3.535 -1.963 -2.559) 4.784 10.812 ( -1.472 3.530 -1.035) 3.963 10.874 ( -3.148 -0.836 -0.425) 3.284 11.196 ( -1.166 3.590 -1.657) 4.122 11.295 ( 4.347 4.533 0.290) 6.287 11.474 ( -4.683 4.180 7.322) 9.645 11.708 ( -0.219 3.650 1.686) 4.026 11.815 ( -2.670 -2.024 3.621) 4.933 11.969 ( 0.361 2.930 0.137) 2.955 12.023 ( 1.527 3.340 1.571) 3.994 12.182 ( 1.215 -0.154 -5.662) 5.793 12.572 ( -4.270 4.270 1.013) 6.123 12.743 ( 2.309 0.999 1.607) 2.985 13.150 ( -8.024 7.162 -1.775) 10.901 13.418 ( 1.122 0.784 -3.396) 3.661 16.130 ( -2.272 0.484 1.806) 2.943 16.213 ( -3.372 -0.830 -4.316) 5.540 16.359 ( -2.662 2.831 5.047) 6.370 16.494 ( -3.067 -0.007 -8.240) 8.792 ======================= Grid point 273 (134/172) ======================= q-point: (-0.20 -0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 304 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -23.592 -14.742 7.860) 28.908 2.406 ( -22.617 -15.629 14.543) 31.102 3.198 ( -8.648 -0.741 -2.507) 9.034 3.432 ( -19.607 -3.794 3.460) 20.268 3.832 ( 1.216 -4.322 -5.988) 7.484 3.960 ( -8.023 -2.954 -8.123) 11.793 4.135 ( 12.552 -1.856 8.825) 15.455 4.379 ( 6.208 6.436 7.892) 11.926 4.485 ( 3.336 4.871 1.782) 6.167 4.828 ( -1.428 8.911 7.786) 11.920 5.151 ( 4.599 0.154 -3.812) 5.976 5.285 ( 7.274 1.944 -4.692) 8.872 5.951 ( -0.939 4.593 -4.923) 6.798 6.018 ( -2.007 2.963 0.886) 3.687 6.226 ( -2.879 2.125 -1.624) 3.930 6.473 ( 4.657 -4.221 -3.020) 6.973 6.637 ( 0.963 -4.556 2.714) 5.390 6.667 ( -0.525 -3.542 -0.712) 3.650 6.852 ( -0.389 -6.860 -1.362) 7.005 6.997 ( -1.309 -6.117 -2.201) 6.632 7.714 ( 1.951 -6.043 0.038) 6.350 7.906 ( -5.851 -3.617 6.286) 9.319 8.198 ( 2.399 -10.246 -0.979) 10.569 8.305 ( 1.122 -4.912 0.096) 5.039 8.474 ( 3.171 -8.720 -1.717) 9.436 8.582 ( 1.882 -8.008 0.756) 8.261 8.693 ( 0.983 -5.189 1.182) 5.412 8.927 ( 4.348 -3.585 -1.667) 5.877 9.132 ( -2.117 -0.326 -3.710) 4.284 9.423 ( 5.675 -5.804 -1.767) 8.308 9.557 ( -0.052 0.374 2.004) 2.039 9.743 ( 3.299 -2.791 -0.143) 4.324 9.969 ( 4.613 0.880 0.356) 4.710 10.131 ( 5.430 -0.427 -1.141) 5.565 10.445 ( 1.686 -2.360 -0.423) 2.931 10.585 ( -1.634 2.266 0.014) 2.794 10.745 ( 4.169 3.172 -3.658) 6.389 10.871 ( -2.229 -1.165 0.920) 2.678 11.115 ( -0.534 3.329 -1.020) 3.523 11.209 ( 3.123 8.563 -1.073) 9.177 11.391 ( -2.610 3.793 5.930) 7.507 11.625 ( -0.148 6.717 -0.339) 6.727 11.770 ( -4.395 4.719 -0.459) 6.465 11.894 ( 1.032 6.624 0.990) 6.776 12.006 ( 1.671 0.677 5.759) 6.035 12.180 ( -0.164 -0.077 -3.584) 3.589 12.438 ( -4.856 7.170 1.586) 8.804 12.742 ( 3.288 1.859 0.694) 3.840 12.952 ( -9.855 6.159 0.108) 11.622 13.357 ( 0.223 5.531 -5.132) 7.549 16.088 ( -5.281 0.337 -1.909) 5.625 16.199 ( -3.173 -1.806 -3.644) 5.158 16.287 ( -3.654 3.637 4.893) 7.108 16.474 ( -0.297 -1.279 -5.009) 5.178 ======================= Grid point 274 (135/172) ======================= q-point: (-0.10 -0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -17.019 -17.319 7.395) 25.383 2.582 ( -16.928 -18.351 10.574) 27.113 3.160 ( -5.422 -3.637 -5.122) 8.298 3.444 ( -7.790 -6.261 5.343) 11.333 3.871 ( -2.455 -1.503 -8.005) 8.507 3.939 ( -7.561 -6.141 -5.529) 11.200 4.191 ( 5.402 6.270 11.124) 13.865 4.366 ( 3.477 4.234 4.131) 6.862 4.484 ( 6.322 -1.360 4.397) 7.820 4.668 ( -0.951 11.325 9.900) 15.072 5.037 ( 0.947 10.647 -6.033) 12.274 5.326 ( 8.539 1.995 -5.042) 10.115 5.856 ( -5.873 1.390 -4.772) 7.694 5.965 ( -0.150 1.185 0.647) 1.358 6.214 ( -1.078 -2.017 1.760) 2.886 6.588 ( 7.361 -3.909 -2.441) 8.684 6.714 ( 0.885 -2.719 -1.540) 3.248 6.736 ( 1.230 -4.559 1.753) 5.037 6.941 ( -2.862 -5.471 -2.994) 6.861 7.082 ( -1.686 -5.259 0.598) 5.555 7.833 ( 0.580 -5.512 2.077) 5.918 7.931 ( -4.521 -3.324 4.503) 7.194 8.389 ( -1.941 -8.230 0.475) 8.469 8.409 ( 5.621 -5.882 -0.819) 8.177 8.652 ( 1.929 -7.462 -0.208) 7.710 8.706 ( 1.153 -7.250 -1.774) 7.552 8.834 ( 1.500 -9.429 -1.946) 9.744 9.060 ( 1.137 -9.308 0.613) 9.397 9.100 ( 1.266 1.146 -2.361) 2.914 9.475 ( -1.279 1.151 -2.141) 2.747 9.639 ( 1.754 -7.555 1.276) 7.860 9.843 ( 2.590 -6.275 -0.031) 6.788 9.972 ( 2.341 1.351 -2.510) 3.688 10.144 ( 4.467 6.024 1.407) 7.630 10.426 ( 1.033 4.989 0.082) 5.095 10.541 ( 0.766 -0.361 -1.020) 1.325 10.734 ( 4.220 4.035 -3.381) 6.747 10.857 ( -1.758 0.589 2.684) 3.262 11.061 ( 1.989 6.690 -0.422) 6.993 11.107 ( 1.911 1.889 -1.180) 2.935 11.343 ( -0.156 1.892 2.447) 3.097 11.473 ( -0.768 9.120 -2.427) 9.469 11.606 ( -4.060 9.813 -1.540) 10.731 11.793 ( -0.379 5.398 3.251) 6.312 12.022 ( 0.026 2.254 5.952) 6.364 12.127 ( -3.963 3.021 -1.706) 5.267 12.316 ( -1.286 2.593 0.912) 3.034 12.739 ( 3.865 2.039 -0.623) 4.414 12.817 ( -6.459 1.850 1.278) 6.839 13.219 ( -1.232 7.683 -5.328) 9.431 16.042 ( -4.744 -0.475 -3.295) 5.796 16.191 ( -3.281 0.177 0.974) 3.427 16.238 ( -1.807 -0.963 0.551) 2.121 16.491 ( 0.893 -1.199 -3.045) 3.392 ======================= Grid point 282 (136/172) ======================= q-point: (-0.30 -0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( -29.648 -0.000 10.178) 31.346 2.093 ( -28.767 -0.000 17.787) 33.822 3.105 ( -31.858 -0.000 1.502) 31.893 3.476 ( -20.553 -0.000 7.394) 21.842 3.683 ( -11.570 -0.000 -11.814) 16.536 3.950 ( 15.278 0.000 -2.676) 15.510 4.036 ( 8.150 0.000 6.618) 10.499 4.499 ( 5.347 0.000 8.316) 9.887 4.725 ( 9.043 0.000 -1.029) 9.102 4.955 ( 12.832 0.000 -4.453) 13.583 5.010 ( -1.909 -0.000 3.970) 4.405 5.330 ( 4.713 0.000 -6.956) 8.402 6.032 ( 2.193 0.000 3.718) 4.316 6.161 ( -3.236 -0.000 -9.686) 10.212 6.343 ( 1.439 0.000 5.078) 5.278 6.390 ( -4.660 -0.000 -6.256) 7.801 6.468 ( 0.074 0.000 7.506) 7.506 6.624 ( -0.021 -0.000 0.360) 0.360 6.686 ( 1.091 0.000 -2.173) 2.431 6.861 ( 1.332 0.000 -7.173) 7.295 7.593 ( 2.748 0.000 -1.919) 3.351 7.779 ( -5.185 -0.000 9.170) 10.534 8.053 ( 2.334 0.000 -2.210) 3.215 8.173 ( -1.017 -0.000 -4.279) 4.398 8.346 ( 3.602 0.000 1.021) 3.744 8.403 ( 4.362 0.000 1.890) 4.754 8.627 ( 0.841 0.000 5.329) 5.395 8.866 ( 3.685 0.000 -2.834) 4.649 9.100 ( -1.872 -0.000 -3.674) 4.124 9.334 ( 8.408 0.000 -2.709) 8.834 9.599 ( 2.843 0.000 2.591) 3.846 9.688 ( 2.571 0.000 1.574) 3.014 10.001 ( 6.711 0.000 3.493) 7.566 10.100 ( 4.111 0.000 -5.494) 6.862 10.374 ( -0.178 -0.000 0.863) 0.881 10.558 ( 2.530 0.000 -2.370) 3.467 10.810 ( -5.425 -0.000 -1.204) 5.557 10.852 ( -0.206 -0.000 0.707) 0.736 11.216 ( -1.315 -0.000 -1.663) 2.120 11.356 ( 1.343 0.000 0.145) 1.351 11.508 ( -2.517 -0.000 6.607) 7.070 11.749 ( -0.577 -0.000 0.182) 0.605 11.784 ( -0.792 -0.000 5.991) 6.043 11.987 ( -0.341 -0.000 -1.305) 1.349 12.072 ( 1.920 0.000 1.980) 2.758 12.179 ( 1.082 0.000 -4.645) 4.769 12.577 ( -4.455 -0.000 0.950) 4.555 12.775 ( 2.366 0.000 2.462) 3.415 13.143 ( -9.322 -0.000 -5.645) 10.898 13.417 ( 0.602 0.000 -1.752) 1.852 16.133 ( -1.791 -0.000 2.544) 3.111 16.152 ( -5.670 -0.000 -4.989) 7.553 16.381 ( -3.114 -0.000 5.368) 6.206 16.422 ( -5.880 -0.000 -10.867) 12.356 ======================= Grid point 283 (137/172) ======================= q-point: (-0.20 -0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( -27.107 -10.336 12.956) 31.772 2.020 ( -26.666 -11.151 19.208) 34.704 2.921 ( -35.378 -10.532 9.030) 38.000 3.287 ( -15.084 4.487 -1.145) 15.779 3.638 ( -12.136 -7.968 -11.533) 18.542 3.989 ( 8.466 5.021 -2.321) 10.113 4.194 ( 12.412 -4.645 6.377) 14.707 4.546 ( 7.834 3.135 7.331) 11.178 4.687 ( 9.377 9.943 2.340) 13.866 4.959 ( -0.072 5.023 4.797) 6.946 5.121 ( 6.963 -5.925 -4.874) 10.361 5.353 ( 6.823 0.341 -4.273) 8.058 6.022 ( -5.735 7.116 -8.740) 12.646 6.048 ( 0.401 1.051 0.840) 1.404 6.256 ( -2.775 3.781 -1.205) 4.843 6.439 ( 2.115 -2.716 -1.263) 3.667 6.537 ( -2.117 -5.884 4.724) 7.837 6.618 ( 1.073 -1.471 -0.372) 1.858 6.765 ( 1.969 -5.087 -0.195) 5.458 6.885 ( -0.148 -4.058 -5.036) 6.470 7.646 ( 4.016 -3.610 -2.516) 5.957 7.804 ( -6.621 -4.541 8.374) 11.601 8.073 ( -0.141 -3.192 -2.581) 4.107 8.230 ( 2.035 -6.949 -3.574) 8.075 8.396 ( 4.073 -2.242 1.478) 4.879 8.494 ( 4.392 -5.243 1.444) 6.990 8.658 ( 0.435 -1.454 4.218) 4.482 8.902 ( 3.014 -1.847 -2.133) 4.128 9.096 ( -0.268 -1.520 -3.356) 3.694 9.404 ( 7.343 -1.939 -3.336) 8.295 9.603 ( 3.163 3.037 2.789) 5.197 9.740 ( 3.889 -1.546 2.449) 4.849 10.034 ( 4.888 2.312 -0.640) 5.445 10.145 ( 5.271 -2.451 -1.291) 5.955 10.403 ( 0.614 -2.872 0.786) 3.040 10.590 ( 0.776 -1.081 -0.459) 1.407 10.776 ( -1.800 -0.880 -4.552) 4.974 10.839 ( -1.742 0.478 1.806) 2.554 11.163 ( -1.311 3.799 -1.200) 4.194 11.332 ( 0.021 3.251 0.218) 3.258 11.467 ( -0.756 4.450 4.721) 6.532 11.715 ( -0.111 3.769 1.350) 4.005 11.791 ( -1.928 1.252 1.839) 2.944 11.976 ( 1.179 1.226 0.270) 1.722 12.065 ( 1.618 2.969 2.767) 4.369 12.169 ( -0.380 0.110 -2.577) 2.608 12.507 ( -4.584 4.357 1.101) 6.419 12.791 ( 2.115 0.963 0.867) 2.480 12.980 ( -10.330 6.643 -2.542) 12.542 13.409 ( 0.404 1.621 -3.797) 4.149 16.062 ( -7.152 2.563 -2.864) 8.119 16.119 ( -4.932 -1.167 -2.646) 5.717 16.328 ( -3.994 2.278 2.802) 5.385 16.406 ( -2.559 -3.591 -5.521) 7.066 ======================= Grid point 284 (138/172) ======================= q-point: (-0.10 -0.30 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -19.978 -18.640 13.295) 30.386 2.140 ( -21.689 -18.769 15.639) 32.669 2.975 ( -18.534 -15.272 3.720) 24.302 3.157 ( -13.462 -5.540 1.634) 14.649 3.661 ( -12.906 -9.564 -12.269) 20.213 3.934 ( 5.100 5.882 -3.480) 8.527 4.349 ( 7.700 0.115 9.685) 12.373 4.546 ( 8.534 7.414 0.108) 11.306 4.599 ( 7.437 7.603 10.530) 14.966 4.862 ( 0.035 8.260 7.969) 11.478 5.158 ( 0.897 3.511 -6.140) 7.129 5.406 ( 8.323 1.194 -3.273) 9.023 5.838 ( -6.125 4.508 -6.676) 10.120 5.996 ( -0.847 2.667 -2.284) 3.612 6.225 ( 2.683 0.877 1.300) 3.108 6.507 ( 1.341 -5.861 -4.451) 7.481 6.653 ( -0.714 -6.566 1.263) 6.724 6.673 ( 1.198 -3.758 1.229) 4.131 6.846 ( 1.743 -3.119 -3.509) 5.008 6.966 ( -2.049 -6.622 0.143) 6.933 7.747 ( 1.402 -5.164 0.116) 5.352 7.851 ( -3.644 -3.972 4.535) 7.044 8.180 ( -1.792 -10.505 -1.340) 10.740 8.367 ( 3.737 -5.933 -1.445) 7.159 8.508 ( 2.764 -7.854 -0.340) 8.333 8.635 ( 3.324 -5.626 2.606) 7.035 8.717 ( 1.250 -5.016 0.917) 5.250 8.962 ( 1.456 -3.706 -0.818) 4.065 9.119 ( 2.689 -0.718 -2.751) 3.914 9.480 ( 3.694 -0.874 -3.745) 5.333 9.582 ( 0.881 0.125 3.376) 3.492 9.800 ( 2.794 -1.788 2.549) 4.184 10.008 ( 1.471 2.306 -3.718) 4.616 10.240 ( 7.285 -1.052 2.163) 7.672 10.469 ( 0.345 -1.687 0.196) 1.733 10.536 ( -3.543 3.079 0.813) 4.763 10.778 ( 2.390 -0.416 -6.203) 6.661 10.852 ( -1.032 -0.851 1.964) 2.376 11.108 ( 0.865 1.095 -0.759) 1.588 11.248 ( 2.706 7.457 -1.575) 8.088 11.393 ( -0.954 3.989 3.602) 5.459 11.616 ( -0.354 7.737 -0.942) 7.802 11.703 ( -3.351 6.234 -0.161) 7.079 11.920 ( 1.080 7.335 2.251) 7.749 12.053 ( 0.263 0.119 3.266) 3.278 12.141 ( -3.676 2.044 0.132) 4.208 12.380 ( -2.821 5.757 0.765) 6.457 12.748 ( -6.546 1.724 -5.244) 8.562 12.849 ( 1.555 3.073 5.365) 6.376 13.324 ( -0.694 6.589 -5.081) 8.349 15.973 ( -6.764 -0.868 -3.434) 7.635 16.107 ( -5.106 -2.576 -2.441) 6.218 16.267 ( -2.674 2.399 4.026) 5.396 16.447 ( 0.240 -3.260 -4.754) 5.769 ======================= Grid point 293 (139/172) ======================= q-point: (-0.20 -0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 172 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -26.347 -0.000 19.569) 32.819 1.757 ( -28.301 -0.000 23.227) 36.612 2.541 ( -40.585 -0.000 22.488) 46.399 3.228 ( -13.955 -0.000 -3.608) 14.414 3.413 ( -11.102 -0.000 -17.147) 20.428 4.140 ( 8.827 0.000 -2.064) 9.065 4.231 ( 10.408 0.000 7.955) 13.100 4.665 ( 10.820 0.000 4.081) 11.564 4.863 ( 6.533 0.000 2.680) 7.062 5.032 ( 2.351 0.000 3.150) 3.930 5.080 ( 5.110 0.000 -5.844) 7.763 5.392 ( 7.505 0.000 -5.297) 9.186 6.018 ( -6.311 -0.000 -9.371) 11.297 6.055 ( -1.050 -0.000 1.948) 2.213 6.306 ( -1.998 -0.000 -4.535) 4.956 6.339 ( -4.471 -0.000 5.498) 7.086 6.534 ( 3.384 0.000 3.149) 4.622 6.611 ( -1.321 -0.000 0.029) 1.321 6.722 ( 3.384 0.000 0.753) 3.466 6.843 ( 0.754 0.000 -5.983) 6.031 7.648 ( 6.162 0.000 -4.213) 7.465 7.726 ( -7.466 -0.000 9.004) 11.697 8.057 ( 0.505 0.000 -3.175) 3.215 8.137 ( -0.342 -0.000 -4.226) 4.240 8.436 ( 5.229 0.000 2.379) 5.745 8.479 ( 3.389 0.000 2.332) 4.113 8.660 ( -0.113 -0.000 5.047) 5.048 8.910 ( 4.233 0.000 -1.644) 4.541 9.071 ( 0.846 0.000 -3.032) 3.148 9.435 ( 6.210 0.000 -3.819) 7.290 9.699 ( 7.871 0.000 1.705) 8.053 9.764 ( 4.627 0.000 4.388) 6.377 10.119 ( 1.556 0.000 -4.376) 4.644 10.125 ( 7.284 0.000 0.874) 7.337 10.383 ( 0.377 0.000 1.734) 1.774 10.578 ( 1.182 0.000 -0.815) 1.435 10.717 ( -5.282 -0.000 -1.467) 5.482 10.830 ( -4.077 -0.000 -1.209) 4.252 11.198 ( 0.954 0.000 -0.723) 1.197 11.345 ( -2.079 -0.000 1.725) 2.702 11.514 ( -1.061 -0.000 2.148) 2.396 11.753 ( 0.156 0.000 0.925) 0.938 11.808 ( 0.795 0.000 4.159) 4.234 11.987 ( 1.975 0.000 -1.182) 2.302 12.118 ( 1.358 0.000 3.237) 3.511 12.154 ( -2.276 -0.000 -2.502) 3.382 12.513 ( -4.367 -0.000 1.285) 4.552 12.796 ( -3.767 -0.000 -4.217) 5.654 12.983 ( -3.345 -0.000 0.007) 3.345 13.411 ( 0.285 0.000 -2.508) 2.524 15.994 ( -10.807 -0.000 -6.718) 12.725 16.100 ( -3.568 -0.000 0.498) 3.603 16.280 ( -3.727 -0.000 -7.413) 8.297 16.346 ( -4.645 -0.000 4.592) 6.532 ======================= Grid point 294 (140/172) ======================= q-point: (-0.10 -0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -19.954 -12.188 21.789) 31.960 1.727 ( -24.220 -13.215 23.312) 36.121 2.493 ( -27.299 -17.703 27.339) 42.498 3.068 ( -9.537 2.818 -8.547) 13.113 3.368 ( -11.219 -8.089 -16.010) 21.156 4.091 ( 4.510 7.652 -2.540) 9.239 4.391 ( 6.588 -4.046 8.594) 11.560 4.720 ( 10.312 4.735 0.150) 11.349 4.837 ( 6.322 7.960 5.636) 11.623 4.990 ( 0.143 5.113 3.642) 6.279 5.151 ( 2.226 -2.723 -5.546) 6.567 5.454 ( 6.781 -1.662 -5.672) 8.995 5.881 ( -3.486 6.834 -6.083) 9.791 6.033 ( -1.724 2.505 -0.709) 3.123 6.244 ( 0.936 -0.135 0.677) 1.163 6.415 ( -3.273 -5.238 0.066) 6.176 6.562 ( 1.951 -1.932 1.261) 3.021 6.627 ( -0.056 -2.376 -0.255) 2.391 6.804 ( 2.395 -4.624 0.168) 5.211 6.853 ( -0.575 -3.070 -4.286) 5.303 7.693 ( -0.065 -2.153 1.739) 2.768 7.759 ( -0.318 -5.398 1.664) 5.657 8.053 ( -0.310 -2.610 -1.837) 3.207 8.228 ( 0.782 -9.130 -5.247) 10.559 8.473 ( 3.064 -0.989 3.597) 4.827 8.565 ( 2.922 -5.418 2.031) 6.482 8.683 ( -0.236 -1.250 4.684) 4.854 8.948 ( 4.859 -0.499 -1.157) 5.020 9.102 ( 3.040 -2.388 -2.555) 4.634 9.475 ( 3.191 -1.373 -3.245) 4.754 9.684 ( 4.222 6.904 1.303) 8.197 9.823 ( 3.819 -0.269 3.899) 5.464 10.059 ( 0.955 3.960 -3.663) 5.478 10.249 ( 7.015 -4.506 1.200) 8.423 10.419 ( 0.426 -3.149 1.933) 3.720 10.570 ( -3.993 2.908 1.424) 5.140 10.723 ( -0.174 -4.468 -7.462) 8.699 10.797 ( -4.311 -2.992 -0.542) 5.275 11.170 ( 2.344 4.023 0.897) 4.742 11.327 ( -0.420 1.614 0.587) 1.768 11.468 ( -1.429 3.980 1.641) 4.536 11.719 ( 0.848 4.380 -0.226) 4.467 11.788 ( 0.148 4.617 2.058) 5.057 12.019 ( 1.620 -0.787 -0.633) 1.909 12.068 ( -2.459 4.372 0.783) 5.077 12.140 ( -2.273 0.433 2.221) 3.207 12.446 ( -3.460 4.159 0.867) 5.479 12.696 ( -9.952 1.813 -7.353) 12.506 12.957 ( 5.616 4.238 6.281) 9.431 13.389 ( -0.232 2.677 -4.088) 4.892 15.887 ( -9.737 -0.510 -4.118) 10.585 16.047 ( -3.640 0.535 -0.740) 3.753 16.272 ( -3.817 0.098 0.746) 3.891 16.360 ( -0.720 -4.853 -2.478) 5.496 ======================= Grid point 304 (141/172) ======================= q-point: (-0.10 -0.10 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( -14.190 -0.000 29.309) 32.563 1.502 ( -19.355 -0.000 31.348) 36.842 2.232 ( -19.184 -0.000 39.770) 44.155 3.005 ( -9.559 -0.000 -8.515) 12.802 3.160 ( -7.253 -0.000 -21.255) 22.458 4.172 ( -1.460 -0.000 -8.246) 8.374 4.417 ( 5.062 0.000 11.977) 13.003 4.850 ( 10.944 0.000 -2.828) 11.303 4.950 ( 2.770 0.000 4.186) 5.019 5.072 ( -1.403 -0.000 -2.636) 2.986 5.108 ( 5.393 0.000 -0.051) 5.393 5.445 ( 2.351 0.000 -9.804) 10.082 5.943 ( 3.275 0.000 -2.844) 4.338 6.026 ( -3.902 -0.000 1.108) 4.056 6.276 ( 0.104 0.000 -1.662) 1.665 6.310 ( -1.895 -0.000 5.008) 5.354 6.582 ( 0.758 0.000 0.889) 1.168 6.596 ( 0.042 0.000 -0.819) 0.820 6.770 ( 1.738 0.000 -0.201) 1.750 6.818 ( 0.070 0.000 -4.909) 4.909 7.659 ( -6.593 -0.000 7.560) 10.031 7.730 ( 7.245 0.000 -5.379) 9.024 8.044 ( 0.034 0.000 -2.444) 2.444 8.118 ( 0.855 0.000 -4.149) 4.237 8.499 ( 0.575 0.000 3.076) 3.130 8.531 ( 1.041 0.000 3.946) 4.081 8.684 ( -0.562 -0.000 5.474) 5.503 8.997 ( 7.459 0.000 -1.351) 7.581 9.100 ( 4.600 0.000 -1.560) 4.857 9.467 ( -0.260 -0.000 -3.841) 3.850 9.796 ( 1.894 0.000 -4.274) 4.675 9.852 ( 1.638 0.000 4.557) 4.842 10.116 ( 1.250 0.000 -0.685) 1.426 10.255 ( 10.063 0.000 -0.087) 10.064 10.404 ( 0.722 0.000 2.366) 2.474 10.572 ( -3.368 -0.000 1.790) 3.814 10.644 ( -0.588 -0.000 -5.113) 5.147 10.700 ( -9.345 -0.000 -2.327) 9.630 11.240 ( 3.033 0.000 0.303) 3.048 11.325 ( -2.402 -0.000 1.564) 2.866 11.504 ( 0.436 0.000 0.874) 0.976 11.774 ( 3.638 0.000 -0.789) 3.723 11.851 ( 1.239 0.000 3.470) 3.685 11.951 ( -9.447 -0.000 -5.577) 10.971 12.121 ( 1.526 0.000 2.385) 2.831 12.134 ( -1.181 -0.000 2.149) 2.452 12.463 ( -2.762 -0.000 1.447) 3.118 12.614 ( -9.183 -0.000 -6.095) 11.021 13.084 ( 9.546 0.000 4.097) 10.389 13.395 ( -0.611 -0.000 -3.082) 3.142 15.797 ( -7.166 -0.000 -1.729) 7.372 16.029 ( -4.711 -0.000 -2.021) 5.126 16.253 ( 3.410 0.000 -2.467) 4.209 16.290 ( -5.262 -0.000 3.584) 6.366 ======================= Grid point 305 (142/172) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -2.742 -0.000 -9.181) 9.581 2.042 ( 2.742 0.000 9.181) 9.581 2.445 ( -4.903 -0.000 -15.016) 15.796 2.445 ( 4.903 0.000 15.016) 15.796 3.464 ( -3.706 -0.000 -36.672) 36.859 3.464 ( 3.706 0.000 36.672) 36.859 4.758 ( 4.889 0.000 -11.571) 12.561 4.758 ( -4.889 -0.000 11.571) 12.561 5.072 ( 5.582 0.000 -1.893) 5.895 5.072 ( -5.582 -0.000 1.893) 5.895 5.190 ( -0.652 -0.000 -6.052) 6.087 5.190 ( 0.652 0.000 6.052) 6.087 6.008 ( 8.716 0.000 -3.793) 9.505 6.008 ( -8.716 -0.000 3.793) 9.505 6.320 ( -1.177 -0.000 -2.202) 2.497 6.320 ( 1.177 0.000 2.202) 2.497 6.576 ( 1.869 0.000 -1.012) 2.126 6.576 ( -1.869 -0.000 1.012) 2.126 6.749 ( 2.026 0.000 -1.184) 2.347 6.749 ( -2.026 -0.000 1.184) 2.347 7.705 ( 7.685 0.000 -5.085) 9.214 7.705 ( -7.685 -0.000 5.085) 9.214 8.039 ( -0.206 -0.000 -1.884) 1.895 8.039 ( 0.206 0.000 1.884) 1.895 8.574 ( 2.174 0.000 -2.719) 3.481 8.574 ( -2.174 -0.000 2.719) 3.481 8.899 ( 3.872 0.000 -11.611) 12.240 8.899 ( -3.872 -0.000 11.611) 12.240 9.259 ( -10.404 -0.000 -3.855) 11.095 9.259 ( 10.404 0.000 3.855) 11.095 9.804 ( -3.079 -0.000 -3.681) 4.799 9.804 ( 3.079 0.000 3.681) 4.799 10.283 ( -0.401 -0.000 -6.483) 6.495 10.283 ( 0.401 0.000 6.483) 6.495 10.509 ( -2.839 -0.000 -2.709) 3.924 10.509 ( 2.839 0.000 2.709) 3.924 10.551 ( -2.071 -0.000 0.632) 2.166 10.551 ( 2.071 0.000 -0.632) 2.166 11.274 ( -3.288 -0.000 -0.130) 3.291 11.274 ( 3.288 0.000 0.130) 3.291 11.638 ( -9.218 -0.000 -2.569) 9.569 11.638 ( 9.218 0.000 2.569) 9.569 11.882 ( -5.578 -0.000 1.109) 5.687 11.882 ( 5.578 0.000 -1.109) 5.687 12.156 ( 1.330 0.000 -1.353) 1.897 12.156 ( -1.330 -0.000 1.353) 1.897 12.479 ( 0.764 0.000 -1.999) 2.140 12.479 ( -0.764 -0.000 1.999) 2.140 13.274 ( -4.135 -0.000 -3.131) 5.187 13.274 ( 4.135 0.000 3.131) 5.187 15.862 ( -5.719 -0.000 -3.232) 6.569 15.862 ( 5.719 0.000 3.232) 6.569 16.280 ( 6.660 0.000 -2.876) 7.254 16.280 ( -6.660 -0.000 2.876) 7.254 ======================= Grid point 307 (143/172) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 0.600 -7.107 -17.746) 19.125 2.169 ( 5.474 -9.555 -3.753) 11.634 2.420 ( 2.980 -2.060 -5.597) 6.667 2.586 ( 9.273 -4.677 21.915) 24.251 3.418 ( 1.337 -6.532 -30.422) 31.144 3.654 ( 8.739 -4.100 28.574) 30.160 4.633 ( -12.602 6.770 5.066) 15.176 4.731 ( -0.478 2.383 -2.352) 3.382 5.012 ( -3.704 4.331 1.847) 5.990 5.088 ( 5.785 1.356 -6.660) 8.925 5.191 ( -2.127 -1.068 -1.496) 2.811 5.246 ( 3.202 -1.356 3.164) 4.701 5.908 ( -8.625 3.143 1.286) 9.270 6.018 ( 6.256 3.723 -3.306) 7.995 6.312 ( -3.688 -2.045 -1.737) 4.561 6.382 ( 3.914 -4.007 0.980) 5.687 6.533 ( -3.346 2.668 1.730) 4.616 6.591 ( 3.360 0.183 0.444) 3.394 6.776 ( -3.264 -4.143 2.151) 5.696 6.817 ( 2.766 -5.717 -1.265) 6.476 7.700 ( -6.835 -4.302 4.779) 9.384 7.785 ( 7.377 -3.428 -5.037) 9.568 8.076 ( -0.873 -5.558 -3.257) 6.501 8.106 ( 0.404 -6.656 3.587) 7.571 8.591 ( -2.744 -3.453 0.601) 4.451 8.617 ( 0.862 -4.240 -1.391) 4.545 8.881 ( -0.931 0.282 -7.978) 8.037 8.895 ( -4.778 -0.761 8.605) 9.872 9.185 ( -6.942 -0.999 -3.803) 7.978 9.347 ( 8.714 0.495 4.383) 9.767 9.753 ( -4.381 1.427 -2.863) 5.425 9.834 ( 2.451 0.002 4.705) 5.306 10.135 ( -9.860 7.032 -2.116) 12.294 10.280 ( 4.829 2.874 1.156) 5.738 10.514 ( -1.025 -2.142 -1.688) 2.913 10.535 ( 1.247 -2.391 -0.903) 2.844 10.591 ( -3.757 -4.948 2.266) 6.613 10.685 ( 8.121 -5.969 -0.128) 10.079 11.223 ( -3.220 2.924 0.302) 4.360 11.279 ( 3.381 2.857 1.098) 4.561 11.555 ( -6.623 1.224 -2.542) 7.199 11.675 ( 2.398 4.379 3.533) 6.116 11.825 ( -0.744 3.351 0.082) 3.434 11.894 ( 6.145 2.165 -1.301) 6.644 12.124 ( -1.473 2.950 0.216) 3.305 12.164 ( 4.360 1.171 -1.986) 4.932 12.445 ( -0.386 3.279 -0.957) 3.437 12.479 ( 2.755 1.330 1.990) 3.650 13.186 ( -5.702 4.217 -3.745) 8.020 13.270 ( 2.515 4.110 3.221) 5.796 15.835 ( -2.612 -1.822 -2.738) 4.200 15.931 ( 6.651 -0.959 2.133) 7.050 16.257 ( -3.946 -2.117 1.709) 4.793 16.324 ( 5.601 -0.052 -2.462) 6.118 ======================= Grid point 308 (144/172) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 5.291 -13.420 -16.232) 21.716 2.379 ( 2.890 -13.229 -13.040) 18.799 2.558 ( 11.553 -6.805 7.298) 