----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 15:47:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.907099315447047 -3.307637110000000 0.000000000000000 b 6.907099315447047 3.307637110000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): *1 Zr 0.94287421767976 0.94287421767976 0.59625509325501 91.224 2 Zr 0.05712578232024 0.05712578232024 0.40374490674499 91.224 *3 Zr 0.31599145396184 0.31599145396184 0.86385126420211 91.224 4 Zr 0.68400854603816 0.68400854603816 0.13614873579789 91.224 *5 P 0.40696865052019 0.40696865052019 0.66576440427612 30.974 *6 P 0.17040522646165 0.17040522646165 0.03999664238229 30.974 7 P 0.59303134947981 0.59303134947981 0.33423559572388 30.974 8 P 0.82959477353835 0.82959477353835 0.96000335761771 30.974 *9 O 0.99507599680754 0.37518666746954 0.13891317686482 15.999 *10 O 0.76053737487919 0.38178896463529 0.39555417136327 15.999 *11 O 0.51549253873179 0.51549253873179 0.13225233800614 15.999 12 O 0.23946262512081 0.61821103536471 0.60444582863673 15.999 13 O 0.37518666746954 0.99507599680754 0.13891317686482 15.999 14 O 0.00492400319246 0.62481333253046 0.86108682313518 15.999 *15 O 0.26679195032784 0.26679195032784 0.59923098395643 15.999 16 O 0.73320804967216 0.73320804967216 0.40076901604357 15.999 17 O 0.48450746126821 0.48450746126821 0.86774766199386 15.999 *18 O 0.72663936867513 0.72663936867513 0.97716436447643 15.999 *19 O 0.03360950208560 0.03360950208560 0.85456550272148 15.999 20 O 0.96639049791440 0.96639049791440 0.14543449727852 15.999 *21 O 0.88621948198399 0.88621948198399 0.34401164198202 15.999 22 O 0.62481333253046 0.00492400319247 0.86108682313518 15.999 23 O 0.61821103536471 0.23946262512081 0.60444582863673 15.999 24 O 0.27336063132487 0.27336063132487 0.02283563552357 15.999 25 O 0.38178896463529 0.76053737487919 0.39555417136327 15.999 26 O 0.11378051801602 0.11378051801602 0.65598835801798 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 13.814198630894094 0.000000000000000 0.000000000000000 b 0.000000000000000 6.615274220000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): *1 Zr 0.94287421767976 0.00000000000000 0.59625509325501 91.224 > 1 2 Zr 0.05712578232024 0.00000000000000 0.40374490674499 91.224 > 2 *3 Zr 0.31599145396184 0.00000000000000 0.86385126420211 91.224 > 3 4 Zr 0.68400854603816 0.00000000000000 0.13614873579789 91.224 > 4 5 Zr 0.44287421767976 0.50000000000000 0.59625509325501 91.224 > 1 6 Zr 0.55712578232024 0.50000000000000 0.40374490674499 91.224 > 2 7 Zr 0.81599145396184 0.50000000000000 0.86385126420211 91.224 > 3 8 Zr 0.18400854603816 0.50000000000000 0.13614873579789 91.224 > 4 *9 P 0.90696865052019 0.50000000000000 0.66576440427612 30.974 > 5 *10 P 0.67040522646165 0.50000000000000 0.03999664238229 30.974 > 6 11 P 0.09303134947981 0.50000000000000 0.33423559572388 30.974 > 7 12 P 0.32959477353835 0.50000000000000 0.96000335761771 30.974 > 8 13 P 0.40696865052019 0.00000000000000 0.66576440427612 30.974 > 5 14 P 0.17040522646165 0.00000000000000 0.03999664238229 30.974 > 6 15 P 0.59303134947981 0.00000000000000 0.33423559572388 30.974 > 7 16 P 0.82959477353835 0.00000000000000 0.96000335761771 30.974 > 8 *17 O 0.68513133213854 0.69005533533100 0.13891317686482 15.999 > 9 *18 O 0.07116316975724 0.31062579487805 0.39555417136327 15.999 > 10 *19 O 0.01549253873179 0.50000000000000 0.13225233800614 15.999 > 11 20 O 0.92883683024276 0.68937420512195 0.60444582863673 15.999 > 12 21 O 0.68513133213854 0.30994466466900 0.13891317686482 15.999 > 13 22 O 0.31486866786146 0.30994466466900 0.86108682313518 15.999 > 14 *23 O 0.26679195032784 0.00000000000000 0.59923098395643 15.999 > 15 24 O 0.73320804967216 0.00000000000000 0.40076901604357 15.999 > 16 25 O 0.98450746126821 0.50000000000000 0.86774766199386 15.999 > 17 *26 O 0.22663936867513 0.50000000000000 0.97716436447643 15.999 > 18 *27 O 0.03360950208560 0.00000000000000 0.85456550272148 15.999 > 19 28 O 0.96639049791440 0.00000000000000 0.14543449727852 15.999 > 20 *29 O 0.88621948198399 0.00000000000000 0.34401164198202 15.999 > 21 30 O 0.31486866786146 0.69005533533100 0.86108682313518 15.999 > 22 31 O 0.92883683024276 0.31062579487805 0.60444582863673 15.999 > 23 32 O 0.77336063132487 0.50000000000000 0.02283563552357 15.999 > 24 33 O 0.07116316975724 0.68937420512195 0.39555417136327 15.999 > 25 34 O 0.11378051801602 0.00000000000000 0.65598835801798 15.999 > 26 35 O 0.18513133213854 0.19005533533100 0.13891317686482 15.999 > 9 36 O 0.57116316975724 0.81062579487805 0.39555417136327 15.999 > 10 37 O 0.51549253873179 0.00000000000000 0.13225233800614 15.999 > 11 38 O 0.42883683024276 0.18937420512195 0.60444582863673 15.999 > 12 39 O 0.18513133213854 0.80994466466900 0.13891317686482 15.999 > 13 40 O 0.81486866786146 0.80994466466900 0.86108682313518 15.999 > 14 41 O 0.76679195032784 0.50000000000000 0.59923098395643 15.999 > 15 42 O 0.23320804967216 0.50000000000000 0.40076901604357 15.999 > 16 43 O 0.48450746126821 0.00000000000000 0.86774766199386 15.999 > 17 44 O 0.72663936867513 0.00000000000000 0.97716436447643 15.999 > 18 45 O 0.53360950208560 0.50000000000000 0.85456550272148 15.999 > 19 46 O 0.46639049791440 0.50000000000000 0.14543449727852 15.999 > 20 47 O 0.38621948198398 0.50000000000000 0.34401164198202 15.999 > 21 48 O 0.81486866786146 0.19005533533100 0.86108682313518 15.999 > 22 49 O 0.42883683024276 0.81062579487805 0.60444582863673 15.999 > 23 50 O 0.27336063132487 0.00000000000000 0.02283563552357 15.999 > 24 51 O 0.57116316975724 0.18937420512195 0.39555417136327 15.999 > 25 52 O 0.61378051801601 0.50000000000000 0.65598835801798 15.999 > 26 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.814198630894094 0.000000000000000 0.000000000000000 b 0.000000000000000 13.230548440000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): *1 Zr 0.94287421767976 0.00000000000000 0.59625509325501 91.224 > 1 2 Zr 0.94287421767976 0.50000000000000 0.59625509325501 91.224 > 1 3 Zr 0.05712578232024 0.00000000000000 0.40374490674499 91.224 > 2 4 Zr 0.05712578232024 0.50000000000000 0.40374490674499 91.224 > 2 *5 Zr 0.31599145396184 0.00000000000000 0.86385126420211 91.224 > 3 6 Zr 0.31599145396184 0.50000000000000 0.86385126420211 91.224 > 3 7 Zr 0.68400854603816 0.00000000000000 0.13614873579789 91.224 > 4 8 Zr 0.68400854603816 0.50000000000000 0.13614873579789 91.224 > 4 9 Zr 0.44287421767976 0.25000000000000 0.59625509325501 91.224 > 1 10 Zr 0.44287421767976 0.75000000000000 0.59625509325501 91.224 > 1 11 Zr 0.55712578232024 0.25000000000000 0.40374490674499 91.224 > 2 12 Zr 0.55712578232024 0.75000000000000 0.40374490674499 91.224 > 2 13 Zr 0.81599145396184 0.25000000000000 0.86385126420211 91.224 > 3 14 Zr 0.81599145396184 0.75000000000000 0.86385126420211 91.224 > 3 15 Zr 0.18400854603816 0.25000000000000 0.13614873579789 91.224 > 4 16 Zr 0.18400854603816 0.75000000000000 0.13614873579789 91.224 > 4 *17 P 0.90696865052019 0.25000000000000 0.66576440427612 30.974 > 5 18 P 0.90696865052019 0.75000000000000 0.66576440427612 30.974 > 5 *19 P 0.67040522646165 0.25000000000000 0.03999664238229 30.974 > 6 20 P 0.67040522646165 0.75000000000000 0.03999664238229 30.974 > 6 21 P 0.09303134947981 0.25000000000000 0.33423559572388 30.974 > 7 22 P 0.09303134947981 0.75000000000000 0.33423559572388 30.974 > 7 23 P 0.32959477353835 0.25000000000000 0.96000335761771 30.974 > 8 24 P 0.32959477353835 0.75000000000000 0.96000335761771 30.974 > 8 25 P 0.40696865052019 0.00000000000000 0.66576440427612 30.974 > 5 26 P 0.40696865052019 0.50000000000000 0.66576440427612 30.974 > 5 27 P 0.17040522646165 0.00000000000000 0.03999664238229 30.974 > 6 28 P 0.17040522646165 0.50000000000000 0.03999664238229 30.974 > 6 29 P 0.59303134947981 0.00000000000000 0.33423559572388 30.974 > 7 30 P 0.59303134947981 0.50000000000000 0.33423559572388 30.974 > 7 31 P 0.82959477353835 0.00000000000000 0.96000335761771 30.974 > 8 32 P 0.82959477353835 0.50000000000000 0.96000335761771 30.974 > 8 *33 O 0.68513133213854 0.34502766766550 0.13891317686482 15.999 > 9 34 O 0.68513133213854 0.84502766766550 0.13891317686482 15.999 > 9 *35 O 0.07116316975724 0.15531289743903 0.39555417136327 15.999 > 10 36 O 0.07116316975724 0.65531289743903 0.39555417136327 15.999 > 10 *37 O 0.01549253873179 0.25000000000000 0.13225233800614 15.999 > 11 38 O 0.01549253873179 0.75000000000000 0.13225233800614 15.999 > 11 39 O 0.92883683024276 0.34468710256097 0.60444582863673 15.999 > 12 40 O 0.92883683024276 0.84468710256097 0.60444582863673 15.999 > 12 41 O 0.68513133213854 0.15497233233450 0.13891317686482 15.999 > 13 42 O 0.68513133213854 0.65497233233450 0.13891317686482 15.999 > 13 43 O 0.31486866786146 0.15497233233450 0.86108682313518 15.999 > 14 44 O 0.31486866786146 0.65497233233450 0.86108682313518 15.999 > 14 *45 O 0.26679195032784 0.00000000000000 0.59923098395643 15.999 > 15 46 O 0.26679195032784 0.50000000000000 0.59923098395643 15.999 > 15 47 O 0.73320804967216 0.00000000000000 0.40076901604357 15.999 > 16 48 O 0.73320804967216 0.50000000000000 0.40076901604357 15.999 > 16 49 O 0.98450746126821 0.25000000000000 0.86774766199386 15.999 > 17 50 O 0.98450746126821 0.75000000000000 0.86774766199386 15.999 > 17 *51 O 0.22663936867513 0.25000000000000 0.97716436447643 15.999 > 18 52 O 0.22663936867513 0.75000000000000 0.97716436447643 15.999 > 18 *53 O 0.03360950208560 0.00000000000000 0.85456550272148 15.999 > 19 54 O 0.03360950208560 0.50000000000000 0.85456550272148 15.999 > 19 55 O 0.96639049791440 0.00000000000000 0.14543449727852 15.999 > 20 56 O 0.96639049791440 0.50000000000000 0.14543449727852 15.999 > 20 *57 O 0.88621948198399 0.00000000000000 0.34401164198202 15.999 > 21 58 O 0.88621948198399 0.50000000000000 0.34401164198202 15.999 > 21 59 O 0.31486866786146 0.34502766766550 0.86108682313518 15.999 > 22 60 O 0.31486866786146 0.84502766766550 0.86108682313518 15.999 > 22 61 O 0.92883683024276 0.15531289743903 0.60444582863673 15.999 > 23 62 O 0.92883683024276 0.65531289743903 0.60444582863673 15.999 > 23 63 O 0.77336063132487 0.25000000000000 0.02283563552357 15.999 > 24 64 O 0.77336063132487 0.75000000000000 0.02283563552357 15.999 > 24 65 O 0.07116316975724 0.34468710256097 0.39555417136327 15.999 > 25 66 O 0.07116316975724 0.84468710256097 0.39555417136327 15.999 > 25 67 O 0.11378051801602 0.00000000000000 0.65598835801798 15.999 > 26 68 O 0.11378051801602 0.50000000000000 0.65598835801798 15.999 > 26 69 O 0.18513133213854 0.09502766766550 0.13891317686482 15.999 > 9 70 O 0.18513133213854 0.59502766766550 0.13891317686482 15.999 > 9 71 O 0.57116316975724 0.40531289743903 0.39555417136327 15.999 > 10 72 O 0.57116316975724 0.90531289743903 0.39555417136327 15.999 > 10 73 O 0.51549253873179 0.00000000000000 0.13225233800614 15.999 > 11 74 O 0.51549253873179 0.50000000000000 0.13225233800614 15.999 > 11 75 O 0.42883683024276 0.09468710256097 0.60444582863673 15.999 > 12 76 O 0.42883683024276 0.59468710256097 0.60444582863673 15.999 > 12 77 O 0.18513133213854 0.40497233233450 0.13891317686482 15.999 > 13 78 O 0.18513133213854 0.90497233233450 0.13891317686482 15.999 > 13 79 O 0.81486866786146 0.40497233233450 0.86108682313518 15.999 > 14 80 O 0.81486866786146 0.90497233233450 0.86108682313518 15.999 > 14 81 O 0.76679195032784 0.25000000000000 0.59923098395643 15.999 > 15 82 O 0.76679195032784 0.75000000000000 0.59923098395643 15.999 > 15 83 O 0.23320804967216 0.25000000000000 0.40076901604357 15.999 > 16 84 O 0.23320804967216 0.75000000000000 0.40076901604357 15.999 > 16 85 O 0.48450746126821 0.00000000000000 0.86774766199386 15.999 > 17 86 O 0.48450746126821 0.50000000000000 0.86774766199386 15.999 > 17 87 O 0.72663936867513 0.00000000000000 0.97716436447643 15.999 > 18 88 O 0.72663936867513 0.50000000000000 0.97716436447643 15.999 > 18 89 O 0.53360950208560 0.25000000000000 0.85456550272148 15.999 > 19 90 O 0.53360950208560 0.75000000000000 0.85456550272148 15.999 > 19 91 O 0.46639049791440 0.25000000000000 0.14543449727852 15.999 > 20 92 O 0.46639049791440 0.75000000000000 0.14543449727852 15.999 > 20 93 O 0.38621948198398 0.25000000000000 0.34401164198202 15.999 > 21 94 O 0.38621948198398 0.75000000000000 0.34401164198202 15.999 > 21 95 O 0.81486866786146 0.09502766766550 0.86108682313518 15.999 > 22 96 O 0.81486866786146 0.59502766766550 0.86108682313518 15.999 > 22 97 O 0.42883683024276 0.40531289743903 0.60444582863673 15.999 > 23 98 O 0.42883683024276 0.90531289743903 0.60444582863673 15.999 > 23 99 O 0.27336063132487 0.00000000000000 0.02283563552357 15.999 > 24 100 O 0.27336063132487 0.50000000000000 0.02283563552357 15.999 > 24 101 O 0.57116316975724 0.09468710256097 0.39555417136327 15.999 > 25 102 O 0.57116316975724 0.59468710256097 0.39555417136327 15.999 > 25 103 O 0.61378051801601 0.25000000000000 0.65598835801798 15.999 > 26 104 O 0.61378051801601 0.75000000000000 0.65598835801798 15.999 > 26 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4207433 0.0000000 0.0308597 0.0000000 3.5598024 0.0000000 0.0308615 0.0000000 3.4032474 -------------------------- Born effective charges -------------------------- 1 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 2 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 3 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 4 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 5 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 6 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 7 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 8 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 9 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 10 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 11 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 12 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 13 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 14 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 15 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 16 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 17 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 18 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 19 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 20 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 21 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 22 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 23 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 24 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 25 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 26 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 ---------------------------------------------------------------------------- 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: 312/312 Permutation basis: 15450/15450 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3240 Number of blocks in projector: 3240 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: 838 Use submatrix version of eigh solver. (1) Block: 500 / 838 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 229 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 479 eigenvectors found. (1) Block: 838 / 838 (1) 321 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 514 Use submatrix version of eigh solver. (1) Block: 514 / 514 (2) Block: 250 / 514 (2) 246 eigenvectors found. (2) Block: 514 / 514 (2) 260 eigenvectors found. (2) Complementary block size: 8 (2) Compute compressed projector. (2) Use standard solver. (2) 4 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 4 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 514 Use submatrix version of eigh solver. (1) Block: 514 / 514 (2) Block: 250 / 514 (2) 246 eigenvectors found. (2) Block: 514 / 514 (2) 260 eigenvectors found. (2) Complementary block size: 8 (2) Compute compressed projector. (2) Use standard solver. (2) 4 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 4 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 458 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 458 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 458 Use standard eigh solver. Tree of FC basis block matrices: - (3240, 3178), data: False |-- (458, 447), data: True |-- (458, 447), data: True |-- (458, 447), data: True |-- (514, 510), data: False |-- (514, 510), data: False |-- (514, 4), data: (514, 8) @ (8, 4) |-- (264, 260), data: True |-- (250, 246), data: True |-- (514, 510), data: False |-- (514, 510), data: False |-- (514, 4), data: (514, 8) @ (8, 4) |-- (264, 260), data: True |-- (250, 246), data: True |-- (838, 817), data: False |-- (838, 17), data: (838, 38) @ (38, 17) |-- (338, 321), data: True |-- (500, 479), data: False |-- (500, 17), data: (500, 38) @ (38, 17) |-- (250, 229), data: True |-- (250, 233), data: True ----- Solver_atoms: 1 -- 104 / 104 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 800 - Time: 0.806 Solver_block: 200 / 800 - Time: 0.706 Solver_block: 300 / 800 - Time: 0.716 Solver_block: 400 / 800 - Time: 0.704 Solver_block: 500 / 800 - Time: 0.707 Solver_block: 600 / 800 - Time: 0.706 Solver_block: 700 / 800 - Time: 0.711 Solver_block: 800 / 800 - Time: 0.703 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.892 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (zz) 0.00000000 (zz) Permutation basis: 312/312 Permutation basis: 15450/15450 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 3240 Number of blocks in projector: 3240 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: 838 Use submatrix version of eigh solver. (1) Block: 500 / 838 (2) Block: 250 / 500 (2) 233 eigenvectors found. (2) Block: 500 / 500 (2) 229 eigenvectors found. (2) Complementary block size: 38 (2) Compute compressed projector. (2) Use standard solver. (2) 17 eigenvectors found. (1) 479 eigenvectors found. (1) Block: 838 / 838 (1) 321 eigenvectors found. (1) Complementary block size: 38 (1) Compute compressed projector. (1) Use standard solver. (1) 17 eigenvectors found. --- Eigsh_solver_block: 2 / 6 --- Block_size: 514 Use submatrix version of eigh solver. (1) Block: 514 / 514 (2) Block: 250 / 514 (2) 246 eigenvectors found. (2) Block: 514 / 514 (2) 260 eigenvectors found. (2) Complementary block size: 8 (2) Compute compressed projector. (2) Use standard solver. (2) 4 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 4 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 3 / 6 --- Block_size: 514 Use submatrix version of eigh solver. (1) Block: 514 / 514 (2) Block: 250 / 514 (2) 246 eigenvectors found. (2) Block: 514 / 514 (2) 260 eigenvectors found. (2) Complementary block size: 8 (2) Compute compressed projector. (2) Use standard solver. (2) 4 eigenvectors found. (1) 510 eigenvectors found. (1) Complementary block size: 4 (1) Compute compressed projector. (1) Use standard solver. (1) 0 eigenvectors found. --- Eigsh_solver_block: 4 / 6 --- Block_size: 458 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 458 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 458 Use standard eigh solver. Tree of FC basis block matrices: - (3240, 3178), data: False |-- (458, 447), data: True |-- (458, 447), data: True |-- (458, 447), data: True |-- (514, 510), data: False |-- (514, 510), data: False |-- (514, 4), data: (514, 8) @ (8, 4) |-- (264, 260), data: True |-- (250, 246), data: True |-- (514, 510), data: False |-- (514, 510), data: False |-- (514, 4), data: (514, 8) @ (8, 4) |-- (264, 260), data: True |-- (250, 246), data: True |-- (838, 817), data: False |-- (838, 17), data: (838, 38) @ (38, 17) |-- (338, 321), data: True |-- (500, 479), data: False |-- (500, 17), data: (500, 38) @ (38, 17) |-- (250, 229), data: True |-- (250, 233), data: True Max drift after symmetrization by symfc projector: 0.00000000 (zz) 0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 15:48:11]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 15:48:12]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.907099315447047 -3.307637110000000 0.000000000000000 b 6.907099315447047 3.307637110000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): 1 Zr 0.94287421767976 0.94287421767976 0.59625509325501 91.224 2 Zr 0.05712578232024 0.05712578232024 0.40374490674499 91.224 3 Zr 0.31599145396184 0.31599145396184 0.86385126420211 91.224 4 Zr 0.68400854603816 0.68400854603816 0.13614873579789 91.224 5 P 0.40696865052019 0.40696865052019 0.66576440427612 30.974 6 P 0.17040522646165 0.17040522646165 0.03999664238229 30.974 7 P 0.59303134947981 0.59303134947981 0.33423559572388 30.974 8 P 0.82959477353835 0.82959477353835 0.96000335761771 30.974 9 O 0.99507599680754 0.37518666746954 0.13891317686482 15.999 10 O 0.76053737487919 0.38178896463529 0.39555417136327 15.999 11 O 0.51549253873179 0.51549253873179 0.13225233800614 15.999 12 O 0.23946262512081 0.61821103536471 0.60444582863673 15.999 13 O 0.37518666746954 0.99507599680754 0.13891317686482 15.999 14 O 0.00492400319246 0.62481333253046 0.86108682313518 15.999 15 O 0.26679195032784 0.26679195032784 0.59923098395643 15.999 16 O 0.73320804967216 0.73320804967216 0.40076901604357 15.999 17 O 0.48450746126821 0.48450746126821 0.86774766199386 15.999 18 O 0.72663936867513 0.72663936867513 0.97716436447643 15.999 19 O 0.03360950208560 0.03360950208560 0.85456550272148 15.999 20 O 0.96639049791440 0.96639049791440 0.14543449727852 15.999 21 O 0.88621948198399 0.88621948198399 0.34401164198202 15.999 22 O 0.62481333253046 0.00492400319247 0.86108682313518 15.999 23 O 0.61821103536471 0.23946262512081 0.60444582863673 15.999 24 O 0.27336063132487 0.27336063132487 0.02283563552357 15.999 25 O 0.38178896463529 0.76053737487919 0.39555417136327 15.999 26 O 0.11378051801602 0.11378051801602 0.65598835801798 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.814198630894094 0.000000000000000 0.000000000000000 b 0.000000000000000 13.230548440000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): 1 Zr 0.94287421767976 0.00000000000000 0.59625509325501 91.224 > 1 2 Zr 0.94287421767976 0.50000000000000 0.59625509325501 91.224 > 1 3 Zr 0.05712578232024 0.00000000000000 0.40374490674499 91.224 > 3 4 Zr 0.05712578232024 0.50000000000000 0.40374490674499 91.224 > 3 5 Zr 0.31599145396184 0.00000000000000 0.86385126420211 91.224 > 5 6 Zr 0.31599145396184 0.50000000000000 0.86385126420211 91.224 > 5 7 Zr 0.68400854603816 0.00000000000000 0.13614873579789 91.224 > 7 8 Zr 0.68400854603816 0.50000000000000 0.13614873579789 91.224 > 7 9 Zr 0.44287421767976 0.25000000000000 0.59625509325501 91.224 > 1 10 Zr 0.44287421767976 0.75000000000000 0.59625509325501 91.224 > 1 11 Zr 0.55712578232024 0.25000000000000 0.40374490674499 91.224 > 3 12 Zr 0.55712578232024 0.75000000000000 0.40374490674499 91.224 > 3 13 Zr 0.81599145396184 0.25000000000000 0.86385126420211 91.224 > 5 14 Zr 0.81599145396184 0.75000000000000 0.86385126420211 91.224 > 5 15 Zr 0.18400854603816 0.25000000000000 0.13614873579789 91.224 > 7 16 Zr 0.18400854603816 0.75000000000000 0.13614873579789 91.224 > 7 17 P 0.90696865052019 0.25000000000000 0.66576440427612 30.974 > 17 18 P 0.90696865052019 0.75000000000000 0.66576440427612 30.974 > 17 19 P 0.67040522646165 0.25000000000000 0.03999664238229 30.974 > 19 20 P 0.67040522646165 0.75000000000000 0.03999664238229 30.974 > 19 21 P 0.09303134947981 0.25000000000000 0.33423559572388 30.974 > 21 22 P 0.09303134947981 0.75000000000000 0.33423559572388 30.974 > 21 23 P 0.32959477353835 0.25000000000000 0.96000335761771 30.974 > 23 24 P 0.32959477353835 0.75000000000000 0.96000335761771 30.974 > 23 25 P 0.40696865052019 0.00000000000000 0.66576440427612 30.974 > 17 26 P 0.40696865052019 0.50000000000000 0.66576440427612 30.974 > 17 27 P 0.17040522646165 0.00000000000000 0.03999664238229 30.974 > 19 28 P 0.17040522646165 0.50000000000000 0.03999664238229 30.974 > 19 29 P 0.59303134947981 0.00000000000000 0.33423559572388 30.974 > 21 30 P 0.59303134947981 0.50000000000000 0.33423559572388 30.974 > 21 31 P 0.82959477353835 0.00000000000000 0.96000335761771 30.974 > 23 32 P 0.82959477353835 0.50000000000000 0.96000335761771 30.974 > 23 33 O 0.68513133213854 0.34502766766550 0.13891317686482 15.999 > 33 34 O 0.68513133213854 0.84502766766550 0.13891317686482 15.999 > 33 35 O 0.07116316975724 0.15531289743903 0.39555417136327 15.999 > 35 36 O 0.07116316975724 0.65531289743903 0.39555417136327 15.999 > 35 37 O 0.01549253873179 0.25000000000000 0.13225233800614 15.999 > 37 38 O 0.01549253873179 0.75000000000000 0.13225233800614 15.999 > 37 39 O 0.92883683024276 0.34468710256097 0.60444582863673 15.999 > 39 40 O 0.92883683024276 0.84468710256097 0.60444582863673 15.999 > 39 41 O 0.68513133213854 0.15497233233450 0.13891317686482 15.999 > 41 42 O 0.68513133213854 0.65497233233450 0.13891317686482 15.999 > 41 43 O 0.31486866786146 0.15497233233450 0.86108682313518 15.999 > 43 44 O 0.31486866786146 0.65497233233450 0.86108682313518 15.999 > 43 45 O 0.26679195032784 0.00000000000000 0.59923098395643 15.999 > 45 46 O 0.26679195032784 0.50000000000000 0.59923098395643 15.999 > 45 47 O 0.73320804967216 0.00000000000000 0.40076901604357 15.999 > 47 48 O 0.73320804967216 0.50000000000000 0.40076901604357 15.999 > 47 49 O 0.98450746126821 0.25000000000000 0.86774766199386 15.999 > 49 50 O 0.98450746126821 0.75000000000000 