15.266 2.880 ( 12.497 -12.129 20.522) 26.915 3.524 ( 4.344 -10.657 -19.668) 22.788 3.819 ( 5.380 -0.208 11.378) 12.588 4.443 ( -10.306 5.992 9.690) 15.363 4.678 ( 0.118 2.097 -2.061) 2.943 4.868 ( -5.208 8.247 0.629) 9.774 5.061 ( 4.077 4.963 -9.345) 11.339 5.139 ( -2.221 5.721 -0.998) 6.217 5.241 ( 1.549 5.707 4.290) 7.306 5.835 ( -7.293 -2.598 -1.619) 7.910 6.001 ( 1.832 -0.106 -3.725) 4.153 6.319 ( -4.050 -1.970 -1.427) 4.724 6.442 ( -2.191 -1.291 1.609) 3.010 6.540 ( 4.377 -3.886 3.023) 6.588 6.628 ( 3.170 -1.076 3.547) 4.877 6.834 ( -3.756 -5.219 0.945) 6.500 6.956 ( 3.347 -7.454 -1.394) 8.289 7.759 ( -4.863 -6.320 3.605) 8.752 7.887 ( 5.921 -3.511 -4.534) 8.243 8.199 ( -0.455 -10.169 -3.760) 10.851 8.274 ( 0.388 -10.353 4.521) 11.303 8.638 ( -4.631 -5.333 -1.575) 7.236 8.715 ( -1.154 -7.080 -0.050) 7.174 8.836 ( -3.193 0.455 -6.089) 6.890 8.922 ( -2.865 -4.105 7.173) 8.747 9.162 ( -3.333 -1.875 -4.248) 5.716 9.385 ( 3.408 2.476 4.840) 6.417 9.691 ( -3.480 0.195 -2.745) 4.437 9.874 ( 2.299 -0.757 4.421) 5.040 9.968 ( -6.887 2.586 -3.095) 7.981 10.260 ( 6.636 5.811 1.847) 9.012 10.525 ( -4.231 -1.939 -2.356) 5.217 10.594 ( -0.409 -3.241 -2.338) 4.017 10.638 ( -3.839 -2.671 4.616) 6.571 10.819 ( 6.978 -2.410 -1.080) 7.461 11.138 ( -3.014 3.891 0.718) 4.974 11.225 ( 1.027 5.949 1.461) 6.211 11.480 ( -2.168 3.043 -3.118) 4.866 11.556 ( -2.526 8.006 2.587) 8.784 11.718 ( -0.679 8.035 -1.485) 8.200 11.925 ( 7.829 3.161 1.424) 8.562 12.044 ( -1.941 3.706 0.110) 4.185 12.161 ( 6.223 3.470 -3.437) 7.911 12.376 ( 0.255 3.594 -1.239) 3.810 12.498 ( 5.512 0.867 3.797) 6.749 13.044 ( -6.421 5.002 -2.791) 8.605 13.206 ( 1.582 5.702 2.135) 6.291 15.864 ( -0.017 -3.016 -0.631) 3.082 16.002 ( 5.490 -1.504 0.709) 5.736 16.299 ( 0.729 -3.160 -0.939) 3.376 16.355 ( 2.737 -0.492 0.328) 2.800 ======================= Grid point 309 (145/172) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 7.117 -14.193 -9.753) 18.634 2.621 ( 6.027 -14.940 -8.683) 18.300 2.827 ( 9.481 -11.349 7.936) 16.783 3.267 ( 12.083 -14.069 17.816) 25.716 3.678 ( -0.991 -6.331 -7.872) 10.150 3.848 ( 2.130 -3.255 -2.251) 4.494 4.311 ( -4.120 5.952 6.770) 9.912 4.613 ( -6.156 6.064 -4.379) 9.687 4.712 ( 1.089 5.028 0.730) 5.196 4.913 ( -3.399 12.156 0.612) 12.637 4.955 ( 3.408 11.349 -11.170) 16.284 5.160 ( 4.943 6.781 6.206) 10.437 5.819 ( -7.472 -1.475 -2.294) 7.955 6.027 ( -3.936 -3.807 -3.230) 6.358 6.332 ( -0.604 -4.561 -3.742) 5.930 6.508 ( -0.585 -5.781 4.942) 7.628 6.620 ( -0.073 -1.480 3.856) 4.131 6.716 ( 4.844 -3.654 4.693) 7.671 6.897 ( -2.670 -5.011 -1.032) 5.771 7.094 ( 2.723 -5.834 -1.660) 6.649 7.853 ( -2.294 -6.740 2.292) 7.479 7.972 ( 4.506 -3.031 -4.092) 6.800 8.361 ( -0.007 -8.682 -1.579) 8.824 8.456 ( -0.356 -8.799 2.658) 9.199 8.693 ( -5.411 -6.040 -0.366) 8.117 8.766 ( -2.652 0.662 -2.634) 3.796 8.851 ( -2.688 -8.213 -1.236) 8.730 9.039 ( -0.377 -7.809 4.011) 8.787 9.155 ( -4.438 -3.282 -3.052) 6.307 9.376 ( 1.829 0.476 2.558) 3.180 9.693 ( 1.259 -1.466 -0.887) 2.127 9.880 ( 0.518 1.372 1.386) 2.018 9.959 ( -1.609 -4.704 -3.218) 5.922 10.184 ( 2.687 7.612 1.393) 8.191 10.493 ( -5.529 0.481 -1.978) 5.892 10.575 ( -2.994 4.156 2.017) 5.505 10.665 ( -1.099 -1.539 0.820) 2.061 10.866 ( 3.691 1.442 -1.153) 4.127 11.039 ( -2.071 6.110 2.296) 6.848 11.135 ( 0.084 3.808 0.202) 3.815 11.369 ( -1.367 7.841 0.239) 7.962 11.436 ( 1.284 5.276 -1.125) 5.545 11.570 ( -2.102 6.792 -0.998) 7.180 11.865 ( 2.310 6.516 -1.459) 7.066 12.004 ( 0.877 2.491 3.565) 4.437 12.121 ( 5.490 4.828 -4.667) 8.674 12.337 ( 1.232 1.363 -1.220) 2.205 12.559 ( 7.624 -0.032 5.158) 9.205 12.913 ( -7.015 3.297 -0.613) 7.775 13.124 ( 0.891 5.211 -0.230) 5.292 15.923 ( 0.817 -3.116 1.303) 3.475 16.077 ( 5.216 -2.181 0.544) 5.679 16.326 ( 1.085 0.057 -4.246) 4.383 16.408 ( 1.302 -2.917 2.924) 4.330 ======================= Grid point 310 (146/172) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.699 ( 4.326 -8.211 -4.216) 10.193 2.904 ( 7.982 -12.244 -3.866) 15.119 3.099 ( 4.847 -9.111 5.557) 11.721 3.564 ( 1.321 -6.301 8.961) 11.034 3.725 ( -0.948 -8.012 3.286) 8.711 3.964 ( 0.213 -5.351 -2.735) 6.013 4.238 ( 3.760 3.025 2.454) 5.414 4.412 ( -6.461 6.717 -8.834) 12.842 4.608 ( -2.934 9.988 0.946) 10.453 4.674 ( -0.222 9.342 1.933) 9.542 4.784 ( 3.119 8.027 -10.367) 13.478 5.135 ( 4.517 3.308 5.371) 7.759 5.776 ( -2.555 0.070 -0.535) 2.611 6.024 ( -6.337 -1.599 -1.726) 6.760 6.441 ( 3.003 -7.487 -7.726) 11.170 6.593 ( -0.171 0.024 7.682) 7.684 6.648 ( -3.486 -3.727 3.521) 6.199 6.811 ( 2.926 -2.221 2.617) 4.510 6.954 ( -0.776 -3.336 -1.055) 3.584 7.179 ( 1.458 -2.720 -1.695) 3.521 7.950 ( -0.353 -4.614 0.966) 4.727 8.035 ( 2.535 -2.042 -2.413) 4.052 8.468 ( 0.028 -4.285 -0.114) 4.286 8.557 ( -2.007 -3.924 -0.186) 4.411 8.702 ( -2.009 2.084 1.279) 3.165 8.762 ( -2.745 -3.190 -0.078) 4.209 8.947 ( -0.546 -1.953 -1.173) 2.343 9.153 ( -1.944 -11.784 -0.735) 11.966 9.292 ( -1.298 -10.956 2.644) 11.345 9.416 ( 0.742 -3.292 -1.838) 3.842 9.728 ( 2.621 0.528 0.545) 2.729 9.856 ( 3.733 4.928 0.699) 6.222 9.995 ( 0.616 -0.514 -2.847) 2.957 10.112 ( -2.697 -1.274 -1.162) 3.202 10.382 ( -4.250 11.170 -0.336) 11.956 10.460 ( -3.431 1.699 3.128) 4.944 10.669 ( -0.492 0.059 -1.454) 1.537 10.829 ( -1.158 2.417 0.984) 2.855 10.977 ( 0.808 1.413 1.806) 2.431 11.058 ( 2.613 7.230 -0.221) 7.691 11.265 ( -3.235 0.808 1.582) 3.690 11.364 ( 4.156 5.805 -1.499) 7.295 11.460 ( -2.717 2.757 -1.944) 4.331 11.785 ( 0.972 3.576 -0.950) 3.825 11.965 ( 0.997 3.522 2.717) 4.558 12.083 ( 2.590 1.944 -2.327) 3.988 12.332 ( 1.210 0.046 -1.584) 1.994 12.623 ( 6.223 1.186 4.167) 7.582 12.833 ( -5.501 -0.266 0.619) 5.542 13.046 ( 0.083 3.786 -1.610) 4.115 15.978 ( 0.483 -1.941 1.444) 2.467 16.159 ( 4.859 -2.171 1.619) 5.562 16.304 ( -1.252 0.915 -3.952) 4.245 16.466 ( 0.854 -1.820 1.492) 2.503 ======================= Grid point 311 (147/172) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.782 ( -0.000 0.000 0.000) 0.000 3.078 ( 0.000 -0.000 0.000) 0.000 3.171 ( -0.000 0.000 0.000) 0.000 3.630 ( 0.000 0.000 -0.000) 0.000 3.859 ( -0.000 -0.000 0.000) 0.000 3.978 ( -0.000 0.000 0.000) 0.000 4.236 ( -0.000 0.000 0.000) 0.000 4.310 ( -0.000 0.000 0.000) 0.000 4.481 ( 0.000 0.000 -0.000) 0.000 4.589 ( -0.000 0.000 0.000) 0.000 4.711 ( -0.000 0.000 0.000) 0.000 5.129 ( -0.000 0.000 -0.000) 0.000 5.773 ( -0.000 0.000 0.000) 0.000 6.001 ( -0.000 0.000 0.000) 0.000 6.542 ( 0.000 -0.000 -0.000) 0.000 6.566 ( -0.000 0.000 0.000) 0.000 6.679 ( -0.000 0.000 0.000) 0.000 6.847 ( -0.000 -0.000 0.000) 0.000 6.980 ( -0.000 0.000 0.000) 0.000 7.205 ( -0.000 0.000 0.000) 0.000 7.991 ( 0.000 0.000 -0.000) 0.000 8.062 ( 0.000 0.000 0.000) 0.000 8.506 ( -0.000 0.000 0.000) 0.000 8.582 ( -0.000 0.000 0.000) 0.000 8.668 ( -0.000 0.000 0.000) 0.000 8.777 ( 0.000 0.000 0.000) 0.000 8.947 ( -0.000 0.000 0.000) 0.000 9.323 ( 0.000 -0.000 0.000) 0.000 9.374 ( -0.000 0.000 -0.000) 0.000 9.465 ( 0.000 0.000 0.000) 0.000 9.701 ( -0.000 -0.000 0.000) 0.000 9.814 ( -0.000 -0.000 0.000) 0.000 10.037 ( -0.000 0.000 0.000) 0.000 10.107 ( -0.000 -0.000 0.000) 0.000 10.211 ( -0.000 -0.000 0.000) 0.000 10.450 ( 0.000 0.000 0.000) 0.000 10.660 ( -0.000 0.000 0.000) 0.000 10.805 ( -0.000 0.000 0.000) 0.000 10.960 ( -0.000 -0.000 0.000) 0.000 11.003 ( -0.000 0.000 0.000) 0.000 11.268 ( -0.000 0.000 0.000) 0.000 11.310 ( 0.000 0.000 0.000) 0.000 11.427 ( -0.000 0.000 0.000) 0.000 11.757 ( -0.000 0.000 0.000) 0.000 11.938 ( 0.000 0.000 -0.000) 0.000 12.075 ( -0.000 0.000 0.000) 0.000 12.337 ( -0.000 0.000 0.000) 0.000 12.637 ( -0.000 0.000 0.000) 0.000 12.826 ( 0.000 0.000 0.000) 0.000 13.005 ( -0.000 0.000 0.000) 0.000 15.999 ( -0.000 0.000 0.000) 0.000 16.216 ( -0.000 0.000 0.000) 0.000 16.270 ( -0.000 0.000 0.000) 0.000 16.488 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 318 (148/172) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.978 ( 7.092 0.000 -21.198) 22.353 2.105 ( 9.851 0.000 -18.612) 21.059 2.458 ( 9.441 0.000 5.996) 11.184 2.690 ( 11.122 0.000 21.891) 24.554 3.316 ( 10.110 0.000 -32.525) 34.060 3.782 ( 10.330 0.000 29.789) 31.529 4.624 ( -12.946 -0.000 -6.892) 14.666 4.645 ( -14.874 -0.000 12.520) 19.442 5.042 ( 0.706 0.000 -4.605) 4.659 5.134 ( 1.977 0.000 -2.998) 3.591 5.157 ( 0.249 0.000 -5.756) 5.761 5.261 ( 3.131 0.000 5.640) 6.451 5.885 ( -7.958 -0.000 2.958) 8.490 6.093 ( 5.028 0.000 -4.838) 6.977 6.277 ( -3.031 -0.000 -1.328) 3.309 6.360 ( 3.635 0.000 0.191) 3.640 6.568 ( 0.201 0.000 1.652) 1.665 6.594 ( 0.266 0.000 -0.448) 0.521 6.729 ( -1.977 -0.000 3.276) 3.827 6.766 ( 0.236 0.000 -0.425) 0.486 7.619 ( -6.485 -0.000 4.805) 8.071 7.802 ( 8.328 0.000 -5.347) 9.896 8.020 ( -1.073 -0.000 -1.293) 1.680 8.049 ( -0.395 -0.000 2.231) 2.266 8.546 ( -2.870 -0.000 1.898) 3.441 8.573 ( -0.663 -0.000 -3.230) 3.297 8.848 ( -2.233 -0.000 -8.740) 9.021 8.863 ( -7.620 -0.000 10.586) 13.043 9.117 ( -4.574 -0.000 -3.596) 5.818 9.415 ( 4.012 0.000 2.843) 4.918 9.741 ( -2.837 -0.000 0.177) 2.843 9.854 ( -0.198 -0.000 4.309) 4.313 10.158 ( -8.128 -0.000 -4.339) 9.213 10.218 ( -8.026 -0.000 2.759) 8.487 10.478 ( -0.293 -0.000 -4.390) 4.400 10.526 ( -1.838 -0.000 3.896) 4.308 10.638 ( 9.334 0.000 -2.621) 9.695 10.657 ( 9.135 0.000 2.073) 9.367 11.228 ( -3.322 -0.000 1.088) 3.496 11.330 ( 2.707 0.000 1.053) 2.904 11.520 ( -3.298 -0.000 -0.532) 3.341 11.725 ( -2.596 -0.000 2.951) 3.930 11.880 ( 6.099 0.000 2.274) 6.509 11.930 ( 1.635 0.000 -4.161) 4.471 12.155 ( 0.423 0.000 -0.940) 1.031 12.193 ( 4.238 0.000 -3.008) 5.197 12.495 ( 2.507 0.000 -1.500) 2.921 12.512 ( 4.003 0.000 4.106) 5.734 13.164 ( -6.819 -0.000 -4.163) 7.990 13.328 ( 0.896 0.000 3.002) 3.133 15.808 ( 1.855 0.000 -2.333) 2.980 15.990 ( 7.946 0.000 1.566) 8.099 16.204 ( -4.386 -0.000 2.186) 4.900 16.369 ( 6.803 0.000 -4.067) 7.926 ======================= Grid point 319 (149/172) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.047 ( 11.177 -6.617 -19.170) 23.156 2.214 ( 13.551 -7.500 -19.682) 25.045 2.617 ( 15.711 -3.871 8.872) 18.453 2.881 ( 12.939 -5.178 19.306) 23.811 3.387 ( 13.929 -5.653 -23.185) 27.632 3.915 ( 4.575 1.746 15.390) 16.150 4.457 ( -12.723 2.905 5.738) 14.256 4.600 ( -12.497 -2.780 5.200) 13.818 4.988 ( -1.565 6.277 -6.212) 8.969 5.088 ( -0.339 0.741 -4.830) 4.898 5.163 ( 0.494 0.055 -5.077) 5.101 5.305 ( -0.077 -0.524 5.099) 5.127 5.801 ( -4.330 3.696 2.083) 6.062 6.064 ( 2.550 4.987 -3.894) 6.822 6.255 ( -2.415 -1.601 -0.534) 2.946 6.428 ( 1.363 -1.278 -0.006) 1.868 6.534 ( 1.759 0.386 2.473) 3.059 6.626 ( 0.624 -1.923 1.194) 2.348 6.745 ( -2.285 -2.771 2.242) 4.234 6.839 ( 0.692 -7.306 -0.871) 7.390 7.629 ( -5.147 -4.752 3.990) 8.062 7.877 ( 7.642 -2.249 -4.772) 9.286 8.046 ( -0.763 -5.366 -2.588) 6.006 8.126 ( -0.488 -7.698 4.100) 8.736 8.539 ( -4.001 -1.866 -0.933) 4.512 8.593 ( -2.870 -4.659 -1.468) 5.666 8.802 ( -3.090 0.292 -5.721) 6.509 8.852 ( -5.694 -2.347 8.229) 10.278 9.097 ( -2.359 -1.723 -3.434) 4.508 9.426 ( -2.227 0.219 2.459) 3.325 9.693 ( -1.625 2.852 -0.855) 3.392 9.858 ( -2.762 -0.809 2.367) 3.727 10.004 ( -4.681 5.806 0.232) 7.462 10.251 ( -6.654 -5.503 0.660) 8.660 10.489 ( -0.992 -2.853 -4.452) 5.380 10.563 ( -2.912 -3.718 4.001) 6.190 10.615 ( 8.625 5.561 -0.064) 10.262 10.808 ( 7.113 -4.489 -0.751) 8.444 11.173 ( -3.513 3.038 0.537) 4.676 11.320 ( 0.424 3.441 1.200) 3.669 11.499 ( 1.026 1.465 -0.860) 1.984 11.664 ( -2.210 5.334 3.497) 6.750 11.845 ( 1.207 6.125 -2.481) 6.717 11.974 ( 1.839 -2.140 1.975) 3.444 12.110 ( 0.236 4.430 -2.140) 4.925 12.220 ( 4.063 -0.098 -4.359) 5.959 12.468 ( 3.857 4.643 -1.035) 6.124 12.572 ( 7.625 0.503 4.801) 9.024 13.064 ( -6.006 3.757 -4.486) 8.385 13.307 ( 0.230 3.744 3.315) 5.006 15.845 ( 5.092 -1.083 -0.082) 5.207 16.038 ( 5.499 0.732 0.251) 5.554 16.234 ( -0.053 -4.660 2.368) 5.227 16.396 ( 5.521 1.309 -3.781) 6.819 ======================= Grid point 320 (150/172) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( 13.064 -13.435 -13.416) 23.047 2.449 ( 15.437 -11.432 -12.315) 22.818 2.831 ( 15.257 -3.228 9.513) 18.267 3.191 ( 13.970 -12.245 14.023) 23.275 3.560 ( 10.714 -6.594 -10.168) 16.176 3.858 ( -4.947 4.287 2.655) 7.064 4.352 ( -10.442 2.171 7.424) 12.995 4.585 ( -6.401 -0.874 0.523) 6.481 4.815 ( -2.007 7.270 -7.965) 10.969 5.024 ( -2.854 4.988 -5.171) 7.731 5.122 ( 2.143 5.963 -5.342) 8.288 5.284 ( -1.842 2.919 7.469) 8.228 5.754 ( -0.331 -0.115 0.312) 0.469 5.984 ( -0.811 2.760 -2.281) 3.671 6.271 ( -0.998 -1.474 -1.903) 2.606 6.427 ( -1.476 -2.336 3.140) 4.182 6.599 ( -0.510 -2.321 3.746) 4.436 6.696 ( 3.798 -4.107 2.344) 6.065 6.797 ( -0.842 -4.631 -0.856) 4.784 6.983 ( 0.967 -8.264 -1.031) 8.384 7.713 ( -2.928 -7.458 2.455) 8.380 7.953 ( 5.198 -2.154 -3.555) 6.655 8.184 ( 0.666 -10.783 -2.414) 11.070 8.294 ( -0.967 -10.106 4.340) 11.041 8.548 ( -4.976 -4.527 -2.497) 7.176 8.670 ( -3.731 -7.439 -0.685) 8.351 8.763 ( -2.556 0.095 -3.579) 4.399 8.907 ( -3.727 -6.076 6.334) 9.536 9.101 ( -1.674 -1.005 -3.176) 3.728 9.400 ( -3.153 0.376 3.454) 4.692 9.658 ( 0.164 -1.053 -3.216) 3.388 9.845 ( -5.361 -1.128 -1.274) 5.624 9.932 ( 0.611 1.360 2.995) 3.346 10.264 ( -6.671 -1.293 0.168) 6.798 10.504 ( 0.986 1.589 -1.758) 2.567 10.564 ( 0.039 1.291 -2.662) 2.959 10.626 ( -1.193 -1.602 5.726) 6.065 10.903 ( 4.419 -1.627 -2.054) 5.137 11.099 ( -2.159 2.584 0.618) 3.424 11.218 ( -2.438 7.672 1.295) 8.154 11.468 ( 2.352 3.342 -2.838) 4.976 11.546 ( -0.850 8.041 4.203) 9.113 11.719 ( 1.825 8.649 -1.332) 8.939 11.969 ( -2.269 4.274 -0.848) 4.913 12.046 ( 0.985 1.671 2.089) 2.851 12.221 ( 3.734 2.339 -6.131) 7.550 12.408 ( 4.272 5.206 -1.726) 6.952 12.641 ( 8.970 0.651 5.268) 10.423 12.934 ( -4.638 4.945 -2.623) 7.270 13.233 ( 0.562 5.899 2.608) 6.474 15.910 ( 5.067 -1.227 2.020) 5.591 16.081 ( 4.220 -1.654 0.279) 4.541 16.326 ( 2.833 -2.704 -0.290) 3.927 16.397 ( 2.825 0.716 -1.360) 3.216 ======================= Grid point 321 (151/172) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 12.951 -12.380 -8.002) 19.622 2.760 ( 14.906 -13.000 -5.428) 20.510 3.028 ( 10.961 -5.401 6.353) 13.773 3.531 ( 7.957 -10.120 10.168) 16.405 3.612 ( -2.974 0.923 4.460) 5.440 3.860 ( 1.129 -6.064 -1.063) 6.259 4.278 ( -6.484 -0.157 5.838) 8.726 4.446 ( -6.677 7.592 -8.789) 13.396 4.704 ( -0.947 4.430 -8.061) 9.246 4.864 ( -2.410 9.678 -2.675) 10.326 4.941 ( 0.894 12.321 -3.944) 12.968 5.238 ( -1.281 3.965 3.286) 5.307 5.771 ( 2.058 -0.116 2.185) 3.003 5.963 ( -0.769 -1.262 -0.585) 1.590 6.316 ( 1.510 -5.655 -5.619) 8.113 6.508 ( -2.969 -6.457 3.292) 7.832 6.623 ( -1.764 -0.941 6.042) 6.364 6.786 ( 0.874 -3.101 -0.273) 3.233 6.893 ( 3.282 -5.042 0.260) 6.022 7.110 ( 0.560 -5.918 -1.590) 6.154 7.838 ( -0.639 -7.788 1.134) 7.896 8.012 ( 2.414 -1.996 -2.122) 3.784 8.360 ( -0.240 -8.579 0.296) 8.587 8.444 ( -1.324 -7.075 -0.499) 7.215 8.630 ( -2.129 -8.716 -0.194) 8.974 8.715 ( -2.285 0.193 -1.509) 2.745 8.804 ( -2.904 -9.546 0.854) 10.014 9.039 ( -1.924 -8.728 3.255) 9.512 9.090 ( -1.298 -2.799 -2.387) 3.901 9.405 ( 0.030 -0.839 2.924) 3.042 9.708 ( 1.588 -4.113 -3.937) 5.910 9.836 ( -4.603 -3.513 0.393) 5.804 9.951 ( -0.120 -2.296 -0.368) 2.329 10.179 ( -4.032 5.760 -1.467) 7.182 10.436 ( -0.693 5.299 1.374) 5.518 10.520 ( -3.629 2.763 -1.011) 4.673 10.657 ( -1.465 -1.630 2.361) 3.222 10.893 ( -0.187 5.790 -0.709) 5.836 11.036 ( 0.034 3.920 2.193) 4.492 11.109 ( -2.310 0.376 -1.186) 2.623 11.369 ( 0.518 10.172 1.871) 10.355 11.440 ( 0.709 3.273 -1.485) 3.663 11.583 ( 3.083 9.481 0.768) 9.999 11.860 ( -0.775 5.120 -2.615) 5.801 12.035 ( -0.733 1.946 6.181) 6.522 12.167 ( 3.818 4.676 -6.859) 9.137 12.360 ( 3.164 2.929 -3.028) 5.268 12.704 ( 4.614 1.173 2.692) 5.469 12.826 ( -1.093 3.321 1.417) 3.773 13.138 ( 0.968 6.223 1.015) 6.379 15.971 ( 3.407 -0.996 3.153) 4.748 16.158 ( 4.062 -2.855 1.322) 5.138 16.327 ( 2.317 2.794 -5.233) 6.368 16.439 ( 0.696 -2.516 1.885) 3.220 ======================= Grid point 322 (152/172) ======================= q-point: ( 0.50 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( 10.803 -3.192 -2.936) 11.641 3.039 ( 9.681 -7.685 -3.738) 12.913 3.186 ( 3.362 -1.439 4.787) 6.024 3.563 ( -0.359 -3.563 -0.182) 3.586 3.783 ( -0.254 -8.204 11.101) 13.806 3.969 ( 0.594 -3.456 1.998) 4.036 4.245 ( -8.239 1.663 -5.331) 9.953 4.297 ( 0.386 0.861 1.879) 2.102 4.552 ( -3.098 7.632 -3.111) 8.805 4.666 ( -0.807 9.839 -0.042) 9.872 4.767 ( 0.922 6.943 -7.853) 10.522 5.149 ( -4.237 3.668 -0.182) 5.607 5.786 ( 1.358 0.681 2.388) 2.830 6.015 ( 6.405 -1.810 1.776) 6.888 6.430 ( 1.299 -7.254 -8.923) 11.573 6.564 ( -5.688 -2.804 2.079) 6.674 6.661 ( 0.889 -1.723 6.027) 6.331 6.826 ( -0.405 -1.980 -2.623) 3.312 6.987 ( 3.691 -1.794 2.083) 4.602 7.182 ( 0.063 -2.694 -1.286) 2.986 7.951 ( 0.182 -4.647 -0.191) 4.654 8.046 ( -0.614 -1.402 0.352) 1.571 8.473 ( 0.338 -4.591 0.511) 4.632 8.516 ( -1.353 -4.375 -3.107) 5.534 8.687 ( -0.803 1.004 0.933) 1.589 8.735 ( -1.312 -3.909 1.129) 4.275 8.963 ( 2.272 -3.708 1.815) 4.712 9.132 ( 0.369 -11.878 -0.836) 11.913 9.285 ( -1.002 -14.475 0.691) 14.526 9.412 ( -0.802 0.792 0.999) 1.506 9.744 ( -0.154 1.175 -1.635) 2.019 9.883 ( -0.186 -0.312 0.370) 0.519 10.002 ( -1.930 -4.629 -2.118) 5.444 10.057 ( 0.142 1.006 -2.053) 2.291 10.291 ( -5.508 10.873 -1.431) 12.272 10.435 ( -2.723 1.296 4.335) 5.280 10.654 ( -0.160 1.038 -2.429) 2.646 10.800 ( -3.799 0.342 2.597) 4.615 11.009 ( 1.713 2.547 1.478) 3.407 11.076 ( 0.250 4.208 -1.413) 4.446 11.230 ( -1.886 3.616 3.348) 5.277 11.386 ( -1.255 3.647 -1.871) 4.287 11.474 ( 5.554 5.469 -0.303) 7.800 11.779 ( -0.797 2.913 -1.494) 3.369 11.994 ( -0.893 3.955 7.215) 8.276 12.108 ( 3.461 3.181 -6.785) 8.254 12.340 ( 1.471 0.795 -2.286) 2.832 12.649 ( -4.471 3.205 -1.052) 5.600 12.847 ( 6.057 -0.185 2.887) 6.713 13.053 ( 0.982 4.526 0.924) 4.722 16.009 ( 1.674 0.083 3.263) 3.668 16.226 ( 1.021 -0.334 -0.829) 1.357 16.281 ( 2.577 1.361 -2.295) 3.710 16.476 ( -0.337 -1.197 0.489) 1.336 ======================= Grid point 323 (153/172) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.844 ( 6.316 6.166 1.727) 8.994 3.069 ( 1.231 8.619 1.305) 8.804 3.165 ( -1.455 3.644 -2.608) 4.711 3.632 ( -1.101 1.069 -3.807) 4.105 3.837 ( -1.198 5.081 -0.524) 5.247 4.008 ( 3.636 -2.819 2.069) 5.044 4.171 ( -4.893 0.342 -3.153) 5.831 4.332 ( -3.280 -5.843 8.940) 11.173 4.505 ( 2.249 -3.024 2.374) 4.454 4.571 ( -1.821 -1.228 1.830) 2.859 4.687 ( -0.379 -0.947 -4.995) 5.098 5.055 ( -7.657 1.143 -4.495) 8.953 5.812 ( 6.428 -0.182 2.423) 6.872 6.103 ( 7.749 -0.196 3.379) 8.456 6.485 ( -4.074 -1.505 -4.667) 6.375 6.560 ( -0.929 -0.686 -0.321) 1.199 6.698 ( 1.347 0.215 0.802) 1.582 6.816 ( -1.757 1.537 -4.071) 4.693 7.022 ( 3.755 1.624 2.028) 4.566 7.196 ( -1.313 0.309 0.466) 1.427 7.988 ( -0.147 0.059 -0.253) 0.299 8.046 ( -2.306 0.551 1.334) 2.720 8.510 ( 0.189 0.272 1.226) 1.270 8.579 ( 0.752 -2.696 -3.576) 4.541 8.686 ( 2.024 -0.820 0.353) 2.212 8.777 ( -0.516 -2.138 1.093) 2.456 8.992 ( 4.866 1.814 1.869) 5.519 9.306 ( -2.365 1.161 -1.171) 2.883 9.388 ( 1.583 -1.559 1.777) 2.845 9.470 ( 0.131 -3.382 0.810) 3.480 9.678 ( -1.628 2.299 -2.132) 3.533 9.796 ( -2.579 4.863 -0.447) 5.523 10.026 ( -1.649 2.645 1.478) 3.450 10.098 ( -1.606 -2.826 -0.594) 3.304 10.208 ( 1.821 -10.091 -1.184) 10.322 10.449 ( -1.714 -2.455 0.268) 3.006 10.650 ( 1.186 -1.981 -2.512) 3.412 10.806 ( -1.913 -1.365 3.690) 4.375 10.962 ( 0.316 1.956 0.057) 1.982 10.999 ( -0.190 3.254 -0.571) 3.309 11.233 ( -2.564 -3.367 1.881) 4.631 11.311 ( -1.297 1.798 -1.473) 2.662 11.479 ( 5.794 0.359 1.041) 5.898 11.741 ( -1.930 -0.155 -0.813) 2.100 11.948 ( -0.409 2.225 5.180) 5.653 12.070 ( 0.931 1.398 -5.134) 5.402 12.334 ( 0.340 0.514 -0.312) 0.691 12.562 ( -6.224 1.188 -2.997) 7.009 12.893 ( 6.575 1.006 -0.486) 6.670 13.023 ( 0.523 0.171 3.138) 3.186 16.011 ( 0.801 1.639 2.040) 2.736 16.165 ( -2.901 3.142 -3.882) 5.776 16.321 ( 3.291 -0.642 2.702) 4.306 16.476 ( -1.205 0.527 -0.917) 1.603 ======================= Grid point 324 (154/172) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( 1.150 13.535 5.444) 14.634 2.883 ( 1.399 14.915 2.753) 15.231 2.979 ( -4.394 12.522 -2.306) 13.470 3.392 ( -10.953 15.066 -12.812) 22.607 3.779 ( 5.332 2.921 -0.389) 6.093 3.962 ( -5.194 9.258 6.095) 12.241 4.214 ( 4.190 -6.799 -0.340) 7.993 4.479 ( -4.559 -9.341 2.683) 10.735 4.639 ( 4.182 -6.177 -4.804) 8.872 4.697 ( 3.989 -13.691 0.100) 14.261 4.776 ( -4.355 -9.082 10.289) 14.398 4.990 ( -7.380 -4.191 -6.619) 10.763 5.903 ( 10.744 -0.690 3.341) 11.273 6.138 ( 3.727 2.959 2.363) 5.314 6.424 ( -1.938 3.776 3.333) 5.396 6.546 ( -1.364 1.423 -5.027) 5.400 6.668 ( 1.330 3.833 -3.570) 5.404 6.729 ( -4.204 4.054 -3.096) 6.610 7.009 ( 4.871 4.049 0.397) 6.347 7.151 ( -3.383 3.251 1.685) 4.986 7.953 ( 0.994 3.814 -1.503) 4.218 8.001 ( -3.369 2.594 2.902) 5.148 8.480 ( 1.079 4.302 1.718) 4.756 8.560 ( -0.887 3.874 -2.347) 4.616 8.745 ( 4.179 -2.315 -1.132) 4.910 8.808 ( 1.561 -0.143 1.060) 1.893 8.994 ( 3.841 4.302 3.307) 6.648 9.163 ( -1.344 9.038 -2.162) 9.390 9.320 ( 4.067 9.504 -1.109) 10.397 9.409 ( -1.512 7.229 2.122) 7.685 9.674 ( -2.483 -1.991 -1.678) 3.598 9.758 ( -7.284 -6.127 -0.150) 9.519 10.038 ( 3.025 0.018 3.301) 4.477 10.133 ( -0.042 0.217 -1.026) 1.049 10.422 ( 2.238 -12.324 -1.550) 12.621 10.487 ( -0.200 -3.891 0.159) 3.899 10.702 ( 3.952 -0.141 -0.388) 3.974 10.830 ( -1.522 -1.752 1.243) 2.633 10.965 ( 0.292 -1.522 -1.251) 1.991 11.013 ( -2.496 -7.429 -0.577) 7.858 11.283 ( 0.170 -3.736 -0.417) 3.763 11.320 ( -2.572 -4.478 1.320) 5.330 11.548 ( 6.369 -2.131 2.258) 7.085 11.751 ( -3.761 -3.746 -0.536) 5.336 11.949 ( 0.013 -1.336 1.662) 2.133 12.047 ( -2.706 -0.675 -1.405) 3.123 12.330 ( 1.055 0.258 0.209) 1.106 12.489 ( -6.855 0.256 -3.881) 7.881 12.937 ( 7.092 -0.591 -1.095) 7.201 13.053 ( -1.204 -2.492 2.771) 3.916 15.979 ( 1.112 3.137 0.124) 3.331 16.077 ( -4.249 2.777 -1.432) 5.274 16.348 ( 1.727 0.791 3.190) 3.713 16.436 ( -1.637 2.209 -2.226) 3.537 ======================= Grid point 325 (155/172) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( 0.204 15.279 11.836) 19.328 2.594 ( -4.171 14.432 -10.733) 18.463 2.742 ( 3.721 16.191 14.528) 22.069 2.978 ( -11.589 16.433 -18.010) 26.995 3.731 ( 0.742 8.654 8.081) 11.863 3.799 ( -3.628 4.739 -2.684) 6.544 4.383 ( 9.729 -7.069 -5.325) 13.152 4.538 ( -11.187 -6.288 1.686) 12.943 4.806 ( 10.016 -7.667 -5.396) 13.719 4.910 ( -8.177 -9.576 9.723) 15.909 4.994 ( 5.534 -13.016 -0.867) 14.170 5.073 ( -4.130 -10.387 -1.229) 11.245 5.970 ( 8.739 3.938 1.274) 9.669 6.064 ( -2.714 6.188 2.628) 7.251 6.392 ( 4.527 1.966 3.626) 6.124 6.477 ( -1.666 2.244 -5.124) 5.837 6.584 ( -1.560 5.036 0.536) 5.299 6.619 ( -3.638 3.330 -4.346) 6.574 6.965 ( 5.474 5.688 -0.968) 7.953 7.043 ( -4.880 5.914 1.641) 7.841 7.882 ( 3.375 5.195 -3.187) 6.967 7.923 ( -4.332 3.974 3.973) 7.095 8.385 ( 1.386 8.781 2.971) 9.373 8.428 ( -1.454 9.033 -3.316) 9.731 8.777 ( 4.706 4.046 -1.239) 6.329 8.809 ( -0.103 1.999 2.200) 2.974 8.912 ( 3.340 6.267 5.161) 8.779 8.996 ( -2.425 6.937 -5.758) 9.335 9.243 ( 4.073 3.459 3.053) 6.155 9.318 ( -3.464 1.012 -2.797) 4.566 9.712 ( 4.072 -2.490 -0.251) 4.779 9.805 ( -6.648 -4.246 -0.289) 7.893 10.035 ( 4.165 2.754 3.859) 6.311 10.117 ( -3.676 -1.483 -3.237) 5.118 10.570 ( 1.333 -3.196 3.450) 4.888 10.590 ( 0.827 -5.030 -3.163) 5.999 10.708 ( 5.502 2.532 -0.950) 6.130 10.798 ( -5.669 1.631 1.023) 5.987 11.071 ( 3.021 -6.554 -1.315) 7.335 11.111 ( -2.353 -6.014 0.017) 6.458 11.394 ( 2.045 -8.033 -1.374) 8.402 11.417 ( -2.176 -8.451 2.306) 9.026 11.657 ( 7.190 -3.472 1.631) 8.149 11.786 ( -7.358 -4.592 -1.003) 8.731 11.997 ( 2.046 -3.291 -0.723) 3.942 12.052 ( -5.103 -3.684 1.489) 6.467 12.352 ( 2.828 -1.050 0.914) 3.152 12.431 ( -5.591 -0.631 -2.999) 6.375 13.023 ( 6.213 -3.484 0.142) 7.125 13.097 ( -3.157 -4.148 0.465) 5.234 15.934 ( 2.514 3.458 0.031) 4.275 15.995 ( -4.724 2.541 -0.370) 5.377 16.341 ( 0.077 1.942 3.854) 4.317 16.371 ( -1.019 2.814 -3.588) 4.672 ======================= Grid point 326 (156/172) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 155 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( -1.565 12.181 -19.840) 23.334 2.295 ( 1.565 12.181 19.840) 23.334 2.594 ( -5.987 11.514 -24.087) 27.361 2.594 ( 5.987 11.514 24.087) 27.361 3.636 ( -2.339 7.567 -22.119) 23.494 3.636 ( 2.339 7.567 22.119) 23.494 4.582 ( 6.308 -7.880 -7.017) 12.293 4.582 ( -6.308 -7.880 7.017) 12.293 4.988 ( 6.983 -5.396 -8.592) 12.317 4.988 ( -6.983 -5.396 8.592) 12.317 5.193 ( 3.369 -5.333 -10.570) 12.309 5.193 ( -3.369 -5.333 10.570) 12.309 5.950 ( 1.122 2.313 -6.342) 6.843 5.950 ( -1.122 2.313 6.342) 6.843 6.405 ( -3.403 3.096 -4.621) 6.520 6.405 ( 3.403 3.096 4.621) 6.520 6.543 ( -1.525 0.277 -5.168) 5.396 6.543 ( 1.525 0.277 5.168) 5.396 6.898 ( 0.877 6.454 -0.933) 6.580 6.898 ( -0.877 6.454 0.933) 6.580 7.820 ( 4.409 4.863 -5.556) 8.600 7.820 ( -4.409 4.863 5.556) 8.600 8.236 ( -1.058 10.145 -4.381) 11.101 8.236 ( 1.058 10.145 4.381) 11.101 8.702 ( -0.570 6.696 -2.639) 7.220 8.702 ( 0.570 6.696 2.639) 7.220 8.906 ( 1.323 0.906 -10.025) 10.153 8.906 ( -1.323 0.906 10.025) 10.153 9.264 ( -6.515 0.199 -4.586) 7.970 9.264 ( 6.515 0.199 4.586) 7.970 9.788 ( -5.334 -0.556 -3.445) 6.374 9.788 ( 5.334 -0.556 3.445) 6.374 10.113 ( -7.122 -4.949 -3.925) 9.520 10.113 ( 7.122 -4.949 3.925) 9.520 10.589 ( 1.165 2.916 -5.669) 6.481 10.589 ( -1.165 2.916 5.669) 6.481 10.709 ( -1.667 3.360 -2.598) 4.563 10.709 ( 1.667 3.360 2.598) 4.563 11.183 ( -0.865 -4.674 -2.105) 5.198 11.183 ( 0.865 -4.674 2.105) 5.198 11.548 ( -0.283 -6.763 -5.557) 8.758 11.548 ( 0.283 -6.763 5.557) 8.758 11.783 ( -5.244 -3.940 -2.283) 6.946 11.783 ( 5.244 -3.940 2.283) 6.946 12.088 ( -0.574 -3.901 -0.511) 3.976 12.088 ( 0.574 -3.901 0.511) 3.976 12.414 ( -3.185 -2.358 -2.291) 4.578 12.414 ( 3.185 -2.358 2.291) 4.578 13.148 ( -3.490 -5.377 -3.174) 7.153 13.148 ( 3.490 -5.377 3.174) 7.153 15.911 ( -4.580 2.566 -1.529) 5.468 15.911 ( 4.580 2.566 1.529) 5.468 16.314 ( 0.439 2.021 -4.073) 4.567 16.314 ( -0.439 2.021 4.073) 4.567 ======================= Grid point 330 (157/172) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( 16.496 0.000 -20.304) 26.161 2.228 ( 19.553 0.000 -19.735) 27.781 2.723 ( 18.335 0.000 5.750) 19.216 3.011 ( 14.096 0.000 21.262) 25.510 3.425 ( 22.702 0.000 -22.746) 32.137 3.997 ( -1.988 -0.000 12.668) 12.823 4.348 ( -17.031 -0.000 -3.604) 17.408 4.517 ( -8.988 -0.000 16.088) 18.429 4.982 ( -4.418 -0.000 -7.852) 9.010 5.096 ( -4.414 -0.000 -4.702) 6.449 5.133 ( 1.244 0.000 -6.886) 6.997 5.289 ( -3.059 -0.000 3.698) 4.799 5.843 ( -0.040 -0.000 7.033) 7.033 6.127 ( 3.032 0.000 -4.792) 5.670 6.233 ( -1.993 -0.000 2.303) 3.046 6.427 ( 4.641 0.000 -2.403) 5.226 6.574 ( -1.968 -0.000 -0.696) 2.087 6.596 ( 1.891 0.000 1.755) 2.580 6.720 ( -2.315 -0.000 4.912) 5.430 6.747 ( -1.684 -0.000 -1.962) 2.586 7.561 ( -3.672 -0.000 3.689) 5.205 7.908 ( 8.998 0.000 -5.953) 10.789 7.990 ( -2.657 -0.000 0.504) 2.704 8.057 ( -0.255 -0.000 3.114) 3.125 8.504 ( -5.710 -0.000 -3.249) 6.569 8.505 ( -3.246 -0.000 0.330) 3.263 8.768 ( -2.399 -0.000 -5.177) 5.706 8.806 ( -5.835 -0.000 8.533) 10.337 9.058 ( -1.194 -0.000 -2.372) 2.655 9.394 ( -5.947 -0.000 0.720) 5.990 9.711 ( -1.959 -0.000 -0.411) 2.002 9.825 ( -5.002 -0.000 0.085) 5.003 10.038 ( -5.946 -0.000 2.298) 6.375 10.125 ( -5.019 -0.000 0.827) 5.087 10.440 ( -1.239 -0.000 -4.147) 4.329 10.514 ( -2.304 -0.000 3.553) 4.235 10.753 ( 7.280 0.000 -3.461) 8.061 10.809 ( 7.764 0.000 1.450) 7.898 11.177 ( -3.270 -0.000 1.132) 3.460 11.352 ( -0.286 -0.000 0.914) 0.957 11.538 ( 4.491 0.000 0.165) 4.494 11.709 ( -1.192 -0.000 4.105) 4.274 11.906 ( -0.332 -0.000 -5.313) 5.323 11.945 ( -0.625 -0.000 2.726) 2.797 12.147 ( -0.874 -0.000 -1.042) 1.360 12.218 ( 1.453 0.000 -5.814) 5.993 12.542 ( 4.317 0.000 -1.348) 4.522 12.666 ( 10.100 0.000 6.230) 11.867 13.046 ( -3.474 -0.000 -4.369) 5.582 13.347 ( -0.316 -0.000 3.222) 3.238 15.899 ( 8.792 0.000 2.121) 9.045 16.111 ( 6.764 0.000 -0.654) 6.796 16.178 ( -0.509 -0.000 3.248) 3.287 16.444 ( 5.753 0.000 -4.860) 7.531 ======================= Grid point 331 (158/172) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 18.400 -6.177 -15.308) 24.720 2.400 ( 20.920 -6.731 -15.797) 27.065 2.936 ( 18.230 -3.880 6.475) 19.731 3.201 ( 15.407 -3.221 15.096) 21.809 3.586 ( 22.081 -2.612 -11.783) 25.164 3.900 ( -11.216 6.074 4.956) 13.684 4.247 ( -15.897 -2.648 1.056) 16.150 4.532 ( -2.768 -2.140 8.151) 8.870 4.866 ( -6.763 5.353 -10.582) 13.652 5.023 ( -5.678 0.716 -2.761) 6.354 5.148 ( 1.781 -1.583 -7.182) 7.567 5.276 ( -5.768 -0.371 3.303) 6.657 5.832 ( 3.881 4.350 7.908) 9.825 6.075 ( 1.335 6.244 -1.845) 6.647 6.236 ( 0.100 -1.236 0.144) 1.249 6.433 ( -0.854 2.132 0.398) 2.330 6.569 ( 0.005 -1.452 2.170) 2.611 6.643 ( 2.316 -3.886 -2.473) 5.156 6.725 ( -1.714 -2.902 2.913) 4.455 6.833 ( -0.777 -8.628 -0.644) 8.686 7.591 ( -1.681 -4.752 2.430) 5.596 7.964 ( 4.426 -0.336 -2.084) 4.904 8.023 ( 0.390 -6.879 -2.552) 7.347 8.141 ( -0.309 -7.747 4.046) 8.745 8.451 ( -5.407 -1.429 -2.638) 6.184 8.526 ( -4.252 -4.985 -1.145) 6.652 8.735 ( -2.194 0.191 -3.453) 4.095 8.816 ( -4.757 -3.115 7.026) 9.039 9.064 ( -0.069 -1.537 -1.288) 2.006 9.355 ( -5.983 -1.189 1.098) 6.198 9.661 ( -1.736 2.369 -2.513) 3.865 9.789 ( -4.813 -0.707 -1.706) 5.155 9.971 ( -2.823 2.398 4.165) 5.574 10.141 ( -6.904 -4.260 -0.006) 8.112 10.443 ( -1.605 -2.577 -3.448) 4.595 10.535 ( -3.312 -2.868 3.629) 5.689 10.743 ( 6.886 5.448 -0.684) 8.807 10.888 ( 3.962 -2.247 -2.261) 5.085 11.133 ( -1.507 2.881 1.428) 3.551 11.315 ( -1.598 4.227 1.489) 4.758 11.546 ( 4.662 3.290 -2.027) 6.056 11.670 ( -0.612 4.780 4.411) 6.534 11.844 ( 1.502 4.734 -3.028) 5.817 11.962 ( -2.786 -1.201 1.995) 3.631 12.097 ( -1.450 3.327 -0.499) 3.663 12.221 ( -0.006 -1.048 -6.717) 6.798 12.533 ( 4.697 4.425 -1.236) 6.570 12.739 ( 6.238 1.160 4.405) 7.724 12.994 ( 2.235 3.971 -2.370) 5.137 13.326 ( -0.028 3.285 3.397) 4.725 15.973 ( 8.477 0.691 3.746) 9.294 16.107 ( 3.839 1.630 -0.118) 4.172 16.276 ( 2.839 -5.438 2.748) 6.722 16.453 ( 4.623 2.127 -4.864) 7.039 ======================= Grid point 332 (159/172) ======================= q-point: ( 0.40 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 17.300 -11.911 -8.808) 22.776 2.677 ( 19.403 -10.425 -10.076) 24.222 3.120 ( 15.532 -0.339 5.272) 16.405 3.434 ( 7.835 -6.973 6.764) 12.480 3.710 ( 1.740 4.390 11.673) 12.592 3.783 ( 2.374 -3.056 -2.661) 4.696 4.179 ( -12.856 -2.596 3.410) 13.551 4.497 ( -4.172 4.781 -6.177) 8.856 4.721 ( -1.605 2.607 -12.739) 13.102 4.940 ( -4.612 3.645 -1.500) 6.066 5.126 ( 0.484 7.149 -2.690) 7.654 5.226 ( -7.533 -0.928 1.166) 7.679 5.831 ( 4.706 2.279 5.082) 7.292 5.991 ( 3.547 3.515 1.657) 5.261 6.257 ( 0.755 -1.367 -3.151) 3.517 6.416 ( -2.288 -2.036 2.279) 3.817 6.597 ( -1.349 -1.942 4.144) 4.771 6.718 ( -1.094 -3.962 -2.792) 4.969 6.825 ( 4.020 -6.528 0.657) 7.694 6.979 ( -0.740 -8.680 -0.413) 8.722 7.702 ( 0.479 -7.789 0.943) 7.860 7.992 ( -0.126 -1.467 -0.058) 1.474 8.185 ( 1.081 -10.629 -1.658) 10.812 8.301 ( 0.235 -9.223 1.583) 9.361 8.471 ( -2.962 -6.006 -2.099) 7.018 8.604 ( -3.817 -8.126 -0.943) 9.027 8.714 ( -1.801 -0.660 -1.246) 2.287 8.869 ( -5.198 -6.050 4.952) 9.388 9.089 ( 1.746 -0.672 -0.563) 1.954 9.362 ( -3.374 -3.450 2.404) 5.391 9.635 ( -0.443 -1.940 -3.705) 4.206 9.761 ( -4.174 -0.907 -2.123) 4.770 9.943 ( -1.357 0.427 2.836) 3.173 10.132 ( -8.367 -1.787 -0.822) 8.595 10.467 ( -2.072 -2.212 -2.510) 3.935 10.552 ( -3.077 -0.299 3.125) 4.396 10.680 ( 4.566 6.505 0.740) 7.982 10.929 ( 0.846 -0.680 -3.232) 3.409 11.083 ( -0.715 2.162 1.887) 2.957 11.184 ( -2.404 8.856 1.132) 9.246 11.496 ( 2.686 4.876 -2.720) 6.196 11.568 ( 0.701 8.115 3.037) 8.693 11.761 ( 3.524 7.208 0.518) 8.040 11.921 ( -2.153 3.935 -0.615) 4.527 12.055 ( -1.596 0.237 3.286) 3.661 12.201 ( -0.823 0.657 -7.757) 7.829 12.474 ( 5.007 6.030 -1.698) 8.019 12.740 ( -1.481 1.821 0.507) 2.401 12.949 ( 8.592 5.752 1.999) 10.531 13.258 ( 0.519 5.748 2.709) 6.375 16.024 ( 6.445 1.336 3.873) 7.637 16.143 ( 3.184 -2.026 1.228) 3.969 16.370 ( 2.738 -1.484 -0.556) 3.163 16.427 ( 2.279 1.738 -2.762) 3.981 ======================= Grid point 333 (160/172) ======================= q-point: ( 0.50 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.772 ( 14.274 -10.804 -4.427) 18.441 2.963 ( 12.853 -9.242 -5.988) 16.925 3.242 ( 12.641 -0.004 2.775) 12.942 3.524 ( -1.844 -2.018 1.753) 3.247 3.715 ( -1.796 -2.221 10.978) 11.343 3.898 ( 2.303 -4.827 8.594) 10.122 4.142 ( -11.408 -2.668 1.667) 11.834 4.350 ( -1.152 5.645 -8.273) 10.082 4.623 ( -0.507 4.778 -10.808) 11.828 4.823 ( -0.572 6.972 -4.800) 8.484 4.928 ( -2.228 12.733 2.843) 13.235 5.156 ( -7.916 2.619 -2.154) 8.612 5.838 ( 3.909 1.623 4.570) 6.229 6.046 ( 8.773 -2.037 1.292) 9.099 6.306 ( 0.865 -5.054 -5.330) 7.396 6.451 ( -5.011 -4.208 0.610) 6.572 6.648 ( 0.569 -2.668 5.063) 5.751 6.760 ( -1.658 -3.585 -3.209) 5.089 6.968 ( 4.492 -5.101 1.119) 6.888 7.101 ( -0.692 -6.161 -0.734) 6.243 7.848 ( 1.709 -7.494 -0.703) 7.719 8.009 ( -2.989 -1.774 1.881) 3.951 8.353 ( 0.817 -8.575 -2.130) 8.873 8.429 ( -0.331 -4.988 -0.776) 5.058 8.613 ( -0.645 -10.507 0.329) 10.532 8.676 ( -1.955 -1.874 -1.072) 2.913 8.785 ( -0.260 -10.674 2.940) 11.075 8.996 ( -4.660 -12.741 0.499) 13.576 9.117 ( 5.070 -0.367 0.393) 5.098 9.409 ( -2.315 -2.302 4.147) 5.278 9.694 ( 0.623 -5.426 -6.840) 8.753 9.758 ( -5.578 -4.186 0.908) 7.033 9.940 ( -0.609 -0.438 -0.314) 0.814 10.082 ( -5.994 -0.220 -1.014) 6.083 10.429 ( -0.864 6.868 -1.680) 7.123 10.490 ( -1.332 4.906 3.292) 6.056 10.649 ( 0.432 -0.462 -0.335) 0.716 10.843 ( -5.451 7.684 0.511) 9.435 11.053 ( 0.736 1.492 0.922) 1.902 11.084 ( 0.032 1.009 -0.734) 1.248 11.389 ( 0.314 9.526 2.942) 9.975 11.452 ( 1.502 6.056 -2.117) 6.588 11.651 ( 4.342 8.931 1.488) 10.041 11.827 ( -1.578 4.376 -1.913) 5.030 12.051 ( -1.388 1.173 6.355) 6.609 12.155 ( 0.117 1.611 -7.468) 7.640 12.409 ( 4.948 5.175 -2.499) 7.584 12.662 ( -5.498 3.465 -1.149) 6.600 12.947 ( 9.163 3.791 3.386) 10.478 13.160 ( 0.482 6.398 1.552) 6.601 16.054 ( 4.130 1.365 4.348) 6.150 16.208 ( 1.079 -2.121 0.825) 2.519 16.345 ( 3.803 3.619 -4.942) 7.210 16.448 ( -0.636 -1.776 0.911) 2.095 ======================= Grid point 334 (161/172) ======================= q-point: ( 0.60 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.968 ( 9.870 -0.886 -0.406) 9.918 3.118 ( 2.769 -3.172 -4.069) 5.856 3.294 ( 8.319 6.528 3.562) 11.158 3.579 ( 1.124 -3.241 -2.962) 4.533 3.804 ( -2.155 -6.907 7.931) 10.736 3.994 ( -2.632 -3.774 7.022) 8.395 4.101 ( -3.524 -1.208 -7.083) 8.003 4.249 ( -7.394 0.535 0.991) 7.479 4.534 ( 2.203 3.606 2.323) 4.822 4.663 ( 0.180 9.338 -3.144) 9.855 4.735 ( 1.410 7.701 -3.428) 8.547 5.017 ( -10.210 3.714 -3.656) 11.463 5.885 ( 9.092 0.242 4.797) 10.283 6.144 ( 4.154 -1.715 1.967) 4.906 6.383 ( -0.563 -4.908 -5.760) 7.588 6.489 ( -3.553 -4.637 -2.244) 6.258 6.707 ( 0.944 -1.414 4.723) 5.020 6.791 ( -1.345 -1.937 -3.966) 4.614 7.063 ( 4.149 -1.526 1.906) 4.814 7.168 ( -1.263 -2.620 -0.618) 2.974 7.956 ( 1.357 -3.753 -1.755) 4.360 8.019 ( -3.487 -1.584 2.656) 4.661 8.483 ( 0.445 -5.166 0.461) 5.205 8.494 ( 0.835 -4.562 -3.205) 5.638 8.685 ( 0.015 -1.023 0.404) 1.100 8.719 ( -1.796 -3.823 1.254) 4.407 9.032 ( 4.065 -8.397 3.525) 9.973 9.148 ( 1.276 -9.231 -2.079) 9.548 9.279 ( 1.433 -14.317 -0.355) 14.392 9.401 ( -2.609 1.496 3.379) 4.523 9.720 ( -1.174 1.190 -1.595) 2.310 9.817 ( -7.100 -5.463 -2.304) 9.250 9.969 ( 1.783 -2.804 -1.169) 3.522 10.064 ( -1.057 -1.302 -0.938) 1.922 10.241 ( 1.002 11.294 -0.179) 11.340 10.395 ( -5.285 2.926 2.105) 6.397 10.651 ( 2.048 0.554 -2.197) 3.055 10.747 ( -4.551 -1.669 2.775) 5.585 11.036 ( 1.028 2.523 0.176) 2.730 11.064 ( -0.844 2.381 -0.304) 2.544 11.247 ( 1.170 6.634 3.511) 7.596 11.344 ( -2.266 5.302 -2.196) 6.170 11.575 ( 6.382 4.633 0.564) 7.907 11.742 ( -2.963 2.812 -1.454) 4.336 12.023 ( -0.763 3.339 8.485) 9.150 12.104 ( 1.234 2.691 -8.190) 8.709 12.370 ( 3.979 2.770 -1.534) 5.085 12.548 ( -6.378 3.488 -1.433) 7.410 12.969 ( 6.848 2.042 0.746) 7.185 13.072 ( -0.252 4.141 2.123) 4.660 16.063 ( 2.262 2.060 4.659) 5.574 16.189 ( -1.906 2.834 -4.711) 5.819 16.348 ( 4.486 -0.275 0.874) 4.579 16.460 ( -1.805 -0.690 -0.438) 1.982 ======================= Grid point 335 (162/172) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.956 ( 5.537 9.415 4.160) 11.688 3.070 ( -4.770 7.902 -5.502) 10.745 3.215 ( 12.684 10.944 4.602) 17.374 3.476 ( -13.959 8.698 -5.713) 17.411 3.885 ( 7.013 1.935 0.023) 7.275 4.013 ( -6.860 1.118 -1.538) 7.119 4.161 ( 5.407 -6.496 5.550) 10.112 4.279 ( -5.956 -9.021 -0.533) 10.823 4.540 ( 2.080 -2.920 -1.684) 3.961 4.569 ( -3.380 -1.850 5.951) 7.089 4.711 ( 7.522 -1.018 -0.722) 7.625 4.875 ( -10.228 0.725 -5.386) 11.582 5.990 ( 11.960 -0.834 3.860) 12.595 6.159 ( -5.162 -0.350 0.163) 5.177 6.439 ( 3.096 -1.691 -1.489) 3.829 6.517 ( -3.955 -1.999 -2.229) 4.961 6.724 ( 1.029 1.887 2.634) 3.400 6.764 ( -1.675 2.507 -4.050) 5.049 7.100 ( 4.644 1.583 0.749) 4.963 7.164 ( -3.204 0.935 0.369) 3.358 7.990 ( 0.920 0.203 -0.553) 1.093 8.013 ( -2.456 0.494 1.130) 2.748 8.529 ( 0.729 -0.403 2.991) 3.105 8.560 ( -0.388 -1.768 -4.047) 4.433 8.728 ( 3.177 -2.719 -0.871) 4.271 8.766 ( -2.126 -3.356 1.565) 4.269 9.108 ( 7.649 2.249 2.109) 8.247 9.231 ( -6.062 1.984 -1.626) 6.582 9.436 ( 2.767 -4.500 1.382) 5.461 9.470 ( -1.002 -4.211 0.569) 4.366 9.657 ( 1.701 5.587 -2.062) 6.194 9.721 ( -5.950 7.715 -0.107) 9.744 10.024 ( 0.848 -2.775 1.309) 3.183 10.059 ( -2.203 -5.232 -1.236) 5.810 10.270 ( 5.631 -7.722 0.941) 9.603 10.376 ( -6.218 -5.165 -1.452) 8.213 10.696 ( 5.149 -2.965 -1.141) 6.051 10.770 ( -4.673 -3.490 2.078) 6.192 10.973 ( 0.493 4.112 1.542) 4.419 10.990 ( -0.334 4.083 -1.534) 4.375 11.229 ( 0.698 -1.579 1.766) 2.470 11.267 ( -2.581 -0.008 -1.501) 2.985 11.588 ( 6.372 0.430 1.416) 6.542 11.683 ( -4.535 -0.023 -1.388) 4.743 11.986 ( 0.566 2.990 7.542) 8.133 12.039 ( -0.454 2.444 -7.337) 7.746 12.363 ( 3.694 1.477 -0.019) 3.978 12.447 ( -6.136 1.845 -1.757) 6.644 12.987 ( 5.648 1.013 -2.334) 6.194 13.033 ( -2.173 0.569 3.580) 4.226 16.046 ( 1.625 2.960 3.485) 4.853 16.100 ( -2.417 3.569 -4.099) 5.948 16.386 ( 3.105 0.310 2.233) 3.837 16.440 ( -2.322 0.710 -1.655) 2.938 ======================= Grid point 336 (163/172) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 155 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.794 ( -3.478 15.287 -9.515) 18.339 2.794 ( 3.478 15.287 9.515) 18.339 3.123 ( -10.688 15.168 -13.166) 22.752 3.123 ( 10.688 15.168 13.166) 22.752 3.874 ( 2.507 5.927 -6.542) 9.177 3.874 ( -2.507 5.927 6.542) 9.177 4.347 ( -5.449 -6.173 -6.718) 10.626 4.347 ( 5.449 -6.173 6.718) 10.626 4.690 ( 5.654 -11.090 -9.854) 15.876 4.690 ( -5.654 -11.090 9.854) 15.876 4.851 ( 1.721 -7.921 -16.108) 18.032 4.851 ( -1.721 -7.921 16.108) 18.032 6.090 ( -6.001 1.213 -4.573) 7.642 6.090 ( 6.001 1.213 4.573) 7.642 6.473 ( -1.651 1.746 -7.200) 7.590 6.473 ( 1.651 1.746 7.200) 7.590 6.673 ( 1.909 5.062 -4.991) 7.361 6.673 ( -1.909 5.062 4.991) 7.361 7.090 ( -1.405 3.897 -1.180) 4.308 7.090 ( 1.405 3.897 1.180) 4.308 7.968 ( 2.574 3.057 -6.119) 7.309 7.968 ( -2.574 3.057 6.119) 7.309 8.519 ( -1.866 4.078 -2.835) 5.305 8.519 ( 1.866 4.078 2.835) 5.305 8.801 ( 1.533 -2.293 -3.829) 4.719 8.801 ( -1.533 -2.293 3.829) 4.719 9.091 ( -4.199 7.244 -4.635) 9.570 9.091 ( 4.199 7.244 4.635) 9.570 9.382 ( 0.713 9.196 -2.450) 9.543 9.382 ( -0.713 9.196 2.450) 9.543 9.667 ( 2.201 -4.939 -6.752) 8.650 9.667 ( -2.201 -4.939 6.752) 8.650 10.102 ( -1.525 -0.321 -3.733) 4.045 10.102 ( 1.525 -0.321 3.733) 4.045 10.457 ( 2.423 -8.957 -6.462) 11.308 10.457 ( -2.423 -8.957 6.462) 11.308 10.780 ( -0.731 -0.265 -2.443) 2.564 10.780 ( 0.731 -0.265 2.443) 2.564 10.978 ( -0.609 -4.944 -1.534) 5.213 10.978 ( 0.609 -4.944 1.534) 5.213 11.292 ( -0.055 -4.546 -0.703) 4.600 11.292 ( 0.055 -4.546 0.703) 4.600 11.663 ( -5.956 -2.821 -2.008) 6.889 11.663 ( 5.956 -2.821 2.008) 6.889 11.987 ( 0.524 -0.098 -7.238) 7.258 11.987 ( -0.524 -0.098 7.238) 7.258 12.381 ( -3.608 0.395 -2.265) 4.278 12.381 ( 3.608 0.395 2.265) 4.278 13.023 ( 2.212 -1.399 -2.680) 3.745 13.023 ( -2.212 -1.399 2.680) 3.745 16.014 ( -0.711 3.263 -3.179) 4.611 16.014 ( 0.711 3.263 3.179) 4.611 16.393 ( -1.509 1.919 -3.135) 3.974 16.393 ( 1.509 1.919 3.135) 3.974 ======================= Grid point 342 (164/172) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( 21.164 0.000 -14.626) 25.727 2.462 ( 21.686 0.000 -16.310) 27.135 3.058 ( 18.417 0.000 5.597) 19.249 3.359 ( 15.261 0.000 19.247) 24.564 3.717 ( 22.729 0.000 -13.208) 26.288 3.870 ( -16.695 -0.000 5.222) 17.493 4.102 ( -8.523 -0.000 -2.087) 8.775 4.513 ( -3.345 -0.000 8.888) 9.496 4.828 ( -8.205 -0.000 -9.332) 12.426 4.946 ( -10.389 -0.000 -4.925) 11.497 5.120 ( 2.070 0.000 -7.015) 7.314 5.240 ( -4.448 -0.000 2.262) 4.990 5.935 ( 3.551 0.000 11.267) 11.813 6.129 ( 0.405 0.000 -5.569) 5.584 6.251 ( 1.020 0.000 6.279) 6.361 6.440 ( -0.949 -0.000 -3.921) 4.034 6.561 ( 1.434 0.000 -0.459) 1.505 6.635 ( 1.573 0.000 0.753) 1.744 6.702 ( -4.051 -0.000 6.752) 7.874 6.708 ( -0.145 -0.000 -4.990) 4.992 7.551 ( 0.601 0.000 1.762) 1.861 7.933 ( -4.980 -0.000 0.403) 4.997 8.013 ( 7.419 0.000 -4.536) 8.696 8.078 ( 0.218 0.000 4.350) 4.355 8.389 ( -5.461 -0.000 -2.523) 6.016 8.445 ( -3.729 -0.000 -1.460) 4.005 8.716 ( -1.258 -0.000 -3.608) 3.821 8.765 ( -5.479 -0.000 7.399) 9.207 9.052 ( 1.098 0.000 0.361) 1.155 9.297 ( -5.571 -0.000 0.138) 5.573 9.667 ( -1.872 -0.000 -3.547) 4.010 9.732 ( -5.153 -0.000 -1.777) 5.451 9.976 ( -5.571 -0.000 6.041) 8.218 10.055 ( -3.860 -0.000 -1.636) 4.192 10.405 ( -0.486 -0.000 -2.721) 2.764 10.493 ( -2.810 -0.000 3.145) 4.218 10.832 ( 5.047 0.000 -2.718) 5.732 10.888 ( 2.403 0.000 -1.951) 3.095 11.167 ( 0.800 0.000 2.805) 2.917 11.339 ( -2.427 -0.000 1.554) 2.882 11.618 ( 5.817 0.000 -3.122) 6.602 11.708 ( -2.360 -0.000 3.974) 4.622 11.885 ( 1.541 0.000 -4.167) 4.443 11.939 ( -0.958 -0.000 3.620) 3.744 12.115 ( -3.073 -0.000 1.105) 3.266 12.178 ( -1.394 -0.000 -7.589) 7.716 12.603 ( 4.031 0.000 -1.155) 4.193 12.781 ( 0.013 0.000 1.706) 1.706 13.076 ( 8.910 0.000 0.561) 8.928 13.361 ( -0.110 -0.000 3.037) 3.039 16.052 ( 6.505 0.000 4.374) 7.838 16.189 ( 4.313 0.000 -2.832) 5.159 16.236 ( 4.653 0.000 6.527) 8.016 16.493 ( 4.095 0.000 -5.456) 6.822 ======================= Grid point 343 (165/172) ======================= q-point: ( 0.40 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 20.393 -5.468 -9.269) 23.058 2.648 ( 19.833 -6.806 -13.474) 24.924 3.218 ( 11.656 -1.962 3.090) 12.218 3.507 ( 10.799 1.765 15.473) 18.951 3.711 ( -13.162 2.241 4.142) 13.979 3.849 ( 10.056 -2.001 0.471) 10.264 4.081 ( 0.318 0.589 -1.884) 2.000 4.500 ( -4.336 1.096 -1.952) 4.880 4.707 ( -3.652 2.192 -12.033) 12.764 4.889 ( -9.690 -2.904 -0.297) 10.120 5.131 ( 1.069 -1.450 -6.493) 6.738 5.203 ( -4.691 1.673 