0.86774766199386 15.999 > 49 51 O 0.22663936867513 0.25000000000000 0.97716436447643 15.999 > 51 52 O 0.22663936867513 0.75000000000000 0.97716436447643 15.999 > 51 53 O 0.03360950208560 0.00000000000000 0.85456550272148 15.999 > 53 54 O 0.03360950208560 0.50000000000000 0.85456550272148 15.999 > 53 55 O 0.96639049791440 0.00000000000000 0.14543449727852 15.999 > 55 56 O 0.96639049791440 0.50000000000000 0.14543449727852 15.999 > 55 57 O 0.88621948198399 0.00000000000000 0.34401164198202 15.999 > 57 58 O 0.88621948198399 0.50000000000000 0.34401164198202 15.999 > 57 59 O 0.31486866786146 0.34502766766550 0.86108682313518 15.999 > 59 60 O 0.31486866786146 0.84502766766550 0.86108682313518 15.999 > 59 61 O 0.92883683024276 0.15531289743903 0.60444582863673 15.999 > 61 62 O 0.92883683024276 0.65531289743903 0.60444582863673 15.999 > 61 63 O 0.77336063132487 0.25000000000000 0.02283563552357 15.999 > 63 64 O 0.77336063132487 0.75000000000000 0.02283563552357 15.999 > 63 65 O 0.07116316975724 0.34468710256097 0.39555417136327 15.999 > 65 66 O 0.07116316975724 0.84468710256097 0.39555417136327 15.999 > 65 67 O 0.11378051801602 0.00000000000000 0.65598835801798 15.999 > 67 68 O 0.11378051801602 0.50000000000000 0.65598835801798 15.999 > 67 69 O 0.18513133213854 0.09502766766550 0.13891317686482 15.999 > 33 70 O 0.18513133213854 0.59502766766550 0.13891317686482 15.999 > 33 71 O 0.57116316975724 0.40531289743903 0.39555417136327 15.999 > 35 72 O 0.57116316975724 0.90531289743903 0.39555417136327 15.999 > 35 73 O 0.51549253873179 0.00000000000000 0.13225233800614 15.999 > 37 74 O 0.51549253873179 0.50000000000000 0.13225233800614 15.999 > 37 75 O 0.42883683024276 0.09468710256097 0.60444582863673 15.999 > 39 76 O 0.42883683024276 0.59468710256097 0.60444582863673 15.999 > 39 77 O 0.18513133213854 0.40497233233450 0.13891317686482 15.999 > 41 78 O 0.18513133213854 0.90497233233450 0.13891317686482 15.999 > 41 79 O 0.81486866786146 0.40497233233450 0.86108682313518 15.999 > 43 80 O 0.81486866786146 0.90497233233450 0.86108682313518 15.999 > 43 81 O 0.76679195032784 0.25000000000000 0.59923098395643 15.999 > 45 82 O 0.76679195032784 0.75000000000000 0.59923098395643 15.999 > 45 83 O 0.23320804967216 0.25000000000000 0.40076901604357 15.999 > 47 84 O 0.23320804967216 0.75000000000000 0.40076901604357 15.999 > 47 85 O 0.48450746126821 0.00000000000000 0.86774766199386 15.999 > 49 86 O 0.48450746126821 0.50000000000000 0.86774766199386 15.999 > 49 87 O 0.72663936867513 0.00000000000000 0.97716436447643 15.999 > 51 88 O 0.72663936867513 0.50000000000000 0.97716436447643 15.999 > 51 89 O 0.53360950208560 0.25000000000000 0.85456550272148 15.999 > 53 90 O 0.53360950208560 0.75000000000000 0.85456550272148 15.999 > 53 91 O 0.46639049791440 0.25000000000000 0.14543449727852 15.999 > 55 92 O 0.46639049791440 0.75000000000000 0.14543449727852 15.999 > 55 93 O 0.38621948198398 0.25000000000000 0.34401164198202 15.999 > 57 94 O 0.38621948198398 0.75000000000000 0.34401164198202 15.999 > 57 95 O 0.81486866786146 0.09502766766550 0.86108682313518 15.999 > 59 96 O 0.81486866786146 0.59502766766550 0.86108682313518 15.999 > 59 97 O 0.42883683024276 0.40531289743903 0.60444582863673 15.999 > 61 98 O 0.42883683024276 0.90531289743903 0.60444582863673 15.999 > 61 99 O 0.27336063132487 0.00000000000000 0.02283563552357 15.999 > 63 100 O 0.27336063132487 0.50000000000000 0.02283563552357 15.999 > 63 101 O 0.57116316975724 0.09468710256097 0.39555417136327 15.999 > 65 102 O 0.57116316975724 0.59468710256097 0.39555417136327 15.999 > 65 103 O 0.61378051801601 0.25000000000000 0.65598835801798 15.999 > 67 104 O 0.61378051801601 0.75000000000000 0.65598835801798 15.999 > 67 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4207433 0.0000000 0.0308597 0.0000000 3.5598024 0.0000000 0.0308615 0.0000000 3.4032474 -------------------------- Born effective charges -------------------------- 1 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 2 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 3 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 4 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 5 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 6 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 7 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 8 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 9 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 10 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 11 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 12 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 13 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 14 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 15 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 16 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 17 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 18 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 19 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 20 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 21 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 22 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 23 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 24 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 25 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 26 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 ---------------------------------------------------------------------------- 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] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] 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] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 19, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 35, 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] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 37, 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] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 45, 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] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 51, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 53, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0067 0.0000 0.0075] [ 0.0067 0.0000 -0.0075] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 15:48:45]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 15:48:46]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 1] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.907099315447047 -3.307637110000000 0.000000000000000 b 6.907099315447047 3.307637110000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): 1 Zr 0.94287421767976 0.94287421767976 0.59625509325501 91.224 2 Zr 0.05712578232024 0.05712578232024 0.40374490674499 91.224 3 Zr 0.31599145396184 0.31599145396184 0.86385126420211 91.224 4 Zr 0.68400854603816 0.68400854603816 0.13614873579789 91.224 5 P 0.40696865052019 0.40696865052019 0.66576440427612 30.974 6 P 0.17040522646165 0.17040522646165 0.03999664238229 30.974 7 P 0.59303134947981 0.59303134947981 0.33423559572388 30.974 8 P 0.82959477353835 0.82959477353835 0.96000335761771 30.974 9 O 0.99507599680754 0.37518666746954 0.13891317686482 15.999 10 O 0.76053737487919 0.38178896463529 0.39555417136327 15.999 11 O 0.51549253873179 0.51549253873179 0.13225233800614 15.999 12 O 0.23946262512081 0.61821103536471 0.60444582863673 15.999 13 O 0.37518666746954 0.99507599680754 0.13891317686482 15.999 14 O 0.00492400319246 0.62481333253046 0.86108682313518 15.999 15 O 0.26679195032784 0.26679195032784 0.59923098395643 15.999 16 O 0.73320804967216 0.73320804967216 0.40076901604357 15.999 17 O 0.48450746126821 0.48450746126821 0.86774766199386 15.999 18 O 0.72663936867513 0.72663936867513 0.97716436447643 15.999 19 O 0.03360950208560 0.03360950208560 0.85456550272148 15.999 20 O 0.96639049791440 0.96639049791440 0.14543449727852 15.999 21 O 0.88621948198399 0.88621948198399 0.34401164198202 15.999 22 O 0.62481333253046 0.00492400319247 0.86108682313518 15.999 23 O 0.61821103536471 0.23946262512081 0.60444582863673 15.999 24 O 0.27336063132487 0.27336063132487 0.02283563552357 15.999 25 O 0.38178896463529 0.76053737487919 0.39555417136327 15.999 26 O 0.11378051801602 0.11378051801602 0.65598835801798 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.814198630894094 0.000000000000000 0.000000000000000 b 0.000000000000000 13.230548440000000 0.000000000000000 c -6.789048955807035 0.000000000000000 7.595336598600626 Atomic positions (fractional): 1 Zr 0.94287421767976 0.00000000000000 0.59625509325501 91.224 > 1 2 Zr 0.94287421767976 0.50000000000000 0.59625509325501 91.224 > 1 3 Zr 0.05712578232024 0.00000000000000 0.40374490674499 91.224 > 3 4 Zr 0.05712578232024 0.50000000000000 0.40374490674499 91.224 > 3 5 Zr 0.31599145396184 0.00000000000000 0.86385126420211 91.224 > 5 6 Zr 0.31599145396184 0.50000000000000 0.86385126420211 91.224 > 5 7 Zr 0.68400854603816 0.00000000000000 0.13614873579789 91.224 > 7 8 Zr 0.68400854603816 0.50000000000000 0.13614873579789 91.224 > 7 9 Zr 0.44287421767976 0.25000000000000 0.59625509325501 91.224 > 1 10 Zr 0.44287421767976 0.75000000000000 0.59625509325501 91.224 > 1 11 Zr 0.55712578232024 0.25000000000000 0.40374490674499 91.224 > 3 12 Zr 0.55712578232024 0.75000000000000 0.40374490674499 91.224 > 3 13 Zr 0.81599145396184 0.25000000000000 0.86385126420211 91.224 > 5 14 Zr 0.81599145396184 0.75000000000000 0.86385126420211 91.224 > 5 15 Zr 0.18400854603816 0.25000000000000 0.13614873579789 91.224 > 7 16 Zr 0.18400854603816 0.75000000000000 0.13614873579789 91.224 > 7 17 P 0.90696865052019 0.25000000000000 0.66576440427612 30.974 > 17 18 P 0.90696865052019 0.75000000000000 0.66576440427612 30.974 > 17 19 P 0.67040522646165 0.25000000000000 0.03999664238229 30.974 > 19 20 P 0.67040522646165 0.75000000000000 0.03999664238229 30.974 > 19 21 P 0.09303134947981 0.25000000000000 0.33423559572388 30.974 > 21 22 P 0.09303134947981 0.75000000000000 0.33423559572388 30.974 > 21 23 P 0.32959477353835 0.25000000000000 0.96000335761771 30.974 > 23 24 P 0.32959477353835 0.75000000000000 0.96000335761771 30.974 > 23 25 P 0.40696865052019 0.00000000000000 0.66576440427612 30.974 > 17 26 P 0.40696865052019 0.50000000000000 0.66576440427612 30.974 > 17 27 P 0.17040522646165 0.00000000000000 0.03999664238229 30.974 > 19 28 P 0.17040522646165 0.50000000000000 0.03999664238229 30.974 > 19 29 P 0.59303134947981 0.00000000000000 0.33423559572388 30.974 > 21 30 P 0.59303134947981 0.50000000000000 0.33423559572388 30.974 > 21 31 P 0.82959477353835 0.00000000000000 0.96000335761771 30.974 > 23 32 P 0.82959477353835 0.50000000000000 0.96000335761771 30.974 > 23 33 O 0.68513133213854 0.34502766766550 0.13891317686482 15.999 > 33 34 O 0.68513133213854 0.84502766766550 0.13891317686482 15.999 > 33 35 O 0.07116316975724 0.15531289743903 0.39555417136327 15.999 > 35 36 O 0.07116316975724 0.65531289743903 0.39555417136327 15.999 > 35 37 O 0.01549253873179 0.25000000000000 0.13225233800614 15.999 > 37 38 O 0.01549253873179 0.75000000000000 0.13225233800614 15.999 > 37 39 O 0.92883683024276 0.34468710256097 0.60444582863673 15.999 > 39 40 O 0.92883683024276 0.84468710256097 0.60444582863673 15.999 > 39 41 O 0.68513133213854 0.15497233233450 0.13891317686482 15.999 > 41 42 O 0.68513133213854 0.65497233233450 0.13891317686482 15.999 > 41 43 O 0.31486866786146 0.15497233233450 0.86108682313518 15.999 > 43 44 O 0.31486866786146 0.65497233233450 0.86108682313518 15.999 > 43 45 O 0.26679195032784 0.00000000000000 0.59923098395643 15.999 > 45 46 O 0.26679195032784 0.50000000000000 0.59923098395643 15.999 > 45 47 O 0.73320804967216 0.00000000000000 0.40076901604357 15.999 > 47 48 O 0.73320804967216 0.50000000000000 0.40076901604357 15.999 > 47 49 O 0.98450746126821 0.25000000000000 0.86774766199386 15.999 > 49 50 O 0.98450746126821 0.75000000000000 0.86774766199386 15.999 > 49 51 O 0.22663936867513 0.25000000000000 0.97716436447643 15.999 > 51 52 O 0.22663936867513 0.75000000000000 0.97716436447643 15.999 > 51 53 O 0.03360950208560 0.00000000000000 0.85456550272148 15.999 > 53 54 O 0.03360950208560 0.50000000000000 0.85456550272148 15.999 > 53 55 O 0.96639049791440 0.00000000000000 0.14543449727852 15.999 > 55 56 O 0.96639049791440 0.50000000000000 0.14543449727852 15.999 > 55 57 O 0.88621948198399 0.00000000000000 0.34401164198202 15.999 > 57 58 O 0.88621948198399 0.50000000000000 0.34401164198202 15.999 > 57 59 O 0.31486866786146 0.34502766766550 0.86108682313518 15.999 > 59 60 O 0.31486866786146 0.84502766766550 0.86108682313518 15.999 > 59 61 O 0.92883683024276 0.15531289743903 0.60444582863673 15.999 > 61 62 O 0.92883683024276 0.65531289743903 0.60444582863673 15.999 > 61 63 O 0.77336063132487 0.25000000000000 0.02283563552357 15.999 > 63 64 O 0.77336063132487 0.75000000000000 0.02283563552357 15.999 > 63 65 O 0.07116316975724 0.34468710256097 0.39555417136327 15.999 > 65 66 O 0.07116316975724 0.84468710256097 0.39555417136327 15.999 > 65 67 O 0.11378051801602 0.00000000000000 0.65598835801798 15.999 > 67 68 O 0.11378051801602 0.50000000000000 0.65598835801798 15.999 > 67 69 O 0.18513133213854 0.09502766766550 0.13891317686482 15.999 > 33 70 O 0.18513133213854 0.59502766766550 0.13891317686482 15.999 > 33 71 O 0.57116316975724 0.40531289743903 0.39555417136327 15.999 > 35 72 O 0.57116316975724 0.90531289743903 0.39555417136327 15.999 > 35 73 O 0.51549253873179 0.00000000000000 0.13225233800614 15.999 > 37 74 O 0.51549253873179 0.50000000000000 0.13225233800614 15.999 > 37 75 O 0.42883683024276 0.09468710256097 0.60444582863673 15.999 > 39 76 O 0.42883683024276 0.59468710256097 0.60444582863673 15.999 > 39 77 O 0.18513133213854 0.40497233233450 0.13891317686482 15.999 > 41 78 O 0.18513133213854 0.90497233233450 0.13891317686482 15.999 > 41 79 O 0.81486866786146 0.40497233233450 0.86108682313518 15.999 > 43 80 O 0.81486866786146 0.90497233233450 0.86108682313518 15.999 > 43 81 O 0.76679195032784 0.25000000000000 0.59923098395643 15.999 > 45 82 O 0.76679195032784 0.75000000000000 0.59923098395643 15.999 > 45 83 O 0.23320804967216 0.25000000000000 0.40076901604357 15.999 > 47 84 O 0.23320804967216 0.75000000000000 0.40076901604357 15.999 > 47 85 O 0.48450746126821 0.00000000000000 0.86774766199386 15.999 > 49 86 O 0.48450746126821 0.50000000000000 0.86774766199386 15.999 > 49 87 O 0.72663936867513 0.00000000000000 0.97716436447643 15.999 > 51 88 O 0.72663936867513 0.50000000000000 0.97716436447643 15.999 > 51 89 O 0.53360950208560 0.25000000000000 0.85456550272148 15.999 > 53 90 O 0.53360950208560 0.75000000000000 0.85456550272148 15.999 > 53 91 O 0.46639049791440 0.25000000000000 0.14543449727852 15.999 > 55 92 O 0.46639049791440 0.75000000000000 0.14543449727852 15.999 > 55 93 O 0.38621948198398 0.25000000000000 0.34401164198202 15.999 > 57 94 O 0.38621948198398 0.75000000000000 0.34401164198202 15.999 > 57 95 O 0.81486866786146 0.09502766766550 0.86108682313518 15.999 > 59 96 O 0.81486866786146 0.59502766766550 0.86108682313518 15.999 > 59 97 O 0.42883683024276 0.40531289743903 0.60444582863673 15.999 > 61 98 O 0.42883683024276 0.90531289743903 0.60444582863673 15.999 > 61 99 O 0.27336063132487 0.00000000000000 0.02283563552357 15.999 > 63 100 O 0.27336063132487 0.50000000000000 0.02283563552357 15.999 > 63 101 O 0.57116316975724 0.09468710256097 0.39555417136327 15.999 > 65 102 O 0.57116316975724 0.59468710256097 0.39555417136327 15.999 > 65 103 O 0.61378051801601 0.25000000000000 0.65598835801798 15.999 > 67 104 O 0.61378051801601 0.75000000000000 0.65598835801798 15.999 > 67 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.4207433 0.0000000 0.0308597 0.0000000 3.5598024 0.0000000 0.0308615 0.0000000 3.4032474 -------------------------- Born effective charges -------------------------- 1 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 2 Zr 4.6861746 0.0000000 0.3897044 0.0000000 5.2960275 0.0000000 0.0277242 0.0000000 5.6719216 3 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 4 Zr 5.4233862 0.0000000 0.3274572 0.0000000 5.6010706 0.0000000 0.5837811 0.0000000 4.9707761 5 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 6 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 7 P 4.3283914 0.0000000 -0.3259043 0.0000000 4.8572692 0.0000000 -0.2592309 0.0000000 3.5619267 8 P 3.8495511 0.0000000 -0.1852756 0.0000000 5.2374699 0.0000000 -0.2134667 0.0000000 4.0740279 9 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 10 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 11 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 12 O -1.3855216 -1.1369959 0.2348907 -0.8209364 -3.7034171 0.4697328 0.1768021 0.4918459 -1.1384333 13 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 14 O -1.1735668 0.3734705 0.1957627 0.3971844 -4.0147623 -0.5927979 0.2062598 -0.9087458 -1.3535486 15 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 16 O -3.1301138 0.0000000 -0.5701619 0.0000000 -1.1289142 0.0000000 -0.7428530 0.0000000 -2.2934143 17 O -2.2592626 0.0000000 -0.4398504 0.0000000 -1.0777827 0.0000000 -0.0166831 0.0000000 -2.8099275 18 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 19 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 20 O -1.1971780 0.0000000 -0.1982773 0.0000000 -1.2546835 0.0000000 -0.0018524 0.0000000 -3.6136442 21 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 22 O -1.1735668 -0.3734705 0.1957627 -0.3971844 -4.0147623 0.5927979 0.2062598 0.9087458 -1.3535486 23 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 24 O -3.1862169 0.0000000 0.7758417 0.0000000 -1.2016743 0.0000000 0.6209395 0.0000000 -1.4337008 25 O -1.3855216 1.1369959 0.2348907 0.8209364 -3.7034171 -0.4697328 0.1768021 -0.4918459 -1.1384333 26 O -3.3965551 0.0000000 -0.6348405 0.0000000 -0.8924237 0.0000000 -0.7644824 0.0000000 -3.1440017 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (xxx) -0.00000001 (xxx) -0.00000001 (xxx) Max drift of fc2: 0.00000000 (zz) 0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 7 ] 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: 0.59, Number of G-points: 293, Lambda: 0.11 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/160) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.811 ( 0.000 0.000 0.000) 0.000 2.045 ( 0.000 0.000 0.000) 0.000 2.745 ( 0.000 0.000 0.000) 0.000 3.318 ( 0.000 0.000 0.000) 0.000 3.335 ( 0.000 0.000 0.000) 0.000 3.534 ( 0.000 0.000 0.000) 0.000 3.741 ( 0.000 0.000 0.000) 0.000 3.818 ( 0.000 0.000 0.000) 0.000 4.563 ( 0.000 0.000 0.000) 0.000 4.572 ( 0.000 0.000 0.000) 0.000 4.750 ( 0.000 0.000 0.000) 0.000 5.070 ( 0.000 0.000 0.000) 0.000 5.555 ( 0.000 0.000 0.000) 0.000 5.614 ( 0.000 0.000 0.000) 0.000 5.765 ( 0.000 0.000 0.000) 0.000 5.906 ( 0.000 0.000 0.000) 0.000 6.209 ( 0.000 0.000 0.000) 0.000 6.413 ( 0.000 0.000 0.000) 0.000 6.482 ( 0.000 0.000 0.000) 0.000 6.986 ( 0.000 0.000 0.000) 0.000 7.105 ( 0.000 0.000 0.000) 0.000 7.435 ( 0.000 0.000 0.000) 0.000 7.465 ( 0.000 0.000 0.000) 0.000 7.621 ( 0.000 0.000 0.000) 0.000 7.977 ( 0.000 0.000 0.000) 0.000 8.166 ( 0.000 0.000 0.000) 0.000 8.541 ( 0.000 0.000 0.000) 0.000 8.694 ( 0.000 0.000 0.000) 0.000 9.103 ( 0.000 0.000 0.000) 0.000 9.265 ( 0.000 0.000 0.000) 0.000 9.419 ( 0.000 0.000 0.000) 0.000 9.652 ( 0.000 0.000 0.000) 0.000 9.659 ( 0.000 0.000 0.000) 0.000 9.879 ( 0.000 0.000 0.000) 0.000 10.088 ( 0.000 0.000 0.000) 0.000 10.561 ( 0.000 0.000 0.000) 0.000 11.181 ( 0.000 0.000 0.000) 0.000 11.474 ( 0.000 0.000 0.000) 0.000 11.537 ( 0.000 0.000 0.000) 0.000 11.948 ( 0.000 0.000 0.000) 0.000 12.678 ( 0.000 0.000 0.000) 0.000 13.213 ( 0.000 0.000 0.000) 0.000 13.672 ( 0.000 0.000 0.000) 0.000 14.443 ( 0.000 0.000 0.000) 0.000 14.838 ( 0.000 0.000 0.000) 0.000 15.569 ( 0.000 0.000 0.000) 0.000 15.992 ( 0.000 0.000 0.000) 0.000 16.291 ( 0.000 0.000 0.000) 0.000 16.405 ( 0.000 0.000 0.000) 0.000 16.406 ( 0.000 0.000 0.000) 0.000 16.621 ( 0.000 0.000 0.000) 0.000 17.349 ( 0.000 0.000 0.000) 0.000 17.681 ( 0.000 0.000 0.000) 0.000 18.049 ( 0.000 0.000 0.000) 0.000 18.361 ( 0.000 0.000 0.000) 0.000 18.526 ( 0.000 0.000 0.000) 0.000 18.931 ( 0.000 0.000 0.000) 0.000 19.071 ( 0.000 0.000 0.000) 0.000 20.300 ( 0.000 0.000 0.000) 0.000 27.534 ( 0.000 0.000 0.000) 0.000 28.283 ( 0.000 0.000 0.000) 0.000 29.272 ( 0.000 0.000 0.000) 0.000 29.481 ( 0.000 0.000 0.000) 0.000 29.681 ( 0.000 0.000 0.000) 0.000 29.688 ( 0.000 0.000 0.000) 0.000 29.778 ( 0.000 0.000 0.000) 0.000 30.088 ( 0.000 0.000 0.000) 0.000 30.240 ( 0.000 0.000 0.000) 0.000 30.391 ( 0.000 0.000 0.000) 0.000 31.037 ( 0.000 0.000 0.000) 0.000 32.018 ( 0.000 0.000 0.000) 0.000 32.040 ( 0.000 0.000 0.000) 0.000 32.247 ( 0.000 0.000 0.000) 0.000 33.300 ( 0.000 0.000 0.000) 0.000 33.318 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/160) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.578 ( 13.185 -26.256 7.509) 30.325 0.852 ( 33.856 -18.291 36.297) 52.899 1.712 ( 8.503 -90.807 6.669) 91.448 2.259 ( -7.035 -45.258 -1.887) 45.840 2.507 ( 9.128 -40.114 4.728) 41.410 2.846 ( -0.073 -10.629 0.451) 10.639 3.323 ( -2.456 -1.721 0.859) 3.120 3.514 ( -2.064 -14.386 -0.136) 14.534 3.643 ( 2.146 -5.836 -10.628) 12.313 3.840 ( 0.467 -27.556 -9.397) 29.118 4.038 ( -4.091 -23.995 8.313) 25.721 4.566 ( -3.130 -2.750 -1.991) 4.618 4.684 ( -4.507 -8.557 -2.884) 10.092 4.719 ( -2.071 -8.103 -3.233) 8.966 5.155 ( -0.106 -6.585 3.626) 7.518 5.505 ( -2.569 4.925 2.186) 5.970 5.702 ( 4.609 8.364 3.441) 10.151 5.790 ( -0.483 8.965 -0.524) 8.993 5.966 ( 18.266 7.796 14.022) 24.312 6.183 ( 7.327 5.467 -0.098) 9.142 6.369 ( -0.249 3.469 -6.594) 7.455 6.544 ( -0.986 -5.314 -1.467) 5.601 6.980 ( 1.543 7.389 7.321) 10.516 7.071 ( 3.697 8.749 -3.068) 9.981 7.264 ( 3.265 13.507 6.795) 15.468 7.524 ( -3.902 2.294 -3.345) 5.628 7.703 ( 3.012 -6.873 5.221) 9.141 8.008 ( -1.862 -5.816 -3.701) 7.140 8.271 ( 0.968 -9.466 -1.807) 9.686 8.535 ( -2.628 -0.432 -0.135) 2.667 8.715 ( 6.870 8.545 3.382) 11.474 9.123 ( 1.507 -1.460 1.525) 2.594 9.272 ( -0.092 -1.116 -0.802) 1.377 9.430 ( -1.219 -0.878 2.640) 3.037 9.673 ( -4.232 -8.954 -2.989) 10.345 9.796 ( 4.304 -7.385 4.336) 9.584 10.079 ( -0.095 -5.288 -2.214) 5.734 10.570 ( 1.487 0.407 1.601) 2.223 11.106 ( -4.112 3.562 -5.541) 7.765 11.461 ( -0.318 1.476 1.748) 2.309 11.490 ( 2.708 4.055 -5.751) 7.540 11.711 ( 1.319 -27.085 -62.665) 68.281 12.676 ( -3.638 -1.171 0.047) 3.822 12.863 ( -75.063 -20.001 27.014) 82.245 13.557 ( 5.965 7.054 -6.206) 11.129 13.805 ( -11.895 -9.537 2.373) 15.430 14.442 ( -1.955 -0.931 0.011) 2.165 14.966 ( -9.428 4.613 23.062) 25.338 15.660 ( 2.325 6.420 14.136) 15.699 15.948 ( 0.076 5.599 0.531) 5.624 16.217 ( -2.225 6.566 -5.644) 8.940 16.334 ( -0.318 6.620 4.765) 8.162 16.412 ( -2.261 0.867 -0.532) 2.480 16.574 ( 3.077 6.444 0.220) 7.144 17.470 ( 12.735 4.721 0.194) 13.583 17.707 ( -3.549 -5.672 -2.761) 7.238 18.116 ( 4.349 4.061 -2.065) 6.298 18.382 ( 3.934 -0.880 -2.112) 4.551 18.770 ( 24.065 12.205 -6.365) 27.724 19.071 ( 20.385 -3.332 -5.414) 21.354 19.170 ( 19.467 21.279 24.262) 37.688 20.304 ( 0.679 1.596 4.313) 4.649 27.677 ( 9.672 15.278 18.190) 25.649 28.304 ( 1.299 0.644 5.287) 5.483 29.295 ( 2.916 3.542 1.269) 4.760 29.465 ( -2.465 0.580 -0.565) 2.595 29.666 ( 0.062 2.102 0.186) 2.111 29.770 ( 0.934 1.088 -0.801) 1.643 30.065 ( 0.578 1.408 -0.078) 1.524 30.175 ( 1.089 6.764 -0.718) 6.888 30.404 ( 0.651 -4.409 -2.089) 4.922 30.774 ( 5.434 9.995 9.481) 14.810 31.131 ( 3.431 -5.340 1.791) 6.595 31.887 ( -0.112 11.899 -0.353) 11.904 32.293 ( -9.282 -8.429 -0.949) 12.574 33.261 ( 2.723 -11.663 -18.037) 21.651 33.615 ( 5.750 -12.218 20.869) 24.857 35.747 ( -79.302 -74.123 -80.594) 135.197 ======================= Grid point 2 (3/160) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( 11.513 -26.115 9.700) 30.143 1.670 ( 32.812 -16.610 33.993) 50.081 2.738 ( -5.083 -19.226 -10.880) 22.668 3.090 ( 0.549 -34.512 -0.321) 34.517 3.226 ( 7.031 -27.965 -7.995) 29.923 3.274 ( 5.819 -53.669 9.382) 54.793 3.390 ( -4.153 -12.278 4.782) 13.815 3.686 ( 5.621 -13.097 0.969) 14.285 3.806 ( -1.730 -18.748 1.144) 18.862 4.175 ( -5.530 -14.604 -6.431) 16.889 4.477 ( -3.821 -10.206 -3.581) 11.471 4.643 ( -2.327 -17.659 -10.217) 20.534 4.760 ( -5.592 -14.001 1.224) 15.126 5.031 ( -6.762 -30.083 -0.067) 30.834 5.363 ( 3.237 -4.206 2.466) 5.853 5.436 ( -4.277 -1.446 -4.946) 6.696 5.560 ( -5.899 -5.161 1.866) 8.057 5.767 ( 4.281 -0.045 6.191) 7.528 6.043 ( 0.786 -2.315 5.607) 6.117 6.175 ( 16.580 6.318 -5.764) 18.655 6.282 ( -1.460 -5.247 -6.982) 8.855 6.572 ( -4.701 0.235 -3.939) 6.138 6.820 ( 7.559 12.517 3.473) 15.029 7.038 ( 7.162 4.230 4.092) 9.270 7.171 ( 2.643 7.096 8.432) 11.333 7.433 ( -3.013 2.077 -2.154) 4.246 7.837 ( -3.748 -3.621 7.294) 8.964 8.075 ( -1.849 -7.797 -6.931) 10.595 8.382 ( 2.071 -4.034 -3.367) 5.648 8.522 ( -3.409 -3.009 -3.664) 5.839 8.676 ( 2.319 2.902 3.406) 5.040 9.216 ( 3.163 -4.973 3.774) 6.999 9.297 ( -3.347 -5.147 -2.593) 6.664 9.471 ( -1.158 -2.740 3.302) 4.444 9.783 ( -4.017 -6.431 1.016) 7.650 9.975 ( 2.672 -4.610 3.183) 6.206 10.190 ( 0.539 -11.310 -2.356) 11.565 10.594 ( 2.206 -0.186 1.505) 2.677 10.958 ( -4.491 3.920 -5.834) 8.341 11.356 ( 0.891 9.234 -3.451) 9.898 11.438 ( 1.012 1.952 -1.846) 2.871 11.711 ( 0.904 -11.041 -30.701) 32.638 12.610 ( -19.610 3.217 6.436) 20.888 12.783 ( -15.114 -0.150 11.741) 19.139 13.490 ( 8.638 4.398 -0.988) 9.743 13.851 ( -5.580 -1.850 3.169) 6.678 14.445 ( -1.927 -1.009 0.768) 2.307 14.973 ( -4.353 3.283 11.885) 13.076 15.614 ( 3.404 10.366 4.078) 11.648 15.899 ( -0.828 1.276 3.391) 3.716 15.995 ( -2.595 9.826 -4.316) 11.042 16.231 ( -3.270 8.410 2.700) 9.418 16.356 ( -0.998 3.969 1.781) 4.463 16.497 ( 5.499 5.763 -0.587) 7.987 17.493 ( 4.978 2.151 1.848) 5.729 17.764 ( -3.260 -7.016 -4.029) 8.723 18.100 ( 3.096 -1.478 -4.085) 5.335 18.410 ( 3.371 -1.299 -3.755) 5.211 18.732 ( 6.086 3.486 -2.057) 7.309 19.079 ( -5.175 5.766 5.111) 9.282 19.288 ( 20.882 -2.150 -2.948) 21.198 20.319 ( 0.876 2.228 6.963) 7.363 27.621 ( 2.421 6.526 4.433) 8.252 28.351 ( 1.464 0.650 7.091) 7.269 29.273 ( -1.304 0.103 -0.210) 1.325 29.417 ( -3.819 0.654 -2.364) 4.538 29.638 ( 0.379 1.330 0.149) 1.391 29.740 ( 0.599 2.082 -2.190) 3.080 30.017 ( 2.784 6.690 0.718) 7.281 30.062 ( 1.178 7.060 1.686) 7.354 30.451 ( 1.125 -0.432 1.546) 1.960 30.737 ( 0.450 3.180 3.275) 4.587 31.233 ( 2.116 -2.327 1.017) 3.306 31.686 ( 0.050 10.483 -0.571) 10.499 32.368 ( -12.048 -12.957 -2.949) 17.937 33.439 ( 5.790 -16.625 -12.298) 21.474 34.062 ( 9.263 -16.374 16.406) 24.961 35.778 ( -38.943 -36.170 -36.848) 64.673 ======================= Grid point 3 (4/160) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 7.617 -21.896 13.247) 26.700 2.399 ( 29.582 -11.260 27.868) 42.172 2.763 ( -1.268 -3.793 -14.826) 15.356 3.393 ( 2.222 -10.105 -9.710) 14.189 3.461 ( 0.537 -11.144 0.008) 11.157 3.646 ( -3.991 -19.918 4.497) 20.806 3.947 ( -2.909 -12.404 0.053) 12.740 4.054 ( -2.381 -7.954 -0.421) 8.313 4.112 ( -2.708 -15.433 0.593) 15.680 4.424 ( -3.843 -19.056 -4.392) 19.929 4.527 ( 4.275 -12.085 -1.028) 12.860 4.701 ( -4.851 -2.897 -5.479) 7.871 4.912 ( -2.554 -2.607 -3.252) 4.888 5.215 ( 2.330 -1.553 -5.250) 5.950 5.319 ( -0.217 -0.770 7.652) 7.693 5.628 ( -3.452 5.138 1.571) 6.386 5.653 ( -3.060 -15.025 2.972) 15.619 5.989 ( -2.499 -18.281 -1.569) 18.517 6.115 ( 7.849 2.238 -0.224) 8.165 6.300 ( -4.059 -8.523 -0.340) 9.447 6.466 ( 3.232 -24.768 -4.714) 25.419 6.557 ( 2.775 -13.199 -3.163) 13.854 6.784 ( 4.771 2.745 3.582) 6.567 7.077 ( 6.868 0.828 0.117) 6.919 7.174 ( 1.651 0.914 7.235) 7.477 7.380 ( -2.272 0.251 -1.633) 2.809 7.894 ( -6.642 -2.651 7.804) 10.585 8.108 ( -2.817 -4.254 -7.573) 9.131 8.436 ( 4.307 -2.279 -2.072) 5.295 8.534 ( -1.968 -3.429 -2.222) 4.535 8.707 ( 4.033 -1.380 3.851) 5.745 9.304 ( -8.569 -6.099 -5.278) 11.768 9.392 ( 4.097 -4.854 2.231) 6.732 9.559 ( -0.105 -7.606 -0.095) 7.608 9.798 ( -1.847 2.495 4.729) 5.657 10.013 ( -2.218 2.707 5.304) 6.354 10.437 ( 1.813 -15.561 -0.677) 15.681 10.625 ( 2.382 -0.161 0.214) 2.397 10.846 ( -2.883 1.621 -3.423) 4.760 11.136 ( -0.017 12.626 -7.174) 14.522 11.395 ( -1.239 1.021 -2.614) 3.067 11.620 ( 0.490 2.142 -18.102) 18.235 12.410 ( -10.509 10.226 12.149) 19.043 12.801 ( -0.714 -0.871 5.052) 5.176 13.523 ( 6.364 -0.366 0.905) 6.439 13.826 ( -4.448 1.719 1.510) 5.002 14.456 ( -0.566 -0.537 1.269) 1.490 14.941 ( -2.867 5.292 6.691) 9.000 15.489 ( 0.933 5.523 -0.785) 5.657 15.764 ( -1.390 6.226 -4.854) 8.017 15.984 ( 0.902 -1.318 5.607) 5.830 16.040 ( -6.187 9.730 -0.309) 11.535 16.311 ( 0.680 4.131 5.469) 6.888 16.460 ( 4.717 2.771 -2.056) 5.844 17.505 ( 1.970 1.218 1.771) 2.916 17.826 ( -1.458 -5.549 -3.251) 6.594 18.146 ( 3.706 -3.393 -3.541) 6.146 18.427 ( 2.207 -1.608 -4.271) 5.070 18.716 ( 2.804 2.206 1.178) 3.757 18.950 ( -7.740 4.399 -1.399) 9.012 19.443 ( 11.143 -3.098 -2.645) 11.864 20.340 ( 0.561 1.837 6.426) 6.707 27.570 ( 0.561 3.019 0.827) 3.180 28.399 ( 0.806 0.314 5.708) 5.773 29.267 ( -3.212 -0.907 0.651) 3.400 29.364 ( -1.120 -0.496 -4.155) 4.332 29.626 ( 1.400 0.992 -1.110) 2.043 29.690 ( -0.717 1.228 -1.758) 2.261 29.891 ( -0.241 10.459 2.129) 10.676 29.994 ( 1.877 4.433 2.791) 5.564 30.480 ( 1.930 -1.033 1.431) 2.616 30.702 ( -1.473 2.192 -0.009) 2.641 31.259 ( 1.261 1.294 1.311) 2.232 31.546 ( 0.351 5.841 -0.393) 5.865 32.487 ( -8.836 -12.803 -2.775) 15.802 33.679 ( 4.230 -13.979 -6.857) 16.134 34.502 ( 9.779 -13.332 11.961) 20.407 35.795 ( -22.903 -19.635 -20.158) 36.283 ======================= Grid point 4 (5/160) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( 1.737 -14.722 16.140) 21.915 2.530 ( 3.514 7.429 -15.669) 17.694 3.036 ( 16.014 -8.827 16.221) 24.444 3.478 ( -2.099 -3.801 -4.490) 6.246 3.573 ( 2.791 -2.275 1.201) 3.796 3.860 ( -9.064 -2.705 -6.118) 11.265 4.020 ( -4.284 -8.918 0.795) 9.926 4.059 ( -0.640 -5.336 -4.816) 7.216 4.323 ( -0.251 -8.532 0.629) 8.559 4.432 ( -2.667 10.474 0.350) 10.813 4.551 ( -2.654 -4.934 -2.097) 5.982 4.719 ( 1.328 6.277 -0.207) 6.420 4.947 ( 1.611 -7.151 -4.951) 8.846 5.312 ( 3.721 -5.743 2.291) 7.216 5.397 ( -2.072 3.537 7.522) 8.566 5.482 ( 0.226 5.807 -3.463) 6.765 5.764 ( -1.767 -1.915 0.982) 2.785 6.078 ( 2.124 -1.664 -4.022) 4.843 6.211 ( 1.369 -3.869 5.063) 6.518 6.445 ( 1.739 -6.482 -1.819) 6.953 6.643 ( -5.210 -3.630 -2.518) 6.831 6.887 ( 0.791 -14.161 -0.054) 14.183 6.952 ( 1.279 -9.950 6.314) 11.854 7.073 ( 4.104 1.411 -7.154) 8.367 7.266 ( 1.897 -2.499 5.877) 6.662 7.347 ( -1.760 0.864 -2.437) 3.128 7.941 ( -3.065 -2.139 3.618) 5.202 8.086 ( -1.181 -0.745 -3.593) 3.855 8.485 ( 1.704 -2.362 -2.347) 3.740 8.539 ( -0.183 1.462 0.926) 1.741 8.880 ( 6.716 -7.412 6.558) 11.961 9.223 ( -9.108 0.643 -8.301) 12.340 9.426 ( 0.955 2.574 -0.436) 2.779 9.708 ( 2.507 -7.578 -2.674) 8.418 9.846 ( -1.706 -2.610 8.222) 8.793 9.965 ( -1.989 2.445 3.449) 4.672 10.547 ( 0.763 3.012 -2.286) 3.858 10.722 ( -0.074 -7.560 -2.769) 8.052 10.787 ( 0.564 1.767 2.063) 2.774 10.903 ( -0.663 6.079 -4.194) 7.415 11.357 ( -3.911 -2.188 -3.178) 5.494 11.440 ( 3.283 8.685 -3.567) 9.946 12.317 ( -1.733 3.185 4.956) 6.140 12.842 ( 0.299 -0.634 1.890) 2.015 13.592 ( 3.645 -1.424 0.818) 3.998 13.762 ( -3.155 1.928 0.078) 3.698 14.469 ( 0.137 -0.192 0.660) 0.701 14.865 ( -1.393 3.677 1.575) 4.235 15.468 ( -0.060 -1.606 0.309) 1.637 15.672 ( 1.486 2.107 -2.216) 3.400 15.840 ( -4.128 6.190 -0.711) 7.474 16.040 ( 0.386 -0.684 1.989) 2.138 16.305 ( -0.261 1.049 3.486) 3.650 16.443 ( 2.246 1.103 -1.535) 2.936 17.511 ( 0.609 0.403 0.740) 1.040 17.870 ( -0.340 -2.147 -1.211) 2.489 18.200 ( 1.743 -1.831 -1.376) 2.878 18.440 ( 1.169 -1.133 -2.520) 3.000 18.727 ( 3.436 1.692 4.753) 6.104 18.811 ( -6.606 1.724 -4.682) 8.279 19.527 ( 3.586 -1.238 -1.025) 3.930 20.355 ( 0.165 0.714 2.616) 2.716 27.543 ( 0.100 0.879 0.048) 0.886 28.429 ( 0.162 0.087 2.169) 2.177 29.252 ( -1.962 0.027 0.288) 1.983 29.369 ( 0.777 -1.795 -1.916) 2.738 29.617 ( 1.686 -1.214 -2.627) 3.349 29.676 ( -0.467 -0.316 -0.035) 0.565 29.726 ( -2.038 8.419 2.487) 9.012 29.973 ( 0.917 1.495 1.349) 2.213 30.545 ( 2.286 -3.170 1.423) 4.159 30.636 ( -2.265 3.104 -1.498) 4.124 31.250 ( 0.537 1.060 0.694) 1.376 31.485 ( 0.160 1.718 -0.072) 1.727 32.583 ( -3.147 -5.242 -1.061) 6.205 33.839 ( 1.446 -5.413 -2.200) 6.019 34.789 ( 4.818 -5.118 4.970) 8.609 35.784 ( -8.548 -6.369 -7.204) 12.866 ======================= Grid point 10 (6/160) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.607 ( 22.209 0.000 16.962) 27.946 0.660 ( 34.024 0.000 10.711) 35.670 1.493 ( 43.775 0.000 51.966) 67.947 1.744 ( -6.227 -0.000 4.004) 7.403 2.222 ( 10.059 0.000 6.503) 11.978 2.736 ( -1.419 -0.000 -0.499) 1.504 3.294 ( -2.491 -0.000 -2.747) 3.708 3.308 ( -1.634 -0.000 -1.368) 2.131 3.407 ( -0.455 -0.000 -12.801) 12.809 3.683 ( 8.928 0.000 -12.905) 15.692 3.816 ( -8.951 -0.000 7.230) 11.506 4.450 ( -12.552 -0.000 -10.563) 16.405 4.557 ( -3.588 -0.000 2.339) 4.283 4.636 ( -2.882 -0.000 -2.627) 3.899 5.094 ( -5.704 -0.000 0.676) 5.744 5.559 ( 0.695 0.000 -0.473) 0.841 5.757 ( -3.587 -0.000 3.828) 5.246 5.763 ( -2.423 -0.000 -11.934) 12.177 6.283 ( 6.452 0.000 -0.672) 6.486 6.370 ( -7.719 -0.000 -2.600) 8.145 6.449 ( 7.726 0.000 -17.383) 19.023 6.572 ( -1.543 -0.000 13.643) 13.730 7.098 ( -0.705 -0.000 -0.069) 0.709 7.162 ( -1.279 -0.000 12.266) 12.333 7.510 ( 7.412 0.000 0.546) 7.432 7.552 ( 3.754 0.000 -4.207) 5.638 7.721 ( 0.709 0.000 7.861) 7.893 7.886 ( -4.500 -0.000 -8.035) 9.209 8.193 ( 3.888 0.000 -0.474) 3.917 8.496 ( -8.314 -0.000 1.747) 8.495 8.988 ( -3.695 -0.000 -16.349) 16.761 9.159 ( 4.837 0.000 3.294) 5.852 9.397 ( -0.543 -0.000 -1.483) 1.579 9.521 ( -4.624 -0.000 -3.453) 5.771 9.711 ( 24.207 0.000 -13.868) 27.898 9.788 ( 2.887 0.000 4.410) 5.271 9.871 ( -0.437 -0.000 -0.655) 0.788 10.045 ( 0.596 0.000 -5.201) 5.235 10.614 ( 2.424 0.000 3.888) 4.582 11.042 ( -6.609 -0.000 -7.382) 9.908 11.521 ( -1.805 -0.000 4.128) 4.505 11.598 ( 5.624 0.000 2.276) 6.067 12.484 ( -39.238 -0.000 40.964) 56.725 12.709 ( -3.364 -0.000 7.829) 8.521 13.586 ( 4.809 0.000 -5.776) 7.516 13.731 ( -1.894 -0.000 7.476) 7.712 14.415 ( -2.650 -0.000 0.690) 2.739 15.014 ( -10.861 -0.000 11.260) 15.644 15.801 ( -5.854 -0.000 15.982) 17.020 15.997 ( 0.247 0.000 0.449) 0.512 16.229 ( -1.783 -0.000 -4.437) 4.782 16.387 ( 0.396 0.000 -2.646) 2.675 16.414 ( -3.565 -0.000 3.213) 4.800 16.666 ( 4.947 0.000 0.378) 4.962 17.525 ( 3.683 0.000 -3.699) 5.220 17.718 ( 3.706 0.000 0.758) 3.783 18.119 ( -3.580 -0.000 -4.753) 5.950 18.395 ( 5.015 0.000 -4.821) 6.957 18.802 ( -2.949 -0.000 -6.161) 6.831 19.113 ( 7.068 0.000 1.685) 7.266 20.058 ( 9.043 0.000 -29.223) 30.590 20.486 ( 5.831 0.000 4.586) 7.418 28.094 ( -5.302 -0.000 -6.984) 8.768 28.476 ( -11.186 -0.000 23.385) 25.923 29.424 ( -5.325 -0.000 -1.159) 5.449 29.673 ( -0.696 -0.000 -0.121) 0.706 29.696 ( 0.334 0.000 0.498) 0.600 29.748 ( -1.699 -0.000 -1.647) 2.366 29.876 ( 0.928 0.000 -3.168) 3.301 30.224 ( -0.450 -0.000 -1.106) 1.194 30.327 ( 8.184 0.000 -4.005) 9.111 31.027 ( -1.088 -0.000 -0.331) 1.137 32.006 ( -1.048 -0.000 -0.061) 1.050 32.053 ( 0.855 0.000 0.432) 0.958 32.073 ( -46.498 -0.000 31.632) 56.238 32.313 ( 32.333 0.000 -38.210) 50.054 33.024 ( 2.493 0.000 -17.818) 17.991 33.889 ( 24.026 0.000 18.378) 30.249 ======================= Grid point 11 (7/160) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( 24.265 -12.956 18.010) 32.879 1.724 ( 20.502 -52.913 13.434) 58.314 2.178 ( -3.135 -40.498 3.215) 40.746 2.357 ( 32.006 -27.412 35.762) 55.269 2.724 ( 8.432 -34.558 2.644) 35.670 2.858 ( 0.395 -17.426 2.676) 17.635 3.245 ( -3.221 -2.908 -7.406) 8.584 3.424 ( -2.978 -13.335 -6.021) 14.931 3.531 ( 2.800 -19.295 -5.885) 20.366 3.770 ( 8.067 -13.325 -5.883) 16.651 4.035 ( -9.762 -28.741 4.784) 30.729 4.276 ( -15.174 -6.863 -12.282) 20.693 4.584 ( -4.277 -1.404 -5.855) 7.385 4.634 ( -6.501 -10.781 -0.176) 12.591 5.098 ( -8.088 -9.412 -0.392) 12.416 5.514 ( 2.617 5.582 -1.949) 6.466 5.585 ( -2.220 7.150 -8.818) 11.568 5.798 ( -2.585 -2.991 3.994) 5.619 6.196 ( -2.905 3.327 -7.479) 8.686 6.258 ( -0.797 11.271 1.141) 11.357 6.356 ( 11.370 4.122 -5.176) 13.155 6.595 ( 5.687 5.500 6.263) 10.090 7.099 ( 0.992 6.903 2.869) 7.541 7.144 ( -3.209 2.850 5.337) 6.848 7.419 ( 0.100 11.976 3.469) 12.469 7.461 ( 4.723 7.384 -1.381) 8.874 7.799 ( -5.153 -1.671 0.105) 5.418 7.875 ( 3.753 -9.596 -4.451) 11.224 8.296 ( 5.158 -6.598 -1.231) 8.465 8.434 ( -6.271 -0.381 -1.190) 6.394 8.809 ( 1.911 6.032 -1.694) 6.551 9.228 ( -2.096 5.544 -1.633) 6.148 9.247 ( 5.687 0.437 6.061) 8.323 9.490 ( 1.530 3.059 3.128) 4.635 9.574 ( -5.699 -11.001 1.522) 12.482 9.919 ( 2.603 -8.793 3.320) 9.752 10.036 ( 1.246 -3.675 -3.245) 5.058 10.639 ( 4.423 -2.890 -2.464) 5.830 10.750 ( -5.616 -41.692 -29.914) 51.620 10.929 ( -6.578 -1.376 -6.161) 9.117 11.493 ( -1.396 4.516 2.405) 5.304 11.629 ( 4.177 3.343 3.064) 6.166 12.490 ( -21.955 -2.755 17.515) 28.220 12.760 ( -4.376 -1.702 10.069) 11.110 13.572 ( 4.434 1.542 -4.083) 6.222 13.789 ( -3.144 -2.756 4.192) 5.920 14.418 ( -1.819 -1.167 2.458) 3.273 15.007 ( -6.429 0.031 6.390) 9.064 15.845 ( -2.034 4.898 12.702) 13.765 15.969 ( 0.029 3.534 2.171) 4.147 16.102 ( -1.844 8.205 -4.379) 9.482 16.337 ( -5.301 6.124 0.889) 8.148 16.391 ( 1.713 -0.302 -1.360) 2.208 16.659 ( 5.690 6.089 1.162) 8.415 17.562 ( 4.596 -2.428 -2.733) 5.872 17.722 ( 4.230 3.737 1.884) 5.950 18.056 ( -0.742 -0.479 -5.367) 5.439 18.389 ( 3.540 -0.487 -6.928) 7.795 18.743 ( -1.640 0.014 -3.714) 4.060 19.181 ( -0.104 0.909 6.213) 6.280 19.642 ( 14.316 24.620 -14.530) 31.972 20.457 ( 1.580 6.483 10.498) 12.439 27.860 ( 0.235 13.930 -1.000) 13.968 28.470 ( -3.460 5.151 14.909) 16.149 29.333 ( -2.468 6.884 0.711) 7.348 29.392 ( -0.029 5.149 -3.925) 6.474 29.672 ( -0.282 2.277 0.712) 2.402 29.758 ( 0.316 1.336 -2.815) 3.132 30.062 ( -0.811 -6.370 -0.675) 6.457 30.187 ( 0.580 3.846 0.232) 3.896 30.415 ( 3.353 -4.997 -0.669) 6.055 30.916 ( -1.096 11.769 2.859) 12.161 31.319 ( 8.401 14.339 7.111) 18.076 31.869 ( -1.784 11.023 -0.784) 11.194 32.051 ( -13.164 -7.020 -3.126) 15.242 33.085 ( 6.951 -16.902 -18.462) 25.977 33.657 ( -24.011 -65.913 -18.420) 72.528 34.457 ( 7.079 -34.981 8.905) 36.784 ======================= Grid point 12 (8/160) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( 17.953 -15.815 19.536) 30.888 2.555 ( 3.961 -16.232 1.534) 16.779 2.676 ( 24.970 -10.365 19.546) 33.362 3.096 ( 1.434 -27.653 -1.597) 27.736 3.156 ( 5.286 -11.631 -12.633) 17.967 3.394 ( -3.592 -15.581 6.164) 17.137 3.532 ( 6.907 -41.319 7.167) 42.501 3.751 ( -0.974 -26.616 -2.238) 26.727 3.854 ( 3.158 -18.303 3.644) 18.928 3.972 ( -8.558 -11.576 -4.317) 15.029 4.238 ( -3.269 -18.608 -11.542) 22.140 4.547 ( -6.689 -11.160 -0.449) 13.019 4.658 ( 3.023 -20.464 -4.565) 21.183 4.910 ( -10.042 -34.447 1.984) 35.936 5.318 ( -2.245 -9.699 -4.346) 10.863 5.395 ( -3.758 -11.343 -4.638) 12.818 5.468 ( 0.615 1.832 2.098) 2.852 5.862 ( -2.874 -2.830 3.038) 5.050 6.098 ( -2.644 -0.888 -3.996) 4.873 6.178 ( 2.676 -1.403 1.651) 3.443 6.316 ( 11.311 5.941 -6.393) 14.286 6.536 ( 4.063 5.753 -1.413) 7.183 6.928 ( -7.309 9.733 2.156) 12.361 7.123 ( 0.588 1.324 -1.352) 1.981 7.279 ( -2.624 6.357 6.482) 9.451 7.387 ( 0.762 3.274 -2.041) 3.932 7.813 ( -2.467 -4.124 -1.403) 5.006 8.021 ( 3.433 -5.022 0.153) 6.086 8.391 ( -0.415 -1.872 -1.936) 2.724 8.465 ( 4.650 -6.211 0.686) 7.789 8.776 ( 3.269 1.238 2.236) 4.150 9.129 ( -6.389 -0.780 -4.325) 7.754 9.370 ( 3.383 -3.505 4.638) 6.726 9.483 ( 0.565 -0.679 -0.697) 1.125 9.745 ( -6.770 -9.374 6.758) 13.393 10.064 ( 2.666 -0.216 2.456) 3.632 10.178 ( 0.976 -15.766 -0.801) 15.816 10.646 ( 1.546 0.637 -1.761) 2.428 10.807 ( -2.118 0.748 -4.353) 4.899 11.055 ( -3.169 -16.339 -23.776) 29.022 11.395 ( -1.799 5.917 0.773) 6.233 11.597 ( 1.965 5.080 0.915) 5.523 12.461 ( -12.146 0.551 8.119) 14.620 12.825 ( -2.773 -1.022 9.159) 9.624 13.562 ( 3.646 0.412 -2.217) 4.287 13.808 ( -3.553 -0.518 0.565) 3.635 14.450 ( -0.650 -1.075 2.824) 3.091 14.998 ( -5.357 0.570 5.299) 7.557 15.720 ( 1.558 15.428 4.014) 16.017 15.857 ( -0.959 8.955 -2.660) 9.391 16.029 ( -0.983 0.007 7.794) 7.856 16.153 ( -5.904 9.804 -0.533) 11.456 16.391 ( 1.193 1.214 -0.167) 1.710 16.591 ( 5.846 7.754 0.725) 9.738 17.596 ( 5.704 3.047 -0.396) 6.479 17.733 ( 2.834 -2.180 -0.101) 3.577 18.067 ( 1.145 -4.420 -4.361) 6.313 18.380 ( 2.295 -1.595 -6.369) 6.955 18.728 ( 1.164 -1.231 -2.630) 3.129 19.083 ( -3.773 12.384 5.618) 14.112 19.463 ( 9.277 0.948 -8.276) 12.468 20.438 ( -0.905 4.310 7.435) 8.642 27.682 ( 1.288 8.098 0.173) 8.201 28.466 ( -2.518 2.651 7.955) 8.755 29.251 ( -2.007 1.534 0.608) 2.599 29.323 ( -0.310 0.212 -4.610) 4.625 29.641 ( -1.079 1.099 0.883) 1.776 29.699 ( -0.115 2.520 -3.661) 4.446 30.059 ( 0.269 6.103 1.216) 6.229 30.127 ( 2.046 5.619 3.297) 6.829 30.487 ( 1.348 -1.192 0.685) 1.925 30.766 ( -1.629 6.636 1.168) 6.932 31.309 ( 3.515 1.454 2.649) 4.635 31.674 ( -0.185 9.473 -1.024) 9.530 32.110 ( -12.421 -15.780 -3.398) 20.367 33.356 ( 5.078 -20.548 -11.462) 24.070 34.201 ( -11.954 -34.475 -10.809) 38.056 35.086 ( -0.112 -29.891 4.340) 30.205 ======================= Grid point 13 (9/160) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 8.973 -12.978 21.028) 26.290 2.567 ( 5.900 4.775 -12.494) 14.618 3.143 ( 11.684 -3.918 7.617) 14.487 3.281 ( -2.574 -10.025 -6.160) 12.045 3.485 ( 3.374 -15.140 -1.381) 15.573 3.631 ( -6.014 -15.201 4.799) 17.038 3.808 ( -1.201 -5.303 2.540) 6.001 3.988 ( -0.967 -4.250 -5.614) 7.107 4.063 ( -2.018 -20.557 0.484) 20.662 4.337 ( -0.462 -15.940 -2.494) 16.140 4.475 ( -1.813 -9.012 -0.476) 9.205 4.716 ( 4.137 -10.206 0.585) 11.028 4.908 ( 6.107 -0.222 -1.066) 6.204 5.201 ( 2.296 -11.496 -3.454) 12.221 5.434 ( -4.519 -7.623 11.732) 14.703 5.491 ( -3.213 -6.186 -6.425) 9.479 5.738 ( 4.036 -3.204 0.348) 5.165 5.895 ( -5.703 -14.350 -0.253) 15.444 6.193 ( -0.575 -8.983 1.173) 9.077 6.280 ( 6.592 -2.468 -2.619) 7.510 6.382 ( -6.687 -18.191 -6.141) 20.331 6.579 ( 5.809 -11.464 -0.960) 12.887 6.829 ( -2.006 -6.073 0.634) 6.427 7.059 ( -4.015 1.898 -4.145) 6.075 7.251 ( -6.019 -0.711 6.429) 8.835 7.325 ( -3.856 1.084 -1.659) 4.336 7.870 ( 5.246 -3.645 -4.296) 7.698 8.104 ( 2.283 -0.858 3.980) 4.668 8.429 ( 0.304 -3.634 0.028) 3.647 8.596 ( 6.475 -1.310 0.414) 6.619 8.877 ( 7.174 -6.470 5.630) 11.181 9.054 ( -9.639 -1.567 -5.603) 11.259 9.429 ( 0.503 -1.521 -3.331) 3.696 9.561 ( 1.097 -6.956 0.407) 7.053 9.840 ( -4.494 -2.162 7.986) 9.416 10.073 ( -0.930 4.308 6.054) 7.488 10.438 ( 0.386 -13.658 -2.171) 13.835 10.649 ( 0.146 -1.997 -4.010) 4.482 10.769 ( 0.335 -0.139 -1.106) 1.164 10.988 ( 0.595 5.150 -9.679) 10.980 11.309 ( -3.095 2.015 -2.943) 4.723 11.514 ( 1.005 4.723 -2.412) 5.398 12.402 ( -5.020 3.489 4.494) 7.588 12.872 ( -1.517 0.570 6.540) 6.738 13.582 ( 1.007 -1.444 -1.541) 2.339 13.769 ( -1.817 1.437 -1.073) 2.553 14.472 ( -0.456 -0.101 1.458) 1.531 14.961 ( -3.523 4.402 4.718) 7.352 15.520 ( 2.373 9.103 1.231) 9.487 15.729 ( 1.716 4.862 -0.852) 5.226 15.924 ( -5.491 9.590 -2.088) 11.246 16.083 ( -0.464 0.161 6.540) 6.558 16.367 ( -1.630 2.513 2.898) 4.168 16.511 ( 5.311 6.364 -2.533) 8.668 17.567 ( 3.654 3.822 -0.341) 5.298 17.818 ( 3.558 -4.171 -0.610) 5.517 18.134 ( 0.209 -4.935 -2.231) 5.419 18.394 ( 2.195 -2.438 -4.047) 5.210 18.752 ( 2.002 -1.136 -2.854) 3.667 18.902 ( -0.068 9.728 5.531) 11.191 19.492 ( 0.843 -2.807 -3.809) 4.806 20.398 ( -2.542 3.263 2.824) 5.008 27.596 ( 1.250 4.123 0.646) 4.357 28.449 ( -2.449 1.465 2.447) 3.760 29.236 ( -1.113 -0.575 0.433) 1.325 29.322 ( 1.581 -2.574 -2.452) 3.891 29.618 ( 0.276 1.969 -1.759) 2.655 29.648 ( -1.829 -0.794 -0.916) 2.194 29.906 ( -1.825 11.485 2.204) 11.836 30.073 ( 1.991 6.042 3.567) 7.293 30.522 ( 1.383 -2.049 0.698) 2.569 30.665 ( -1.869 3.905 -1.244) 4.504 31.309 ( 1.828 3.249 1.762) 4.123 31.546 ( 0.309 5.288 -0.476) 5.319 32.311 ( -8.257 -18.775 -1.770) 20.587 33.644 ( 3.074 -16.143 -6.129) 17.539 34.509 ( -11.954 -23.083 -11.828) 28.559 35.551 ( 6.363 -17.624 8.817) 20.709 ======================= Grid point 14 (10/160) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( 3.938 13.199 -12.770) 18.783 2.491 ( -2.624 -5.755 14.770) 16.067 2.979 ( -12.538 9.221 -10.116) 18.563 3.422 ( 1.110 -8.595 -2.166) 8.933 3.607 ( 2.419 -0.769 -0.767) 2.652 3.916 ( -2.690 -9.411 -8.297) 12.831 4.019 ( 2.128 -12.836 14.059) 19.156 4.056 ( 6.196 -5.024 5.629) 9.763 4.358 ( 2.024 -10.619 1.528) 10.917 4.442 ( 2.167 2.505 2.165) 3.957 4.512 ( 0.313 -1.170 0.581) 1.343 4.741 ( 1.289 4.731 0.839) 4.975 4.996 ( 9.057 -3.784 -1.836) 9.986 5.347 ( 0.733 -3.802 -1.020) 4.004 5.389 ( -2.103 5.848 -5.306) 8.172 5.470 ( -1.359 6.511 5.230) 8.461 5.767 ( -0.139 -3.511 1.846) 3.969 6.020 ( -3.298 -1.790 -6.252) 7.292 6.238 ( 1.152 -0.495 -4.140) 4.326 6.412 ( -3.840 -9.534 4.872) 11.374 6.649 ( 4.287 -9.685 2.137) 10.804 6.862 ( 1.121 -12.380 -3.311) 12.864 6.924 ( -7.573 -4.989 -6.679) 11.263 7.019 ( -4.470 -2.756 3.282) 6.192 7.249 ( -6.242 1.261 -1.998) 6.675 7.312 ( -3.326 -6.211 3.304) 7.782 7.928 ( 7.901 -0.703 -7.153) 10.681 8.172 ( 3.208 -0.655 7.335) 8.033 8.498 ( 0.017 -3.178 0.894) 3.302 8.603 ( 6.885 6.056 -0.071) 9.170 8.913 ( -5.117 4.873 -2.479) 7.489 9.204 ( 6.170 -15.051 6.755) 17.613 9.395 ( 0.283 1.363 -3.405) 3.679 9.687 ( 1.704 -5.524 -3.887) 6.966 9.893 ( -8.084 1.734 7.965) 11.480 9.988 ( 0.885 4.652 1.272) 4.903 10.535 ( 1.105 1.143 -1.795) 2.398 10.640 ( -0.803 -6.325 -5.640) 8.512 10.839 ( 0.246 -6.240 3.974) 7.402 10.904 ( 2.679 4.372 0.641) 5.167 11.222 ( -5.496 -2.885 -4.283) 7.541 11.457 ( 2.298 2.048 -0.995) 3.235 12.325 ( -1.206 4.775 -0.030) 4.925 12.865 ( -1.644 2.511 2.476) 3.891 13.566 ( -3.835 0.820 -2.331) 4.562 13.757 ( 2.318 -1.083 -0.948) 2.729 14.470 ( -0.484 0.475 0.337) 0.758 14.887 ( 0.142 4.264 2.399) 4.895 15.483 ( 0.832 0.512 0.959) 1.368 15.679 ( -0.218 3.240 0.380) 3.269 15.791 ( 0.489 -1.391 -0.990) 1.776 16.098 ( 1.274 2.788 3.195) 4.427 16.315 ( -3.872 4.205 3.081) 6.494 16.439 ( 2.892 2.168 -4.683) 5.916 17.530 ( 2.035 2.555 -1.224) 3.488 17.900 ( 4.047 -1.581 0.667) 4.396 18.182 ( -2.673 -2.321 0.053) 3.540 18.433 ( 0.960 -2.190 -0.629) 2.473 18.702 ( -0.526 3.198 -2.081) 3.852 18.905 ( 7.878 0.812 6.267) 10.099 19.490 ( -5.478 -1.031 -1.311) 5.727 20.333 ( -3.133 1.771 -2.134) 4.184 27.563 ( 1.265 1.945 1.037) 2.542 28.412 ( -2.233 0.966 -1.764) 3.005 29.258 ( 2.172 -1.272 -0.036) 2.517 29.378 ( 0.666 -2.360 1.553) 2.903 29.594 ( 0.450 -1.821 -3.037) 3.570 29.658 ( -1.573 -1.716 -0.086) 2.329 29.731 ( -1.785 7.846 2.573) 8.448 30.003 ( 0.409 5.206 1.162) 5.349 30.567 ( -2.056 1.910 -0.654) 2.882 30.609 ( 1.994 -2.495 0.143) 3.197 31.266 ( 0.652 3.168 0.163) 3.239 31.488 ( 0.113 1.883 0.176) 1.894 32.532 ( -2.439 -12.043 0.321) 12.291 33.828 ( 0.507 -6.643 -1.514) 6.832 34.603 ( -12.146 -10.055 -12.540) 20.146 35.920 ( 12.003 -8.695 11.978) 19.056 ======================= Grid point 15 (11/160) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( -2.784 19.757 -11.332) 22.946 2.262 ( -19.189 16.871 -15.078) 29.668 2.927 ( 2.671 -0.615 18.070) 18.277 3.479 ( 0.333 -0.720 -8.859) 8.895 3.593 ( 0.948 5.293 5.188) 7.472 3.866 ( -0.610 3.208 -5.979) 6.813 4.122 ( 1.065 5.768 3.117) 6.643 4.277 ( 4.105 10.015 11.006) 15.436 4.337 ( 1.273 11.744 -0.062) 11.813 4.478 ( 3.062 -12.473 -1.432) 12.923 4.619 ( 1.660 -2.389 1.115) 3.115 4.730 ( 1.866 -1.728 3.010) 3.941 5.018 ( -0.810 4.498 -0.702) 4.624 5.262 ( 0.884 2.146 4.110) 4.721 5.317 ( 0.579 6.498 -4.205) 7.762 5.497 ( 0.838 -5.869 -2.488) 6.429 5.827 ( 7.420 1.525 0.162) 7.576 5.973 ( -7.354 -4.365 -1.912) 8.763 6.227 ( 2.891 2.192 1.259) 3.840 6.451 ( -2.020 6.820 3.669) 8.003 6.677 ( -5.610 3.441 -2.473) 7.031 6.826 ( -1.612 10.982 -2.493) 11.376 6.877 ( 1.468 10.005 -1.692) 10.252 6.992 ( -8.519 -0.119 -1.328) 8.623 7.116 ( -7.634 4.160 -2.982) 9.191 7.406 ( 1.421 -1.946 2.369) 3.379 7.917 ( 5.888 1.854 -7.139) 9.438 8.264 ( 3.190 1.329 7.410) 8.176 8.496 ( 2.212 5.187 1.468) 5.827 8.582 ( 3.296 -0.715 -0.510) 3.411 8.763 ( -1.872 8.918 2.053) 9.341 9.377 ( -2.800 -2.602 -1.538) 4.120 9.487 ( 6.790 -0.470 7.399) 10.054 9.665 ( -1.716 4.787 -3.561) 6.208 9.745 ( -1.100 3.187 -5.662) 6.590 9.954 ( 0.890 1.087 -1.303) 1.916 10.575 ( -0.071 -2.588 1.986) 3.263 10.717 ( -0.883 15.262 -0.869) 15.312 10.774 ( 0.579 -9.988 -0.292) 10.009 11.010 ( 1.485 -6.239 5.408) 8.390 11.434 ( 1.747 -4.270 2.124) 5.079 11.473 ( -2.399 -22.386 7.021) 23.584 12.236 ( 1.507 0.669 -9.302) 9.447 12.809 ( -1.161 2.926 -0.873) 3.267 13.484 ( -4.791 2.168 -2.307) 5.743 13.805 ( 2.568 -2.545 -1.362) 3.863 14.462 ( 0.379 0.415 0.144) 0.580 14.868 ( 0.633 -0.277 -0.898) 1.133 15.468 ( 0.251 0.552 -0.225) 0.647 15.702 ( -0.357 -5.259 2.989) 6.060 15.922 ( 3.943 -9.079 1.162) 9.966 16.047 ( 2.368 6.816 0.527) 7.235 16.227 ( -3.308 1.035 -3.190) 4.711 16.421 ( -0.467 -0.691 -1.067) 1.355 17.498 ( 1.052 1.626 -1.396) 2.387 17.942 ( 4.941 1.983 1.919) 5.659 18.166 ( -5.264 0.942 2.028) 5.719 18.454 ( -1.391 0.192 2.011) 2.453 18.666 ( 1.133 0.206 -1.719) 2.069 19.019 ( 9.415 -0.405 4.531) 10.456 19.413 ( -10.645 2.190 0.562) 10.882 20.269 ( -2.506 -0.257 -4.971) 5.572 27.558 ( 1.077 0.764 0.707) 1.498 28.358 ( -2.145 0.865 -3.846) 4.488 29.301 ( 3.999 -0.346 -0.611) 4.060 29.414 ( 1.083 0.587 3.996) 4.181 29.601 ( -3.492 -0.744 0.508) 3.607 29.679 ( 0.043 -1.672 0.066) 1.674 29.726 ( 1.038 -6.699 -0.827) 6.829 29.938 ( -1.018 1.548 -1.193) 2.204 30.488 ( -1.789 3.102 -1.545) 3.900 30.687 ( 1.564 -2.505 0.994) 3.116 31.234 ( -0.201 0.418 -0.590) 0.751 31.485 ( -0.067 -1.475 0.118) 1.481 32.655 ( 2.761 -1.197 1.791) 3.502 33.842 ( -2.179 4.306 2.261) 5.329 34.479 ( -9.571 3.669 -11.516) 15.417 36.210 ( 14.964 -2.034 13.680) 20.376 ======================= Grid point 16 (12/160) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( -9.106 23.891 -10.720) 27.724 1.656 ( -11.216 27.106 -10.794) 31.258 3.068 ( 4.321 5.410 17.229) 18.569 3.346 ( -1.167 6.100 -10.166) 11.913 3.543 ( 0.990 6.968 6.777) 9.770 3.645 ( 0.661 19.169 -2.512) 19.344 3.912 ( -1.802 25.987 -2.093) 26.133 4.051 ( -0.693 18.441 -3.064) 18.706 4.112 ( 1.613 17.780 -0.353) 17.856 4.383 ( -4.154 19.599 -0.362) 20.037 4.666 ( 7.130 1.622 6.730) 9.937 4.803 ( -1.570 0.077 0.535) 1.660 4.997 ( 0.429 1.090 1.398) 1.824 5.249 ( 6.807 -3.284 -0.111) 7.558 5.338 ( -1.247 -4.089 4.714) 6.363 5.531 ( -1.304 -3.024 -6.317) 7.124 5.693 ( -2.256 20.406 -4.251) 20.966 6.043 ( 10.433 13.452 -0.844) 17.045 6.074 ( -4.087 8.791 7.785) 12.433 6.275 ( -1.145 24.053 -4.672) 24.530 6.473 ( -10.606 -11.669 3.035) 16.058 6.558 ( 0.380 19.503 1.651) 19.576 6.727 ( 3.578 6.273 1.622) 7.402 6.909 ( -5.784 -0.912 -1.483) 6.040 7.004 ( -5.087 -2.047 -7.749) 9.493 7.445 ( 1.373 -0.362 1.635) 2.166 7.875 ( 3.734 2.547 -4.913) 6.676 8.228 ( -1.465 5.997 1.851) 6.445 8.487 ( 6.720 4.122 5.116) 9.398 8.617 ( 0.089 1.575 1.535) 2.201 8.634 ( -2.145 2.956 -0.474) 3.683 9.286 ( -2.271 7.363 -1.789) 7.911 9.440 ( 1.241 8.638 0.343) 8.734 9.553 ( 1.491 6.691 -0.960) 6.922 9.762 ( -0.424 -6.904 -1.428) 7.063 9.999 ( 1.403 -2.033 -1.386) 2.832 10.416 ( -0.969 15.767 0.035) 15.797 10.602 ( -0.677 1.688 0.210) 1.831 10.918 ( 1.259 -6.752 1.454) 7.021 11.181 ( -0.289 -10.770 1.003) 10.820 11.416 ( 0.028 1.761 0.105) 1.764 11.960 ( -4.000 -1.928 25.893) 26.271 12.380 ( 12.297 -33.679 -17.530) 39.910 12.761 ( 1.140 -0.010 -2.540) 2.784 13.390 ( -5.335 2.371 -1.705) 6.082 13.853 ( 2.021 -2.289 -1.688) 3.489 14.463 ( 0.869 0.300 0.123) 0.927 14.865 ( -0.533 -1.086 -4.282) 4.450 15.499 ( 0.000 -3.123 0.812) 3.227 15.867 ( 1.128 -10.414 2.180) 10.700 15.931 ( 0.848 5.939 0.637) 6.033 16.100 ( 2.095 -6.383 -2.850) 7.298 16.238 ( -0.620 -7.826 -0.894) 7.901 16.426 ( -1.112 -0.932 -0.109) 1.455 17.467 ( -0.150 1.603 -1.006) 1.898 17.947 ( 6.451 4.742 2.609) 8.421 18.112 ( -5.583 1.688 2.187) 6.230 18.441 ( -0.940 1.643 1.741) 2.572 18.649 ( -3.067 0.665 -1.353) 3.417 19.106 ( 8.423 1.224 0.071) 8.512 19.260 ( -12.254 5.451 1.694) 13.518 20.239 ( -1.164 -1.856 -3.730) 4.326 27.556 ( 0.146 0.320 -0.667) 0.754 28.303 ( -1.500 0.584 -3.068) 3.465 29.308 ( 1.726 1.656 0.208) 2.401 29.453 ( 3.067 -0.015 1.675) 3.495 29.604 ( -2.431 -2.022 0.646) 3.227 29.716 ( -0.024 -1.925 0.935) 2.140 29.864 ( -0.348 -8.609 -0.944) 8.668 29.940 ( -0.909 -4.229 -1.302) 4.517 30.431 ( -1.030 0.740 -1.246) 1.778 30.714 ( 0.416 0.319 -0.244) 0.578 31.235 ( -0.354 -0.515 -0.300) 0.693 31.546 ( -0.086 -6.056 0.119) 6.058 32.641 ( 4.720 7.773 1.667) 9.245 33.701 ( -3.421 11.687 4.620) 13.025 34.183 ( -5.001 14.994 -8.909) 18.144 36.433 ( 14.782 1.222 13.571) 20.105 ======================= Grid point 17 (13/160) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.961 ( 0.000 27.579 0.000) 27.579 1.062 ( 0.000 32.554 0.000) 32.554 2.981 ( 0.000 16.943 0.000) 16.943 3.042 ( 0.000 32.746 0.000) 32.746 3.119 ( 0.000 72.359 0.000) 72.359 3.189 ( 0.000 38.383 0.000) 38.383 3.381 ( 0.000 6.380 0.000) 6.380 3.654 ( 0.000 0.748 0.000) 0.748 3.818 ( 0.000 17.957 0.000) 17.957 4.267 ( 0.000 4.800 0.000) 4.800 4.527 ( 0.000 29.258 0.000) 29.258 4.761 ( 0.000 2.908 0.000) 2.908 4.803 ( 0.000 19.091 0.000) 19.091 5.097 ( 0.000 31.010 0.000) 31.010 5.307 ( 0.000 8.694 0.000) 8.694 5.511 ( -0.000 -1.782 -0.000) 1.782 5.567 ( -0.000 -14.457 -0.000) 14.457 5.615 ( 0.000 18.681 0.000) 18.681 6.006 ( 0.000 8.967 0.000) 8.967 6.066 ( -0.000 -1.769 -0.000) 1.769 6.386 ( 0.000 1.959 0.000) 1.959 6.634 ( 0.000 4.461 0.000) 4.461 6.741 ( -0.000 -16.458 -0.000) 16.458 6.953 ( -0.000 -3.795 -0.000) 3.795 7.028 ( -0.000 -9.370 -0.000) 9.370 7.484 ( -0.000 -3.244 -0.000) 3.244 7.805 ( 0.000 5.934 0.000) 5.934 8.127 ( 0.000 6.027 0.000) 6.027 8.448 ( 0.000 8.636 0.000) 8.636 8.545 ( 0.000 0.664 0.000) 0.664 8.643 ( -0.000 -0.503 -0.000) 0.503 9.162 ( 0.000 4.761 0.000) 4.761 9.325 ( 0.000 4.887 0.000) 4.887 9.465 ( 0.000 3.742 0.000) 3.742 9.814 ( 0.000 1.740 0.000) 1.740 9.921 ( 0.000 10.373 0.000) 10.373 10.207 ( 0.000 8.877 0.000) 8.877 10.563 ( 0.000 1.338 0.000) 1.338 11.051 ( -0.000 -6.812 -0.000) 6.812 11.359 ( -0.000 -9.609 -0.000) 9.609 11.408 ( -0.000 -1.435 -0.000) 1.435 11.985 ( 0.000 2.460 0.000) 2.460 12.686 ( -0.000 -0.411 -0.000) 0.411 13.135 ( -0.000 -34.303 -0.000) 34.303 13.292 ( 0.000 3.958 0.000) 3.958 13.898 ( -0.000 -2.857 -0.000) 2.857 14.462 ( 0.000 0.440 0.000) 0.440 14.843 ( 0.000 0.111 0.000) 0.111 15.546 ( -0.000 -1.907 -0.000) 1.907 15.872 ( -0.000 -1.191 -0.000) 1.191 16.113 ( -0.000 -13.152 -0.000) 13.152 16.169 ( -0.000 -5.138 -0.000) 5.138 16.411 ( -0.000 -10.264 -0.000) 10.264 16.427 ( -0.000 -0.143 -0.000) 0.143 17.423 ( 0.000 2.741 0.000) 2.741 17.900 ( 0.000 7.275 0.000) 7.275 18.064 ( 0.000 1.117 0.000) 1.117 18.411 ( 0.000 2.283 0.000) 2.283 18.579 ( 0.000 2.802 0.000) 2.802 19.084 ( 0.000 7.305 0.000) 7.305 19.120 ( 0.000 2.298 0.000) 2.298 20.257 ( -0.000 -2.164 -0.000) 2.164 27.540 ( 0.000 0.536 0.000) 0.536 28.280 ( 0.000 0.054 0.000) 0.054 29.290 ( 0.000 1.235 0.000) 1.235 29.470 ( -0.000 -0.135 -0.000) 0.135 29.632 ( -0.000 -1.867 -0.000) 1.867 29.747 ( -0.000 -1.500 -0.000) 1.500 29.983 ( -0.000 -6.194 -0.000) 6.194 30.041 ( -0.000 -7.999 -0.000) 7.999 30.424 ( -0.000 -0.318 -0.000) 0.318 30.702 ( 0.000 0.443 0.000) 0.443 31.211 ( 0.000 3.693 0.000) 3.693 31.690 ( -0.000 -10.755 -0.000) 10.755 32.505 ( 0.000 11.014 0.000) 11.014 33.505 ( 0.000 11.393 0.000) 11.393 33.810 ( 0.000 21.055 0.000) 21.055 36.567 ( 0.000 0.147 0.000) 0.147 ======================= Grid point 20 (14/160) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.193 ( 21.428 0.000 15.275) 26.315 1.414 ( 33.642 0.000 17.833) 38.077 1.775 ( -3.722 -0.000 10.259) 10.914 2.450 ( 6.310 0.000 3.676) 7.302 2.665 ( -2.422 -0.000 -3.509) 4.264 2.832 ( 34.544 0.000 41.753) 54.191 3.143 ( -0.362 -0.000 -11.523) 11.528 3.223 ( -4.401 -0.000 -3.651) 5.718 3.306 ( 7.995 0.000 -6.698) 10.430 3.714 ( -14.914 -0.000 6.161) 16.136 3.789 ( 18.674 0.000 -2.812) 18.885 3.979 ( -22.109 -0.000 -13.063) 25.680 4.462 ( -5.783 -0.000 -13.494) 14.681 4.486 ( -8.796 -0.000 1.094) 8.864 4.953 ( -8.614 -0.000 -1.617) 8.764 5.569 ( -0.238 -0.000 -2.619) 2.630 5.582 ( 4.336 0.000 -9.837) 10.750 5.751 ( -5.989 -0.000 3.217) 6.798 6.125 ( -7.509 -0.000 -3.898) 8.460 6.290 ( 2.690 0.000 -12.330) 12.620 6.475 ( 8.535 0.000 3.223) 9.123 6.809 ( 3.158 0.000 10.584) 11.045 7.082 ( -0.376 -0.000 -1.027) 1.094 7.150 ( -15.459 -0.000 2.945) 15.737 7.536 ( -5.158 -0.000 -2.789) 5.863 7.625 ( -2.671 -0.000 -14.293) 14.541 7.644 ( 7.808 0.000 0.020) 7.808 7.846 ( 3.661 0.000 4.854) 6.080 8.276 ( 6.792 0.000 -0.207) 6.795 8.396 ( -3.114 -0.000 2.110) 3.761 8.802 ( -3.529 -0.000 -4.641) 5.831 9.298 ( 1.182 0.000 5.176) 5.309 9.391 ( 1.305 0.000 3.052) 3.320 9.410 ( -4.522 -0.000 -1.661) 4.817 9.824 ( -1.591 -0.000 -3.032) 3.424 9.836 ( 11.294 0.000 -7.168) 13.376 9.839 ( -1.090 -0.000 -0.725) 1.309 10.028 ( 4.067 0.000 -1.357) 4.288 10.695 ( 0.566 0.000 -1.487) 1.591 10.865 ( -3.197 -0.000 0.274) 3.208 11.533 ( -1.815 -0.000 1.494) 2.350 11.718 ( 3.770 0.000 3.022) 4.832 12.441 ( -13.377 -0.000 12.299) 18.172 12.790 ( -3.267 -0.000 10.481) 10.979 13.579 ( 2.186 0.000 -3.807) 4.390 13.775 ( -1.583 -0.000 2.291) 2.785 14.423 ( -0.524 -0.000 4.222) 4.254 15.004 ( -3.361 -0.000 4.060) 5.271 15.949 ( -4.277 -0.000 13.946) 14.587 16.013 ( 0.427 0.000 0.943) 1.035 16.140 ( -1.621 -0.000 -3.651) 3.994 16.351 ( 1.645 0.000 -4.416) 4.713 16.373 ( -4.378 -0.000 0.419) 4.398 16.770 ( 5.382 0.000 1.735) 5.655 17.548 ( 4.751 0.000 -2.470) 5.354 17.820 ( 6.164 0.000 2.088) 6.508 18.005 ( -0.728 -0.000 -5.973) 6.017 18.350 ( 2.203 0.000 -7.951) 8.250 18.704 ( -1.004 -0.000 -2.802) 2.976 19.233 ( -0.352 -0.000 6.869) 6.878 19.755 ( -2.884 -0.000 -19.113) 19.330 20.605 ( -1.930 -0.000 6.924) 7.188 27.931 ( -2.122 -0.000 -7.248) 7.552 28.583 ( -10.407 -0.000 14.851) 18.134 29.311 ( -4.098 -0.000 -2.757) 4.939 29.657 ( -0.868 -0.000 -0.180) 0.887 29.681 ( -1.624 -0.000 -4.427) 4.715 29.711 ( 0.332 0.000 0.776) 0.844 29.797 ( -1.877 -0.000 -6.915) 7.165 30.215 ( 0.103 0.000 1.272) 1.276 30.415 ( 5.796 0.000 0.129) 5.797 30.983 ( -3.059 -0.000 -1.371) 3.352 31.785 ( -20.787 -0.000 6.568) 21.800 31.987 ( -1.112 -0.000 -0.108) 1.118 32.076 ( 0.874 0.000 0.736) 1.143 32.280 ( 17.841 0.000 -22.299) 28.557 32.835 ( -4.837 -0.000 -6.778) 8.327 34.577 ( 20.878 0.000 25.020) 32.586 ======================= Grid point 21 (15/160) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( 22.837 -8.188 24.316) 34.349 2.171 ( 17.608 -52.247 9.526) 55.951 2.236 ( -0.083 -38.400 6.589) 38.961 2.738 ( -0.886 -23.782 -3.938) 24.123 2.899 ( 7.415 -24.170 -1.601) 25.332 3.077 ( 3.406 -5.787 -9.568) 11.689 3.319 ( 8.025 -11.648 9.986) 17.315 3.341 ( 5.410 -9.719 5.018) 12.202 3.571 ( 2.317 -19.166 0.448) 19.311 3.717 ( -15.473 -9.468 -9.666) 20.554 3.908 ( -1.530 -20.442 8.703) 22.270 4.046 ( 2.365 -19.168 1.514) 19.372 4.337 ( -2.615 -6.264 -9.996) 12.083 4.533 ( -3.886 -11.116 -2.572) 12.053 4.935 ( -8.554 -9.019 -2.142) 12.613 5.451 ( 0.850 6.609 -6.912) 9.601 5.553 ( 3.397 4.139 0.031) 5.355 5.742 ( -8.116 -4.134 -2.275) 9.388 6.065 ( -0.715 0.414 -0.108) 0.833 6.212 ( -0.050 1.272 -6.968) 7.083 6.508 ( 8.662 6.813 1.501) 11.122 6.747 ( 4.362 12.252 3.033) 13.355 6.956 ( -15.433 5.834 -4.414) 17.079 7.100 ( -5.143 -0.893 -0.039) 5.220 7.397 ( -7.233 5.759 1.322) 9.340 7.436 ( -2.655 5.378 -7.987) 9.989 7.742 ( 7.914 -3.569 -4.375) 9.722 7.975 ( 4.911 -4.917 5.103) 8.622 8.367 ( 3.626 -2.226 0.071) 4.256 8.420 ( 2.925 -3.034 2.318) 4.809 8.751 ( -4.755 -1.794 -3.067) 5.936 9.192 ( 1.961 10.605 -2.003) 10.969 9.378 ( -0.572 -0.844 1.281) 1.637 9.514 ( 1.354 -3.730 4.526) 6.019 9.601 ( -2.272 0.117 6.937) 7.300 9.929 ( -1.058 -11.917 -1.262) 12.030 10.074 ( 3.798 -2.416 0.487) 4.528 10.362 ( 0.043 -33.067 -16.532) 36.969 10.633 ( -3.260 1.586 -5.300) 6.421 10.885 ( 2.372 1.133 5.490) 6.087 11.484 ( -2.456 4.487 0.248) 5.121 11.725 ( 2.614 4.604 2.404) 5.814 12.428 ( -7.845 -0.351 6.377) 10.116 12.851 ( -3.626 -1.239 10.571) 11.244 13.563 ( 0.654 0.045 -3.124) 3.192 13.780 ( -1.023 -0.450 -0.065) 1.120 14.458 ( -0.180 -0.474 3.954) 3.986 15.008 ( -1.853 0.603 4.187) 4.618 15.948 ( -1.945 6.752 6.298) 9.436 15.979 ( -1.229 6.922 -0.461) 7.045 16.072 ( -1.849 1.262 4.344) 4.887 16.255 ( -4.277 7.176 -0.910) 8.403 16.374 ( 0.964 -1.954 -4.084) 4.629 16.770 ( 4.763 6.003 2.012) 7.923 17.604 ( 5.632 -3.128 -2.520) 6.917 17.842 ( 4.801 5.320 2.176) 7.489 17.975 ( 0.558 -2.696 -5.228) 5.909 18.330 ( 3.239 -1.163 -5.621) 6.591 18.698 ( 2.572 -1.249 -2.864) 4.047 19.248 ( -5.375 3.932 8.860) 11.084 19.506 ( 0.141 7.752 -14.763) 16.675 20.565 ( -2.837 5.742 5.312) 8.321 27.808 ( -0.540 6.460 -3.817) 7.523 28.548 ( -8.059 3.904 8.567) 12.393 29.262 ( -2.250 0.649 -1.906) 3.020 29.362 ( 1.179 10.120 -3.727) 10.849 29.667 ( -1.638 2.621 -0.311) 3.107 29.711 ( 0.206 1.501 -2.722) 3.115 29.998 ( -3.937 -14.196 -2.777) 14.991 30.224 ( 1.461 1.630 3.490) 4.120 30.479 ( 3.997 -1.734 0.615) 4.400 30.880 ( -3.924 7.052 -1.129) 8.149 31.493 ( 1.785 16.535 4.380) 17.198 31.766 ( -8.034 2.629 1.150) 8.531 31.912 ( 1.159 7.097 -3.933) 8.197 32.925 ( 10.884 -24.749 -24.381) 36.407 33.125 ( -19.514 -53.013 -1.058) 56.501 34.995 ( 17.715 -9.636 21.737) 29.651 ======================= Grid point 22 (16/160) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( 13.847 -6.453 22.849) 27.486 2.587 ( 5.258 -4.045 -0.993) 6.708 3.020 ( 0.850 -11.442 -9.563) 14.936 3.093 ( 0.847 -28.622 -2.657) 28.758 3.195 ( 3.239 -5.428 0.983) 6.397 3.414 ( 0.042 -17.493 6.512) 18.665 3.588 ( -0.968 -26.021 1.442) 26.079 3.703 ( 0.885 -24.113 0.552) 24.135 3.751 ( -1.448 -21.498 -3.144) 21.775 3.922 ( -0.994 -16.736 -10.638) 19.856 4.257 ( 4.829 -18.669 3.861) 19.666 4.530 ( 3.838 -21.193 6.234) 22.422 4.731 ( 6.487 -23.048 -0.698) 23.954 4.771 ( -7.730 -32.518 0.982) 33.439 5.188 ( -7.299 -31.392 -1.148) 32.250 5.307 ( 2.685 5.911 -4.357) 7.819 5.566 ( 3.984 -3.821 5.360) 7.694 5.721 ( -6.807 -3.879 -4.427) 8.999 6.102 ( -3.001 -4.020 -5.621) 7.533 6.142 ( 0.377 0.332 0.605) 0.787 6.417 ( 6.704 9.966 -0.466) 12.020 6.621 ( 6.042 6.951 0.256) 9.214 6.751 ( -3.786 2.287 -4.423) 6.255 7.002 ( -11.697 1.763 -2.695) 12.132 7.268 ( -8.898 4.241 3.133) 10.343 7.298 ( -5.406 2.572 -3.769) 7.074 7.846 ( 10.175 -3.709 -4.776) 11.836 8.120 ( 2.588 -3.334 6.514) 7.761 8.392 ( -0.089 -0.866 0.179) 0.889 8.567 ( 6.869 -6.956 -1.187) 9.848 8.757 ( -6.302 -6.893 -1.384) 9.441 9.074 ( 4.374 5.644 -0.221) 7.144 9.385 ( 0.721 -0.778 -2.565) 2.776 9.542 ( 1.372 1.372 3.013) 3.583 9.757 ( -6.687 -9.317 9.245) 14.731 10.135 ( 3.170 -5.265 1.066) 6.238 10.177 ( -0.651 -12.274 -0.450) 12.300 10.549 ( -3.668 0.084 -5.294) 6.442 10.691 ( 0.692 -17.908 -12.806) 22.027 10.922 ( 3.601 0.974 3.907) 5.402 11.355 ( -3.266 7.071 -1.122) 7.870 11.643 ( 1.258 8.276 1.296) 8.471 12.415 ( -3.910 0.301 2.957) 4.911 12.909 ( -3.833 -0.499 8.618) 9.445 13.551 ( -0.121 -0.737 -2.408) 2.521 13.765 ( -0.493 0.614 -1.619) 1.801 14.481 ( -0.555 0.114 2.209) 2.281 15.012 ( -1.443 1.434 4.609) 5.038 15.771 ( 1.524 13.985 0.522) 14.077 15.849 ( 0.439 7.686 1.149) 7.784 16.036 ( -4.977 9.468 -0.991) 10.743 16.120 ( -3.033 0.775 6.891) 7.569 16.370 ( 0.173 -0.597 -4.222) 4.268 16.688 ( 3.718 9.086 1.525) 9.935 17.656 ( 5.259 2.052 -3.172) 6.475 17.806 ( 3.006 0.152 0.946) 3.155 18.026 ( 0.193 -5.243 -2.418) 5.777 18.357 ( 4.038 -1.594 -2.286) 4.906 18.743 ( 6.486 -1.410 -2.675) 7.156 19.114 ( -2.694 10.649 5.577) 12.319 19.402 ( -2.512 -2.615 -5.598) 6.670 20.465 ( -3.944 5.750 1.648) 7.165 27.690 ( 0.765 5.388 -0.600) 5.475 28.473 ( -5.182 2.860 2.084) 6.275 29.228 ( -0.739 0.541 -0.023) 0.917 29.285 ( 1.512 -0.689 -2.699) 3.169 29.618 ( -2.276 0.449 -0.585) 2.392 29.656 ( 0.355 3.166 -1.711) 3.616 30.050 ( -2.391 3.475 0.153) 4.221 30.223 ( 2.570 4.800 4.842) 7.287 30.519 ( 1.495 -0.066 0.484) 1.573 30.721 ( -3.009 6.144 -1.537) 7.012 31.403 ( 3.308 3.597 2.473) 5.477 31.639 ( -2.923 6.193 -0.911) 6.908 31.915 ( -6.272 -13.157 -1.838) 14.691 33.272 ( 4.468 -23.990 -10.778) 26.677 33.740 ( -14.958 -40.808 -10.425) 44.696 35.460 ( 13.402 -13.874 15.862) 24.974 ======================= Grid point 23 (17/160) ======================= q-point: ( 0.56 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -1.260 4.798 -6.627) 8.278 2.607 ( 4.010 3.152 14.897) 15.746 2.987 ( -4.556 6.587 -6.038) 10.030 3.237 ( 0.235 -13.595 0.634) 13.612 3.535 ( 7.362 -15.976 -1.638) 17.667 3.589 ( -2.291 -9.343 -5.525) 11.093 3.833 ( -5.108 -8.687 -5.618) 11.538 4.031 ( -1.045 -18.058 2.589) 18.272 4.090 ( 2.794 -17.215 6.690) 18.679 4.355 ( 4.949 -17.646 2.260) 18.466 4.568 ( 7.246 -5.613 4.653) 10.280 4.757 ( -0.418 -4.362 2.313) 4.955 5.032 ( 5.623 -6.119 0.658) 8.336 5.189 ( 4.518 -14.033 -4.017) 15.280 5.314 ( -4.930 -10.312 -4.837) 12.411 5.550 ( -0.665 -7.076 6.506) 9.635 5.703 ( -2.135 -2.713 -0.772) 3.538 5.928 ( -13.984 -20.464 -3.562) 25.041 5.955 ( 6.849 -3.327 -4.653) 8.924 6.314 ( 1.706 -4.053 1.264) 4.575 6.435 ( 5.328 -14.970 2.757) 16.128 6.677 ( 3.219 -9.191 -0.211) 9.741 6.735 ( -4.491 -1.792 -3.776) 6.135 6.923 ( -4.219 -6.394 -1.638) 7.833 7.164 ( -6.922 0.127 -1.265) 7.038 7.207 ( -8.351 -0.607 1.046) 8.438 7.944 ( 9.026 -2.004 -4.673) 10.359 8.218 ( 0.555 -1.417 7.442) 7.596 8.416 ( -1.267 -3.870 -3.143) 5.144 8.700 ( 8.487 -3.341 -3.436) 9.747 8.873 ( -6.979 -7.540 3.381) 10.817 9.074 ( 6.190 -3.455 2.298) 7.452 9.395 ( 3.101 -0.361 -3.748) 4.878 9.577 ( -0.681 -5.259 1.452) 5.498 9.859 ( -6.832 -2.084 6.566) 9.702 10.154 ( 1.353 7.545 4.726) 9.005 10.384 ( -1.384 -12.526 -3.405) 13.054 10.515 ( -2.823 -5.097 -7.805) 9.740 10.791 ( 2.354 -0.945 -0.924) 2.700 10.978 ( 4.364 -0.312 1.383) 4.589 11.213 ( -4.228 4.438 -2.489) 6.616 11.514 ( 0.671 6.688 -0.206) 6.724 12.387 ( -1.439 2.693 0.935) 3.193 12.916 ( -3.405 2.114 4.651) 6.139 13.537 ( -1.436 0.332 -2.126) 2.587 13.746 ( 0.690 -0.360 -1.566) 1.748 14.481 ( -0.402 0.623 1.079) 1.309 14.984 ( -0.917 4.305 2.973) 5.311 15.593 ( 2.983 9.462 2.599) 10.256 15.763 ( 1.816 4.303 0.490) 4.696 15.811 ( -4.058 8.193 -2.754) 9.548 16.145 ( -1.681 0.226 4.650) 4.949 16.348 ( -1.497 -0.047 -1.410) 2.057 16.551 ( 2.666 10.366 -0.841) 10.737 17.599 ( 2.796 4.365 -2.159) 5.615 17.892 ( 4.369 -4.043 0.451) 5.969 18.095 ( -2.141 -4.716 -0.760) 5.234 18.404 ( 2.429 -1.813 -0.448) 3.063 18.765 ( 4.872 3.386 -1.587) 6.142 19.038 ( 5.094 3.154 5.251) 7.967 19.392 ( -7.094 -3.041 -1.552) 7.872 20.341 ( -4.227 4.650 -1.900) 6.565 27.629 ( 1.355 3.353 0.944) 3.738 28.402 ( -3.251 1.830 -1.316) 3.956 29.243 ( 1.061 -1.868 -0.001) 2.148 29.332 ( 1.374 -4.203 0.145) 4.425 29.590 ( -0.024 2.685 -2.058) 3.383 29.612 ( -1.953 -1.369 0.225) 2.396 29.900 ( -1.780 10.838 1.187) 11.047 30.152 ( 1.470 8.899 3.003) 9.507 30.549 ( 0.146 -2.323 1.497) 2.767 30.615 ( -0.770 3.005 -2.523) 3.999 31.359 ( 1.690 5.932 1.013) 6.250 31.540 ( -0.429 3.643 -0.247) 3.676 32.184 ( -5.096 -22.929 -0.551) 23.495 33.606 ( 2.141 -18.075 -4.693) 18.797 34.120 ( -10.874 -25.634 -9.261) 29.345 35.886 ( 9.825 -14.107 10.520) 20.155 ======================= Grid point 24 (18/160) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.148 ( -6.430 14.410 -9.561) 18.450 2.466 ( -1.950 19.390 -0.401) 19.492 3.027 ( 3.395 -4.927 13.456) 14.726 3.367 ( -1.400 -2.823 -6.209) 6.963 3.652 ( 3.262 -4.880 -0.380) 5.882 3.750 ( -2.125 -6.337 -6.449) 9.288 4.031 ( -1.410 -19.484 1.161) 19.569 4.270 ( 1.010 -6.540 3.919) 7.691 4.404 ( 1.219 -15.317 0.596) 15.377 4.490 ( 0.636 1.950 0.627) 2.145 4.608 ( 2.328 7.718 3.715) 8.876 4.829 ( 3.852 0.153 6.197) 7.298 5.036 ( -1.227 6.200 -4.379) 7.690 5.303 ( 0.373 -0.990 -2.855) 3.044 5.372 ( 3.850 -2.210 -2.171) 4.942 5.522 ( -1.353 8.399 2.487) 8.863 5.806 ( -3.998 -5.000 3.208) 7.160 5.884 ( 9.519 -6.581 -4.411) 12.385 6.186 ( -7.124 -4.994 -0.736) 8.731 6.455 ( 0.003 -7.151 3.261) 7.860 6.659 ( -5.661 -1.091 -4.437) 7.275 6.737 ( 0.535 -11.741 -0.305) 11.757 6.885 ( 3.564 -6.085 -0.901) 7.109 6.944 ( -3.960 0.128 -0.969) 4.078 7.126 ( -5.546 0.235 -0.111) 5.552 7.309 ( -0.760 -11.740 0.994) 11.806 7.964 ( 4.165 2.525 -2.938) 5.688 8.313 ( 0.960 -2.151 6.850) 7.244 8.450 ( -1.529 -5.473 -4.760) 7.413 8.745 ( 10.071 8.017 -1.647) 12.978 8.865 ( -5.182 0.018 4.560) 6.902 9.317 ( -0.147 -5.452 3.992) 6.759 9.384 ( 3.921 -8.862 -5.842) 11.315 9.704 ( 4.586 -0.104 0.759) 4.650 9.819 ( -9.519 3.743 2.624) 10.560 10.021 ( 0.995 6.767 0.468) 6.856 10.521 ( 0.121 -4.917 -1.336) 5.097 10.575 ( -0.397 -11.103 -1.610) 11.226 10.899 ( 0.563 -12.168 2.428) 12.421 10.965 ( 3.052 7.090 0.459) 7.732 11.088 ( -4.208 0.504 -2.278) 4.811 11.475 ( 0.830 -0.307 -0.179) 0.903 12.299 ( -0.430 6.891 -0.894) 6.962 12.859 ( -1.613 3.945 0.898) 4.356 13.485 ( -1.704 2.417 -1.351) 3.251 13.769 ( 0.835 -2.244 -0.785) 2.520 14.476 ( 0.161 0.511 0.561) 0.776 14.914 ( 0.071 4.373 0.812) 4.449 15.508 ( 0.449 4.993 0.545) 5.043 15.670 ( -0.769 1.295 0.283) 1.533 15.816 ( 1.810 -6.082 0.062) 6.346 16.145 ( -0.054 1.328 1.592) 2.074 16.293 ( -2.109 7.707 1.314) 8.097 16.415 ( 1.451 3.130 -2.888) 4.499 17.542 ( 1.364 3.141 -0.965) 3.558 17.986 ( 4.169 -2.242 0.404) 4.750 18.128 ( -3.636 -1.951 0.411) 4.147 18.442 ( 0.043 -1.385 0.324) 1.423 18.718 ( 2.621 3.961 -0.055) 4.750 19.113 ( 7.629 -0.466 2.798) 8.139 19.355 ( -8.204 -0.290 0.254) 8.213 20.233 ( -2.599 2.291 -2.814) 4.463 27.602 ( 1.090 2.200 0.920) 2.622 28.341 ( -1.769 1.563 -1.871) 3.012 29.296 ( 1.962 -2.671 -0.246) 3.323 29.434 ( 1.470 -4.272 3.142) 5.503 29.539 ( -1.764 0.171 -2.701) 3.230 29.637 ( -0.568 -2.553 -0.166) 2.620 29.739 ( -0.587 6.503 0.997) 6.605 30.017 ( -0.049 8.184 0.465) 8.197 30.527 ( -0.943 3.538 -0.604) 3.711 30.641 ( 0.945 -4.564 0.320) 4.672 31.275 ( 0.334 4.620 -0.087) 4.633 31.492 ( -0.007 1.888 0.151) 1.894 32.512 ( -0.938 -16.961 0.497) 16.995 33.814 ( -0.008 -7.367 -0.701) 7.400 34.301 ( -5.545 -10.370 -5.820) 13.121 36.232 ( 6.254 -11.895 6.022) 14.726 ======================= Grid point 25 (19/160) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 0.000 20.440 0.000) 20.440 2.064 ( 0.000 25.917 0.000) 25.917 3.224 ( -0.000 -5.393 -0.000) 5.393 3.289 ( 0.000 3.390 0.000) 3.390 3.661 ( 0.000 5.048 0.000) 5.048 3.799 ( -0.000 -1.211 -0.000) 1.211 4.155 ( 0.000 4.794 0.000) 4.794 4.347 ( 0.000 14.907 0.000) 14.907 4.385 ( 0.000 20.720 0.000) 20.720 4.480 ( -0.000 -13.870 -0.000) 13.870 4.636 ( -0.000 -8.581 -0.000) 8.581 4.832 ( 0.000 4.719 0.000) 4.719 4.937 ( -0.000 -2.704 -0.000) 2.704 5.341 ( 0.000 6.442 0.000) 6.442 5.344 ( 0.000 2.313 0.000) 2.313 5.394 ( -0.000 -2.835 -0.000) 2.835 5.843 ( 0.000 1.153 0.000) 1.153 6.129 ( 0.000 1.106 0.000) 1.106 6.146 ( -0.000 -13.410 -0.000) 13.410 6.454 ( 0.000 9.821 0.000) 9.821 6.549 ( 0.000 11.299 0.000) 11.299 6.815 ( 0.000 3.607 0.000) 3.607 6.865 ( 0.000 3.523 0.000) 3.523 6.936 ( 0.000 3.250 0.000) 3.250 6.990 ( 0.000 11.512 0.000) 11.512 7.438 ( -0.000 -3.061 -0.000) 3.061 7.918 ( 0.000 2.914 0.000) 2.914 8.315 ( 0.000 4.440 0.000) 4.440 8.546 ( -0.000 -6.611 -0.000) 6.611 8.635 ( 0.000 6.470 0.000) 6.470 8.783 ( 0.000 10.825 0.000) 10.825 9.336 ( -0.000 -1.153 -0.000) 1.153 9.600 ( -0.000 -5.144 -0.000) 5.144 9.626 ( 0.000 10.685 0.000) 10.685 9.670 ( 0.000 1.311 0.000) 1.311 9.952 ( 0.000 1.263 0.000) 1.263 10.589 ( -0.000 -3.186 -0.000) 3.186 10.700 ( 0.000 17.548 0.000) 17.548 10.779 ( -0.000 -11.198 -0.000) 11.198 11.061 ( -0.000 -2.979 -0.000) 2.979 11.465 ( 0.000 1.296 0.000) 1.296 11.529 ( -0.000 -46.890 -0.000) 46.890 12.158 ( 0.000 7.959 0.000) 7.959 12.791 ( 0.000 3.371 0.000) 3.371 13.422 ( 0.000 3.345 0.000) 3.345 13.812 ( -0.000 -2.596 -0.000) 2.596 14.473 ( 0.000 0.313 0.000) 0.313 14.863 ( 0.000 1.946 0.000) 1.946 15.468 ( -0.000 -0.337 -0.000) 0.337 15.723 ( -0.000 -6.834 -0.000) 6.834 15.971 ( -0.000 -9.714 -0.000) 9.714 16.099 ( 0.000 11.707 0.000) 11.707 16.147 ( -0.000 -1.124 -0.000) 1.124 16.408 ( -0.000 -0.872 -0.000) 0.872 17.499 ( 0.000 2.277 0.000) 2.277 18.026 ( 0.000 0.396 0.000) 0.396 18.116 ( 0.000 1.011 0.000) 1.011 18.456 ( -0.000 -0.132 -0.000) 0.132 18.674 ( 0.000 2.769 0.000) 2.769 19.167 ( 0.000 0.087 0.000) 0.087 19.287 ( 0.000 3.522 0.000) 3.522 20.197 ( -0.000 -0.522 -0.000) 0.522 27.577 ( 0.000 1.677 0.000) 1.677 28.302 ( 0.000 1.260 0.000) 1.260 29.333 ( -0.000 -0.188 -0.000) 0.188 29.485 ( 0.000 1.073 0.000) 1.073 29.545 ( -0.000 -3.382 -0.000) 3.382 29.680 ( -0.000 -2.687 -0.000) 2.687 29.731 ( -0.000 -5.316 -0.000) 5.316 29.918 ( 0.000 2.860 0.000) 2.860 30.459 ( 0.000 3.391 0.000) 3.391 30.708 ( -0.000 -2.067 -0.000) 2.067 31.228 ( 0.000 0.812 0.000) 0.812 31.485 ( -0.000 -1.366 -0.000) 1.366 32.697 ( -0.000 -4.282 -0.000) 4.282 33.839 ( 0.000 3.897 0.000) 3.897 34.304 ( 0.000 4.317 0.000) 4.317 36.454 ( -0.000 -7.989 -0.000) 7.989 ======================= Grid point 30 (20/160) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( 15.995 0.000 7.567) 17.695 1.855 ( -3.569 -0.000 11.295) 11.845 2.203 ( 26.558 0.000 20.944) 33.822 2.474 ( 0.303 0.000 -1.273) 1.308 2.663 ( 3.596 0.000 -1.949) 4.090 3.030 ( 6.541 0.000 -12.032) 13.695 3.143 ( -2.143 -0.000 0.546) 2.212 3.366 ( 3.871 0.000 -4.144) 5.671 3.369 ( -17.074 -0.000 -3.688) 17.468 3.583 ( -7.349 -0.000 5.824) 9.377 3.642 ( 5.623 0.000 6.441) 8.550 4.005 ( -2.234 -0.000 -12.951) 13.142 4.311 ( -12.023 -0.000 -1.228) 12.086 4.387 ( 18.938 0.000 11.256) 22.031 4.823 ( -2.200 -0.000 -1.587) 2.712 5.488 ( 4.320 0.000 -2.976) 5.246 5.587 ( -11.342 -0.000 -3.773) 11.953 5.642 ( 5.685 0.000 -0.231) 5.689 6.079 ( 0.450 0.000 2.929) 2.963 6.134 ( -4.666 -0.000 -10.225) 11.240 6.650 ( 6.525 0.000 3.723) 7.512 6.833 ( -12.122 -0.000 -4.249) 12.845 6.931 ( -2.431 -0.000 0.566) 2.496 7.055 ( -0.458 -0.000 -1.848) 1.904 7.294 ( -12.827 -0.000 -8.599) 15.442 7.420 ( -2.569 -0.000 -6.703) 7.179 7.749 ( 5.553 0.000 -0.496) 5.575 8.043 ( 8.897 0.000 6.493) 11.014 8.394 ( 7.059 0.000 0.444) 7.073 8.422 ( -1.198 -0.000 2.194) 2.500 8.659 ( -6.791 -0.000 -4.001) 7.882 9.329 ( -3.992 -0.000 -0.161) 3.995 9.331 ( 2.658 0.000 -1.007) 2.842 9.523 ( -0.532 -0.000 10.165) 10.179 9.726 ( -1.462 -0.000 -5.171) 5.374 9.801 ( -2.155 -0.000 -0.877) 2.327 9.909 ( 7.186 0.000 -2.864) 7.735 10.081 ( 3.324 0.000 -0.899) 3.443 10.578 ( -4.185 -0.000 -4.185) 5.919 10.977 ( 5.159 0.000 6.795) 8.532 11.496 ( -3.521 -0.000 -0.958) 3.649 11.801 ( 2.211 0.000 1.845) 2.880 12.416 ( -3.983 -0.000 3.891) 5.568 12.880 ( -4.642 -0.000 9.811) 10.853 13.539 ( -0.436 -0.000 -2.882) 2.915 13.775 ( 0.431 0.000 -0.269) 0.508 14.481 ( -0.350 -0.000 3.459) 3.477 15.041 ( 0.279 0.000 4.422) 4.430 16.026 ( -0.695 -0.000 0.291) 0.754 16.037 ( -6.099 -0.000 10.476) 12.122 16.092 ( 0.943 0.000 -1.105) 1.453 16.296 ( -4.154 -0.000 -1.332) 4.363 16.303 ( 0.850 0.000 -5.884) 5.945 16.872 ( 3.788 0.000 1.715) 4.158 17.603 ( 5.625 0.000 -1.816) 5.911 17.912 ( -0.941 -0.000 -4.968) 5.056 17.929 ( 2.957 0.000 -0.519) 3.002 18.333 ( 6.245 0.000 -1.549) 6.434 18.704 ( 7.429 0.000 -2.408) 7.810 19.285 ( -6.452 -0.000 7.548) 9.930 19.452 ( -5.747 -0.000 -12.054) 13.354 20.611 ( -4.840 -0.000 1.703) 5.131 27.821 ( -1.115 -0.000 -4.316) 4.457 28.556 ( -10.074 -0.000 4.759) 11.141 29.239 ( -0.384 -0.000 -2.083) 2.118 29.547 ( -3.804 -0.000 -7.460) 8.374 29.642 ( -0.721 -0.000 -0.166) 0.740 29.667 ( -2.522 -0.000 -4.448) 5.114 29.727 ( 0.265 0.000 0.708) 0.756 30.275 ( 2.130 0.000 4.070) 4.594 30.508 ( 4.632 0.000 1.045) 4.749 30.886 ( -5.199 -0.000 -2.791) 5.900 31.624 ( -9.388 -0.000 4.300) 10.326 31.969 ( -0.842 -0.000 -0.119) 0.851 32.100 ( 0.695 0.000 0.734) 1.011 32.256 ( 11.575 0.000 -13.561) 17.829 32.668 ( -6.431 -0.000 -3.638) 7.388 35.215 ( 16.239 0.000 19.757) 25.574 ======================= Grid point 31 (21/160) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -4.989 -42.907 4.282) 43.408 2.427 ( 15.298 -22.499 14.551) 30.854 2.521 ( 7.798 -13.083 4.215) 