2.255) 5.467 5.939 ( 2.051 4.641 7.927) 9.412 6.091 ( 1.694 2.680 -1.606) 3.554 6.258 ( 1.413 1.302 3.725) 4.192 6.408 ( -1.631 1.433 -1.589) 2.691 6.572 ( -0.372 -0.722 1.463) 1.673 6.642 ( -0.973 -1.962 -2.294) 3.172 6.740 ( 1.813 -6.022 1.110) 6.387 6.814 ( -1.137 -9.046 0.137) 9.118 7.607 ( 2.762 -4.490 0.591) 5.305 7.924 ( -7.251 -3.370 1.958) 8.232 8.077 ( 6.027 -3.880 -3.635) 8.037 8.162 ( 0.282 -7.152 2.555) 7.600 8.371 ( -2.327 -2.628 -1.974) 4.027 8.453 ( -3.730 -4.769 -1.454) 6.227 8.694 ( -1.252 0.134 -1.720) 2.132 8.769 ( -5.488 -2.893 5.177) 8.080 9.083 ( 2.311 -1.618 1.408) 3.153 9.279 ( -4.062 -2.451 0.028) 4.744 9.622 ( -0.842 1.396 -2.892) 3.320 9.708 ( -3.806 -1.178 -2.403) 4.653 9.943 ( -3.662 0.579 4.754) 6.029 10.039 ( -5.311 -1.790 -1.791) 5.884 10.413 ( -0.011 -1.745 -1.958) 2.623 10.499 ( -3.627 -2.091 2.945) 5.119 10.819 ( 3.836 4.273 -1.524) 5.941 10.910 ( 1.182 -1.135 -3.096) 3.503 11.148 ( 1.322 3.811 2.803) 4.912 11.284 ( -3.274 4.450 1.232) 5.660 11.600 ( 3.870 4.768 -3.226) 6.936 11.675 ( -1.149 3.413 2.263) 4.253 11.871 ( 3.410 2.635 -1.168) 4.465 11.955 ( 0.036 0.080 3.811) 3.812 12.057 ( -3.576 2.445 0.889) 4.422 12.159 ( -2.344 -1.042 -7.455) 7.884 12.595 ( 3.973 3.888 -0.931) 5.637 12.756 ( -2.787 1.783 0.012) 3.308 13.121 ( 10.300 4.008 1.710) 11.184 13.342 ( -0.279 2.997 2.752) 4.078 16.106 ( 4.690 0.248 4.293) 6.363 16.171 ( 4.098 2.255 -0.273) 4.685 16.342 ( 3.267 -3.412 4.079) 6.241 16.484 ( 2.887 2.444 -5.677) 6.821 ======================= Grid point 344 (166/172) ======================= q-point: ( 0.50 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( 16.396 -9.550 -3.595) 19.312 2.891 ( 12.743 -8.729 -9.701) 18.240 3.313 ( 5.731 -2.335 -1.380) 6.341 3.553 ( 4.929 2.987 11.616) 12.967 3.634 ( -10.175 -2.684 5.448) 11.850 3.975 ( 7.501 2.368 3.705) 8.695 4.027 ( -5.064 -0.735 5.723) 7.677 4.400 ( -3.088 4.263 -8.893) 10.334 4.653 ( 3.695 1.317 -13.038) 13.615 4.857 ( -6.791 0.214 1.098) 6.883 5.097 ( -4.125 7.260 3.393) 9.013 5.120 ( -3.281 1.351 -4.307) 5.581 5.913 ( 4.639 1.852 4.179) 6.513 6.088 ( 4.064 0.001 -0.893) 4.161 6.259 ( 1.038 -0.146 1.111) 1.528 6.376 ( -3.075 -0.472 -0.580) 3.165 6.611 ( 0.522 -3.105 2.221) 3.853 6.672 ( -2.524 -3.608 -1.601) 4.685 6.889 ( 3.955 -7.741 -1.250) 8.782 6.962 ( -1.650 -8.755 1.140) 8.982 7.739 ( 4.171 -7.114 -0.877) 8.294 7.931 ( -7.656 -3.645 2.814) 8.934 8.220 ( 4.802 -7.919 -3.170) 9.789 8.313 ( -0.691 -8.665 1.447) 8.812 8.434 ( 0.335 -7.329 -1.849) 7.566 8.542 ( -3.910 -8.872 -0.277) 9.699 8.699 ( 0.224 -2.116 1.187) 2.436 8.802 ( -5.273 -5.307 1.673) 7.666 9.145 ( 4.662 -1.898 1.652) 5.298 9.316 ( -4.098 -5.007 1.059) 6.556 9.617 ( 0.771 -1.809 -2.478) 3.164 9.689 ( -3.348 -0.922 -2.137) 4.078 9.931 ( -1.368 -0.281 2.171) 2.582 10.012 ( -5.843 -0.923 -1.275) 6.051 10.441 ( 0.403 -1.406 -1.394) 2.021 10.509 ( -4.086 -1.432 2.572) 5.036 10.751 ( 4.671 6.920 -1.184) 8.432 10.895 ( -3.321 2.629 -1.714) 4.569 11.098 ( 1.044 3.354 2.245) 4.169 11.159 ( -1.453 6.634 0.085) 6.791 11.525 ( 2.243 6.077 -0.236) 6.482 11.583 ( -0.128 6.841 -0.363) 6.852 11.825 ( 3.652 6.608 1.360) 7.672 11.902 ( -0.578 5.806 0.058) 5.835 12.044 ( -2.041 -1.925 4.712) 5.484 12.130 ( -2.108 -0.513 -7.886) 8.179 12.542 ( 4.665 5.598 -1.062) 7.364 12.681 ( -4.411 3.530 -0.401) 5.664 13.117 ( 9.044 5.758 1.873) 10.884 13.269 ( -1.082 5.601 1.774) 5.974 16.134 ( 4.597 1.863 3.048) 5.822 16.190 ( 1.412 -1.088 1.627) 2.413 16.402 ( 1.658 -0.222 -0.081) 1.674 16.436 ( 1.034 2.342 -3.205) 4.101 ======================= Grid point 345 (167/172) ======================= q-point: ( 0.60 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.955 ( 9.492 -7.986 0.241) 12.407 3.045 ( 0.956 -5.644 -5.266) 7.779 3.434 ( 9.407 -2.446 2.687) 10.084 3.546 ( 0.098 -0.386 -2.552) 2.583 3.704 ( 1.331 -5.691 6.265) 8.568 3.865 ( -13.076 -0.655 3.842) 13.644 4.108 ( 6.278 0.874 4.226) 7.618 4.252 ( -6.656 5.620 -6.032) 10.596 4.638 ( 7.507 3.228 -2.890) 8.667 4.760 ( -4.535 5.041 -5.684) 8.848 4.927 ( -0.522 10.602 7.131) 12.788 5.009 ( -6.699 5.373 -4.939) 9.906 5.975 ( 8.872 -0.367 6.102) 10.774 6.116 ( -2.122 -1.903 -4.629) 5.436 6.308 ( 2.841 -3.539 0.722) 4.596 6.376 ( -3.846 -3.446 -1.873) 5.493 6.683 ( 0.754 -3.393 3.376) 4.845 6.716 ( -1.462 -3.925 -2.993) 5.148 7.036 ( 3.654 -5.639 -0.005) 6.719 7.080 ( -2.035 -6.097 0.313) 6.436 7.885 ( 4.227 -5.927 -2.749) 7.781 7.949 ( -5.872 -3.681 3.639) 7.828 8.376 ( 4.001 -7.175 -4.367) 9.303 8.412 ( -2.778 -5.246 2.805) 6.565 8.611 ( 0.572 -8.630 0.401) 8.659 8.638 ( -2.046 -4.702 -0.938) 5.213 8.831 ( 3.281 -12.332 3.676) 13.280 8.914 ( -4.741 -13.230 -2.272) 14.236 9.231 ( 8.181 -1.906 1.027) 8.463 9.357 ( -7.042 -3.260 2.133) 8.048 9.669 ( 1.855 -3.909 -6.560) 7.858 9.690 ( -4.139 -2.502 3.344) 5.880 9.945 ( 1.963 -1.585 -0.773) 2.639 9.995 ( -4.600 -2.641 0.207) 5.309 10.427 ( 1.926 5.491 -1.091) 5.921 10.467 ( -3.470 4.813 2.042) 6.275 10.681 ( 4.436 3.480 -2.293) 6.087 10.754 ( -6.141 6.284 1.943) 8.998 11.070 ( 0.955 1.490 0.385) 1.811 11.083 ( -0.276 1.905 -0.300) 1.948 11.418 ( 0.920 8.696 3.576) 9.448 11.448 ( -0.191 8.054 -3.193) 8.666 11.727 ( 4.010 7.507 1.302) 8.610 11.787 ( -2.658 5.701 -1.239) 6.411 12.070 ( -0.559 0.059 6.375) 6.399 12.107 ( -0.532 -0.078 -6.968) 6.989 12.482 ( 5.539 5.470 -1.148) 7.869 12.569 ( -5.715 4.631 -0.206) 7.358 13.086 ( 6.389 5.150 1.113) 8.281 13.155 ( -2.336 5.947 0.713) 6.429 16.139 ( 3.318 2.340 4.186) 5.831 16.198 ( -1.618 1.047 -2.300) 3.001 16.388 ( 3.741 1.182 -2.171) 4.485 16.429 ( -2.284 -0.684 0.751) 2.500 ======================= Grid point 346 (168/172) ======================= q-point: ( 0.70 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 155 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.085 ( -2.614 -0.631 -4.056) 4.866 3.085 ( 2.614 -0.631 4.056) 4.866 3.478 ( -7.363 5.401 -5.120) 10.468 3.478 ( 7.363 5.401 5.120) 10.468 3.886 ( 1.969 -8.296 -9.620) 12.855 3.886 ( -1.969 -8.296 9.620) 12.855 4.133 ( -3.103 -0.321 -0.158) 3.124 4.133 ( 3.103 -0.321 0.158) 3.124 4.607 ( -0.826 6.241 -10.000) 11.817 4.607 ( 0.826 6.241 10.000) 11.817 4.831 ( -7.594 5.442 -4.885) 10.543 4.831 ( 7.594 5.442 4.885) 10.543 6.076 ( -7.693 -0.822 -5.973) 9.774 6.076 ( 7.693 -0.822 5.973) 9.774 6.415 ( -0.463 -4.633 -5.834) 7.464 6.415 ( 0.463 -4.633 5.834) 7.464 6.747 ( -0.531 -1.599 -5.161) 5.429 6.747 ( 0.531 -1.599 5.161) 5.429 7.130 ( -2.137 -2.097 -1.653) 3.419 7.130 ( 2.137 -2.097 1.653) 3.419 7.979 ( 2.785 -2.596 -5.610) 6.780 7.979 ( -2.785 -2.596 5.610) 6.780 8.492 ( 1.730 -4.789 -5.246) 7.311 8.492 ( -1.730 -4.789 5.246) 7.311 8.696 ( 0.587 -3.166 -1.538) 3.568 8.696 ( -0.587 -3.166 1.538) 3.568 9.113 ( -2.752 -11.199 -4.139) 12.253 9.113 ( 2.752 -11.199 4.139) 12.253 9.346 ( -3.037 -4.436 -0.624) 5.412 9.346 ( 3.037 -4.436 0.624) 5.412 9.720 ( 1.743 -2.023 -8.090) 8.519 9.720 ( -1.743 -2.023 8.090) 8.519 10.016 ( -3.008 -1.920 -0.704) 3.637 10.016 ( 3.008 -1.920 0.704) 3.637 10.305 ( -1.852 6.877 -3.420) 7.901 10.305 ( 1.852 6.877 3.420) 7.901 10.692 ( 2.026 -1.389 -2.828) 3.746 10.692 ( -2.026 -1.389 2.828) 3.746 11.050 ( 1.067 2.422 -2.743) 3.812 11.050 ( -1.067 2.422 2.743) 3.812 11.294 ( -1.214 6.724 -4.087) 7.962 11.294 ( 1.214 6.724 4.087) 7.962 11.671 ( -3.137 3.533 -2.690) 5.437 11.671 ( 3.137 3.533 2.690) 5.437 12.065 ( 0.726 2.590 -9.478) 9.852 12.065 ( -0.726 2.590 9.478) 9.852 12.446 ( -0.896 3.765 -4.353) 5.824 12.446 ( 0.896 3.765 4.353) 5.824 13.052 ( 2.162 3.305 -5.939) 7.132 13.052 ( -2.162 3.305 5.939) 7.132 16.127 ( -2.189 3.141 -5.312) 6.548 16.127 ( 2.189 3.141 5.312) 6.548 16.415 ( -3.167 -0.411 -1.068) 3.368 16.415 ( 3.167 -0.411 1.068) 3.368 ======================= Grid point 354 (169/172) ======================= q-point: ( 0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( 19.991 0.000 -7.681) 21.416 2.697 ( 16.212 0.000 -11.506) 19.880 3.272 ( 4.051 0.000 1.890) 4.470 3.582 ( -16.752 -0.000 8.590) 18.826 3.711 ( 10.905 0.000 11.904) 16.144 3.859 ( 5.317 0.000 3.706) 6.481 4.175 ( 13.903 0.000 -10.321) 17.315 4.462 ( -7.945 -0.000 1.737) 8.133 4.669 ( -3.370 -0.000 -7.950) 8.635 4.758 ( -8.566 -0.000 -3.348) 9.197 5.124 ( 2.952 0.000 -5.843) 6.547 5.186 ( -4.057 -0.000 2.960) 5.022 6.027 ( -0.369 -0.000 9.976) 9.983 6.078 ( -1.617 -0.000 -6.424) 6.625 6.318 ( 1.275 0.000 9.281) 9.368 6.400 ( 0.195 0.000 -5.962) 5.965 6.582 ( 0.824 0.000 -0.279) 0.870 6.624 ( -2.738 -0.000 -0.262) 2.751 6.696 ( -1.856 -0.000 7.896) 8.111 6.697 ( 2.887 0.000 -7.074) 7.640 7.601 ( 5.069 0.000 -0.060) 5.070 7.832 ( -8.395 -0.000 1.652) 8.556 8.078 ( 4.535 0.000 -6.009) 7.528 8.102 ( -0.990 -0.000 5.183) 5.277 8.336 ( -0.134 -0.000 -0.370) 0.393 8.385 ( -2.202 -0.000 -1.949) 2.941 8.684 ( -0.056 -0.000 -4.214) 4.214 8.713 ( -5.790 -0.000 6.746) 8.890 9.092 ( 2.791 0.000 2.578) 3.799 9.225 ( -3.601 -0.000 -1.249) 3.812 9.627 ( -0.159 -0.000 -3.811) 3.814 9.659 ( -3.182 -0.000 -0.489) 3.220 9.932 ( -4.044 -0.000 6.733) 7.854 9.985 ( -2.718 -0.000 -4.308) 5.094 10.400 ( 1.377 0.000 -1.763) 2.237 10.461 ( -3.214 -0.000 2.572) 4.117 10.881 ( 2.356 0.000 -1.057) 2.582 10.893 ( 0.930 0.000 -2.808) 2.958 11.209 ( 1.876 0.000 2.326) 2.988 11.295 ( -3.583 -0.000 0.776) 3.666 11.672 ( 4.183 0.000 -5.969) 7.288 11.691 ( -2.372 -0.000 4.826) 5.377 11.913 ( 4.112 0.000 -2.966) 5.070 11.959 ( -0.485 -0.000 5.917) 5.937 12.069 ( -3.545 -0.000 2.019) 4.079 12.106 ( -1.900 -0.000 -7.416) 7.655 12.655 ( 3.288 0.000 -0.677) 3.357 12.750 ( -2.949 -0.000 -0.126) 2.952 13.235 ( 8.560 0.000 1.330) 8.663 13.370 ( -1.005 -0.000 2.058) 2.291 16.144 ( 2.631 0.000 4.694) 5.381 16.215 ( 1.681 0.000 -4.415) 4.724 16.366 ( 5.257 0.000 8.178) 9.722 16.507 ( 1.562 0.000 -6.279) 6.470 ======================= Grid point 355 (170/172) ======================= q-point: ( 0.50 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.694 ( 15.557 -4.737 -2.521) 16.457 2.814 ( 5.133 -5.550 -7.377) 10.562 3.305 ( 4.522 -1.368 -1.730) 5.031 3.469 ( -16.687 -1.809 5.808) 17.761 3.772 ( 10.802 5.779 12.179) 17.275 3.944 ( -0.940 -0.807 -3.322) 3.546 4.177 ( 9.292 4.734 4.472) 11.347 4.380 ( -8.203 1.152 -7.912) 11.455 4.659 ( 5.931 -1.157 -9.603) 11.346 4.748 ( -8.846 -4.250 4.005) 10.600 5.124 ( 2.095 1.184 -3.917) 4.597 5.153 ( -3.544 1.780 2.549) 4.714 5.998 ( 2.875 2.697 4.098) 5.686 6.074 ( -2.777 -0.767 -3.220) 4.320 6.318 ( 1.399 2.902 7.701) 8.348 6.370 ( -0.782 1.755 -5.208) 5.552 6.580 ( 1.583 -0.927 -1.634) 2.457 6.606 ( -2.951 -1.293 1.946) 3.764 6.775 ( 2.851 -7.423 -2.473) 8.328 6.799 ( -1.834 -8.439 2.179) 8.907 7.682 ( 6.703 -3.979 -0.960) 7.854 7.800 ( -8.945 -3.568 1.878) 9.812 8.137 ( 3.945 -5.127 -3.313) 7.268 8.166 ( -1.820 -6.669 2.750) 7.440 8.361 ( 1.790 -2.512 -0.926) 3.221 8.399 ( -2.745 -3.908 -0.357) 4.789 8.680 ( 0.772 -0.854 -0.982) 1.513 8.711 ( -4.100 -2.210 2.402) 5.240 9.144 ( 3.632 -2.184 2.767) 5.061 9.216 ( -3.655 -2.689 -1.786) 4.876 9.614 ( 1.296 0.326 -1.120) 1.744 9.646 ( -2.665 -0.687 -1.221) 3.011 9.926 ( -1.315 -0.080 4.706) 4.887 9.960 ( -2.581 -0.500 -3.674) 4.517 10.421 ( 2.117 -1.321 -1.549) 2.937 10.456 ( -3.407 -1.493 2.103) 4.272 10.861 ( 2.829 2.857 -1.020) 4.148 10.897 ( -1.397 0.644 -1.091) 1.886 11.189 ( 2.126 4.097 1.826) 4.964 11.235 ( -3.015 4.011 -0.225) 5.023 11.636 ( 2.312 4.477 -0.805) 5.102 11.663 ( -1.259 3.463 0.046) 3.685 11.930 ( 3.910 1.820 0.240) 4.319 11.983 ( -0.620 0.605 -0.831) 1.200 12.015 ( -1.572 1.597 6.906) 7.261 12.077 ( -2.532 -0.382 -7.222) 7.662 12.650 ( 3.537 3.217 -0.419) 4.800 12.704 ( -3.432 2.534 -0.074) 4.267 13.266 ( 6.692 3.532 0.524) 7.585 13.335 ( -2.543 3.120 1.329) 4.239 16.177 ( 1.756 -0.282 3.958) 4.339 16.204 ( 0.944 0.653 -2.869) 3.090 16.421 ( 2.482 0.353 6.329) 6.808 16.475 ( 0.229 2.104 -6.371) 6.713 ======================= Grid point 356 (171/172) ======================= q-point: ( 0.60 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 155 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.896 ( -5.863 -7.234 -4.170) 10.203 2.896 ( 5.863 -7.234 4.170) 10.203 3.425 ( -4.256 -5.060 -1.751) 6.840 3.425 ( 4.256 -5.060 1.751) 6.840 3.799 ( -11.124 4.518 -9.741) 15.461 3.799 ( 11.124 4.518 9.741) 15.461 4.243 ( -7.493 2.997 -13.686) 15.888 4.243 ( 7.493 2.997 13.686) 15.888 4.727 ( 7.357 -0.449 -9.141) 11.743 4.727 ( -7.357 -0.449 9.141) 11.743 5.076 ( 2.138 5.427 -7.820) 9.756 5.076 ( -2.138 5.427 7.820) 9.756 6.038 ( -4.789 -0.856 -6.729) 8.303 6.038 ( 4.789 -0.856 6.729) 8.303 6.317 ( -0.416 0.582 -7.027) 7.063 6.317 ( 0.416 0.582 7.027) 7.063 6.633 ( 0.304 -3.519 -2.668) 4.427 6.633 ( -0.304 -3.519 2.668) 4.427 6.935 ( 2.138 -8.476 -3.360) 9.365 6.935 ( -2.138 -8.476 3.360) 9.365 7.821 ( 0.338 -5.632 -1.639) 5.875 7.821 ( -0.338 -5.632 1.639) 5.875 8.280 ( 3.113 -7.508 -5.192) 9.645 8.280 ( -3.113 -7.508 5.192) 9.645 8.473 ( -1.981 -8.426 -0.717) 8.685 8.473 ( 1.981 -8.426 0.717) 8.685 8.735 ( -0.137 -4.109 -4.652) 6.208 8.735 ( 0.137 -4.109 4.652) 6.208 9.238 ( -4.730 -3.890 -1.890) 6.409 9.238 ( 4.730 -3.890 1.890) 6.409 9.637 ( 0.793 -1.263 -4.220) 4.475 9.637 ( -0.793 -1.263 4.220) 4.475 9.942 ( 0.971 -0.581 -5.777) 5.886 9.942 ( -0.971 -0.581 5.777) 5.886 10.462 ( 1.510 -1.234 -2.058) 2.835 10.462 ( -1.510 -1.234 2.058) 2.835 10.822 ( -1.421 5.414 -2.066) 5.966 10.822 ( 1.421 5.414 2.066) 5.966 11.131 ( -0.184 4.547 -2.952) 5.425 11.131 ( 0.184 4.547 2.952) 5.425 11.562 ( 1.253 6.363 -5.794) 8.697 11.562 ( -1.253 6.363 5.794) 8.697 11.881 ( -2.081 6.794 -1.157) 7.199 11.881 ( 2.081 6.794 1.157) 7.199 12.063 ( 0.757 -2.020 -9.116) 9.367 12.063 ( -0.757 -2.020 9.116) 9.367 12.610 ( -0.432 4.695 -3.185) 5.690 12.610 ( 0.432 4.695 3.185) 5.690 13.231 ( 1.308 5.682 -6.828) 8.979 13.231 ( -1.308 5.682 6.828) 8.979 16.194 ( -0.260 0.498 -1.872) 1.955 16.194 ( 0.260 0.498 1.872) 1.955 16.425 ( 1.019 1.534 -4.644) 4.996 16.425 ( -1.019 1.534 4.644) 4.996 ======================= Grid point 367 (172/172) ======================= q-point: ( 0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 2.01e-04 2.01e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 Number of triplets: 86 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -7.435 -0.000 -1.109) 7.518 2.746 ( 7.435 0.000 1.109) 7.518 3.349 ( -12.075 -0.000 3.976) 12.713 3.349 ( 12.075 0.000 -3.976) 12.713 3.923 ( -3.936 -0.000 -5.060) 6.410 3.923 ( 3.936 0.000 5.060) 6.410 4.293 ( -11.474 -0.000 3.412) 11.971 4.293 ( 11.474 0.000 -3.412) 11.971 4.665 ( 4.136 0.000 -2.176) 4.674 4.665 ( -4.136 -0.000 2.176) 4.674 5.147 ( 3.528 0.000 -4.314) 5.573 5.147 ( -3.528 -0.000 4.314) 5.573 6.044 ( 2.247 0.000 -7.455) 7.786 6.044 ( -2.247 -0.000 7.455) 7.786 6.373 ( 0.969 0.000 -8.955) 9.008 6.373 ( -0.969 -0.000 8.955) 9.008 6.590 ( 1.149 0.000 -0.509) 1.257 6.590 ( -1.149 -0.000 0.509) 1.257 6.705 ( 2.617 0.000 -7.153) 7.617 6.705 ( -2.617 -0.000 7.153) 7.617 7.704 ( -8.207 -0.000 1.228) 8.298 7.704 ( 8.207 0.000 -1.228) 8.298 8.101 ( 2.817 0.000 -5.754) 6.407 8.101 ( -2.817 -0.000 5.754) 6.407 8.353 ( -1.189 -0.000 -1.172) 1.670 8.353 ( 1.189 0.000 1.172) 1.670 8.676 ( 2.898 0.000 -5.734) 6.425 8.676 ( -2.898 -0.000 5.734) 6.425 9.159 ( -3.425 -0.000 -2.868) 4.468 9.159 ( 3.425 0.000 2.868) 4.468 9.625 ( 1.741 0.000 -1.833) 2.528 9.625 ( -1.741 -0.000 1.833) 2.528 9.933 ( 0.234 0.000 -6.064) 6.068 9.933 ( -0.234 -0.000 6.064) 6.068 10.424 ( 2.838 0.000 -1.935) 3.435 10.424 ( -2.838 -0.000 1.935) 3.435 10.895 ( 0.388 0.000 -1.115) 1.181 10.895 ( -0.388 -0.000 1.115) 1.181 11.248 ( -2.299 -0.000 -0.706) 2.405 11.248 ( 2.299 0.000 0.706) 2.405 11.688 ( 2.331 0.000 -6.185) 6.609 11.688 ( -2.331 -0.000 6.185) 6.609 11.961 ( 3.792 0.000 -4.719) 6.054 11.961 ( -3.792 -0.000 4.719) 6.054 12.052 ( 0.061 0.000 -4.699) 4.700 12.052 ( -0.061 -0.000 4.699) 4.700 12.702 ( -3.078 -0.000 0.165) 3.082 12.702 ( 3.078 0.000 -0.165) 3.082 13.339 ( -4.197 -0.000 0.417) 4.217 13.339 ( 4.197 0.000 -0.417) 4.217 16.196 ( -0.626 -0.000 -5.017) 5.056 16.196 ( 0.626 0.000 5.017) 5.056 16.467 ( -1.847 -0.000 -7.382) 7.609 16.467 ( 1.847 0.000 7.382) 7.609 =================== 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 3/32400 10.0 3984.857 2852.524 1930.953 0.000 970.190 0.000 3/32400 20.0 1224.795 993.888 915.094 0.000 107.777 0.000 3/32400 30.0 427.203 351.401 317.350 0.000 21.354 0.000 3/32400 40.0 195.224 162.129 142.385 0.000 8.060 0.000 3/32400 50.0 105.201 87.982 76.071 0.000 3.988 0.000 3/32400 60.0 64.161 53.862 46.206 0.000 2.358 0.000 3/32400 70.0 42.951 36.122 30.872 0.000 1.577 0.000 3/32400 80.0 30.857 25.978 22.164 0.000 1.145 0.000 3/32400 90.0 23.409 19.726 16.813 0.000 0.881 0.000 3/32400 100.0 18.530 15.632 13.314 0.000 0.706 0.000 3/32400 110.0 15.170 12.815 10.906 0.000 0.584 0.000 3/32400 120.0 12.758 10.795 9.178 0.000 0.494 0.000 3/32400 130.0 10.965 9.294 7.894 0.000 0.427 0.000 3/32400 140.0 9.593 8.147 6.911 0.000 0.374 0.000 3/32400 150.0 8.517 7.247 6.139 0.000 0.332 0.000 3/32400 160.0 7.653 6.525 5.520 0.000 0.299 0.000 3/32400 170.0 6.948 5.935 5.014 0.000 0.271 0.000 3/32400 180.0 6.362 5.445 4.594 0.000 0.248 0.000 3/32400 190.0 5.869 5.032 4.239 0.000 0.228 0.000 3/32400 200.0 5.448 4.679 3.937 0.000 0.211 0.000 3/32400 210.0 5.086 4.375 3.677 0.000 0.197 0.000 3/32400 220.0 4.770 4.110 3.449 0.000 0.184 0.000 3/32400 230.0 4.492 3.876 3.250 0.000 0.173 0.000 3/32400 240.0 4.247 3.669 3.073 0.000 0.163 0.000 3/32400 250.0 4.028 3.485 2.915 0.000 0.155 0.000 3/32400 260.0 3.831 3.319 2.774 0.000 0.147 0.000 3/32400 270.0 3.654 3.169 2.646 0.000 0.140 0.000 3/32400 280.0 3.493 3.033 2.530 0.000 0.133 0.000 3/32400 290.0 3.346 2.908 2.424 0.000 0.127 0.000 3/32400 300.0 3.212 2.794 2.328 0.000 0.122 0.000 3/32400 310.0 3.089 2.689 2.239 0.000 0.117 0.000 3/32400 320.0 2.975 2.593 2.157 0.000 0.113 0.000 3/32400 330.0 2.870 2.503 2.081 0.000 0.108 0.000 3/32400 340.0 2.772 2.419 2.010 0.000 0.105 0.000 3/32400 350.0 2.681 2.342 1.944 0.000 0.101 0.000 3/32400 360.0 2.596 2.269 1.883 0.000 0.098 0.000 3/32400 370.0 2.516 2.201 1.825 0.000 0.095 0.000 3/32400 380.0 2.442 2.137 1.772 0.000 0.092 0.000 3/32400 390.0 2.372 2.077 1.721 0.000 0.089 0.000 3/32400 400.0 2.306 2.020 1.673 0.000 0.086 0.000 3/32400 410.0 2.244 1.967 1.628 0.000 0.084 0.000 3/32400 420.0 2.185 1.916 1.586 0.000 0.082 0.000 3/32400 430.0 2.129 1.868 1.545 0.000 0.079 0.000 3/32400 440.0 2.076 1.823 1.507 0.000 0.077 0.000 3/32400 450.0 2.026 1.779 1.471 0.000 0.075 0.000 3/32400 460.0 1.978 1.738 1.436 0.000 0.074 0.000 3/32400 470.0 1.933 1.699 1.403 0.000 0.072 0.000 3/32400 480.0 1.889 1.661 1.372 0.000 0.070 0.000 3/32400 490.0 1.848 1.625 1.342 0.000 0.069 0.000 3/32400 500.0 1.808 1.591 1.313 0.000 0.067 0.000 3/32400 510.0 1.771 1.558 1.286 0.000 0.066 0.000 3/32400 520.0 1.734 1.527 1.259 0.000 0.064 0.000 3/32400 530.0 1.700 1.497 1.234 0.000 0.063 0.000 3/32400 540.0 1.666 1.468 1.210 0.000 0.062 0.000 3/32400 550.0 1.634 1.440 1.187 0.000 0.060 0.000 3/32400 560.0 1.603 1.413 1.165 0.000 0.059 0.000 3/32400 570.0 1.574 1.388 1.143 0.000 0.058 0.000 3/32400 580.0 1.545 1.363 1.122 0.000 0.057 0.000 3/32400 590.0 1.518 1.339 1.103 0.000 0.056 0.000 3/32400 600.0 1.491 1.316 1.083 0.000 0.055 0.000 3/32400 610.0 1.466 1.293 1.065 0.000 0.054 0.000 3/32400 620.0 1.441 1.272 1.047 0.000 0.053 0.000 3/32400 630.0 1.417 1.251 1.030 0.000 0.052 0.000 3/32400 640.0 1.394 1.231 1.013 0.000 0.051 0.000 3/32400 650.0 1.372 1.212 0.997 0.000 0.050 0.000 3/32400 660.0 1.350 1.193 0.981 0.000 0.050 0.000 3/32400 670.0 1.329 1.175 0.966 0.000 0.049 0.000 3/32400 680.0 1.309 1.157 0.951 0.000 0.048 0.000 3/32400 690.0 1.290 1.140 0.937 0.000 0.047 0.000 3/32400 700.0 1.270 1.123 0.923 0.000 0.047 0.000 3/32400 710.0 1.252 1.107 0.910 0.000 0.046 0.000 3/32400 720.0 1.234 1.091 0.897 0.000 0.045 0.000 3/32400 730.0 1.217 1.076 0.884 0.000 0.045 0.000 3/32400 740.0 1.200 1.061 0.872 0.000 0.044 0.000 3/32400 750.0 1.183 1.047 0.860 0.000 0.043 0.000 3/32400 760.0 1.167 1.033 0.848 0.000 0.043 0.000 3/32400 770.0 1.152 1.019 0.837 0.000 0.042 0.000 3/32400 780.0 1.137 1.006 0.826 0.000 0.042 0.000 3/32400 790.0 1.122 0.993 0.815 0.000 0.041 0.000 3/32400 800.0 1.107 0.980 0.805 0.000 0.040 0.000 3/32400 810.0 1.093 0.968 0.795 0.000 0.040 0.000 3/32400 820.0 1.080 0.956 0.785 0.000 0.039 0.000 3/32400 830.0 1.066 0.944 0.775 0.000 0.039 0.000 3/32400 840.0 1.054 0.933 0.766 0.000 0.038 0.000 3/32400 850.0 1.041 0.922 0.757 0.000 0.038 0.000 3/32400 860.0 1.028 0.911 0.748 0.000 0.038 0.000 3/32400 870.0 1.016 0.900 0.739 0.000 0.037 0.000 3/32400 880.0 1.005 0.890 0.730 0.000 0.037 0.000 3/32400 890.0 0.993 0.880 0.722 0.000 0.036 0.000 3/32400 900.0 0.982 0.870 0.714 0.000 0.036 0.000 3/32400 910.0 0.971 0.860 0.706 0.000 0.035 0.000 3/32400 920.0 0.960 0.851 0.698 0.000 0.035 0.000 3/32400 930.0 0.950 0.842 0.690 0.000 0.035 0.000 3/32400 940.0 0.939 0.833 0.683 0.000 0.034 0.000 3/32400 950.0 0.929 0.824 0.676 0.000 0.034 0.000 3/32400 960.0 0.920 0.815 0.668 0.000 0.033 0.000 3/32400 970.0 0.910 0.807 0.661 0.000 0.033 0.000 3/32400 980.0 0.900 0.798 0.655 0.000 0.033 0.000 3/32400 990.0 0.891 0.790 0.648 0.000 0.032 0.000 3/32400 1000.0 0.882 0.782 0.641 0.000 0.032 0.000 3/32400 Thermal conductivity related properties were written into "kappa-m10106.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 21:50:32]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|