15.803 2.701 ( -0.358 -27.219 0.777) 27.232 2.948 ( 7.777 -22.214 -3.195) 23.752 3.094 ( 4.688 -23.244 -3.292) 23.940 3.247 ( -6.778 -1.871 2.100) 7.338 3.329 ( -2.056 -12.714 3.738) 13.411 3.490 ( 0.851 -10.960 -3.297) 11.477 3.675 ( 2.732 -5.614 -10.956) 12.610 3.861 ( -8.897 -26.287 0.757) 27.762 3.970 ( -0.212 -20.777 -7.664) 22.147 4.363 ( -5.672 -17.323 0.361) 18.232 4.638 ( 4.722 -6.278 9.775) 12.540 4.854 ( 3.706 -3.172 0.597) 4.914 5.424 ( -1.804 5.542 -0.943) 5.904 5.572 ( 2.486 -2.631 -0.757) 3.698 5.659 ( 1.856 1.994 1.606) 3.162 6.014 ( -1.770 0.713 -7.333) 7.577 6.135 ( 1.285 -2.578 2.896) 4.084 6.642 ( 4.482 8.935 1.585) 10.121 6.707 ( -5.013 3.627 -1.816) 6.448 6.821 ( -6.264 4.279 -5.268) 9.236 6.938 ( -2.871 6.883 -3.868) 8.401 7.198 ( -7.701 -1.829 -4.057) 8.894 7.322 ( -3.847 4.451 -1.032) 5.973 7.820 ( 5.908 -3.688 -2.665) 7.457 8.162 ( 4.619 -0.987 7.680) 9.016 8.389 ( -1.708 1.466 -1.391) 2.647 8.502 ( 4.897 -5.158 -0.046) 7.112 8.605 ( -5.163 -3.200 -3.148) 6.841 9.227 ( 4.143 8.709 -1.243) 9.724 9.346 ( -1.490 -3.369 -0.334) 3.699 9.624 ( 0.285 -2.965 5.655) 6.391 9.641 ( -2.394 1.669 3.784) 4.778 9.894 ( -1.327 -12.882 -0.874) 12.980 10.122 ( 2.211 -3.122 -0.628) 3.877 10.214 ( 1.828 -24.857 -6.881) 25.856 10.518 ( -2.868 1.179 -2.312) 3.868 11.047 ( 5.563 2.627 6.063) 8.638 11.415 ( -4.226 4.391 -2.189) 6.475 11.782 ( 1.326 5.213 1.203) 5.512 12.414 ( -1.459 0.173 1.986) 2.471 12.915 ( -4.816 -1.157 7.123) 8.676 13.524 ( -0.040 -0.518 -1.944) 2.012 13.768 ( 0.321 0.935 -0.831) 1.292 14.496 ( -0.556 0.213 2.100) 2.183 15.065 ( 0.492 1.307 4.056) 4.290 15.953 ( -0.177 7.256 -1.148) 7.348 15.992 ( -1.107 6.948 3.957) 8.072 16.110 ( -1.548 0.877 4.429) 4.773 16.178 ( -3.860 5.798 -0.447) 6.980 16.303 ( -0.390 -2.414 -6.175) 6.642 16.857 ( 2.616 5.909 1.409) 6.614 17.665 ( 5.493 -2.674 -1.540) 6.301 17.836 ( -2.519 2.388 -3.782) 5.133 17.957 ( 1.644 -2.047 -1.126) 2.856 18.377 ( 4.386 0.081 0.512) 4.416 18.788 ( 13.479 -0.658 -0.951) 13.529 19.257 ( -7.693 4.791 7.321) 11.651 19.298 ( -4.775 0.510 -8.201) 9.504 20.530 ( -4.525 4.816 -0.527) 6.629 27.759 ( -0.232 3.266 -1.844) 3.758 28.479 ( -6.750 2.208 0.344) 7.110 29.231 ( 0.288 -0.148 -0.620) 0.700 29.317 ( -0.577 7.119 -2.509) 7.570 29.608 ( -1.731 1.202 -2.378) 3.177 29.705 ( 0.560 2.647 -0.130) 2.709 29.895 ( -3.630 -16.680 -1.746) 17.159 30.324 ( 2.845 0.611 4.408) 5.282 30.549 ( 3.292 0.626 0.783) 3.441 30.777 ( -4.960 4.827 -2.582) 7.387 31.504 ( -3.133 7.208 1.197) 7.950 31.749 ( -1.624 13.150 5.443) 14.325 31.885 ( 2.653 8.923 -4.969) 10.552 32.758 ( 5.658 -31.376 -15.315) 35.369 32.932 ( -9.226 -35.302 3.230) 36.631 35.504 ( 11.434 -6.204 13.687) 18.883 ======================= Grid point 32 (22/160) ======================= q-point: ( 0.56 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -1.909 5.330 -5.046) 7.584 2.740 ( -0.431 -7.556 17.581) 19.141 2.925 ( 2.266 -15.415 -13.254) 20.456 3.032 ( 2.040 -9.683 8.155) 12.823 3.305 ( 3.801 -9.322 7.184) 12.368 3.472 ( 0.125 -5.153 -2.586) 5.767 3.584 ( -1.581 -8.768 -12.516) 15.363 3.677 ( -0.443 -24.633 -0.112) 24.637 3.725 ( -1.390 -28.592 -0.175) 28.626 3.844 ( 6.166 -48.204 1.349) 48.615 4.335 ( 2.563 -30.554 1.211) 30.685 4.581 ( -8.098 -42.146 -2.979) 43.020 4.680 ( 4.385 -13.272 2.843) 14.264 4.878 ( 3.598 -6.614 1.937) 7.774 5.070 ( -7.035 -35.546 -0.885) 36.247 5.333 ( 3.684 4.809 1.275) 6.190 5.627 ( -5.867 -0.614 -1.505) 6.088 5.635 ( -1.223 -6.505 -1.148) 6.717 6.014 ( 10.307 2.510 0.569) 10.623 6.258 ( 6.771 -5.744 4.172) 9.811 6.471 ( -2.915 10.035 -0.038) 10.450 6.598 ( -2.535 3.576 -2.824) 5.214 6.659 ( -12.160 -1.872 -4.277) 13.025 6.876 ( 9.976 2.197 -0.905) 10.256 7.114 ( -8.553 1.395 -1.209) 8.750 7.206 ( -3.516 5.180 0.396) 6.273 7.914 ( 4.171 -4.579 -2.491) 6.676 8.251 ( -0.375 -0.942 7.580) 7.647 8.337 ( -0.780 -0.419 -5.386) 5.459 8.626 ( 3.286 -5.780 -3.644) 7.582 8.676 ( -2.369 -10.524 2.823) 11.151 9.152 ( 3.233 3.820 0.111) 5.006 9.391 ( 2.203 -1.543 -0.739) 2.789 9.563 ( -1.274 3.463 0.834) 3.783 9.776 ( -3.453 -7.299 4.348) 9.170 10.129 ( -0.602 -14.705 -1.558) 14.800 10.220 ( 2.463 -6.569 1.907) 7.270 10.422 ( -2.795 4.078 -3.616) 6.125 10.600 ( 0.903 -20.252 -2.765) 20.460 11.066 ( 4.705 3.993 4.144) 7.434 11.262 ( -4.053 7.002 -2.646) 8.512 11.670 ( 0.456 9.279 0.491) 9.304 12.411 ( -0.314 0.713 0.749) 1.081 12.934 ( -3.126 -0.181 3.333) 4.573 13.522 ( 0.051 -0.232 -0.993) 1.021 13.743 ( 0.102 0.958 -0.968) 1.366 14.496 ( -0.270 0.567 0.918) 1.112 15.058 ( 0.003 2.770 2.244) 3.565 15.806 ( 2.022 9.490 -0.034) 9.703 15.870 ( -0.568 8.385 1.769) 8.589 15.952 ( -2.272 12.060 -1.797) 12.403 16.165 ( -1.669 -0.082 4.717) 5.005 16.295 ( -0.418 -2.168 -4.425) 4.945 16.746 ( 1.278 9.793 0.675) 9.899 17.676 ( 2.145 4.072 -2.054) 5.040 17.833 ( 0.499 -5.408 -0.145) 5.433 18.006 ( -0.023 -3.597 -0.700) 3.665 18.406 ( 1.683 -0.299 0.393) 1.754 18.873 ( 9.598 3.337 -0.325) 10.166 19.153 ( 2.306 4.209 0.634) 4.841 19.262 ( -9.425 -3.813 0.683) 10.190 20.394 ( -2.882 6.319 -1.359) 7.077 27.698 ( 0.474 3.285 0.039) 3.319 28.402 ( -2.760 1.959 -0.883) 3.497 29.226 ( 0.104 -0.135 0.041) 0.176 29.281 ( 0.613 -2.287 -0.543) 2.429 29.577 ( -0.828 -0.294 -0.922) 1.274 29.648 ( -0.065 3.936 -0.108) 3.938 30.012 ( -1.571 0.651 -0.119) 1.705 30.327 ( 2.032 6.166 3.023) 7.161 30.543 ( 0.628 0.923 0.316) 1.160 30.648 ( -2.052 4.237 -1.752) 5.023 31.481 ( 3.214 0.018 0.872) 3.330 31.565 ( -4.316 5.975 -0.141) 7.372 31.849 ( -0.948 -7.359 -0.499) 7.437 33.201 ( 2.082 -27.112 -5.604) 27.763 33.493 ( -5.494 -34.804 -1.663) 35.274 35.792 ( 5.669 -11.123 6.440) 14.047 ======================= Grid point 33 (23/160) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 0.000 10.397 0.000) 10.397 2.760 ( 0.000 14.203 0.000) 14.203 2.976 ( -0.000 -7.015 -0.000) 7.015 3.350 ( 0.000 1.469 0.000) 1.469 3.384 ( -0.000 -20.366 -0.000) 20.366 3.635 ( -0.000 -9.064 -0.000) 9.064 3.715 ( -0.000 -15.136 -0.000) 15.136 4.027 ( -0.000 -20.210 -0.000) 20.210 4.151 ( -0.000 -18.744 -0.000) 18.744 4.444 ( -0.000 -14.354 -0.000) 14.354 4.682 ( -0.000 -3.157 -0.000) 3.157 4.788 ( -0.000 -6.190 -0.000) 6.190 5.049 ( -0.000 -12.353 -0.000) 12.353 5.148 ( -0.000 -17.747 -0.000) 17.747 5.327 ( -0.000 -1.350 -0.000) 1.350 5.591 ( -0.000 -14.256 -0.000) 14.256 5.640 ( -0.000 -12.312 -0.000) 12.312 5.746 ( -0.000 -4.584 -0.000) 4.584 6.068 ( -0.000 -3.827 -0.000) 3.827 6.337 ( -0.000 -3.390 -0.000) 3.390 6.455 ( -0.000 -9.646 -0.000) 9.646 6.610 ( -0.000 -5.881 -0.000) 5.881 6.739 ( -0.000 -14.121 -0.000) 14.121 6.930 ( -0.000 -1.051 -0.000) 1.051 7.057 ( -0.000 -1.958 -0.000) 1.958 7.141 ( -0.000 -2.056 -0.000) 2.056 7.984 ( -0.000 -1.795 -0.000) 1.795 8.316 ( -0.000 -3.439 -0.000) 3.439 8.327 ( -0.000 -2.104 -0.000) 2.104 8.742 ( -0.000 -7.819 -0.000) 7.819 8.865 ( -0.000 -5.984 -0.000) 5.984 9.143 ( -0.000 -4.435 -0.000) 4.435 9.399 ( 0.000 1.947 0.000) 1.947 9.590 ( -0.000 -8.730 -0.000) 8.730 9.834 ( 0.000 0.989 0.000) 0.989 10.223 ( 0.000 12.823 0.000) 12.823 10.332 ( -0.000 -12.153 -0.000) 12.153 10.418 ( -0.000 -9.633 -0.000) 9.633 10.808 ( -0.000 -3.782 -0.000) 3.782 11.076 ( 0.000 0.156 0.000) 0.156 11.116 ( 0.000 5.392 0.000) 5.392 11.519 ( 0.000 7.178 0.000) 7.178 12.384 ( 0.000 3.213 0.000) 3.213 12.913 ( 0.000 2.496 0.000) 2.496 13.509 ( 0.000 1.437 0.000) 1.437 13.740 ( -0.000 -1.004 -0.000) 1.004 14.488 ( 0.000 0.631 0.000) 0.631 15.000 ( 0.000 4.855 0.000) 4.855 15.662 ( 0.000 10.866 0.000) 10.866 15.734 ( 0.000 6.840 0.000) 6.840 15.784 ( 0.000 2.734 0.000) 2.734 16.167 ( 0.000 0.891 0.000) 0.891 16.315 ( -0.000 -1.773 -0.000) 1.773 16.568 ( 0.000 11.775 0.000) 11.775 17.605 ( 0.000 4.066 0.000) 4.066 17.937 ( -0.000 -5.390 -0.000) 5.390 18.064 ( -0.000 -3.665 -0.000) 3.665 18.424 ( -0.000 -0.952 -0.000) 0.952 18.816 ( 0.000 5.892 0.000) 5.892 19.151 ( 0.000 0.045 0.000) 0.045 19.286 ( -0.000 -3.402 -0.000) 3.402 20.275 ( 0.000 5.235 0.000) 5.235 27.651 ( 0.000 2.712 0.000) 2.712 28.356 ( 0.000 1.857 0.000) 1.857 29.254 ( -0.000 -2.641 -0.000) 2.641 29.350 ( -0.000 -5.473 -0.000) 5.473 29.571 ( 0.000 3.099 0.000) 3.099 29.597 ( -0.000 -0.965 -0.000) 0.965 29.892 ( 0.000 10.158 0.000) 10.158 30.189 ( 0.000 10.825 0.000) 10.825 30.572 ( -0.000 -3.456 -0.000) 3.456 30.577 ( 0.000 3.049 0.000) 3.049 31.382 ( 0.000 7.745 0.000) 7.745 31.532 ( 0.000 1.957 0.000) 1.957 32.139 ( -0.000 -24.153 -0.000) 24.153 33.587 ( -0.000 -19.052 -0.000) 19.052 33.963 ( -0.000 -24.324 -0.000) 24.324 36.052 ( -0.000 -13.886 -0.000) 13.886 ======================= Grid point 40 (24/160) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -3.307 -0.000 -0.892) 3.425 2.182 ( 11.783 0.000 9.586) 15.190 2.476 ( -2.640 -0.000 -0.228) 2.650 2.567 ( -1.278 -0.000 -3.665) 3.882 2.637 ( 0.452 0.000 -4.212) 4.236 3.097 ( 8.484 0.000 15.158) 17.370 3.161 ( -0.116 -0.000 2.342) 2.345 3.292 ( -3.725 -0.000 -0.094) 3.726 3.327 ( 5.927 0.000 8.186) 10.107 3.593 ( -6.159 -0.000 -10.863) 12.488 3.652 ( 4.466 0.000 0.430) 4.487 3.718 ( -2.642 -0.000 -15.877) 16.095 4.119 ( -7.504 -0.000 -0.741) 7.541 4.669 ( 0.463 0.000 5.007) 5.029 4.908 ( 5.951 0.000 2.354) 6.399 5.388 ( -5.379 -0.000 -2.456) 5.913 5.611 ( -2.802 -0.000 0.706) 2.890 5.680 ( 1.269 0.000 -1.927) 2.307 6.076 ( 18.681 0.000 6.630) 19.823 6.133 ( 0.693 0.000 1.706) 1.842 6.627 ( -23.016 -0.000 -9.037) 24.726 6.709 ( -0.618 -0.000 -4.673) 4.714 6.774 ( 2.745 0.000 2.167) 3.497 7.019 ( -0.556 -0.000 -1.394) 1.501 7.106 ( -0.493 -0.000 -2.196) 2.251 7.336 ( -0.854 -0.000 -1.549) 1.769 7.805 ( 2.058 0.000 -0.282) 2.077 8.244 ( 2.837 0.000 6.520) 7.111 8.369 ( -3.140 -0.000 -3.276) 4.538 8.490 ( 3.253 0.000 0.381) 3.275 8.531 ( -1.646 -0.000 -2.223) 2.766 9.281 ( -1.863 -0.000 0.224) 1.876 9.363 ( 1.810 0.000 -0.422) 1.859 9.626 ( -0.621 -0.000 4.814) 4.853 9.653 ( -0.632 -0.000 -2.103) 2.196 9.758 ( -1.044 -0.000 -0.808) 1.320 9.970 ( 2.709 0.000 -0.475) 2.750 10.102 ( 1.087 0.000 -0.822) 1.363 10.496 ( -1.507 -0.000 -0.898) 1.754 11.155 ( 4.930 0.000 4.784) 6.870 11.399 ( -4.103 -0.000 -2.614) 4.866 11.843 ( 0.760 0.000 0.610) 0.974 12.422 ( -0.142 -0.000 0.965) 0.976 12.908 ( -3.387 -0.000 3.762) 5.062 13.509 ( 0.199 0.000 -0.990) 1.010 13.779 ( 0.298 0.000 -0.228) 0.375 14.506 ( -0.369 -0.000 1.185) 1.241 15.106 ( 0.434 0.000 2.372) 2.412 16.008 ( -0.591 -0.000 -0.344) 0.683 16.092 ( -2.789 -0.000 8.169) 8.632 16.132 ( 2.771 0.000 1.323) 3.071 16.206 ( -0.119 -0.000 -7.518) 7.519 16.209 ( -3.572 -0.000 -1.823) 4.010 16.932 ( 1.358 0.000 0.688) 1.522 17.670 ( 4.069 0.000 0.082) 4.070 17.801 ( -2.984 -0.000 -3.916) 4.924 17.947 ( 0.815 0.000 -0.554) 0.986 18.408 ( 1.584 0.000 0.487) 1.657 18.916 ( 17.227 0.000 0.982) 17.255 19.192 ( -10.347 -0.000 -2.523) 10.650 19.290 ( -4.533 -0.000 1.958) 4.938 20.533 ( -3.219 -0.000 -1.259) 3.456 27.771 ( -0.277 -0.000 -1.202) 1.233 28.446 ( -4.546 -0.000 -0.923) 4.639 29.228 ( 0.426 0.000 -0.245) 0.491 29.416 ( -2.122 -0.000 -2.586) 3.345 29.591 ( -1.027 -0.000 -1.872) 2.135 29.631 ( -0.279 -0.000 -0.067) 0.287 29.737 ( 0.103 0.000 0.285) 0.302 30.366 ( 1.703 0.000 2.538) 3.056 30.598 ( 4.199 0.000 1.730) 4.542 30.752 ( -5.270 -0.000 -2.991) 6.059 31.578 ( -2.929 -0.000 2.112) 3.611 31.958 ( -0.314 -0.000 -0.052) 0.319 32.116 ( 0.273 0.000 0.312) 0.415 32.263 ( 5.532 0.000 -5.121) 7.538 32.543 ( -3.944 -0.000 -1.015) 4.072 35.605 ( 6.232 0.000 7.568) 9.804 ======================= Grid point 41 (25/160) ======================= q-point: ( 0.56 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( -0.000 -47.772 -0.000) 47.772 2.514 ( 0.000 2.072 0.000) 2.072 2.629 ( -0.000 -13.143 -0.000) 13.143 2.832 ( -0.000 -54.237 -0.000) 54.237 2.932 ( -0.000 -28.926 -0.000) 28.926 3.146 ( -0.000 -6.953 -0.000) 6.953 3.367 ( -0.000 -9.177 -0.000) 9.177 3.388 ( -0.000 -14.335 -0.000) 14.335 3.456 ( 0.000 8.126 0.000) 8.126 3.497 ( 0.000 0.381 0.000) 0.381 3.758 ( -0.000 -40.297 -0.000) 40.297 3.908 ( -0.000 -19.678 -0.000) 19.678 4.304 ( -0.000 -25.556 -0.000) 25.556 4.717 ( -0.000 -4.195 -0.000) 4.195 4.927 ( 0.000 1.902 0.000) 1.902 5.374 ( -0.000 -1.349 -0.000) 1.349 5.571 ( 0.000 0.403 0.000) 0.403 5.638 ( 0.000 4.243 0.000) 4.243 6.130 ( 0.000 2.174 0.000) 2.174 6.337 ( -0.000 -0.940 -0.000) 0.940 6.372 ( -0.000 -2.333 -0.000) 2.333 6.663 ( 0.000 3.813 0.000) 3.813 6.703 ( 0.000 9.300 0.000) 9.300 6.977 ( 0.000 3.374 0.000) 3.374 7.094 ( 0.000 1.039 0.000) 1.039 7.284 ( 0.000 4.653 0.000) 4.653 7.847 ( -0.000 -3.679 -0.000) 3.679 8.283 ( 0.000 0.019 0.000) 0.019 8.316 ( 0.000 1.727 0.000) 1.727 8.544 ( -0.000 -3.250 -0.000) 3.250 8.550 ( -0.000 -5.162 -0.000) 5.162 9.257 ( 0.000 7.787 0.000) 7.787 9.332 ( -0.000 -5.371 -0.000) 5.371 9.641 ( 0.000 3.637 0.000) 3.637 9.672 ( -0.000 -4.279 -0.000) 4.279 9.872 ( -0.000 -12.979 -0.000) 12.979 10.135 ( -0.000 -3.834 -0.000) 3.834 10.188 ( -0.000 -21.772 -0.000) 21.772 10.480 ( 0.000 1.319 0.000) 1.319 11.173 ( 0.000 3.002 0.000) 3.002 11.329 ( 0.000 4.396 0.000) 4.396 11.802 ( 0.000 5.398 0.000) 5.398 12.422 ( 0.000 0.340 0.000) 0.340 12.919 ( -0.000 -1.119 -0.000) 1.119 13.512 ( -0.000 -0.563 -0.000) 0.563 13.764 ( 0.000 1.511 0.000) 1.511 14.507 ( 0.000 0.321 0.000) 0.321 15.103 ( 0.000 1.487 0.000) 1.487 15.943 ( 0.000 6.524 0.000) 6.524 16.025 ( 0.000 7.988 0.000) 7.988 16.107 ( 0.000 7.286 0.000) 7.286 16.178 ( -0.000 -0.394 -0.000) 0.394 16.221 ( -0.000 -3.646 -0.000) 3.646 16.889 ( 0.000 5.885 0.000) 5.885 17.736 ( -0.000 -4.767 -0.000) 4.767 17.742 ( 0.000 2.986 0.000) 2.986 17.962 ( -0.000 -1.644 -0.000) 1.644 18.414 ( 0.000 0.134 0.000) 0.134 18.996 ( 0.000 3.677 0.000) 3.677 19.135 ( -0.000 -3.608 -0.000) 3.608 19.240 ( 0.000 4.017 0.000) 4.017 20.473 ( 0.000 4.548 0.000) 4.548 27.746 ( 0.000 2.232 0.000) 2.232 28.413 ( 0.000 1.144 0.000) 1.144 29.233 ( -0.000 -0.253 -0.000) 0.253 29.292 ( 0.000 5.290 0.000) 5.290 29.573 ( 0.000 0.592 0.000) 0.592 29.710 ( 0.000 3.081 0.000) 3.081 29.851 ( -0.000 -16.490 -0.000) 16.490 30.392 ( -0.000 -0.294 -0.000) 0.294 30.598 ( 0.000 3.593 0.000) 3.593 30.690 ( 0.000 2.467 0.000) 2.467 31.483 ( 0.000 6.029 0.000) 6.029 31.794 ( 0.000 18.879 0.000) 18.879 31.859 ( 0.000 5.496 0.000) 5.496 32.693 ( -0.000 -30.291 -0.000) 30.291 32.882 ( -0.000 -33.180 -0.000) 33.180 35.701 ( -0.000 -5.336 -0.000) 5.336 ======================= Grid point 83 (26/160) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.540 ( -2.808 -0.000 28.562) 28.699 0.565 ( -9.927 -0.000 30.170) 31.762 1.203 ( 18.031 0.000 62.702) 65.243 1.883 ( -6.965 -0.000 7.396) 10.159 2.106 ( 6.928 0.000 5.962) 9.140 2.758 ( -1.209 -0.000 0.751) 1.423 3.274 ( 1.814 0.000 -10.727) 10.880 3.289 ( 0.225 0.000 -7.097) 7.101 3.365 ( 0.372 0.000 -7.707) 7.716 3.561 ( -1.847 -0.000 -12.576) 12.710 3.970 ( -4.761 -0.000 10.689) 11.701 4.556 ( 4.119 0.000 -0.899) 4.216 4.643 ( -14.352 -0.000 -2.225) 14.523 4.670 ( -2.129 -0.000 -0.095) 2.131 5.099 ( 4.531 0.000 -2.957) 5.411 5.589 ( -4.896 -0.000 3.104) 5.797 5.750 ( -1.345 -0.000 -13.326) 13.393 5.791 ( 2.489 0.000 3.013) 3.908 6.045 ( 43.972 0.000 -9.171) 44.918 6.228 ( -0.781 -0.000 1.823) 1.983 6.349 ( 18.970 0.000 -2.058) 19.081 6.478 ( -5.805 -0.000 -0.612) 5.837 7.043 ( 5.791 0.000 -5.709) 8.132 7.067 ( 5.939 0.000 5.579) 8.148 7.450 ( 1.497 0.000 -3.602) 3.901 7.477 ( -2.331 -0.000 3.600) 4.289 7.668 ( 6.418 0.000 2.696) 6.961 7.965 ( -6.804 -0.000 -0.743) 6.844 8.156 ( 0.192 0.000 -0.953) 0.972 8.733 ( -9.251 -0.000 5.805) 10.922 8.836 ( 5.860 0.000 -2.438) 6.347 9.150 ( -3.697 -0.000 -5.475) 6.606 9.334 ( 1.276 0.000 0.764) 1.487 9.564 ( -1.771 -0.000 10.426) 10.576 9.576 ( -4.019 -0.000 -3.413) 5.273 9.748 ( 4.596 0.000 4.842) 6.676 9.866 ( 0.608 0.000 -1.678) 1.785 10.023 ( -1.031 -0.000 -5.627) 5.721 10.595 ( 1.865 0.000 2.753) 3.325 11.107 ( -5.160 -0.000 -6.092) 7.984 11.514 ( 5.672 0.000 2.235) 6.096 11.578 ( -2.585 -0.000 4.680) 5.347 12.672 ( 0.795 0.000 -0.495) 0.936 13.219 ( -0.124 -0.000 0.612) 0.624 13.621 ( -8.560 -0.000 -4.417) 9.633 13.921 ( -18.587 -0.000 1.557) 18.652 14.470 ( -2.435 -0.000 2.856) 3.753 15.365 ( -16.335 -0.000 -0.969) 16.363 15.994 ( 0.314 0.000 0.265) 0.411 16.098 ( 1.291 0.000 -7.959) 8.063 16.232 ( -1.167 -0.000 -4.591) 4.737 16.422 ( -13.575 -0.000 0.914) 13.605 16.459 ( 1.658 0.000 3.909) 4.246 16.621 ( -0.894 -0.000 0.007) 0.894 17.383 ( 8.070 0.000 2.409) 8.422 17.701 ( -1.474 -0.000 1.628) 2.196 18.059 ( 15.068 0.000 -4.407) 15.700 18.278 ( 4.553 0.000 -7.656) 8.908 18.589 ( 12.053 0.000 4.247) 12.780 18.936 ( 3.819 0.000 0.719) 3.886 19.766 ( 3.431 0.000 3.047) 4.589 20.388 ( 5.800 0.000 8.239) 10.076 28.005 ( 12.476 0.000 -14.906) 19.438 28.639 ( 20.637 0.000 16.932) 26.694 29.412 ( 26.203 0.000 -3.313) 26.412 29.543 ( 24.801 0.000 3.231) 25.010 29.684 ( -0.631 -0.000 0.229) 0.671 29.690 ( 0.622 0.000 0.240) 0.667 29.754 ( 0.379 0.000 -2.500) 2.528 30.089 ( -0.145 -0.000 -0.339) 0.369 30.250 ( -2.474 -0.000 0.986) 2.663 30.735 ( 38.634 0.000 2.057) 38.689 31.033 ( -0.239 -0.000 -0.324) 0.402 32.020 ( -0.397 -0.000 0.255) 0.472 32.042 ( 0.446 0.000 0.131) 0.465 32.603 ( -16.837 -0.000 -21.407) 27.235 33.571 ( 25.375 0.000 19.006) 31.704 34.679 (-109.885 -0.000 -1.479) 109.895 ======================= Grid point 84 (27/160) ======================= q-point: ( 0.11 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( 9.610 -15.917 22.371) 29.089 1.529 ( 15.274 -39.333 28.200) 50.750 2.120 ( 14.833 -47.809 37.193) 62.362 2.278 ( -6.968 -35.301 3.575) 36.159 2.602 ( 8.131 -35.101 4.322) 36.289 2.869 ( -0.417 -14.051 1.876) 14.181 3.211 ( -0.439 -6.885 -17.137) 18.474 3.401 ( -0.920 -15.404 -8.106) 17.431 3.530 ( -0.670 -18.357 0.276) 18.371 3.642 ( 3.693 -22.769 -7.506) 24.257 4.200 ( -7.088 -23.678 6.683) 25.604 4.480 ( -15.149 -1.657 -6.717) 16.654 4.636 ( -4.084 -3.709 -1.156) 5.637 4.694 ( -1.084 -11.113 -2.510) 11.444 5.140 ( 2.933 -6.931 -4.696) 8.871 5.482 ( -2.417 7.582 -8.314) 11.509 5.596 ( -4.827 3.070 -6.462) 8.630 5.844 ( 0.630 -0.827 3.950) 4.084 6.048 ( 16.771 8.326 -4.536) 19.265 6.200 ( 3.912 5.965 1.545) 7.299 6.311 ( 1.975 10.903 1.041) 11.129 6.521 ( 3.093 -3.303 0.573) 4.561 6.943 ( 9.937 12.106 -6.920) 17.122 7.143 ( 6.947 3.594 5.416) 9.514 7.363 ( 5.186 7.711 2.679) 9.671 7.490 ( -4.376 2.341 -0.032) 4.963 7.796 ( 4.503 -8.427 0.689) 9.579 7.924 ( -9.095 -3.724 -1.902) 10.010 8.229 ( 1.927 -6.729 -2.301) 7.368 8.581 ( -10.250 5.768 2.271) 11.979 8.782 ( 1.442 4.719 4.085) 6.406 9.166 ( 6.463 -1.533 3.017) 7.295 9.262 ( -2.684 1.619 -0.128) 3.138 9.482 ( 0.279 1.946 0.305) 1.990 9.668 ( -3.867 -11.476 3.621) 12.640 9.886 ( 3.763 -7.503 5.173) 9.860 10.016 ( -0.782 -5.191 -3.928) 6.556 10.497 ( 6.291 -22.246 -19.074) 29.971 10.710 ( -1.739 -21.097 -12.429) 24.548 10.999 ( -5.492 1.228 -5.798) 8.080 11.512 ( 0.886 4.475 0.727) 4.619 11.589 ( 2.035 3.018 5.469) 6.570 12.673 ( -0.745 -0.072 -0.299) 0.805 13.143 ( -22.996 -0.349 5.745) 23.705 13.491 ( 0.897 4.511 -2.569) 5.268 13.882 ( -5.719 -2.338 2.825) 6.794 14.474 ( -2.966 -0.550 3.284) 4.459 15.205 ( -13.782 1.811 2.958) 14.212 15.917 ( 1.024 13.458 4.427) 14.205 15.988 ( 0.704 1.935 6.094) 6.432 16.109 ( -1.915 8.291 -5.690) 10.236 16.361 ( -2.668 -1.385 -2.483) 3.899 16.439 ( -3.736 5.448 4.579) 8.037 16.594 ( -0.015 4.794 1.008) 4.898 17.472 ( 6.191 -1.607 0.205) 6.400 17.692 ( 0.434 0.820 1.404) 1.683 18.025 ( 2.790 3.289 -6.554) 7.846 18.272 ( 6.275 -1.315 -7.836) 10.125 18.699 ( 9.129 2.073 0.505) 9.375 19.044 ( 14.347 -3.545 -0.251) 14.780 19.488 ( -2.340 23.342 10.395) 25.659 20.454 ( 3.779 3.676 9.706) 11.045 27.804 ( 4.739 13.073 -4.195) 14.524 28.561 ( 3.452 13.411 18.157) 22.835 29.311 ( 3.012 7.064 0.102) 7.681 29.431 ( -2.458 0.715 -2.604) 3.651 29.663 ( 1.571 2.868 -0.550) 3.317 29.737 ( 0.590 0.753 -2.109) 2.315 30.063 ( 0.672 1.092 -0.458) 1.361 30.171 ( 1.811 3.126 0.722) 3.684 30.363 ( 1.609 -13.928 -1.290) 14.080 30.866 ( 12.183 11.303 1.480) 16.685 31.100 ( 10.633 -5.736 -3.552) 12.593 31.910 ( -2.918 10.364 1.894) 10.932 32.236 ( -8.033 -8.688 -4.490) 12.656 32.732 ( 9.946 -33.807 -30.294) 46.471 33.951 ( 8.043 -9.422 14.741) 19.255 34.728 ( -49.255 -62.957 -20.208) 82.450 ======================= Grid point 85 (28/160) ======================= q-point: ( 0.22 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 15.632 -20.794 17.963) 31.614 2.360 ( 24.635 -15.999 35.988) 46.454 2.540 ( -1.448 -4.325 -11.227) 12.118 3.001 ( 3.761 -16.408 -10.725) 19.960 3.105 ( -1.241 -29.444 1.438) 29.505 3.461 ( 2.569 -28.882 9.821) 30.614 3.492 ( -0.567 -38.013 5.969) 38.483 3.733 ( 1.029 -29.371 -0.175) 29.390 3.864 ( -0.144 -20.429 4.876) 21.003 4.051 ( -4.452 -19.199 -5.259) 20.398 4.318 ( -11.461 -9.740 -10.987) 18.626 4.537 ( 2.026 -9.336 -2.226) 9.809 4.728 ( -8.834 -12.237 -5.232) 15.973 5.058 ( -7.000 -32.313 0.659) 33.070 5.263 ( 2.371 2.273 -8.463) 9.078 5.381 ( 5.453 -15.206 -1.332) 16.209 5.513 ( -6.591 -7.960 -6.880) 12.415 5.876 ( 3.868 1.305 3.518) 5.389 6.095 ( 8.292 -3.693 0.886) 9.121 6.133 ( 1.480 1.033 -4.964) 5.282 6.193 ( -2.924 2.654 5.047) 6.408 6.494 ( -0.788 5.728 -3.932) 6.992 6.838 ( 15.889 8.416 -1.910) 18.081 7.124 ( -0.979 4.184 3.370) 5.461 7.317 ( 2.305 5.918 7.292) 9.670 7.407 ( -3.132 1.845 -0.664) 3.695 7.893 ( -6.478 -7.000 -9.339) 13.348 7.986 ( 0.738 -5.384 5.758) 7.917 8.337 ( 3.805 -4.505 -1.883) 6.190 8.478 ( -4.360 -0.423 -0.244) 4.387 8.761 ( 0.082 2.315 5.156) 5.653 9.213 ( -5.318 -3.006 -4.455) 7.561 9.315 ( 5.861 -3.821 4.750) 8.456 9.464 ( 0.059 -1.508 -3.568) 3.874 9.841 ( -1.560 -5.071 3.475) 6.342 10.059 ( -0.313 -5.749 3.989) 7.004 10.168 ( 0.671 -15.202 2.059) 15.356 10.587 ( 4.234 -0.946 -3.528) 5.591 10.825 ( -3.670 -2.927 -10.248) 11.272 10.981 ( -0.512 -9.462 -17.019) 19.479 11.421 ( -0.934 5.812 0.316) 5.895 11.567 ( 2.287 5.208 2.053) 6.047 12.641 ( -5.320 1.589 -0.166) 5.554 12.996 ( -14.086 4.438 8.637) 17.109 13.470 ( 6.468 0.792 -1.200) 6.626 13.881 ( -4.292 -0.396 0.089) 4.311 14.486 ( -1.892 -0.252 3.280) 3.795 15.129 ( -7.636 1.070 3.793) 8.593 15.696 ( 3.791 18.253 3.418) 18.953 15.866 ( -2.132 10.268 -4.528) 11.423 16.048 ( 3.380 1.301 6.081) 7.078 16.263 ( -7.104 8.492 -0.848) 11.104 16.388 ( -2.211 -0.986 2.833) 3.726 16.504 ( 4.715 8.548 1.483) 9.874 17.530 ( 2.943 0.201 1.468) 3.295 17.713 ( -0.456 -3.261 -0.358) 3.312 17.993 ( 4.875 -1.939 -6.583) 8.418 18.295 ( 3.749 -2.726 -7.227) 8.586 18.718 ( 0.971 0.051 1.169) 1.521 19.190 ( 1.567 10.742 0.023) 10.856 19.242 ( 5.063 -2.188 3.986) 6.805 20.474 ( 0.801 3.835 8.023) 8.928 27.648 ( 2.108 6.878 -1.431) 7.335 28.527 ( 0.615 5.941 9.900) 11.562 29.266 ( -0.338 0.014 -0.471) 0.580 29.360 ( -5.231 1.077 -3.117) 6.184 29.626 ( 2.762 2.863 -1.252) 4.170 29.699 ( -1.152 1.289 -1.737) 2.451 30.022 ( 4.402 5.720 -0.106) 7.218 30.112 ( 1.044 5.792 3.300) 6.747 30.488 ( -0.717 -1.645 2.677) 3.223 30.777 ( 1.084 6.054 0.601) 6.180 31.224 ( 6.227 -2.369 -1.546) 6.840 31.727 ( -4.912 8.890 4.219) 10.998 32.291 ( -11.728 -13.790 -4.803) 18.729 33.170 ( 9.850 -27.211 -15.534) 32.844 34.290 ( 1.027 -17.528 5.834) 18.502 35.194 ( -16.619 -38.756 -18.557) 46.071 ======================= Grid point 86 (29/160) ======================= q-point: ( 0.33 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( 16.900 -16.679 13.297) 27.215 2.438 ( -0.316 1.679 -10.994) 11.126 2.979 ( 16.080 -10.321 21.828) 29.009 3.249 ( 4.631 -14.330 1.187) 15.107 3.452 ( -0.133 -14.293 -1.145) 14.339 3.757 ( -5.344 -14.625 5.990) 16.683 3.886 ( -9.967 -5.353 -8.627) 14.228 4.006 ( -4.269 -3.417 -4.435) 7.041 4.108 ( -3.077 -17.430 0.740) 17.715 4.351 ( -2.590 -17.733 -2.811) 18.141 4.516 ( -3.011 -12.986 -2.434) 13.551 4.605 ( 6.121 -7.273 -2.253) 9.770 4.863 ( 0.250 6.903 -2.690) 7.413 5.119 ( 4.889 -14.395 -2.594) 15.422 5.456 ( 2.083 -0.288 -1.385) 2.518 5.592 ( -2.683 -6.987 1.767) 7.690 5.694 ( -2.489 -10.125 -0.044) 10.427 5.939 ( 2.175 -4.292 0.356) 4.825 6.178 ( 2.940 -2.568 4.176) 5.716 6.220 ( -1.598 -14.271 -5.533) 15.389 6.442 ( -1.575 -25.409 -3.278) 25.668 6.516 ( 1.941 -15.486 1.576) 15.686 6.797 ( 5.692 1.837 -2.894) 6.645 7.067 ( -1.696 3.010 -0.377) 3.476 7.324 ( -1.418 -0.433 6.125) 6.302 7.384 ( -0.141 1.054 4.192) 4.325 7.875 ( -7.436 -5.314 -8.603) 12.551 8.090 ( 1.105 -1.791 4.601) 5.060 8.400 ( 2.329 -2.668 -0.689) 3.608 8.540 ( 2.318 -4.305 1.551) 5.129 8.799 ( 3.750 -2.256 4.997) 6.642 9.158 ( -6.589 -1.249 -9.038) 11.255 9.415 ( 0.315 -2.284 -0.890) 2.472 9.532 ( 2.235 -6.871 -0.394) 7.236 9.854 ( 3.619 2.810 1.033) 4.697 10.172 ( -4.810 -2.425 8.497) 10.061 10.438 ( -0.714 -12.120 1.428) 12.224 10.609 ( 2.298 -1.400 -2.911) 3.964 10.775 ( -1.963 -1.384 -3.555) 4.290 10.921 ( 1.469 2.855 -10.771) 11.240 11.336 ( -1.691 2.142 -2.301) 3.569 11.479 ( 1.744 6.799 -1.519) 7.182 12.524 ( -7.146 6.155 2.157) 9.675 12.924 ( -1.760 3.983 7.001) 8.245 13.526 ( 4.695 -2.244 -0.537) 5.232 13.825 ( -4.785 1.918 -1.294) 5.315 14.494 ( -1.115 0.437 2.478) 2.753 15.043 ( -3.785 8.137 3.201) 9.528 15.493 ( 1.338 6.998 1.251) 7.234 15.700 ( 1.052 5.816 -1.836) 6.189 16.025 ( -7.559 10.142 -0.971) 12.686 16.080 ( 3.468 2.685 2.590) 5.093 16.408 ( 5.683 7.686 -1.570) 9.686 16.423 ( -3.171 -1.506 5.253) 6.318 17.537 ( 0.289 1.318 1.368) 1.921 17.786 ( 0.157 -5.374 -0.628) 5.412 18.058 ( 6.999 -4.472 -5.191) 9.795 18.319 ( 2.850 -2.961 -6.230) 7.464 18.747 ( -1.047 -2.161 2.046) 3.154 18.986 ( -6.484 9.315 4.032) 12.044 19.395 ( 8.538 -4.719 -1.828) 9.925 20.451 ( -1.716 3.902 4.456) 6.166 27.572 ( 1.457 3.333 -0.460) 3.667 28.494 ( -1.217 3.514 3.409) 5.045 29.280 ( -4.217 0.120 -0.361) 4.235 29.299 ( 0.213 -2.882 -1.284) 3.162 29.586 ( 2.480 2.958 -2.097) 4.393 29.670 ( -0.866 -0.117 -0.932) 1.278 29.923 ( 0.715 9.305 0.847) 9.371 30.047 ( 2.575 6.024 2.740) 7.101 30.513 ( 0.189 -1.121 2.204) 2.480 30.688 ( -1.499 3.827 -1.554) 4.394 31.251 ( 4.531 2.473 -1.658) 5.422 31.612 ( -5.953 4.305 6.516) 9.820 32.435 ( -7.951 -14.489 -2.320) 16.689 33.560 ( 4.215 -20.874 -6.000) 22.124 34.594 ( -2.475 -16.762 -3.440) 17.290 35.514 ( -1.331 -19.532 -6.273) 20.558 ======================= Grid point 87 (30/160) ======================= q-point: ( 0.44 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( 8.448 7.437 -15.704) 19.320 2.589 ( 0.746 -11.270 19.084) 22.176 3.131 ( -10.123 4.495 -8.400) 13.901 3.440 ( -3.130 -7.314 1.946) 8.190 3.605 ( -1.437 -3.582 0.405) 3.881 3.895 ( 4.157 -7.813 -1.444) 8.967 3.940 ( 3.795 -0.041 6.793) 7.781 4.072 ( -0.296 -13.230 1.782) 13.353 4.346 ( 0.722 -5.210 2.032) 5.638 4.430 ( 0.306 2.915 0.914) 3.070 4.530 ( -1.990 -0.687 0.380) 2.139 4.719 ( 2.320 4.464 0.293) 5.039 4.818 ( 7.197 -10.679 -7.468) 14.887 5.352 ( 0.220 -5.904 0.316) 5.916 5.360 ( 2.212 4.906 -7.665) 9.366 5.535 ( -2.637 9.946 6.264) 12.046 5.742 ( 1.917 -0.251 -3.010) 3.577 6.077 ( -3.034 -9.199 3.123) 10.177 6.217 ( -2.741 1.511 -3.755) 4.889 6.473 ( 3.077 -8.497 3.560) 9.713 6.622 ( -2.365 -8.430 0.360) 8.763 6.847 ( -0.902 -11.504 -5.070) 12.604 6.910 ( 1.378 -4.766 -6.298) 8.017 7.074 ( 1.869 -7.315 4.982) 9.046 7.322 ( -4.128 0.871 -0.429) 4.240 7.421 ( -2.416 1.256 9.587) 9.966 7.840 ( -4.287 -3.921 -9.930) 11.504 8.148 ( 2.304 0.274 5.719) 6.171 8.472 ( 2.602 -3.134 0.247) 4.081 8.582 ( -1.573 1.423 2.888) 3.583 8.949 ( 0.160 1.104 -0.236) 1.140 9.088 ( 7.373 -7.443 -3.996) 11.213 9.402 ( -2.091 0.089 -1.988) 2.886 9.625 ( 3.904 -0.405 -3.162) 5.040 9.918 ( 3.861 -4.514 -0.434) 5.956 10.102 ( -8.347 11.905 7.928) 16.561 10.510 ( 0.997 -0.175 -1.484) 1.796 10.627 ( -0.621 -5.925 -4.997) 7.776 10.840 ( 1.434 -7.195 2.845) 7.868 10.882 ( 0.253 1.696 0.822) 1.902 11.281 ( -4.148 -3.447 -4.776) 7.204 11.399 ( 4.003 2.945 -0.841) 5.041 12.379 ( -4.454 7.349 2.105) 8.847 12.889 ( 0.041 4.231 2.536) 4.933 13.589 ( 1.213 -2.001 -1.063) 2.570 13.743 ( -2.689 1.625 -1.858) 3.650 14.487 ( -1.121 0.907 1.180) 1.863 14.891 ( 0.269 7.286 0.848) 7.340 15.485 ( -0.433 -0.538 1.576) 1.721 15.665 ( 2.005 -0.832 1.280) 2.520 15.823 ( -4.829 4.477 -1.416) 6.735 16.070 ( 3.343 3.555 1.204) 5.026 16.300 ( 5.155 7.702 -3.804) 10.019 16.460 ( -5.260 -2.737 3.561) 6.917 17.520 ( -1.207 0.845 0.333) 1.511 17.864 ( 0.584 -3.196 0.418) 3.276 18.157 ( 5.340 -3.875 -2.886) 7.201 18.359 ( 4.351 -3.381 -4.882) 7.362 18.768 ( -6.714 -0.239 0.216) 6.721 18.876 ( 0.650 3.744 9.393) 10.132 19.499 ( 3.520 -3.232 -1.591) 5.037 20.383 ( -3.416 3.399 0.105) 4.820 27.545 ( 1.276 1.351 0.341) 1.890 28.438 ( -1.881 2.431 -1.293) 3.334 29.243 ( -0.835 0.309 -1.026) 1.359 29.385 ( -0.128 -4.641 2.892) 5.470 29.558 ( 2.234 -0.541 -2.673) 3.526 29.670 ( -0.036 -0.774 -0.598) 0.979 29.765 ( -1.213 8.423 0.944) 8.562 29.987 ( 1.815 4.507 0.146) 4.861 30.578 ( 1.587 -3.514 2.058) 4.370 30.602 ( -2.285 3.111 -2.039) 4.366 31.220 ( 3.205 2.295 -2.664) 4.757 31.566 ( -6.191 1.562 7.131) 9.572 32.572 ( -2.257 -6.739 0.094) 7.108 33.824 ( -0.386 -10.588 -0.002) 10.595 34.719 ( -7.741 -8.133 -10.491) 15.366 35.760 ( 11.166 -6.299 3.778) 13.365 ======================= Grid point 88 (31/160) ======================= q-point: (-0.44 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.942 ( 1.682 14.191 -11.739) 18.494 2.577 ( -26.682 11.054 -15.265) 32.667 2.962 ( 3.100 0.833 14.257) 14.614 3.474 ( -3.534 1.288 -5.323) 6.517 3.630 ( -1.972 1.530 6.393) 6.863 3.823 ( 2.171 5.349 -5.990) 8.318 4.107 ( 3.629 2.377 5.341) 6.881 4.250 ( 6.378 16.045 13.365) 21.834 4.317 ( 0.413 11.988 0.309) 11.999 4.411 ( 5.561 -17.013 -0.274) 17.901 4.590 ( 2.015 0.824 1.813) 2.833 4.721 ( 0.709 -3.822 0.266) 3.896 4.976 ( 4.986 -1.578 -1.009) 5.326 5.228 ( 2.452 1.981 -6.392) 7.127 5.360 ( -5.296 3.683 4.029) 7.605 5.491 ( -1.005 -2.508 -2.060) 3.397 5.715 ( 1.883 2.070 -3.490) 4.473 6.086 ( -1.503 4.240 -6.946) 8.276 6.190 ( -1.828 -2.191 6.406) 7.013 6.506 ( -3.589 8.545 3.821) 10.025 6.692 ( 2.965 1.190 1.787) 3.660 6.794 ( 2.084 6.877 -8.943) 11.472 6.871 ( -1.679 8.830 -1.859) 9.178 7.163 ( -6.990 0.742 1.132) 7.120 7.227 ( -5.307 6.707 1.131) 8.627 7.416 ( -2.847 1.217 4.394) 5.375 7.779 ( 4.284 2.189 -9.888) 10.997 8.209 ( 4.815 1.567 6.361) 8.130 8.529 ( -2.552 1.757 0.233) 3.107 8.546 ( -0.197 -1.649 1.272) 2.092 8.805 ( -1.907 8.288 1.649) 8.663 9.329 ( 13.379 -0.907 0.831) 13.436 9.430 ( -2.285 -6.807 0.720) 7.216 9.559 ( 4.767 4.692 -10.283) 12.267 9.839 ( -6.412 12.462 2.502) 14.237 9.942 ( 1.057 1.218 0.365) 1.654 10.589 ( -0.665 -5.091 1.901) 5.475 10.717 ( -0.208 9.493 -2.201) 9.747 10.774 ( -0.348 -5.286 0.651) 5.338 11.007 ( 1.938 -6.595 4.976) 8.486 11.404 ( 2.678 -0.805 1.875) 3.366 11.485 ( 2.439 -24.041 -1.829) 24.233 12.230 ( -3.423 6.878 -1.390) 7.808 12.818 ( -0.479 4.182 -1.259) 4.393 13.562 ( -5.442 0.709 -2.067) 5.864 13.740 ( 3.505 -1.473 -1.931) 4.264 14.466 ( -0.655 1.123 0.485) 1.388 14.841 ( 2.025 0.688 -0.821) 2.291 15.472 ( -0.558 0.447 0.787) 1.064 15.729 ( -1.440 -3.841 2.515) 4.812 15.860 ( 3.298 -7.901 1.406) 8.676 16.020 ( 2.335 6.326 1.351) 6.877 16.206 ( 2.830 1.681 -6.413) 7.208 16.479 ( -5.755 -2.506 1.907) 6.560 17.499 ( -1.990 0.066 -0.054) 1.992 17.898 ( 1.002 0.688 1.126) 1.657 18.205 ( 1.240 -0.079 -0.753) 1.453 18.423 ( 4.258 -2.673 -3.827) 6.319 18.706 ( -6.334 -0.236 2.025) 6.654 18.952 ( 3.298 -0.403 9.173) 9.757 19.533 ( -2.861 -1.075 -0.044) 3.056 20.297 ( -3.427 1.662 -3.259) 5.013 27.546 ( 0.835 0.172 0.641) 1.066 28.370 ( -1.688 1.684 -3.671) 4.377 29.239 ( 2.519 0.236 -0.863) 2.673 29.436 ( -1.175 1.119 4.049) 4.362 29.619 ( 0.554 -4.109 -2.066) 4.632 29.669 ( 0.872 0.147 -0.382) 0.963 29.716 ( 0.595 -4.626 1.164) 4.807 29.936 ( 0.308 1.089 -2.583) 2.820 30.518 ( -2.644 2.778 -1.597) 4.154 30.662 ( 2.117 -2.438 1.445) 3.537 31.203 ( 1.587 -0.589 -2.917) 3.372 31.562 ( -5.889 -1.256 6.647) 8.968 32.608 ( 4.052 4.171 1.538) 6.015 33.899 ( -3.511 0.954 3.098) 4.778 34.589 ( -10.009 4.587 -12.889) 16.951 35.958 ( 20.701 3.293 8.550) 22.638 ======================= Grid point 89 (32/160) ======================= q-point: (-0.33 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -5.544 20.237 -6.435) 21.947 1.945 ( -29.819 19.624 -16.958) 39.520 3.061 ( 5.808 7.424 14.974) 17.693 3.311 ( -1.164 5.763 -10.723) 12.229 3.582 ( -0.144 15.150 3.538) 15.558 3.617 ( 0.405 12.889 1.497) 12.982 3.951 ( -3.085 23.603 -0.306) 23.806 4.082 ( 1.156 19.594 -0.565) 19.636 4.097 ( -3.448 7.147 6.429) 10.213 4.465 ( -1.724 22.286 0.390) 22.356 4.607 ( 0.563 3.241 5.694) 6.576 4.771 ( 5.635 -1.249 1.880) 6.070 4.988 ( 3.784 2.439 3.956) 5.993 5.142 ( 4.025 2.515 -5.827) 7.515 5.378 ( -0.783 -4.904 6.543) 8.214 5.495 ( 1.245 0.660 -8.625) 8.739 5.653 ( 4.333 14.326 1.046) 15.004 5.897 ( 3.147 12.253 -8.115) 15.030 6.167 ( 4.415 14.650 1.369) 15.362 6.295 ( -11.314 5.666 0.050) 12.653 6.586 ( -1.707 14.228 4.272) 14.954 6.601 ( -1.142 8.059 2.490) 8.511 6.708 ( -0.779 0.612 -3.241) 3.389 7.042 ( -7.005 1.556 -2.903) 7.740 7.064 ( -10.127 1.083 -5.707) 11.675 7.427 ( 1.351 -0.021 2.856) 3.160 7.738 ( 9.278 1.931 -5.789) 11.105 8.225 ( 3.096 5.204 3.214) 6.856 8.470 ( -2.534 1.075 2.244) 3.551 8.592 ( 2.603 0.184 1.789) 3.164 8.703 ( -4.048 4.718 3.846) 7.310 9.290 ( 0.903 7.553 -5.252) 9.244 9.391 ( 4.137 7.309 -0.598) 8.419 9.503 ( 2.904 5.961 -1.538) 6.807 9.756 ( 0.440 -4.165 0.236) 4.195 9.991 ( -0.056 -2.729 1.796) 3.268 10.437 ( -2.029 15.019 -1.025) 15.190 10.623 ( -1.923 1.724 0.128) 2.586 10.898 ( 2.321 -5.448 2.126) 6.293 11.181 ( 0.323 -10.104 -0.608) 10.128 11.423 ( -0.417 -0.558 1.058) 1.267 12.025 ( 17.462 -16.754 -23.928) 34.032 12.116 ( 0.295 -3.753 26.443) 26.710 12.740 ( -0.035 2.915 -2.193) 3.648 13.496 ( -7.717 -1.580 -1.665) 8.051 13.775 ( 4.959 -0.320 -3.167) 5.893 14.453 ( 0.625 0.956 0.958) 1.491 14.847 ( 0.769 -0.695 -2.218) 2.448 15.517 ( -1.186 -4.539 1.863) 5.047 15.852 ( 1.804 -8.807 2.490) 9.328 15.889 ( 2.097 4.809 -3.204) 6.147 16.080 ( 1.951 -6.625 4.051) 8.007 16.217 ( 2.403 -5.275 -3.433) 6.737 16.486 ( -5.930 -3.075 0.689) 6.715 17.487 ( -2.883 -0.794 0.273) 3.003 17.877 ( 2.353 4.351 1.365) 5.131 18.182 ( -1.528 1.954 0.293) 2.497 18.434 ( 0.844 0.159 -4.450) 4.532 18.716 ( -4.871 -3.607 1.929) 6.361 19.036 ( 2.277 0.232 5.634) 6.081 19.483 ( -11.327 1.138 2.124) 11.580 20.243 ( -1.604 -0.819 -3.332) 3.787 27.555 ( -0.188 -0.456 -0.016) 0.493 28.308 ( -1.199 0.929 -3.661) 3.963 29.256 ( 4.036 0.543 -0.532) 4.107 29.428 ( 0.374 1.260 1.993) 2.387 29.620 ( 0.304 0.188 -1.444) 1.488 29.720 ( -0.200 -3.355 0.526) 3.402 29.874 ( -0.391 -10.247 1.142) 10.318 29.938 ( -0.128 -4.345 -3.078) 5.327 30.452 ( -2.225 1.140 -1.387) 2.859 30.700 ( 1.262 0.220 0.018) 1.281 31.216 ( 0.700 -1.460 -2.389) 2.886 31.617 ( -5.243 -5.309 6.045) 9.603 32.529 ( 9.616 12.418 1.643) 15.792 33.795 ( -5.555 9.147 3.251) 11.185 34.243 ( -7.781 16.453 -12.189) 21.905 36.107 ( 28.865 10.321 9.569) 32.113 ======================= Grid point 90 (33/160) ======================= q-point: (-0.22 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( -13.411 23.265 -1.417) 26.891 1.258 ( -25.417 24.714 -3.129) 35.589 2.945 ( 5.550 24.714 8.877) 26.840 3.053 ( -3.112 23.728 -7.228) 24.999 3.166 ( -4.178 56.936 1.511) 57.109 3.283 ( -7.707 36.968 -1.316) 37.785 3.323 ( 3.013 18.564 1.849) 18.898 3.715 ( -5.501 5.631 0.912) 7.925 3.809 ( 0.190 17.488 0.267) 17.491 4.300 ( -0.961 5.626 7.469) 9.400 4.451 ( 6.002 28.500 -5.909) 29.718 4.751 ( 2.481 7.334 2.631) 8.177 4.847 ( -2.692 14.668 6.769) 16.377 5.052 ( 5.471 27.204 1.345) 27.782 5.273 ( 4.050 12.724 -3.975) 13.932 5.377 ( 9.530 3.518 -7.911) 12.876 5.574 ( -0.369 -10.206 2.455) 10.504 5.688 ( -5.575 6.014 -2.190) 8.488 5.955 ( 1.196 5.475 -3.691) 6.710 6.222 ( -13.236 -4.171 -2.742) 14.146 6.370 ( -0.561 3.692 0.983) 3.862 6.610 ( 3.208 4.770 0.214) 5.752 6.766 ( -1.288 -10.822 -0.493) 10.910 6.976 ( -3.900 -3.618 -7.968) 9.581 7.049 ( -3.745 -8.787 1.438) 9.660 7.479 ( 1.105 -2.941 1.925) 3.684 7.747 ( 6.078 3.141 -0.904) 6.902 8.150 ( -1.656 5.640 1.622) 6.098 8.456 ( -0.295 5.823 3.132) 6.618 8.569 ( -1.339 2.475 0.440) 2.848 8.653 ( -1.966 -1.314 1.368) 2.732 9.148 ( 0.677 4.723 -3.627) 5.993 9.315 ( 1.042 3.340 -0.246) 3.508 9.440 ( 3.192 3.930 1.974) 5.434 9.799 ( 2.127 3.100 1.818) 4.176 9.943 ( -2.620 8.691 -0.115) 9.078 10.216 ( -1.100 8.908 -0.237) 8.979 10.562 ( -0.375 2.193 -1.602) 2.742 11.037 ( 2.388 -6.387 1.917) 7.084 11.309 ( 2.245 -6.156 -4.755) 8.096 11.464 ( -3.760 -5.196 2.303) 6.815 11.868 ( 7.568 7.182 -31.037) 32.743 12.685 ( 4.391 -1.925 5.871) 7.580 12.715 ( 31.895 -0.189 21.619) 38.531 13.508 ( -11.146 -10.967 0.802) 15.658 13.791 ( 8.359 1.472 -1.893) 8.696 14.457 ( 1.013 0.696 1.802) 2.181 14.854 ( -0.141 -0.733 3.509) 3.587 15.571 ( -2.664 -2.253 -0.589) 3.539 15.860 ( 0.943 -2.569 -0.041) 2.737 16.081 ( 3.763 -12.280 1.786) 12.967 16.180 ( -1.074 -5.446 -1.325) 5.706 16.349 ( 5.831 -3.743 1.764) 7.150 16.514 ( -6.793 -6.395 1.394) 9.433 17.481 ( -5.853 -2.139 0.822) 6.286 17.814 ( 4.513 7.130 0.469) 8.451 18.137 ( -3.614 0.631 -0.375) 3.688 18.379 ( -0.302 1.162 -8.074) 8.163 18.745 ( -10.950 -5.845 0.192) 12.414 19.040 ( -1.644 2.074 -1.432) 3.009 19.362 ( -19.438 0.704 6.884) 20.633 20.253 ( 0.306 -2.119 0.020) 2.141 27.551 ( -1.399 -0.083 -0.456) 1.474 28.275 ( -0.039 0.088 -1.487) 1.490 29.274 ( 2.405 0.303 -0.049) 2.425 29.432 ( 2.325 0.126 -0.936) 2.510 29.622 ( 0.857 -1.392 -1.787) 2.422 29.754 ( -0.875 -1.396 -0.927) 1.891 30.011 ( -2.050 -6.486 -0.082) 6.803 30.048 ( -1.255 -9.102 0.668) 9.213 30.425 ( -0.415 0.310 -0.544) 0.751 30.686 ( 1.220 1.809 -1.531) 2.666 31.193 ( 0.593 3.718 -2.627) 4.591 31.745 ( -4.227 -9.677 4.923) 11.651 32.399 ( 12.122 13.667 0.345) 18.271 33.571 ( -8.309 10.249 -5.403) 14.257 33.782 ( 1.739 25.626 -5.226) 26.211 36.214 ( 35.833 14.094 2.458) 38.584 ======================= Grid point 91 (34/160) ======================= q-point: (-0.11 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.629 ( -12.009 20.889 14.555) 28.150 0.793 ( -9.581 20.060 31.091) 38.221 1.784 ( -11.062 86.905 13.462) 88.635 2.342 ( 1.967 47.558 6.202) 48.001 2.452 ( -5.354 37.309 -0.502) 37.695 2.855 ( -0.510 10.189 1.306) 10.285 3.307 ( 4.609 1.613 -0.720) 4.936 3.512 ( 2.045 14.272 -0.799) 14.440 3.607 ( -3.162 10.185 -11.766) 15.880 3.778 ( 1.078 27.397 -11.802) 29.850 4.121 ( -0.119 21.775 11.391) 24.575 4.635 ( -1.527 4.591 3.427) 5.929 4.682 ( 3.634 12.960 -0.195) 13.461 4.775 ( -9.248 0.953 -1.883) 9.485 5.094 ( 6.597 6.009 -0.219) 8.926 5.480 ( 16.334 -2.290 5.051) 17.250 5.615 ( -9.211 -3.609 -0.801) 9.925 5.763 ( 4.360 -5.643 -2.351) 7.508 5.851 ( -3.038 1.281 -2.438) 4.100 6.200 ( -6.635 -4.625 1.069) 8.158 6.331 ( -0.553 -0.754 -10.697) 10.738 6.553 ( 1.070 4.661 1.373) 4.975 6.932 ( 4.154 -8.072 -2.030) 9.302 7.008 ( 1.054 -5.305 -3.382) 6.379 7.255 ( 0.435 -12.849 3.536) 13.334 7.560 ( -0.608 -4.548 -0.841) 4.665 7.678 ( 1.863 9.711 3.245) 10.407 8.048 ( -3.552 4.687 0.966) 5.959 8.275 ( -2.371 10.347 -1.718) 10.754 8.624 ( -1.259 -6.785 6.756) 9.658 8.697 ( -4.540 -4.944 2.329) 7.105 9.103 ( 1.109 -0.957 -1.047) 1.801 9.286 ( -1.729 0.782 1.049) 2.168 9.441 ( 1.333 0.597 3.252) 3.565 9.727 ( -3.697 8.608 -2.002) 9.580 9.747 ( 3.924 8.222 4.125) 10.001 10.081 ( -1.269 5.424 -1.962) 5.906 10.536 ( 2.718 1.016 -3.190) 4.313 11.119 ( 1.767 3.715 -13.059) 13.692 11.223 ( 9.529 32.030 -44.041) 55.284 11.449 ( 6.580 4.556 -6.003) 10.004 11.541 ( -3.799 -4.197 3.224) 6.515 12.673 ( 0.932 0.513 -0.912) 1.401 13.108 ( 28.327 5.653 14.070) 32.130 13.637 ( -5.271 -6.390 -1.375) 8.397 13.945 ( 7.724 -8.832 3.131) 12.144 14.466 ( -0.156 0.501 2.350) 2.408 15.121 ( 19.921 -16.524 33.879) 42.634 15.600 ( 5.436 -3.364 8.850) 10.918 15.947 ( 0.254 -5.041 0.511) 5.073 16.222 ( -1.874 -6.039 -5.632) 8.467 16.335 ( 4.978 -7.467 5.194) 10.369 16.409 ( 3.012 0.366 -0.134) 3.037 16.613 ( -2.322 -5.384 4.576) 7.437 17.461 ( -15.030 -3.663 -1.035) 15.505 17.718 ( 1.890 6.042 -1.862) 6.599 18.069 ( -10.931 -0.738 -6.921) 12.959 18.291 ( 2.705 1.071 -9.241) 9.688 18.680 ( -29.803 -5.536 -5.230) 30.760 18.942 ( 1.796 3.769 -2.330) 4.781 19.370 ( -18.540 -13.783 20.447) 30.852 20.306 ( 1.095 -1.532 3.853) 4.289 27.586 ( 6.958 -3.628 11.104) 13.597 28.288 ( 2.559 -0.425 3.088) 4.033 29.276 ( -0.783 0.177 -0.548) 0.971 29.445 ( 3.438 -0.470 -2.399) 4.219 29.656 ( 0.855 -2.765 -1.008) 3.065 29.753 ( 0.306 -0.334 -2.026) 2.076 30.066 ( -0.404 -1.420 -0.658) 1.616 30.171 ( -1.552 -4.817 -1.096) 5.178 30.385 ( -0.352 7.675 -2.749) 8.161 30.621 ( 10.436 9.658 -1.839) 14.337 31.073 ( 1.270 6.609 -2.690) 7.247 31.924 ( -2.724 -10.380 2.598) 11.041 32.263 ( 9.740 13.471 -3.288) 16.945 33.147 ( -6.071 19.066 -27.535) 34.038 33.487 ( 16.701 19.920 10.862) 28.173 36.031 ( 8.742 29.980 -43.042) 53.177 ======================= Grid point 93 (35/160) ======================= q-point: ( 0.11 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( 10.669 0.000 23.354) 25.676 1.078 ( 18.002 0.000 29.220) 34.320 1.902 ( -5.820 -0.000 11.732) 13.097 2.351 ( 8.473 0.000 6.404) 10.621 2.496 ( 31.315 0.000 51.808) 60.537 2.696 ( -3.531 -0.000 -5.394) 6.447 3.043 ( 2.830 0.000 -23.173) 23.345 3.129 ( 5.845 0.000 -12.465) 13.767 3.283 ( -2.174 -0.000 -2.917) 3.638 3.562 ( 7.976 0.000 2.327) 8.309 3.969 ( -12.030 -0.000 8.125) 14.516 4.262 ( -19.056 -0.000 -8.522) 20.875 4.535 ( -9.642 -0.000 -11.350) 14.892 4.573 ( -1.507 -0.000 -0.950) 1.781 5.053 ( -2.844 -0.000 -4.335) 5.184 5.477 ( 1.829 0.000 -11.526) 11.670 5.554 ( -1.626 -0.000 -5.154) 5.405 5.851 ( -3.464 -0.000 6.219) 7.119 6.138 ( 8.026 0.000 -12.062) 14.488 6.241 ( -7.072 -0.000 -3.663) 7.965 6.373 ( 3.664 0.000 2.487) 4.428 6.739 ( 14.521 0.000 4.436) 15.184 7.045 ( 3.733 0.000 -4.925) 6.180 7.266 ( 5.758 0.000 -0.654) 5.795 7.429 ( 5.922 0.000 -6.479) 8.778 7.547 ( 4.135 0.000 2.794) 4.990 7.664 ( -5.962 -0.000 -10.350) 11.944 7.882 ( -2.766 -0.000 6.045) 6.648 8.179 ( 4.476 0.000 -0.981) 4.583 8.543 ( -13.799 -0.000 0.899) 13.828 8.840 ( -2.329 -0.000 1.292) 2.663 9.257 ( 9.377 0.000 6.007) 11.136 9.329 ( 1.417 0.000 -4.407) 4.629 9.477 ( -4.292 -0.000 -1.000) 4.407 9.711 ( 2.447 0.000 6.200) 6.665 9.820 ( -0.493 -0.000 -5.326) 5.349 9.855 ( 0.280 0.000 2.327) 2.344 9.960 ( 2.833 0.000 -2.245) 3.615 10.668 ( 2.280 0.000 0.849) 2.433 10.932 ( -5.389 -0.000 -3.169) 6.252 11.560 ( -0.502 -0.000 0.853) 0.990 11.676 ( 3.029 0.000 4.607) 5.514 12.650 ( -5.077 -0.000 0.152) 5.079 13.020 ( -19.250 -0.000 11.036) 22.189 13.516 ( 2.623 0.000 -2.429) 3.574 13.841 ( -4.789 -0.000 3.070) 5.689 14.472 ( -2.896 -0.000 4.816) 5.619 15.121 ( -10.105 -0.000 1.280) 10.185 16.009 ( 0.533 0.000 0.909) 1.054 16.068 ( -1.048 -0.000 9.988) 10.043 16.146 ( -1.317 -0.000 -4.273) 4.471 16.293 ( -0.852 -0.000 -5.274) 5.342 16.459 ( -5.493 -0.000 1.585) 5.717 16.682 ( 6.083 0.000 1.248) 6.210 17.476 ( 3.305 0.000 -1.422) 3.598 17.743 ( 4.006 0.000 1.387) 4.239 18.004 ( -2.213 -0.000 -6.509) 6.874 18.248 ( 5.118 0.000 -8.932) 10.294 18.740 ( -1.859 -0.000 -0.356) 1.893 19.134 ( 14.609 0.000 -0.809) 14.632 19.754 ( -4.656 -0.000 -3.861) 6.049 20.612 ( 4.493 0.000 6.424) 7.840 27.881 ( 2.632 0.000 -11.808) 12.098 28.830 ( -9.771 -0.000 14.925) 17.839 29.382 ( -5.414 -0.000 -3.572) 6.487 29.672 ( -0.993 -0.000 0.091) 0.997 29.686 ( -1.477 -0.000 -4.984) 5.198 29.706 ( 0.635 0.000 0.513) 0.816 29.783 ( 1.178 0.000 -5.062) 5.197 30.228 ( 0.113 0.000 1.319) 1.324 30.265 ( 13.258 0.000 -2.246) 13.447 31.013 ( -1.436 -0.000 -1.012) 1.757 31.404 ( 54.319 0.000 -26.520) 60.447 32.007 ( -1.292 -0.000 0.109) 1.297 32.061 ( 1.190 0.000 0.422) 1.262 32.068 ( -15.632 -0.000 -11.173) 19.214 33.522 ( -57.911 -0.000 19.618) 61.143 34.322 ( 23.131 0.000 23.596) 33.043 ======================= Grid point 94 (36/160) ======================= q-point: ( 0.22 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.529 ( 23.393 -8.602 27.091) 36.813 1.985 ( 10.128 -62.718 14.851) 65.244 2.282 ( -1.140 -25.849 6.298) 26.629 2.693 ( 4.460 -17.091 -6.528) 18.831 2.801 ( 3.110 -17.333 -0.704) 17.624 2.956 ( 4.615 -19.665 -6.700) 21.282 3.180 ( 15.670 -15.042 25.095) 33.189 3.294 ( 3.592 -18.537 -7.247) 20.224 3.525 ( 0.717 -25.251 1.275) 25.293 3.756 ( 12.204 -11.423 7.544) 18.339 4.001 ( -17.975 -4.298 -4.944) 19.132 4.217 ( -12.588 -25.612 3.633) 28.768 4.366 ( -10.246 -5.250 -17.389) 20.855 4.611 ( -4.772 -8.436 -2.220) 9.943 5.053 ( -5.724 -9.740 -4.411) 12.128 5.360 ( 4.592 7.302 -9.204) 12.614 5.501 ( 1.945 2.540 -2.774) 4.234 5.876 ( -6.317 -2.572 3.670) 7.745 6.054 ( 1.832 3.296 -7.435) 8.336 6.173 ( -2.183 -0.408 -3.538) 4.177 6.390 ( 7.223 7.400 4.343) 11.215 6.680 ( 5.790 14.561 1.514) 15.743 7.059 ( 10.960 3.457 -6.082) 13.002 7.168 ( -9.128 5.626 -5.014) 11.837 7.396 ( 0.432 1.159 -3.559) 3.768 7.471 ( -1.858 6.064 2.712) 6.898 7.685 ( -1.030 -6.266 -5.536) 8.425 7.946 ( 0.821 -4.532 5.421) 7.113 8.269 ( 5.961 -5.435 -1.602) 8.224 8.464 ( -5.520 1.343 3.997) 6.946 8.811 ( -3.297 0.868 1.799) 3.855 9.182 ( -2.164 7.362 -3.158) 8.298 9.369 ( 5.061 -0.023 5.660) 7.592 9.465 ( 2.409 1.984 -1.938) 3.673 9.697 ( -3.604 -8.874 7.240) 12.007 9.938 ( -0.748 -10.480 -1.816) 10.662 10.019 ( 3.499 -4.526 1.696) 5.967 10.272 ( 1.366 -31.267 -15.151) 34.771 10.648 ( -1.026 1.869 -3.320) 3.946 10.895 ( -1.352 0.605 1.921) 2.426 11.517 ( -1.329 4.640 0.341) 4.839 11.693 ( 2.622 4.126 3.034) 5.753 12.594 ( -8.546 0.104 0.473) 8.559 12.993 ( -9.328 -0.316 10.764) 14.246 13.514 ( 3.617 0.883 -2.197) 4.323 13.829 ( -4.569 -0.937 0.510) 4.692 14.493 ( -1.793 -0.297 4.701) 5.040 15.079 ( -5.366 -0.750 2.047) 5.792 15.963 ( 0.941 7.301 1.526) 7.518 16.001 ( -1.795 10.469 -3.419) 11.158 16.137 ( 1.015 0.608 8.957) 9.035 16.277 ( -0.671 -0.475 -5.763) 5.822 16.385 ( -5.755 3.118 1.072) 6.633 16.691 ( 6.058 5.801 2.012) 8.625 17.521 ( 3.385 -2.930 -1.457) 4.708 17.774 ( 4.942 3.150 3.044) 6.604 17.943 ( 0.185 -0.805 -5.699) 5.759 18.232 ( 4.112 -1.427 -8.592) 9.632 18.709 ( -3.533 -0.097 -0.211) 3.540 19.250 ( 11.238 -2.611 -3.020) 11.926 19.498 ( -6.774 17.983 2.682) 19.402 20.611 ( 0.267 5.459 5.317) 7.625 27.765 ( 2.678 6.291 -6.483) 9.422 28.729 ( -8.056 10.301 10.185) 16.575 29.300 ( -3.055 1.645 -4.662) 5.812 29.341 ( -0.701 8.936 -0.267) 8.968 29.681 ( 0.795 2.348 0.129) 2.482 29.696 ( -0.853 1.298 -3.261) 3.612 30.042 ( -2.305 -10.429 -1.385) 10.770 30.221 ( 0.997 2.618 2.925) 4.050 30.408 ( 4.706 -7.281 0.020) 8.669 30.921 ( -1.563 8.122 -1.341) 8.379 31.316 ( 18.331 10.546 -5.477) 21.846 31.885 ( -3.172 10.660 1.450) 11.217 31.966 ( -11.343 -6.872 -4.509) 14.007 32.592 ( 14.183 -37.071 -19.721) 44.321 33.605 ( -36.383 -36.716 2.522) 51.751 34.784 ( 19.421 -13.249 19.038) 30.252 ======================= Grid point 95 (37/160) ======================= q-point: ( 0.33 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.085 ( 21.136 -12.079 25.153) 35.004 2.424 ( 8.257 2.801 -11.765) 14.643 2.861 ( 7.023 -18.416 -3.224) 19.972 3.084 ( 0.506 -30.819 2.367) 30.914 3.195 ( 4.918 -14.111 11.990) 19.159 3.485 ( -3.680 -30.753 -2.468) 31.070 3.556 ( 0.994 -17.282 -0.347) 17.314 3.672 ( 0.535 -22.889 -3.613) 23.178 3.882 ( -7.350 -11.394 2.429) 13.775 3.932 ( -8.658 -15.991 -6.116) 19.185 4.184 ( 6.960 -20.892 6.836) 23.057 4.541 ( -2.558 -8.383 0.384) 8.773 4.584 ( 7.550 -31.416 -0.779) 32.320 4.923 ( -8.371 -29.893 -1.458) 31.077 5.219 ( 3.282 -2.401 -4.332) 5.941 5.291 ( -5.311 -23.918 -5.202) 25.047 5.508 ( 5.089 -3.846 1.509) 6.555 5.862 ( -10.506 -3.848 -1.476) 11.285 6.049 ( 5.904 -4.377 -1.815) 7.570 6.165 ( -0.972 -0.898 -1.760) 2.202 6.315 ( 4.787 8.728 3.686) 10.615 6.504 ( 5.792 8.357 -1.339) 10.256 6.849 ( -5.710 7.248 -9.407) 13.176 7.080 ( -1.657 2.423 -3.477) 4.550 7.350 ( -3.575 1.618 -0.496) 3.955 7.426 ( -4.491 1.544 7.787) 9.121 7.714 ( 1.005 -3.566 -7.173) 8.073 8.087 ( 3.492 -4.548 4.913) 7.551 8.380 ( 3.132 -2.535 -0.040) 4.029 8.485 ( 1.892 -4.117 1.467) 4.763 8.816 ( -1.133 -2.789 1.814) 3.515 9.060 ( -3.636 2.122 -2.698) 5.001 9.369 ( -0.136 0.549 -3.305) 3.353 9.507 ( 4.627 -0.829 3.206) 5.690 9.873 ( -2.484 -6.420 5.274) 8.672 10.092 ( 2.108 -8.032 0.497) 8.319 10.209 ( -2.541 -13.406 3.035) 13.978 10.550 ( 1.791 -5.266 -9.349) 10.878 10.623 ( -1.431 -12.237 -8.430) 14.928 10.891 ( 1.718 2.084 1.711) 3.197 11.397 ( -2.382 7.027 -0.693) 7.452 11.624 ( 1.724 7.852 1.261) 8.137 12.524 ( -7.610 0.980 0.855) 7.720 13.008 ( -3.937 1.342 8.765) 9.702 13.522 ( 2.861 -0.656 -1.988) 3.545 13.795 ( -4.243 0.539 -1.424) 4.508 14.509 ( -1.454 0.351 3.074) 3.419 15.073 ( -3.971 0.011 3.054) 5.009 15.749 ( 1.089 15.613 -0.906) 15.677 15.835 ( 1.748 9.226 0.539) 9.406 16.124 ( -6.187 9.704 -2.858) 11.858 16.173 ( 1.356 2.208 4.226) 4.957 16.359 ( -2.466 -2.378 -0.485) 3.460 16.627 ( 4.820 8.913 2.798) 10.512 17.576 ( 3.279 -0.152 -0.973) 3.424 17.765 ( 2.891 1.798 2.619) 4.295 17.985 ( 3.650 -5.437 -3.898) 7.620 18.248 ( 5.010 -2.818 -6.828) 8.926 18.702 ( -1.619 -1.899 -0.204) 2.504 19.190 ( -1.822 13.410 1.586) 13.626 19.367 ( 3.473 -3.119 1.730) 4.978 20.534 ( -3.213 5.474 2.268) 6.741 27.658 ( 2.499 5.128 -1.869) 6.003 28.572 ( -5.688 6.411 1.901) 8.778 29.252 ( -2.614 0.520 -1.630) 3.124 29.263 ( 0.234 -0.296 0.059) 0.382 29.637 ( 0.167 2.513 -2.169) 3.324 29.652 ( -1.193 0.848 -0.333) 1.501 30.069 ( 0.767 4.614 -0.117) 4.678 30.198 ( 2.985 5.369 3.736) 7.189 30.508 ( -0.286 -1.787 1.521) 2.364 30.757 ( -2.031 7.292 -1.811) 7.783 31.319 ( 7.416 1.471 -1.561) 7.720 31.707 ( -5.318 7.621 4.223) 10.208 32.046 ( -10.418 -16.473 -2.773) 19.687 33.117 ( 8.460 -29.336 -12.282) 32.909 33.984 ( -20.234 -35.007 -8.958) 41.414 35.291 ( 15.163 -15.907 13.061) 25.565 ======================= Grid point 96 (38/160) ======================= q-point: ( 0.44 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( 13.226 8.134 -14.393) 21.172 2.585 ( 6.272 -8.975 23.414) 25.848 3.027 ( -5.198 -0.380 -13.995) 14.934 3.297 ( -5.418 -9.793 6.187) 12.788 3.437 ( 2.695 -14.651 -3.604) 15.326 3.643 ( -6.913 -8.343 -7.578) 13.222 3.872 ( -1.338 -10.943 -0.835) 11.056 4.029 ( 4.731 -13.775 10.398) 17.895 4.098 ( -1.312 -16.657 4.198) 17.227 4.299 ( 3.596 -22.926 1.032) 23.229 4.489 ( 2.862 -4.824 2.313) 6.067 4.733 ( 5.941 -9.019 1.745) 10.940 4.888 ( 6.756 7.089 -0.611) 9.812 5.157 ( 1.093 -17.621 -1.266) 17.700 5.337 ( -0.777 -6.505 -8.907) 11.057 5.640 ( -5.521 -9.018 8.466) 13.545 5.691 ( 2.113 -4.094 -4.086) 6.158 5.905 ( -1.972 -7.951 1.793) 8.386 6.145 ( -11.354 -8.902 -5.333) 15.382 6.277 ( 1.414 -11.781 -1.502) 11.960 6.340 ( 7.032 -14.567 3.441) 16.537 6.573 ( 4.647 -10.994 0.110) 11.937 6.779 ( 0.368 -6.238 -5.697) 8.456 6.993 ( -4.697 -1.828 -2.213) 5.504 7.283 ( -6.422 1.472 -0.074) 6.589 7.396 ( -13.772 -1.872 3.614) 14.361 7.758 ( 9.768 -1.723 -4.683) 10.969 8.207 ( 4.016 -1.472 5.779) 7.190 8.423 ( -0.345 -2.931 -1.824) 3.470 8.590 ( 3.258 -3.380 -1.394) 4.897 8.948 ( 4.623 -10.506 2.011) 11.653 8.997 ( -1.825 2.436 0.982) 3.198 9.356 ( -0.075 -1.490 -3.617) 3.913 9.580 ( 0.894 -4.418 1.207) 4.666 9.927 ( 2.157 0.983 1.579) 2.848 10.204 ( -4.095 0.876 6.293) 7.559 10.405 ( -3.129 -11.716 -1.683) 12.243 10.521 ( -2.162 -1.775 -7.078) 7.611 10.746 ( 2.012 -4.177 -1.414) 4.847 10.904 ( 4.962 -0.601 0.458) 5.019 11.263 ( -3.410 4.448 -2.336) 6.072 11.495 ( 1.402 7.869 -0.178) 7.995 12.449 ( -5.010 3.335 1.626) 6.234 12.986 ( -2.582 4.316 4.556) 6.786 13.546 ( 0.006 -1.744 -2.012) 2.663 13.735 ( -1.544 1.189 -2.203) 2.941 14.502 ( -1.433 0.956 1.628) 2.370 15.019 ( -2.193 5.853 1.294) 6.383 15.559 ( 2.716 7.908 2.947) 8.865 15.729 ( 2.565 5.148 0.417) 5.767 15.879 ( -5.889 9.449 -3.006) 11.533 16.157 ( 2.004 2.663 0.223) 3.341 16.381 ( -2.290 -2.433 -0.157) 3.344 16.507 ( 1.883 10.784 2.313) 11.189 17.558 ( 1.472 3.014 -0.082) 3.356 17.827 ( 3.542 -3.319 0.999) 4.955 18.091 ( 3.012 -5.770 -2.140) 6.851 18.304 ( 6.155 -3.213 -4.725) 8.398 18.729 ( -0.865 -1.147 0.609) 1.560 19.036 ( -0.024 7.009 6.477) 9.543 19.448 ( 0.210 -3.473 0.405) 3.503 20.413 ( -5.364 4.994 -1.363) 7.455 27.604 ( 2.177 3.148 0.597) 3.874 28.451 ( -3.889 3.362 -2.394) 5.671 29.230 ( -0.149 -0.440 -0.818) 0.941 29.318 ( 0.827 -4.578 1.380) 4.853 29.584 ( 0.032 2.637 -0.590) 2.702 29.637 ( -1.241 -0.978 -1.263) 2.023 29.928 ( -0.952 10.663 0.006) 10.705 30.128 ( 2.801 8.214 1.962) 8.897 30.545 ( 0.519 -2.572 1.592) 3.069 30.630 ( -2.002 4.167 -2.082) 5.070 31.301 ( 4.681 4.871 -1.901) 7.018 31.611 ( -6.005 3.535 6.416) 9.472 32.287 ( -7.606 -20.518 -0.581) 21.891 33.539 ( 3.573 -21.858 -5.121) 22.732 34.277 ( -13.545 -23.532 -10.198) 29.004 35.734 ( 13.903 -13.323 8.762) 21.155 ======================= Grid point 97 (39/160) ======================= q-point: (-0.44 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 6.061 12.414 -10.929) 17.615 2.534 ( -12.970 13.868 -9.759) 21.349 3.055 ( 2.718 -5.690 14.745) 16.037 3.401 ( -4.940 -0.387 -2.109) 5.385 3.613 ( 2.146 -8.141 1.850) 8.620 3.751 ( -1.530 -8.172 -4.288) 9.355 4.048 ( -0.542 -15.750 -1.245) 15.809 4.252 ( 2.530 -4.870 2.715) 6.123 4.387 ( 1.090 -11.128 1.534) 11.286 4.490 ( 0.279 -2.565 1.812) 3.153 4.615 ( 1.038 6.217 10.087) 11.894 4.789 ( 4.490 2.664 5.336) 7.465 4.923 ( 13.034 -2.021 -4.951) 14.088 5.268 ( 1.582 3.862 -5.580) 6.967 5.335 ( -1.729 -5.932 -1.136) 6.282 5.565 ( -2.670 9.880 3.151) 10.708 5.726 ( 5.378 -1.127 -3.826) 6.696 5.949 ( -10.834 -4.809 -1.318) 11.926 6.230 ( 3.071 -3.286 3.475) 5.683 6.496 ( -3.304 -10.369 3.124) 11.322 6.684 ( 1.762 -6.169 0.586) 6.443 6.726 ( 0.588 -6.631 -9.862) 11.899 6.831 ( 0.442 -8.702 -1.572) 8.853 7.058 ( -10.099 -3.261 -1.567) 10.727 7.229 ( -6.005 -1.985 -0.517) 6.346 7.373 ( -7.192 -5.029 1.965) 8.993 7.828 ( 10.139 1.265 -1.830) 10.380 8.301 ( 4.874 -0.938 5.737) 7.586 8.457 ( -1.570 -4.963 -4.625) 6.963 8.604 ( 3.811 3.947 -0.565) 5.516 8.954 ( -2.034 4.200 6.249) 7.799 9.241 ( 9.906 -14.887 -1.873) 17.979 9.335 ( -0.998 0.055 -2.167) 2.387 9.660 ( 2.504 1.789 1.348) 3.360 9.963 ( 3.078 -1.969 -1.747) 4.050 10.022 ( -10.537 13.634 2.597) 17.425 10.513 ( 0.480 -4.625 -0.076) 4.651 10.574 ( -0.365 -10.328 -1.265) 10.411 10.892 ( 1.393 -15.443 0.661) 15.519 10.914 ( 2.643 7.258 0.119) 7.725 11.147 ( -4.376 1.083 -3.328) 5.603 11.445 ( 2.554 0.118 -0.260) 2.570 12.340 ( -3.767 7.219 2.484) 8.513 12.890 ( -1.932 5.784 -0.597) 6.127 13.524 ( -3.719 0.893 -1.717) 4.192 13.730 ( 2.799 -1.379 -1.707) 3.556 14.485 ( -0.804 1.002 1.040) 1.653 14.908 ( 0.792 5.501 -0.278) 5.564 15.510 ( -0.067 3.972 1.752) 4.342 15.691 ( -1.402 1.142 0.105) 1.811 15.783 ( 1.743 -4.122 0.501) 4.503 16.130 ( 2.014 2.108 -0.584) 2.973 16.324 ( 3.031 11.962 -0.796) 12.365 16.408 ( -5.070 -2.171 1.421) 5.695 17.522 ( 0.767 2.481 0.919) 2.755 17.910 ( 4.085 -1.922 -0.067) 4.515 18.172 ( -0.273 -3.337 -1.003) 3.495 18.376 ( 5.389 -3.206 -4.619) 7.788 18.715 ( -1.770 2.345 3.161) 4.315 19.043 ( 3.379 0.614 6.101) 7.002 19.484 ( -4.818 -1.683 1.779) 5.405 20.278 ( -4.924 3.272 -3.463) 6.852 27.586 ( 1.566 1.976 1.606) 2.989 28.360 ( -2.195 2.076 -3.457) 4.591 29.249 ( 2.728 -1.076 -0.776) 3.034 29.432 ( 0.616 -5.402 2.747) 6.092 29.547 ( -0.409 0.350 -1.123) 1.246 29.650 ( -0.943 -2.639 -0.624) 2.871 29.752 ( -0.769 7.669 -0.487) 7.723 30.009 ( 1.123 7.674 -0.664) 7.785 30.542 ( -1.434 3.240 -1.630) 3.900 30.629 ( 1.030 -4.249 1.753) 4.710 31.234 ( 3.056 4.194 -2.411) 5.721 31.567 ( -6.105 1.556 6.731) 9.219 32.545 ( -2.455 -13.443 1.057) 13.706 33.805 ( 0.097 -10.353 -1.837) 10.515 34.399 ( -9.592 -9.383 -7.051) 15.158 36.085 ( 14.160 -9.172 4.590) 17.484 ======================= Grid point 98 (40/160) ======================= q-point: (-0.33 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -2.641 18.284 -5.405) 19.248 2.082 ( -7.383 21.890 -4.716) 23.578 3.212 ( -0.802 -2.698 -5.506) 6.184 3.320 ( 0.153 4.334 8.161) 9.242 3.698 ( -3.015 3.895 5.147) 7.124 3.786 ( 0.906 -0.797 -0.686) 1.388 4.172 ( -1.462 3.725 2.179) 4.556 4.333 ( 1.430 11.584 -0.789) 11.698 4.355 ( 1.462 12.468 -2.444) 12.789 4.523 ( -0.397 -7.336 4.750) 8.748 4.618 ( 0.495 -3.851 -0.265) 3.892 4.811 ( 3.611 1.960 4.716) 6.255 4.961 ( -2.553 -2.193 -3.916) 5.164 5.256 ( 7.646 2.994 0.329) 8.218 5.375 ( -1.845 -0.999 2.606) 3.346 5.414 ( -2.696 3.442 -4.461) 6.247 5.838 ( 16.251 -3.143 2.192) 16.696 5.901 ( -7.214 0.890 -4.200) 8.394 6.300 ( -1.065 0.819 4.220) 4.428 6.520 ( -0.327 8.457 3.927) 9.331 6.573 ( -8.621 4.415 -7.997) 12.561 6.787 ( 2.567 3.165 -2.144) 4.604 6.851 ( 1.928 7.477 -0.654) 7.749 6.955 ( -8.014 0.708 -2.632) 8.465 7.089 ( -8.268 10.250 -0.472) 13.178 7.442 ( 0.023 -2.121 1.021) 2.353 7.847 ( 7.915 3.623 0.505) 8.720 8.329 ( -0.201 3.872 -0.781) 3.956 8.523 ( 4.531 -1.944 1.012) 5.033 8.565 ( 1.617 0.272 -0.230) 1.656 8.859 ( -3.907 10.578 6.046) 12.795 9.335 ( -0.294 -0.493 -3.252) 3.303 9.485 ( 7.035 -6.658 -6.498) 11.663 9.589 ( 4.815 8.782 1.798) 10.175 9.762 ( -6.223 7.211 2.761) 9.917 9.964 ( -0.483 -0.396 2.053) 2.146 10.595 ( -0.646 -3.699 0.116) 3.757 10.685 ( 0.899 14.446 -2.222) 14.643 10.789 ( -0.508 -8.882 1.740) 9.065 11.067 ( -0.308 -2.348 0.816) 2.505 11.448 ( 4.318 -31.380 -7.858) 32.636 11.457 ( 2.141 -6.791 -3.929) 8.133 12.224 ( -3.985 4.286 10.161) 11.726 12.786 ( 0.008 4.013 -1.855) 4.421 13.453 ( -3.867 2.441 -0.650) 4.619 13.775 ( 3.712 -1.855 -1.534) 4.424 14.476 ( -0.075 0.548 1.021) 1.161 14.854 ( 0.916 1.699 -0.568) 2.012 15.477 ( -0.698 -0.513 1.260) 1.529 15.725 ( -0.582 -6.169 -0.652) 6.230 15.916 ( 3.749 -4.649 -1.968) 6.288 16.114 ( 1.449 2.281 2.485) 3.671 16.172 ( -1.189 3.569 2.182) 4.349 16.415 ( -2.312 -1.457 -0.145) 2.737 17.500 ( 0.180 1.964 1.891) 2.732 17.950 ( 4.917 0.849 -1.257) 5.146 18.176 ( -3.350 0.217 -1.042) 3.515 18.407 ( 3.122 -0.694 -6.265) 7.034 18.697 ( -1.827 1.539 4.673) 5.248 19.102 ( 3.831 0.427 2.163) 4.420 19.441 ( -11.004 1.441 3.175) 11.543 20.202 ( -1.373 -0.014 -1.646) 2.143 27.578 ( 0.396 1.476 1.509) 2.148 28.299 ( -0.413 1.338 -2.058) 2.489 29.290 ( 4.421 -0.553 -0.550) 4.489 29.473 ( 0.454 2.188 1.323) 2.597 29.573 ( -2.317 -4.009 -2.665) 5.343 29.675 ( 0.615 -0.630 -0.630) 1.082 29.735 ( -0.292 -6.915 1.525) 7.087 29.910 ( 0.556 2.876 -1.591) 3.333 30.469 ( -1.219 3.132 -0.208) 3.367 30.703 ( 0.789 -1.943 0.603) 2.182 31.195 ( 2.127 0.525 -2.444) 3.282 31.563 ( -6.072 -1.342 6.812) 9.223 32.683 ( 2.028 -1.843 1.071) 2.942 33.848 ( -2.180 2.241 -3.139) 4.430 34.343 ( -4.755 5.101 -0.970) 7.040 36.329 ( 13.972 -4.786 -1.627) 14.859 ======================= Grid point 99 (41/160) ======================= q-point: (-0.22 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( 0.771 23.372 6.601) 24.299 1.638 ( -2.902 26.144 7.677) 27.402 3.070 ( -5.208 3.776 -14.722) 16.066 3.337 ( 4.258 8.408 7.034) 11.760 3.565 ( -2.457 10.080 -4.942) 11.492 3.650 ( 0.613 19.177 3.088) 19.434 3.922 ( -0.754 25.278 4.925) 25.764 4.087 ( -1.439 18.395 3.430) 18.767 4.141 ( -2.896 15.425 5.046) 16.486 4.392 ( -4.546 18.658 1.827) 19.290 4.719 ( 1.930 -5.332 -3.485) 6.656 4.751 ( -1.457 8.199 -3.803) 9.154 5.003 ( 0.116 -1.183 -0.686) 1.373 5.274 ( 6.459 -3.407 0.664) 7.332 5.336 ( -4.407 -1.573 -5.056) 6.889 5.492 ( 5.042 -4.361 4.275) 7.920 5.672 ( -0.640 21.353 1.188) 21.395 6.004 ( 16.004 10.335 -3.135) 19.308 6.088 ( -7.693 14.698 -4.725) 17.250 6.225 ( 0.014 19.417 -1.260) 19.458 6.486 ( -10.244 -8.242 -2.321) 13.351 6.574 ( -1.497 19.548 0.350) 19.608 6.768 ( 1.715 7.339 3.994) 8.530 6.852 ( -0.705 -0.905 -5.853) 5.964 6.984 ( 0.256 -2.974 6.472) 7.127 7.455 ( -0.605 -0.577 -0.621) 1.041 7.869 ( 6.778 2.902 3.906) 8.344 8.220 ( -2.134 5.141 -1.853) 5.867 8.536 ( 1.963 2.394 -0.969) 3.244 8.597 ( -1.696 1.971 -3.295) 4.197 8.675 ( -4.751 5.089 4.412) 8.242 9.247 ( 2.423 7.309 -1.676) 7.880 9.423 ( 2.634 7.894 -1.525) 8.461 9.557 ( 1.090 5.076 1.018) 5.290 9.754 ( 0.376 -6.722 0.078) 6.733 10.038 ( -0.961 -0.769 5.421) 5.559 10.404 ( 0.170 15.473 -1.099) 15.513 10.600 ( -0.618 2.025 -0.620) 2.206 10.928 ( -0.479 -6.937 -0.449) 6.968 11.162 ( 0.843 -8.942 -3.230) 9.545 11.424 ( -0.706 0.808 0.522) 1.193 11.756 ( 6.268 -4.839 -28.517) 29.596 12.562 ( -1.797 -25.890 16.232) 30.611 12.767 ( 3.788 -5.861 5.928) 9.156 13.375 ( -3.308 3.247 0.119) 4.636 13.830 ( 4.870 -1.806 -0.505) 5.218 14.477 ( -0.411 0.139 1.196) 1.273 14.867 ( 1.386 -2.069 4.128) 4.822 15.513 ( -1.686 -2.679 0.661) 3.234 15.863 ( 0.821 -9.123 -1.517) 9.285 15.900 ( 2.026 1.019 -3.542) 4.206 16.138 ( 1.487 -1.609 4.180) 4.719 16.276 ( -3.779 -10.608 5.725) 12.633 16.418 ( -0.236 -0.394 -0.668) 0.811 17.481 ( -0.782 2.043 2.392) 3.241 17.943 ( 5.362 3.543 -2.813) 7.015 18.099 ( -5.648 2.260 -3.988) 7.274 18.368 ( 4.004 2.080 -7.808) 9.018 18.675 ( -4.890 2.148 4.171) 6.776 19.106 ( 4.902 3.621 -1.353) 6.243 19.321 ( -14.615 2.457 4.632) 15.527 20.232 ( 1.607 -2.248 3.108) 4.159 27.567 ( -0.519 0.759 1.656) 1.894 28.286 ( 1.757 0.456 1.331) 2.251 29.310 ( 1.757 1.358 0.092) 2.223 29.451 ( 2.346 0.994 -1.998) 3.238 29.580 ( -0.966 -2.222 -3.066) 3.908 29.708 ( 0.047 -2.567 -1.381) 2.915 29.884 ( -1.782 -7.625 2.495) 8.218 29.923 ( 1.373 -4.948 0.038) 5.136 30.431 ( -0.221 0.814 1.454) 1.681 30.714 ( 0.497 0.789 0.103) 0.938 31.204 ( 1.808 -0.798 -2.218) 2.971 31.618 ( -5.737 -5.321 6.417) 10.120 32.653 ( 2.921 7.787 -0.451) 8.329 33.658 ( -2.094 12.710 -8.546) 15.458 34.166 ( 1.555 15.682 6.616) 17.092 36.412 ( 8.648 0.826 -15.062) 17.388 ======================= Grid point 100 (42/160) ======================= q-point: (-0.11 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( 3.189 26.677 10.259) 28.759 1.427 ( 14.568 19.369 36.579) 43.880 2.783 ( -6.947 15.802 -11.610) 20.803 3.081 ( 0.718 31.773 -2.465) 31.876 3.161 ( -2.615 29.188 -2.341) 29.398 3.259 ( 1.517 56.183 10.681) 57.210 3.434 ( 0.923 18.194 4.284) 18.714 3.648 ( 0.481 14.283 1.647) 14.385 3.830 ( -0.039 18.733 1.607) 18.802 4.249 ( -6.249 20.083 -4.971) 21.613 4.482 ( 1.815 11.879 -0.517) 12.028 4.667 ( -7.166 4.217 -9.503) 12.627 4.836 ( -1.855 14.514 2.387) 14.825 5.101 ( -1.034 32.164 0.762) 32.190 5.293 ( 3.688 8.845 -2.488) 9.901 5.440 ( 0.778 -5.806 -9.405) 11.081 5.671 ( -3.707 13.329 6.210) 15.165 5.691 ( 9.450 -3.453 10.753) 14.727 5.886 ( 7.819 2.108 -10.217) 13.037 6.093 ( -1.305 -1.221 1.229) 2.169 6.304 ( -3.697 6.359 -4.012) 8.379 6.635 ( 0.197 4.573 -1.677) 4.875 6.674 ( 1.115 -16.374 -7.625) 18.097 6.972 ( 5.708 -4.938 6.707) 10.097 7.149 ( 3.892 -7.211 7.442) 11.069 7.469 ( -2.092 -3.274 -1.166) 4.056 7.875 ( 3.512 6.433 5.365) 9.083 8.096 ( -4.072 5.624 -3.137) 7.619 8.379 ( -3.885 6.923 -5.329) 9.562 8.557 ( -1.850 -1.088 -0.123) 2.150 8.688 ( -0.707 -1.413 5.008) 5.251 9.161 ( 4.427 5.065 0.893) 6.786 9.324 ( -0.754 4.380 -1.026) 4.561 9.489 ( -0.219 2.926 0.923) 3.076 9.825 ( -0.607 2.319 1.221) 2.690 9.971 ( 0.560 10.450 5.561) 11.851 10.179 ( -0.430 10.114 -2.470) 10.420 10.561 ( 2.133 1.517 -0.925) 2.776 10.996 ( -3.247 -4.839 -5.394) 7.941 11.261 ( 4.318 -1.761 -15.644) 16.325 11.457 ( -2.160 -3.437 0.143) 4.063 11.548 ( 4.702 7.621 -16.992) 19.207 12.677 ( 0.197 -0.278 -0.903) 0.965 13.242 ( -22.428 -17.654 3.321) 28.735 13.324 ( 12.415 -2.464 2.988) 13.005 13.905 ( 1.948 -1.955 0.583) 2.821 14.479 ( -1.380 0.103 1.873) 2.328 15.082 ( 1.487 -12.331 15.223) 19.647 15.573 ( 2.504 -7.906 2.937) 8.798 15.910 ( 1.693 -1.690 3.365) 4.128 16.012 ( -2.262 -10.337 -6.106) 12.217 16.273 ( 2.545 -7.262 6.276) 9.930 16.400 ( -3.387 -1.815 -1.903) 4.289 16.475 ( -3.420 -9.032 5.474) 11.102 17.452 ( 0.437 2.794 2.778) 3.964 17.818 ( -3.852 8.477 -6.627) 11.429 18.008 ( 2.609 0.582 -5.665) 6.264 18.311 ( 6.320 2.870 -7.168) 9.978 18.629 ( 0.180 2.647 4.165) 4.938 19.051 ( 7.592 6.349 -1.729) 10.047 19.260 ( -12.494 -3.929 9.654) 16.271 20.326 ( 2.181 -2.414 6.998) 7.718 27.603 ( 1.800 -3.866 3.834) 5.735 28.339 ( 3.865 -1.269 6.934) 8.039 29.285 ( -0.670 1.133 -0.458) 1.393 29.444 ( 1.254 -0.179 -2.601) 2.893 29.607 ( 1.806 -2.898 -2.287) 4.109 29.730 ( -0.157 -1.317 -1.268) 1.835 29.981 ( 0.239 -5.568 -0.502) 5.596 30.064 ( -0.153 -7.251 2.643) 7.720 30.449 ( 0.367 0.438 2.803) 2.860 30.719 ( 2.863 -0.454 1.315) 3.183 31.182 ( 2.734 4.316 -2.407) 5.647 31.742 ( -4.773 -9.525 4.636) 11.619 32.480 ( -1.927 11.299 -2.636) 11.761 33.286 ( 2.631 20.522 -17.191) 26.900 33.987 ( 8.773 17.189 12.906) 23.216 36.063 ( -14.852 21.614 -41.171) 48.814 ======================= Grid point 103 (43/160) ======================= q-point: ( 0.22 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 13.651 0.000 15.448) 20.615 1.881 ( 26.236 0.000 29.721) 39.645 1.987 ( -5.960 -0.000 9.261) 11.013 2.459 ( 0.636 0.000 -1.819) 1.927 2.597 ( 3.445 0.000 -2.942) 4.530 2.810 ( 10.214 0.000 -21.630) 23.920 3.135 ( 6.818 0.000 -3.850) 7.830 3.226 ( 2.314 0.000 -3.352) 4.073 3.374 ( 8.355 0.000 7.671) 11.342 3.841 ( -16.190 -0.000 7.039) 17.654 3.852 ( -17.823 -0.000 4.953) 18.499 3.952 ( 10.544 0.000 10.120) 14.614 4.144 ( 4.488 0.000 -9.524) 10.528 4.465 ( -7.771 -0.000 -3.274) 8.432 4.907 ( -7.080 -0.000 -3.158) 7.752 5.399 ( 4.424 0.000 -6.796) 8.109 5.542 ( 5.408 0.000 -1.340) 5.572 5.779 ( -13.079 -0.000 -0.800) 13.104 6.077 ( 4.074 0.000 -9.894) 10.700 6.102 ( -2.112 -0.000 1.661) 2.687 6.551 ( 8.067 0.000 4.626) 9.299 6.930 ( 3.978 0.000 -0.803) 4.058 7.024 ( 2.452 0.000 -4.694) 5.296 7.049 ( -16.004 -0.000 -10.551) 19.169 7.373 ( 0.160 0.000 -9.423) 9.425 7.477 ( -6.413 -0.000 -2.814) 7.003 7.658 ( 5.504 0.000 1.236) 5.641 7.952 ( 3.520 0.000 6.358) 7.267 8.269 ( 7.712 0.000 -0.482) 7.727 8.477 ( -3.637 -0.000 5.643) 6.714 8.773 ( -7.890 -0.000 0.028) 7.890 9.274 ( 2.217 0.000 -4.790) 5.278 9.408 ( -4.953 -0.000 1.514) 5.179 9.512 ( 8.084 0.000 7.098) 10.758 9.721 ( -0.868 -0.000 -5.653) 5.719 9.805 ( 2.625 0.000 1.811) 3.189 9.834 ( -2.395 -0.000 -0.872) 2.549 10.017 ( 4.069 0.000 -0.334) 4.083 10.622 ( -3.322 -0.000 -3.965) 5.173 10.938 ( 2.913 0.000 5.300) 6.048 11.541 ( -2.420 -0.000 -0.634) 2.502 11.769 ( 2.583 0.000 2.072) 3.312 12.531 ( -8.021 -0.000 0.974) 8.080 13.004 ( -5.772 -0.000 9.647) 11.242 13.525 ( 1.168 0.000 -1.966) 2.287 13.795 ( -3.123 -0.000 0.614) 3.182 14.513 ( -1.451 -0.000 4.451) 4.682 15.067 ( -1.428 -0.000 3.231) 3.532 16.034 ( 0.099 0.000 1.095) 1.099 16.078 ( -0.156 -0.000 -2.482) 2.486 16.189 ( -6.784 -0.000 8.416) 10.810 16.221 ( 5.384 0.000 -6.429) 8.386 16.373 ( -5.807 -0.000 -0.377) 5.819 16.802 ( 5.669 0.000 1.430) 5.847 17.512 ( 4.322 0.000 -1.320) 4.519 17.856 ( 6.045 0.000 -0.347) 6.055 17.911 ( -0.491 -0.000 -1.176) 1.274 18.198 ( 5.896 0.000 -7.458) 9.507 18.672 ( -3.313 -0.000 -0.738) 3.394 19.277 ( 7.802 0.000 -5.282) 9.422 19.588 ( -12.425 -0.000 3.108) 12.808 20.680 ( -2.395 -0.000 0.933) 2.571 27.786 ( 2.277 0.000 -6.900) 7.266 28.781 ( -14.844 -0.000 4.394) 15.481 29.253 ( -2.581 -0.000 -2.307) 3.462 29.570 ( -2.685 -0.000 -6.242) 6.795 29.656 ( -1.075 -0.000 0.005) 1.075 29.687 ( -2.538 -0.000 -4.513) 5.178 29.723 ( 0.544 0.000 0.466) 0.717 30.265 ( 1.134 0.000 3.427) 3.610 30.418 ( 7.429 0.000 0.211) 7.432 30.947 ( -3.847 -0.000 -2.496) 4.586 31.621 ( 17.429 0.000 -23.373) 29.156 31.924 ( 7.991 0.000 1.701) 8.170 31.986 ( -1.283 -0.000 0.028) 1.283 32.087 ( 1.162 0.000 0.404) 1.230 33.033 ( -32.669 -0.000 10.181) 34.219 35.007 ( 20.849 0.000 20.202) 29.031 ======================= Grid point 104 (44/160) ======================= q-point: ( 0.33 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( 6.717 -41.123 4.819) 41.946 2.332 ( 17.077 -12.662 23.066) 31.369 2.419 ( 5.423 -26.397 9.679) 28.634 2.629 ( 7.097 -28.714 -7.854) 30.603 2.736 ( 6.938 -9.634 -8.128) 14.388 2.989 ( 4.339 -32.457 -2.637) 32.851 3.266 ( 1.422 -8.628 -8.407) 12.130 3.370 ( -1.484 -10.665 -2.515) 11.058 3.557 ( 0.271 -21.527 -3.464) 21.806 3.706 ( -14.407 0.437 6.538) 15.827 3.908 ( -2.352 -12.204 -15.963) 20.231 4.073 ( -12.326 -30.252 6.072) 33.226 4.446 ( 4.836 -9.006 11.176) 15.146 4.506 ( 8.903 -8.998 8.127) 15.043 4.884 ( -6.079 -7.706 -2.725) 10.186 5.359 ( 6.576 6.298 -1.499) 9.228 5.546 ( 4.103 2.372 -0.381) 4.754 5.700 ( -10.078 -4.039 -1.587) 10.972 6.012 ( 0.514 0.544 -8.396) 8.429 6.142 ( -0.356 -2.093 2.409) 3.212 6.563 ( 6.309 9.433 3.273) 11.811 6.737 ( 3.006 10.556 -7.405) 13.240 6.819 ( -7.607 7.273 -4.450) 11.427 7.056 ( -4.643 0.468 -5.430) 7.160 7.303 ( -5.636 -1.538 -3.579) 6.851 7.403 ( -8.524 0.328 -2.153) 8.798 7.703 ( 7.028 -0.084 0.616) 7.056 8.090 ( 6.821 -3.864 6.568) 10.228 8.362 ( 6.655 -3.060 -0.628) 7.352 8.474 ( -3.244 0.346 2.939) 4.391 8.713 ( -8.458 -2.666 -1.650) 9.020 9.148 ( 3.748 8.657 -2.211) 9.689 9.382 ( -2.186 1.343 0.707) 2.661 9.588 ( 4.727 2.453 2.054) 5.708 9.735 ( -3.985 -7.947 6.268) 10.877 9.910 ( -0.615 -12.189 -0.793) 12.230 10.079 ( 2.710 -4.633 -0.175) 5.370 10.126 ( 2.896 -24.412 -9.150) 26.230 10.560 ( -3.275 1.133 -1.998) 4.000 10.991 ( 4.428 2.357 5.435) 7.396 11.469 ( -3.461 4.558 -1.883) 6.025 11.759 ( 2.059 4.843 1.040) 5.364 12.483 ( -5.721 0.117 1.289) 5.866 13.028 ( -5.282 -0.791 6.526) 8.433 13.517 ( 0.264 -0.176 -1.422) 1.457 13.774 ( -1.835 0.827 -0.163) 2.019 14.525 ( -1.617 0.334 2.761) 3.217 15.085 ( -0.619 0.542 4.150) 4.231 15.943 ( 0.192 9.235 -2.546) 9.582 16.005 ( 0.762 7.156 1.938) 7.452 16.176 ( -2.102 2.337 -4.418) 5.422 16.222 ( -2.035 0.884 2.480) 3.328 16.306 ( -4.468 0.288 -0.247) 4.484 16.805 ( 4.473 5.484 1.468) 7.227 17.572 ( 5.076 -2.668 -0.695) 5.776 17.864 ( -1.836 3.271 -0.636) 3.805 17.910 ( 4.135 -2.173 -0.721) 4.726 18.235 ( 10.295 -0.926 -3.743) 10.993 18.667 ( 1.176 -1.391 -0.323) 1.850 19.273 ( 2.894 1.114 -9.145) 9.656 19.451 ( -9.705 6.985 10.657) 16.017 20.602 ( -4.370 4.967 -1.305) 6.743 27.732 ( 2.152 3.275 -3.414) 5.197 28.615 ( -10.661 5.497 -2.412) 12.235 29.235 ( -0.836 -0.174 0.395) 0.941 29.319 ( -0.682 8.243 -1.438) 8.395 29.625 ( -1.813 0.933 -2.839) 3.496 29.693 ( 0.705 2.288 -0.210) 2.404 29.958 ( -4.602 -16.733 -1.446) 17.414 30.300 ( 2.409 1.002 4.096) 4.856 30.488 ( 4.441 -1.613 0.257) 4.732 30.839 ( -4.146 5.903 -2.988) 7.808 31.442 ( 9.858 9.649 -8.831) 16.379 31.821 ( -5.736 7.716 3.495) 10.230 31.871 ( -1.415 5.217 1.541) 5.621 32.577 ( 9.456 -32.539 -8.786) 35.006 33.186 ( -21.073 -32.589 2.137) 38.868 35.348 ( 16.231 -6.493 15.481) 23.351 ======================= Grid point 105 (45/160) ======================= q-point: ( 0.44 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( 7.533 4.643 -10.254) 13.545 2.745 ( 11.318 -4.468 22.449) 25.535 2.818 ( 0.877 -12.030 -15.563) 19.690 3.040 ( 3.430 -19.121 1.748) 19.505 3.217 ( 0.994 -12.137 1.413) 12.260 3.446 ( 0.592 -9.583 -9.777) 13.703 3.606 ( -0.291 -22.297 -1.394) 22.342 3.685 ( 1.372 -33.061 1.952) 33.147 3.723 ( -4.998 -25.123 1.671) 25.670 3.865 ( -3.681 -26.923 7.453) 28.177 4.286 ( 3.123 -29.345 -0.406) 29.513 4.574 ( 4.782 -20.403 -1.668) 21.022 4.740 ( -8.957 -24.523 -0.877) 26.123 4.837 ( 5.075 -12.907 6.371) 15.262 5.171 ( -5.433 -34.967 -1.123) 35.405 5.274 ( 5.138 6.456 1.393) 8.368 5.602 ( 4.783 -5.123 0.295) 7.015 5.729 ( -5.969 -6.206 2.961) 9.106 5.933 ( -4.069 -0.017 -8.027) 8.999 6.200 ( 3.747 -2.581 3.509) 5.746 6.436 ( 5.615 9.760 1.231) 11.327 6.635 ( 9.136 6.844 1.374) 11.498 6.661 ( -3.983 -0.198 -4.299) 5.864 6.910 ( -10.100 1.525 -6.165) 11.930 7.247 ( -8.463 0.968 -1.632) 8.673 7.289 ( -8.478 1.616 -2.351) 8.945 7.798 ( 8.846 -2.261 0.896) 9.174 8.242 ( 4.853 -3.103 5.190) 7.753 8.369 ( -4.150 0.990 -2.055) 4.735 8.530 ( 4.743 -4.685 -2.136) 7.001 8.756 ( -5.268 -10.493 0.803) 11.768 9.079 ( 4.984 3.438 0.665) 6.091 9.357 ( 2.134 1.594 0.213) 2.673 9.572 ( 0.312 1.925 0.013) 1.950 9.883 ( -5.767 -7.252 3.628) 9.950 10.132 ( 0.287 -14.264 -1.137) 14.313 10.192 ( 0.838 -6.922 1.870) 7.219 10.429 ( 0.653 -5.061 -7.817) 9.335 10.563 ( 0.159 -13.111 -0.136) 13.113 11.004 ( 5.050 4.393 4.272) 7.940 11.318 ( -4.179 6.974 -2.826) 8.608 11.658 ( 1.212 8.935 0.209) 9.019 12.452 ( -3.727 0.561 1.910) 4.226 13.021 ( -5.766 0.560 2.035) 6.140 13.519 ( 0.129 -0.506 -0.539) 0.750 13.735 ( -0.301 1.569 -1.384) 2.114 14.516 ( -1.539 0.767 1.313) 2.163 15.080 ( -1.396 2.531 2.365) 3.735 15.766 ( 2.583 10.532 -0.312) 10.848 15.878 ( 0.909 9.253 1.611) 9.436 15.992 ( -4.019 10.987 -3.796) 12.300 16.189 ( -0.079 1.389 -2.759) 3.089 16.314 ( -3.522 -2.897 1.647) 4.849 16.716 ( 2.643 9.470 1.147) 9.899 17.624 ( 3.506 1.824 0.253) 3.960 17.822 ( 1.089 -1.067 0.532) 1.615 17.995 ( 1.406 -5.395 -0.733) 5.623 18.306 ( 8.992 -0.540 -2.901) 9.463 18.732 ( 5.914 -1.453 1.951) 6.395 19.158 ( -1.439 5.397 -2.216) 6.009 19.415 ( -6.136 -0.535 7.089) 9.391 20.449 ( -4.985 6.220 -2.974) 8.507 27.679 ( 1.873 3.251 -0.298) 3.764 28.451 ( -4.823 3.434 -4.107) 7.206 29.224 ( -0.092 0.742 -0.342) 0.822 29.275 ( 0.260 -2.008 1.112) 2.310 29.588 ( -1.294 -0.121 -1.382) 1.898 29.648 ( 0.022 3.119 -0.175) 3.124 30.046 ( -2.268 2.087 -0.597) 3.139 30.300 ( 3.084 6.062 2.849) 7.374 30.528 ( 0.822 -0.896 0.397) 1.279 30.680 ( -2.746 5.878 -2.530) 6.964 31.400 ( 6.713 1.802 -3.069) 7.598 31.659 ( -7.661 4.109 3.094) 9.228 31.907 ( -5.262 -10.871 1.153) 12.133 33.110 ( 6.415 -28.732 -4.387) 29.765 33.629 ( -12.606 -33.545 -3.098) 35.969 35.690 ( 11.035 -10.690 8.377) 17.499 ======================= Grid point 106 (46/160) ======================= q-point: ( 0.56 0.22 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( 3.729 8.994 -6.598) 11.762 2.648 ( 3.558 10.426 -14.310) 18.060 3.048 ( -0.801 -5.958 14.322) 15.533 3.339 ( -3.437 -2.154 -13.627) 14.218 3.432 ( -0.748 -18.772 11.440) 21.996 3.515 ( 7.878 -13.233 0.642) 15.414 3.827 ( -7.043 -9.322 5.214) 12.794 4.044 ( -1.719 -17.780 -0.741) 17.878 4.114 ( 2.300 -21.006 -3.741) 21.460 4.441 ( 1.266 -13.649 4.693) 14.489 4.658 ( 4.552 -7.701 4.069) 9.828 4.809 ( -0.481 -4.203 1.741) 4.575 5.011 ( 6.213 -10.395 -4.246) 12.833 5.121 ( 0.214 -17.530 -1.677) 17.611 5.254 ( 3.370 -1.383 0.150) 3.646 5.631 ( -4.215 -8.086 1.492) 9.240 5.674 ( 0.581 -5.654 -2.996) 6.425 5.816 ( -8.696 -5.143 -0.220) 10.105 6.034 ( 2.049 -17.869 6.602) 19.160 6.312 ( 2.951 -4.859 -1.712) 5.937 6.494 ( 2.551 -10.774 2.743) 11.407 6.629 ( -6.669 -4.150 -4.868) 9.241 6.695 ( 7.316 -5.441 0.587) 9.136 6.884 ( -1.307 -7.942 -2.744) 8.504 7.127 ( -6.715 0.236 -3.082) 7.392 7.226 ( -8.729 -3.248 0.824) 9.350 7.911 ( 8.354 -1.184 1.242) 8.528 8.315 ( -2.370 -3.722 -6.419) 7.789 8.352 ( 0.804 -1.186 6.413) 6.571 8.627 ( 6.780 -4.246 -4.100) 8.989 8.951 ( -4.892 -10.230 3.457) 11.855 9.099 ( 4.936 -2.296 0.637) 5.481 9.369 ( 4.018 1.015 1.408) 4.377 9.588 ( -0.605 -6.552 -0.402) 6.592 9.906 ( -5.829 -0.672 -1.625) 6.088 10.227 ( -1.066 12.410 1.030) 12.499 10.338 ( -1.138 -12.298 -0.385) 12.357 10.422 ( -0.645 -8.859 -0.614) 8.903 10.783 ( 2.693 -5.137 0.143) 5.802 11.018 ( 5.381 1.517 2.184) 6.003 11.161 ( -4.246 4.378 -2.895) 6.751 11.512 ( 0.782 7.550 -0.118) 7.592 12.417 ( -3.058 2.950 2.666) 5.017 12.940 ( -3.993 3.539 -2.608) 5.939 13.515 ( -0.680 0.860 0.142) 1.106 13.720 ( 1.860 -0.457 -1.159) 2.239 14.498 ( -1.077 0.789 0.501) 1.426 15.003 ( -0.593 5.655 -1.055) 5.783 15.650 ( 1.991 8.675 3.303) 9.493 15.752 ( -1.677 8.236 -2.713) 8.832 15.777 ( -0.059 3.183 0.254) 3.193 16.147 ( 1.000 0.964 -4.083) 4.313 16.346 ( -3.026 -2.308 1.569) 4.117 16.555 ( 1.541 11.988 0.904) 12.120 17.597 ( 1.550 3.692 2.273) 4.604 17.898 ( 3.823 -3.585 0.023) 5.242 18.086 ( -1.276 -5.117 -0.050) 5.274 18.353 ( 6.252 -1.069 -4.695) 7.891 18.793 ( 3.695 2.789 4.722) 6.612 19.096 ( 1.881 0.672 -0.191) 2.006 19.423 ( -9.059 -1.973 4.644) 10.369 20.293 ( -3.028 5.313 -2.588) 6.640 27.645 ( 0.994 2.513 0.778) 2.813 28.357 ( -1.133 2.041 -3.003) 3.804 29.236 ( 1.630 -1.720 -0.634) 2.453 29.350 ( 0.360 -5.203 1.251) 5.364 29.582 ( -0.836 2.776 1.500) 3.264 29.597 ( -0.524 -1.167 -1.896) 2.288 29.901 ( -1.134 10.471 -0.994) 10.579 30.176 ( 1.449 10.635 -0.666) 10.754 30.553 ( 0.332 -0.797 -2.417) 2.567 30.600 ( -0.887 0.535 2.361) 2.578 31.343 ( 3.819 6.883 -1.943) 8.108 31.598 ( -6.081 1.859 5.387) 8.334 32.180 ( -4.943 -23.600 0.112) 24.112 33.553 ( 3.857 -19.915 -0.359) 20.288 34.020 ( -7.064 -23.877 -1.522) 24.946 35.995 ( 7.024 -12.670 0.921) 14.516 ======================= Grid point 107 (47/160) ======================= q-point: (-0.33 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( 4.296 14.470 3.822) 15.571 2.379 ( 5.390 16.437 -7.281) 18.768 3.067 ( -7.258 -1.183 -9.859) 12.300 3.396 ( 0.076 -5.735 8.677) 10.401 3.717 ( 1.769 -6.936 7.001) 10.012 3.739 ( -2.666 -2.208 5.075) 6.143 4.007 ( -0.165 -18.788 -3.477) 19.108 4.254 ( 0.491 -7.190 -3.904) 8.196 4.409 ( 0.377 -15.605 -0.090) 15.610 4.506 ( -0.873 4.034 0.964) 4.238 4.650 ( -3.300 5.841 -0.128) 6.710 4.862 ( -2.982 -3.118 -5.660) 7.117 5.001 ( 3.858 8.798 2.611) 9.956 5.316 ( 1.137 -3.143 3.119) 4.571 5.350 ( 8.484 -0.997 0.901) 8.590 5.499 ( -1.279 8.337 -3.814) 9.257 5.793 ( -4.427 -1.795 -1.848) 5.122 5.910 ( 7.771 -8.874 3.323) 12.255 6.235 ( -10.853 -3.071 5.464) 12.533 6.448 ( -1.124 -6.803 -4.475) 8.220 6.618 ( 1.139 -4.651 1.533) 5.028 6.728 ( 2.008 -8.035 -0.828) 8.323 6.873 ( 4.605 -6.326 -1.535) 7.973 6.913 ( -0.031 0.505 -0.159) 0.530 7.124 ( -5.212 -1.675 -0.136) 5.476 7.327 ( -2.739 -10.994 0.836) 11.361 7.964 ( 5.182 2.564 2.199) 6.186 8.314 ( -2.830 -2.542 -5.904) 7.024 8.450 ( 1.461 -4.954 4.347) 6.750 8.684 ( 8.966 3.813 -4.337) 10.664 8.953 ( -8.772 1.617 4.018) 9.783 9.265 ( 3.213 -7.748 -5.266) 9.904 9.411 ( 4.437 -1.532 4.230) 6.319 9.724 ( 1.344 -2.198 1.407) 2.936 9.820 ( -10.268 1.964 -2.673) 10.791 9.996 ( 2.860 7.070 -2.565) 8.047 10.529 ( -0.058 -5.425 2.021) 5.789 10.574 ( 0.542 -11.143 1.606) 11.271 10.890 ( 0.124 -10.501 -3.068) 10.940 10.971 ( 3.040 7.349 0.471) 7.967 11.064 ( -1.580 1.344 -0.396) 2.112 11.471 ( 1.152 -0.271 -0.284) 1.217 12.337 ( -3.267 5.622 4.620) 7.976 12.836 ( 0.038 3.610 -3.280) 4.878 13.482 ( -0.685 2.589 1.084) 2.890 13.756 ( 2.418 -2.143 -0.517) 3.272 14.483 ( -0.790 0.345 0.162) 0.877 14.903 ( 0.613 4.170 -1.813) 4.588 15.520 ( -0.975 5.506 0.633) 5.628 15.667 ( -0.496 1.131 -0.428) 1.307 15.826 ( 0.857 -6.112 0.852) 6.231 16.117 ( 1.544 0.328 -3.933) 4.238 16.306 ( -3.937 6.693 -0.453) 7.778 16.426 ( 1.910 3.778 3.756) 5.660 17.566 ( -0.119 3.285 3.504) 4.804 17.972 ( 4.545 -1.535 -1.890) 5.156 18.129 ( -3.122 -1.862 -0.340) 3.651 18.376 ( 4.833 -1.089 -6.335) 8.042 18.772 ( -1.747 4.092 5.391) 6.990 19.135 ( 4.661 -1.136 -0.483) 4.822 19.382 ( -11.426 0.057 1.640) 11.543 20.213 ( 0.937 2.037 1.146) 2.518 27.614 ( -0.569 1.972 0.186) 2.061 28.318 ( 1.424 1.337 -0.365) 1.987 29.290 ( 2.704 -2.653 -0.400) 3.809 29.451 ( -1.294 -5.622 -1.355) 5.926 29.525 ( 0.131 2.741 0.297) 2.761 29.642 ( -0.654 -3.989 1.606) 4.349 29.728 ( -0.033 6.810 -1.972) 7.090 30.005 ( 0.830 8.416 -1.813) 8.649 30.519 ( 0.251 2.691 -0.249) 2.714 30.653 ( -0.435 -3.846 0.881) 3.970 31.246 ( 2.365 5.111 -2.060) 5.997 31.563 ( -5.865 1.184 6.202) 8.618 32.517 ( -1.823 -17.337 0.017) 17.433 33.801 ( 1.916 -6.576 -0.240) 6.854 34.287 ( -1.290 -10.620 4.047) 11.438 36.223 ( 3.506 -11.102 -6.765) 13.465 ======================= Grid point 108 (48/160) ======================= q-point: (-0.22 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 10.122 19.875 9.947) 24.421 2.110 ( 7.424 18.887 9.401) 22.366 2.929 ( -7.006 0.108 -14.423) 16.035 3.509 ( 1.080 2.282 4.489) 5.150 3.643 ( -5.117 6.891 0.930) 8.633 3.859 ( 1.933 0.119 4.908) 5.277 4.137 ( -2.653 3.865 -1.450) 4.907 4.287 ( -2.202 0.466 -5.077) 5.554 4.355 ( -0.557 15.364 0.564) 15.385 4.531 ( -1.917 -3.825 0.189) 4.283 4.616 ( 0.426 -4.397 -1.000) 4.529 4.769 ( -4.507 0.747 -4.221) 6.220 4.984 ( 3.207 2.946 1.727) 4.685 5.282 ( -2.722 3.045 -4.241) 5.888 5.342 ( -0.919 6.258 0.886) 6.386 5.494 ( 5.117 -5.390 6.508) 9.878 5.770 ( 2.645 -0.351 -6.829) 7.332 6.107 ( -8.967 -7.517 -4.159) 12.418 6.156 ( 6.020 4.747 3.449) 8.407 6.388 ( 0.913 9.997 -4.592) 11.039 6.624 ( 1.599 8.170 4.576) 9.500 6.804 ( 2.246 5.110 0.584) 5.612 6.921 ( 2.544 2.014 4.934) 5.905 6.936 ( -1.475 9.662 0.009) 9.774 7.021 ( 3.385 3.266 4.023) 6.190 7.423 ( -1.697 -2.351 -1.213) 3.143 7.979 ( 2.619 1.595 5.021) 5.883 8.254 ( -1.766 2.195 -5.451) 6.136 8.540 ( -2.167 -0.394 -0.644) 2.295 8.603 ( 2.873 4.099 -3.861) 6.322 8.799 ( -8.114 10.047 2.554) 13.165 9.332 ( 3.049 -1.363 -0.698) 3.412 9.514 ( 1.983 -6.510 -4.260) 8.029 9.581 ( 0.849 11.206 -4.535) 12.119 9.783 ( 1.299 4.392 3.916) 6.026 10.003 ( -2.518 -4.868 7.106) 8.974 10.570 ( -0.587 -0.871 -1.998) 2.257 10.696 ( 1.928 13.138 0.330) 13.283 10.792 ( -1.317 -7.696 0.543) 7.827 11.010 ( -1.762 -4.771 -6.079) 7.926 11.352 ( 5.727 -24.197 -10.696) 27.068 11.452 ( -0.499 2.038 -1.404) 2.524 12.342 ( -4.613 -6.858 12.676) 15.133 12.788 ( 1.833 1.256 0.263) 2.238 13.443 ( 1.281 3.444 1.949) 4.159 13.815 ( 1.938 -2.807 0.282) 3.423 14.476 ( -1.080 -0.085 0.514) 1.199 14.868 ( 0.944 -0.724 0.447) 1.271 15.484 ( -1.167 0.134 1.607) 1.991 15.690 ( -0.416 -5.748 -3.138) 6.562 15.929 ( 1.916 -2.759 -2.153) 3.990 16.118 ( -3.214 -3.852 -0.095) 5.018 16.184 ( -0.511 2.718 2.510) 3.735 16.434 ( 0.424 0.912 3.115) 3.274 17.534 ( -1.638 2.585 3.414) 4.585 17.986 ( 1.920 1.213 -3.844) 4.465 18.087 ( -1.096 2.754 -3.372) 4.490 18.375 ( 5.047 0.331 -6.602) 8.317 18.724 ( -3.822 2.834 4.614) 6.628 19.174 ( -1.540 -0.924 1.062) 2.087 19.276 ( -3.947 3.646 -1.966) 5.721 20.251 ( 2.734 -1.297 5.405) 6.194 27.577 ( -1.565 0.986 -0.372) 1.887 28.331 ( 3.059 0.413 3.003) 4.307 29.337 ( 0.610 -0.073 0.690) 0.924 29.447 ( -4.230 -0.683 -2.910) 5.180 29.518 ( 4.215 -0.092 -3.561) 5.518 29.670 ( 0.712 -0.896 -1.309) 1.738 29.757 ( -1.500 -7.824 3.109) 8.552 29.916 ( 1.882 1.893 -0.326) 2.689 30.477 ( 0.498 2.858 1.773) 3.400 30.702 ( -0.744 -2.105 -0.644) 2.324 31.198 ( 2.442 0.834 -2.289) 3.450 31.563 ( -6.220 -1.514 6.978) 9.469 32.683 ( -1.553 -3.786 -1.460) 4.344 33.801 ( 1.987 7.070 -2.347) 7.710 34.408 ( 4.408 3.211 9.158) 10.658 36.285 ( -2.540 -3.992 -16.714) 17.371 ======================= Grid point 109 (49/160) ======================= q-point: (-0.11 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( 9.103 24.879 7.938) 27.656 2.120 ( 21.020 14.042 33.626) 42.068 2.741 ( -5.806 2.855 -15.840) 17.110 3.324 ( -0.105 13.427 -9.730) 16.582 3.490 ( -2.506 14.092 0.214) 14.315 3.707 ( 0.105 17.777 4.982) 18.462 4.004 ( -2.930 15.928 5.696) 17.168 4.103 ( -3.003 9.347 1.649) 9.955 4.162 ( -2.767 14.161 2.104) 14.582 4.415 ( 1.800 24.280 3.025) 24.534 4.519 ( -4.865 3.969 -6.959) 9.373 4.727 ( -0.804 3.391 -7.003) 7.822 4.942 ( -2.689 1.050 -4.448) 5.302 5.185 ( -2.976 -1.476 -9.341) 9.914 5.320 ( 3.045 1.745 5.528) 6.548 5.641 ( 1.464 -1.781 2.155) 3.156 5.781 ( -2.373 5.546 3.842) 7.152 5.863 ( 3.947 13.304 -9.343) 16.729 6.086 ( -1.169 14.627 3.724) 15.139 6.312 ( 13.256 10.209 -6.649) 18.004 6.427 ( -4.428 5.876 3.964) 8.357 6.509 ( -2.391 25.555 -3.408) 25.891 6.700 ( 3.380 2.898 -0.390) 4.469 7.017 ( 3.615 -2.370 7.080) 8.296 7.149 ( 5.262 -3.246 8.607) 10.597 7.411 ( -2.107 -0.695 -1.492) 2.674 8.007 ( -0.602 2.368 7.102) 7.510 8.124 ( -3.611 5.914 -8.868) 11.254 8.406 ( -2.952 4.921 -2.371) 6.209 8.545 ( -0.540 2.601 -4.025) 4.823 8.706 ( -1.386 0.665 5.686) 5.890 9.327 ( 5.205 5.750 2.591) 8.177 9.372 ( -3.024 6.016 -6.801) 9.570 9.553 ( -0.410 4.611 -1.610) 4.901 9.788 ( 2.980 -5.052 0.555) 5.892 10.110 ( -3.758 0.840 9.454) 10.208 10.413 ( 1.209 15.683 0.492) 15.737 10.592 ( 1.437 1.077 -1.014) 2.062 10.873 ( -2.447 -2.847 -3.375) 5.048 11.086 ( 1.102 -9.340 -11.094) 14.544 11.399 ( -0.668 -0.684 -3.412) 3.544 11.514 ( 3.140 -3.257 -11.764) 12.604 12.592 ( -5.762 -10.832 3.518) 12.764 12.876 ( -5.253 -10.317 8.340) 14.268 13.427 ( 5.490 2.671 1.834) 6.375 13.879 ( -0.480 -2.799 0.688) 2.922 14.479 ( -1.308 -0.354 1.844) 2.289 14.991 ( 1.165 -9.757 7.281) 12.230 15.488 ( -1.289 -2.517 -0.174) 2.833 15.770 ( -2.099 -7.953 -5.796) 10.063 15.960 ( 4.133 -0.905 2.589) 4.960 16.174 ( -9.049 -7.856 2.356) 12.213 16.282 ( 4.564 -7.000 3.154) 8.932 16.434 ( -1.274 0.629 1.594) 2.135 17.509 ( -0.858 1.442 3.021) 3.456 17.865 ( -4.765 6.808 -4.958) 9.676 18.027 ( 6.697 2.524 -6.365) 9.578 18.351 ( 4.650 1.990 -6.038) 7.877 18.699 ( -0.012 1.543 3.875) 4.170 19.130 ( -13.569 -2.943 1.285) 13.944 19.233 ( 12.032 5.366 -0.729) 13.195 20.354 ( 1.832 -2.674 7.566) 8.231 27.570 ( -0.424 -1.907 0.077) 1.955 28.396 ( 3.112 -1.298 6.375) 7.212 29.304 ( -1.341 2.619 -0.137) 2.946 29.403 ( -4.427 -0.906 -3.028) 5.439 29.560 ( 4.865 -3.011 -3.330) 6.620 29.691 ( 0.080 -1.623 -1.246) 2.048 29.895 ( 0.152 -6.544 1.393) 6.692 29.974 ( 1.818 -5.605 2.547) 6.420 30.471 ( 0.461 0.280 2.881) 2.931 30.716 ( -0.249 -1.437 -0.377) 1.507 31.213 ( 3.173 -0.861 -1.953) 3.824 31.616 ( -6.036 -4.928 6.463) 10.123 32.593 ( -5.697 8.572 -3.194) 10.777 33.576 ( 4.731 18.409 -7.016) 20.261 34.399 ( 8.755 12.417 11.717) 19.186 35.996 ( -13.946 13.738 -28.348) 34.451 ======================= Grid point 113 (50/160) ======================= q-point: ( 0.33 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 0.913 0.000 -3.849) 3.955 2.053 ( 7.067 0.000 9.151) 11.562 2.507 ( -0.155 -0.000 4.096) 4.099 2.537 ( 3.990 0.000 0.768) 4.063 2.595 ( 2.484 0.000 -4.070) 4.768 2.826 ( 26.150 0.000 4.537) 26.540 3.172 ( -0.204 -0.000 1.859) 1.870 3.261 ( 7.656 0.000 -6.291) 9.909 3.291 ( -0.940 -0.000 -8.349) 8.402 3.639 ( -1.300 -0.000 -20.979) 21.019 3.704 ( -10.850 -0.000 6.402) 12.598 3.791 ( -11.697 -0.000 13.462) 17.834 4.261 ( -9.886 -0.000 -3.779) 10.583 4.687 ( 4.575 0.000 11.660) 12.525 4.822 ( 3.411 0.000 2.197) 4.057 5.510 ( 11.798 0.000 5.384) 12.969 5.518 ( -11.873 -0.000 -3.351) 12.336 5.657 ( 5.931 0.000 2.079) 6.285 5.941 ( -0.422 -0.000 -8.144) 8.154 6.142 ( -0.348 -0.000 3.322) 3.340 6.684 ( -1.362 -0.000 -10.565) 10.653 6.724 ( 5.127 0.000 3.820) 6.394 6.899 ( -12.077 -0.000 -4.141) 12.767 6.993 ( 2.080 0.000 -4.420) 4.885 7.161 ( -8.513 -0.000 -2.869) 8.983 7.364 ( -3.006 -0.000 -0.264) 3.018 7.753 ( 4.341 0.000 0.902) 4.434 8.175 ( 8.368 0.000 6.680) 10.707 8.393 ( 7.849 0.000 -0.562) 7.869 8.452 ( -6.920 -0.000 1.035) 6.997 8.603 ( -8.327 -0.000 -2.380) 8.660 9.291 ( 5.549 0.000 -2.441) 6.062 9.355 ( -5.729 -0.000 2.892) 6.418 9.650 ( -0.265 -0.000 -2.502) 2.516 9.664 ( -0.334 -0.000 3.986) 4.000 9.777 ( -1.886 -0.000 -1.520) 2.422 9.877 ( 6.636 0.000 -1.567) 6.818 10.064 ( 2.913 0.000 -0.663) 2.988 10.529 ( -2.959 -0.000 -1.203) 3.194 11.094 ( 5.324 0.000 5.437) 7.609 11.457 ( -4.418 -0.000 -3.051) 5.369 11.822 ( 1.915 0.000 0.292) 1.937 12.458 ( -3.492 -0.000 1.725) 3.894 13.002 ( -6.281 -0.000 1.721) 6.512 13.506 ( -0.312 -0.000 -0.251) 0.400 13.779 ( -0.544 -0.000 0.790) 0.959 14.530 ( -1.735 -0.000 1.504) 2.296 15.120 ( -0.334 -0.000 3.671) 3.686 16.015 ( -0.680 -0.000 -1.232) 1.407 16.102 ( 1.877 0.000 1.972) 2.723 16.123 ( 1.588 0.000 -8.100) 8.254 16.217 ( -5.067 -0.000 3.542) 6.183 16.272 ( -5.092 -0.000 -1.168) 5.225 16.893 ( 3.739 0.000 0.445) 3.766 17.587 ( 5.858 0.000 0.323) 5.867 17.839 ( -2.487 -0.000 -1.543) 2.927 17.931 ( 0.654 0.000 -0.071) 0.658 18.311 ( 10.647 0.000 -0.858) 10.681 18.694 ( 8.650 0.000 1.691) 8.813 19.237 ( 0.078 0.000 -6.416) 6.417 19.485 ( -12.625 -0.000 8.263) 15.088 20.590 ( -4.806 -0.000 -3.456) 5.919 27.751 ( 1.761 0.000 -2.659) 3.189 28.541 ( -9.519 -0.000 -5.985) 11.244 29.236 ( -0.848 -0.000 2.060) 2.228 29.446 ( -3.094 -0.000 -3.342) 4.555 29.603 ( -1.551 -0.000 -2.219) 2.707 29.640 ( -0.818 -0.000 0.031) 0.818 29.735 ( 0.349 0.000 0.081) 0.358 30.348 ( 2.098 0.000 3.166) 3.798 30.525 ( 5.481 0.000 0.810) 5.540 30.824 ( -5.274 -0.000 -3.746) 6.469 31.533 ( 6.848 0.000 -13.349) 15.003 31.969 ( -0.934 -0.000 0.044) 0.935 32.107 ( 0.863 0.000 0.013) 0.863 32.144 ( 8.132 0.000 7.662) 11.173 32.721 ( -17.726 -0.000 2.544) 17.907 35.509 ( 11.186 0.000 11.470) 16.022 ======================= Grid point 114 (51/160) ======================= q-point: ( 0.44 0.33 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 1.977 -43.313 -8.838) 44.250 2.478 ( 3.009 0.815 -7.650) 8.261 2.639 ( 1.151 -22.090 6.015) 22.923 2.773 ( 5.649 -43.016 3.017) 43.490 2.924 ( 1.567 -31.991 -1.465) 32.063 3.124 ( 9.292 -13.258 3.089) 16.482 3.176 ( 10.463 0.525 -6.494) 12.326 3.341 ( 2.110 -4.221 -6.066) 7.685 3.427 ( 0.165 -14.846 -2.823) 15.113 3.636 ( -9.833 -9.311 14.325) 19.712 3.811 ( 4.581 -23.813 -6.300) 25.055 3.964 ( -12.104 -22.927 7.789) 27.071 4.341 ( -4.671 -21.226 -1.986) 21.824 4.751 ( -3.794 -5.090 1.028) 6.431 4.895 ( 4.495 -0.163 3.046) 5.432 5.407 ( -3.756 2.499 -0.439) 4.533 5.593 ( 3.605 0.918 1.602) 4.051 5.636 ( -6.060 0.693 -5.469) 8.192 6.000 ( 15.790 2.532 7.741) 17.767 6.194 ( 1.714 -3.684 3.654) 5.465 6.598 ( -1.121 1.444 -9.786) 9.955 6.681 ( -3.399 9.026 1.433) 9.751 6.731 ( -10.379 2.402 -1.620) 10.775 6.895 ( 4.842 6.907 -0.405) 8.444 7.159 ( -4.800 -2.453 -1.813) 5.687 7.300 ( -2.679 5.101 0.232) 5.767 7.818 ( 4.000 -2.811 2.081) 5.313 8.259 ( 2.106 -0.233 -1.138) 2.406 8.367 ( -3.887 2.152 2.421) 5.060 8.490 ( 4.508 -3.531 -0.906) 5.798 8.583 ( -3.628 -5.233 0.441) 6.383 9.206 ( 4.942 7.313 -1.029) 8.885 9.372 ( -2.795 -2.470 2.999) 4.787 9.623 ( 0.935 2.921 -2.018) 3.671 9.723 ( -5.091 -5.593 1.041) 7.634 9.877 ( -0.795 -12.795 -0.836) 12.847 10.113 ( 2.888 -7.461 -0.895) 8.051 10.127 ( 5.786 -17.962 -1.978) 18.974 10.503 ( -2.540 0.492 0.465) 2.629 11.142 ( 4.268 3.071 3.718) 6.439 11.360 ( -4.068 4.395 -3.407) 6.890 11.790 ( 1.251 5.240 -0.361) 5.400 12.448 ( -2.436 0.173 2.072) 3.203 12.958 ( -5.647 -1.159 -3.194) 6.590 13.513 ( 0.025 -0.544 0.944) 1.090 13.764 ( -0.002 1.922 0.397) 1.963 14.520 ( -1.498 0.359 0.226) 1.557 15.119 ( -1.438 1.535 1.167) 2.405 15.926 ( 1.371 7.458 -1.904) 7.818 16.032 ( -0.653 6.439 -0.491) 6.490 16.090 ( 1.315 4.827 -4.137) 6.491 16.180 ( -2.258 2.151 -2.154) 3.790 16.259 ( -2.996 -2.759 3.312) 5.249 16.869 ( 2.279 5.669 -0.132) 6.112 17.668 ( 5.623 -2.048 2.072) 6.333 17.799 ( -3.715 0.341 -0.110) 3.732 17.952 ( 1.535 -1.551 0.762) 2.311 18.358 ( 5.951 0.693 -2.541) 6.508 18.820 ( 13.840 -0.383 4.301) 14.498 19.175 ( -2.320 2.080 -3.457) 4.654 19.408 ( -12.953 1.879 6.282) 14.519 20.491 ( -2.884 4.618 -2.990) 6.212 27.732 ( 1.426 2.027 -0.878) 2.630 28.427 ( -3.331 1.664 -4.982) 6.220 29.246 ( -0.929 0.376 1.878) 2.129 29.293 ( -0.230 5.475 -0.269) 5.486 29.577 ( -0.629 0.621 -0.576) 1.055 29.700 ( 0.826 2.317 -0.476) 2.505 29.881 ( -3.231 -16.477 0.093) 16.791 30.386 ( 1.271 -0.093 1.752) 2.167 30.556 ( 4.001 2.065 -0.055) 4.502 30.724 ( -3.720 3.762 -2.873) 6.021 31.426 ( 5.405 4.298 -8.452) 10.914 31.782 ( -2.093 15.059 -1.338) 15.262 31.912 ( -2.104 7.313 6.595) 10.070 32.657 ( 5.160 -29.236 3.949) 29.949 32.958 ( -9.400 -32.263 -0.305) 33.606 35.672 ( 4.894 -4.875 4.107) 8.036 ======================= Grid point 115 (52/160) ======================= q-point: ( 0.56 0.33 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( 7.626 4.872 0.118) 9.050 2.607 ( 4.680 -6.513 -18.127) 19.822 2.968 ( -0.624 -17.907 3.057) 18.177 3.095 ( -6.691 -4.143 -9.182) 12.093 3.265 ( 1.467 -14.654 -1.787) 14.836 3.418 ( 9.512 -6.547 8.575) 14.383 3.598 ( 2.914 -35.209 -8.701) 36.385 3.679 ( 0.307 -20.225 1.230) 20.265 3.766 ( -6.820 -9.177 16.782) 20.306 3.968 ( -3.081 -42.915 8.066) 43.775 4.339 ( 2.119 -33.341 -1.360) 33.435 4.514 ( -0.839 -39.805 -3.163) 39.939 4.695 ( 0.131 -11.314 -1.776) 11.453 4.913 ( 1.161 -1.957 2.250) 3.200 5.035 ( -4.885 -38.222 -2.858) 38.638 5.378 ( 0.408 1.328 2.823) 3.146 5.553 ( -1.680 -2.412 -4.609) 5.466 5.648 ( -0.621 -5.779 1.959) 6.134 6.068 ( 6.282 2.894 3.286) 7.658 6.344 ( 7.713 -0.107 3.689) 8.551 6.450 ( -15.515 2.114 -2.607) 15.874 6.528 ( 5.048 2.476 -1.084) 5.726 6.632 ( -4.350 1.438 0.637) 4.626 6.897 ( 9.570 2.012 2.960) 10.218 7.105 ( -2.961 2.393 -1.925) 4.266 7.174 ( -4.919 4.681 -0.821) 6.840 7.931 ( 3.877 -3.946 3.170) 6.376 8.212 ( -1.284 -0.794 -7.174) 7.331 8.378 ( -1.660 -0.519 5.587) 5.852 8.571 ( 4.969 -4.293 -2.260) 6.945 8.721 ( -2.695 -11.302 2.164) 11.818 9.159 ( 2.636 2.713 0.518) 3.818 9.422 ( 0.918 -1.146 3.601) 3.889 9.535 ( -0.488 3.254 -3.727) 4.972 9.775 ( -5.606 -6.448 -4.239) 9.538 10.131 ( 0.310 -14.279 2.109) 14.438 10.237 ( -0.279 -9.257 -0.823) 9.298 10.395 ( 2.721 3.538 1.555) 4.727 10.591 ( 1.917 -18.457 1.365) 18.606 11.104 ( -0.668 4.190 -1.065) 4.375 11.226 ( 0.324 6.971 -0.210) 6.982 11.668 ( 0.440 9.224 -0.760) 9.266 12.437 ( -2.837 0.558 1.984) 3.506 12.903 ( -2.388 -0.384 -6.536) 6.969 13.529 ( -0.060 -0.039 1.577) 1.578 13.738 ( 1.143 1.460 0.476) 1.915 14.500 ( -1.086 0.490 -0.581) 1.326 15.061 ( -1.471 3.442 -2.050) 4.268 15.808 ( 2.086 6.726 0.143) 7.044 15.872 ( -2.451 9.850 -2.968) 10.575 15.930 ( 1.384 11.680 1.026) 11.806 16.125 ( 0.165 0.235 -5.452) 5.459 16.313 ( -0.515 -1.933 3.085) 3.677 16.748 ( 0.699 9.513 -0.469) 9.550 17.699 ( 1.361 4.219 4.313) 6.185 17.838 ( 0.272 -5.786 0.652) 5.829 18.009 ( 0.030 -3.334 1.135) 3.522 18.361 ( 4.649 0.450 -4.810) 6.705 18.936 ( 6.462 3.802 7.074) 10.308 19.106 ( 1.376 0.742 -3.110) 3.480 19.331 ( -13.152 -1.422 3.312) 13.637 20.370 ( 0.298 6.188 -0.871) 6.256 27.696 ( 0.508 2.746 -0.346) 2.814 28.367 ( 1.128 1.450 -2.398) 3.021 29.222 ( 0.464 0.154 -0.502) 0.701 29.298 ( -0.600 -2.279 2.413) 3.373 29.569 ( 0.342 -0.243 -0.355) 0.549 29.649 ( -0.020 3.735 0.524) 3.772 30.007 ( -0.998 1.072 -0.370) 1.511 30.336 ( -0.424 7.356 -2.288) 7.715 30.535 ( 0.959 0.984 -1.157) 1.796 30.638 ( 0.018 2.769 0.833) 2.891 31.461 ( 7.066 -1.844 -3.083) 7.927 31.561 ( -7.206 2.590 0.603) 7.681 31.880 ( -2.868 -4.075 2.994) 5.813 33.217 ( 3.942 -26.134 7.595) 27.499 33.476 ( -3.297 -34.308 -0.414) 34.469 35.816 ( -0.245 -10.151 -3.945) 10.894 ======================= Grid point 116 (53/160) ======================= q-point: (-0.33 -0.67 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( 8.271 8.449 11.328) 16.374 2.510 ( 4.991 3.760 -17.536) 18.616 2.969 ( -3.581 1.889 -8.846) 9.728 3.265 ( -0.527 -12.863 5.917) 14.169 3.580 ( -0.556 -18.259 5.361) 19.038 3.652 ( 1.257 -9.695 2.394) 10.065 3.817 ( -3.833 -2.270 7.254) 8.513 4.009 ( -0.082 -18.000 -1.838) 18.094 4.089 ( 0.622 -20.278 -3.397) 20.570 4.447 ( -6.228 -12.728 0.223) 14.172 4.643 ( -4.858 -4.448 -5.072) 8.313 4.740 ( -0.367 -4.483 -2.463) 5.128 5.017 ( 3.712 -9.848 -2.101) 10.732 5.195 ( 6.876 -21.827 2.170) 22.987 5.365 ( -4.795 -3.462 2.748) 6.521 5.546 ( -2.322 -4.390 -5.905) 7.716 5.662 ( 3.518 -18.598 3.672) 19.281 5.778 ( 1.880 -4.698 3.578) 6.197 6.129 ( -7.306 -7.182 4.126) 11.044 6.321 ( -0.264 -0.015 -0.816) 0.858 6.435 ( 2.514 -13.470 -1.083) 13.746 6.617 ( 2.052 -5.330 -0.006) 5.711 6.739 ( 2.376 -11.348 0.476) 11.604 6.935 ( -0.847 0.629 0.772) 1.308 7.075 ( 4.862 0.199 2.392) 5.423 7.133 ( -1.944 -5.884 0.171) 6.199 8.031 ( 2.450 -1.216 3.286) 4.275 8.188 ( -1.781 -3.107 -6.694) 7.592 8.427 ( -0.711 -2.654 3.828) 4.712 8.698 ( 8.824 -5.856 -3.194) 11.062 8.882 ( -7.839 -7.371 1.324) 10.841 9.127 ( -1.329 -0.617 -1.363) 2.001 9.479 ( 0.926 -0.597 5.543) 5.651 9.534 ( -1.355 -8.205 -4.345) 9.383 9.765 ( -1.097 -0.745 -6.492) 6.627 10.164 ( -1.757 9.963 -4.509) 11.076 10.378 ( 1.601 -11.529 3.882) 12.270 10.508 ( 2.192 -7.710 8.247) 11.501 10.813 ( 0.383 -1.334 0.527) 1.484 11.029 ( -3.370 -0.183 -3.284) 4.709 11.151 ( 4.534 5.098 2.300) 7.200 11.517 ( 0.264 6.426 -0.234) 6.436 12.403 ( -3.145 2.291 1.455) 4.154 12.847 ( 1.689 0.891 -6.288) 6.572 13.531 ( 0.382 1.449 2.030) 2.523 13.747 ( 1.500 -0.583 0.805) 1.799 14.480 ( -0.743 0.334 -0.669) 1.054 14.963 ( -0.065 4.465 -3.744) 5.827 15.630 ( -2.947 10.236 -2.506) 10.942 15.772 ( 2.639 6.251 3.070) 7.448 15.782 ( -0.727 3.269 -0.009) 3.349 16.093 ( 1.311 -0.545 -5.569) 5.747 16.337 ( 0.287 1.362 -0.090) 1.394 16.583 ( -0.437 9.239 1.631) 9.392 17.655 ( -1.707 4.664 4.867) 6.954 17.935 ( 0.092 -4.370 -0.121) 4.373 18.071 ( -0.195 -3.137 0.679) 3.215 18.359 ( 5.093 -0.481 -6.037) 7.914 18.875 ( -5.372 6.555 5.644) 10.182 19.127 ( -1.456 -1.170 -1.155) 2.196 19.307 ( -2.275 -2.022 0.826) 3.154 20.295 ( 2.632 4.163 1.755) 5.229 27.642 ( -0.889 2.811 -1.155) 3.167 28.355 ( 2.958 0.973 -0.081) 3.115 29.249 ( 0.566 -2.765 -0.564) 2.878 29.360 ( -1.497 -3.711 1.709) 4.351 29.568 ( 1.748 1.288 -2.390) 3.229 29.613 ( -0.583 0.186 3.350) 3.406 29.873 ( 0.432 10.843 -1.887) 11.015 30.150 ( -0.238 9.923 -3.933) 10.677 30.532 ( 1.069 -0.840 -1.588) 2.091 30.628 ( -0.614 0.596 2.529) 2.670 31.357 ( 0.930 7.629 -1.980) 7.936 31.584 ( -4.051 0.670 4.558) 6.135 32.142 ( 0.118 -23.577 0.261) 23.579 33.644 ( 0.815 -15.922 5.962) 17.021 34.025 ( 4.631 -26.317 6.329) 27.460 35.948 ( -3.809 -13.317 -10.746) 17.531 ======================= Grid point 117 (54/160) ======================= q-point: (-0.22 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( 7.614 11.142 -8.295) 15.841 2.435 ( 5.007 5.207 13.319) 15.152 2.871 ( 2.572 5.915 1.279) 6.575 3.469 ( -1.987 -7.870 4.326) 9.198 3.707 ( -8.491 2.532 4.445) 9.913 3.878 ( 6.178 -3.583 1.802) 7.366 3.953 ( 0.932 -20.278 -4.778) 20.854 4.140 ( -5.787 -4.563 -6.848) 10.060 4.389 ( -1.899 -16.445 -1.281) 16.604 4.475 ( -3.232 0.048 -2.022) 3.812 4.541 ( -3.736 5.374 -2.613) 7.047 4.757 ( -1.166 1.922 -1.416) 2.657 5.061 ( 0.103 1.115 -2.383) 2.633 5.361 ( 2.335 4.727 -1.228) 5.413 5.419 ( -4.755 -4.065 1.619) 6.462 5.447 ( -0.277 5.876 -0.984) 5.965 5.723 ( 1.190 -2.349 -3.606) 4.465 6.019 ( 4.850 -1.442 8.524) 9.912 6.240 ( 0.027 -4.664 3.399) 5.771 6.373 ( -0.772 -5.625 -4.552) 7.277 6.694 ( -1.038 -2.370 -0.572) 2.650 6.777 ( 7.307 -13.509 2.645) 15.585 6.921 ( -3.474 -9.077 3.448) 10.313 6.960 ( 3.714 -2.270 1.391) 4.570 7.145 ( 6.784 1.386 2.934) 7.521 7.302 ( -1.465 -10.061 0.752) 10.195 8.052 ( -0.667 1.999 4.870) 5.307 8.172 ( -3.037 -2.793 -7.132) 8.240 8.495 ( -0.189 -3.199 -0.481) 3.240 8.738 ( -1.278 10.134 -1.020) 10.265 8.841 ( -2.377 -0.885 1.794) 3.107 9.218 ( -0.530 -11.359 -8.526) 14.212 9.455 ( -4.329 4.257 2.403) 6.529 9.652 ( 4.345 -4.326 -6.928) 9.252 9.802 ( 0.470 -5.863 3.191) 6.691 9.989 ( 0.522 3.248 -2.189) 3.952 10.557 ( -0.461 0.604 2.167) 2.297 10.649 ( 1.270 -5.850 5.948) 8.439 10.823 ( -0.306 -3.576 -4.680) 5.898 10.948 ( -3.007 4.996 -1.137) 5.941 11.147 ( 5.952 -1.700 3.921) 7.327 11.475 ( 0.088 1.639 -0.292) 1.668 12.347 ( -2.950 1.823 2.855) 4.492 12.818 ( 2.681 0.723 -2.619) 3.817 13.523 ( 2.288 2.354 2.354) 4.040 13.783 ( 0.129 -1.986 0.546) 2.063 14.470 ( -0.557 -0.011 0.170) 0.583 14.874 ( 0.159 2.421 -3.165) 3.988 15.500 ( -1.485 1.503 -0.290) 2.133 15.670 ( 0.477 5.092 0.863) 5.187 15.824 ( -2.082 -5.079 0.740) 5.538 16.081 ( 1.112 -0.460 -4.347) 4.510 16.251 ( 1.250 5.431 -3.621) 6.646 16.500 ( -1.236 3.494 5.063) 6.275 17.590 ( -3.738 3.765 3.585) 6.403 17.965 ( -2.742 -0.860 -1.406) 3.199 18.110 ( 3.590 0.086 -1.554) 3.913 18.371 ( 5.717 -0.438 -5.803) 8.158 18.772 ( -5.735 3.917 5.101) 8.617 19.067 ( -13.073 -1.047 -1.565) 13.208 19.358 ( 9.654 1.160 0.124) 9.724 20.301 ( 2.676 0.313 3.901) 4.741 27.579 ( -1.542 1.951 -1.609) 2.962 28.379 ( 3.041 -0.037 1.860) 3.564 29.298 ( -1.983 -3.489 -0.243) 4.021 29.392 ( -1.639 -0.657 -0.330) 1.797 29.562 ( 4.390 0.784 -1.001) 4.571 29.661 ( -1.500 -3.363 2.800) 4.626 29.698 ( 0.820 6.115 -2.890) 6.813 29.989 ( 1.084 5.915 -2.442) 6.490 30.539 ( 1.649 1.455 0.725) 2.316 30.641 ( -1.838 -2.261 0.032) 2.914 31.245 ( 1.397 4.511 -2.401) 5.297 31.560 ( -5.544 1.022 6.172) 8.359 32.501 ( 0.790 -15.744 -0.621) 15.776 33.847 ( -0.037 -3.738 3.472) 5.101 34.470 ( 9.815 -11.250 10.704) 18.371 36.013 ( -6.894 -9.626 -16.228) 20.088 ======================= Grid point 118 (55/160) ======================= q-point: (-0.11 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 10.844 15.765 1.360) 19.183 2.478 ( -1.555 -0.409 1.544) 2.229 2.853 ( 14.797 11.436 18.466) 26.281 3.477 ( -0.706 9.187 -3.301) 9.788 3.600 ( -4.158 2.896 1.198) 5.207 3.952 ( -1.041 1.715 1.627) 2.583 4.059 ( -3.302 3.023 -3.602) 5.745 4.098 ( -7.587 0.301 -6.594) 10.057 4.336 ( -1.297 8.879 -0.273) 8.977 4.470 ( -2.574 -6.811 -2.383) 7.662 4.587 ( -2.232 -1.278 -1.753) 3.113 4.694 ( 0.529 -0.863 -1.290) 1.639 4.916 ( -2.407 8.996 -9.828) 13.539 5.261 ( 3.946 9.197 3.091) 10.474 5.409 ( 3.334 -1.849 0.254) 3.820 5.505 ( -3.915 -8.433 1.780) 9.466 5.759 ( 2.406 -2.502 -5.238) 6.283 6.045 ( -0.204 6.106 5.821) 8.438 6.248 ( -0.637 4.827 2.313) 5.390 6.383 ( 5.243 4.589 -3.645) 7.864 6.680 ( 1.500 2.977 -1.280) 3.571 6.872 ( 0.764 11.847 2.547) 12.142 6.898 ( 0.795 15.034 -0.054) 15.055 7.012 ( 1.997 -1.953 0.938) 2.947 7.238 ( 5.929 -1.522 9.725) 11.491 7.374 ( -2.497 -1.253 -0.402) 2.822 8.060 ( -4.331 0.657 6.812) 8.099 8.095 ( -3.358 2.433 -9.645) 10.498 8.465 ( -2.152 4.642 -1.727) 5.400 8.574 ( -1.513 2.928 0.642) 3.358 8.810 ( 3.711 6.752 4.839) 9.098 9.271 ( -3.339 -4.422 -13.060) 14.187 9.429 ( -1.458 -0.999 1.354) 2.226 9.604 ( 6.474 4.171 -5.097) 9.235 9.856 ( 3.003 6.308 1.248) 7.096 10.074 ( -5.311 -9.142 10.426) 14.849 10.530 ( -0.018 -0.257 -2.371) 2.385 10.712 ( -0.410 8.206 -3.182) 8.811 10.782 ( 0.878 -2.181 1.256) 2.666 10.900 ( -0.988 -3.595 -3.516) 5.125 11.348 ( 5.445 -8.475 -3.609) 10.700 11.396 ( -2.529 2.531 -3.076) 4.719 12.400 ( -4.803 -8.089 6.074) 11.198 12.837 ( 1.371 -1.540 2.466) 3.215 13.525 ( 4.417 2.565 1.701) 5.383 13.817 ( -2.546 -2.899 -0.168) 3.862 14.476 ( -0.529 -0.473 1.612) 1.761 14.883 ( -0.144 -5.942 0.532) 5.967 15.484 ( -1.491 1.742 1.345) 2.659 15.644 ( 0.698 -2.008 -2.182) 3.046 15.914 ( -3.568 -7.920 0.456) 8.698 16.042 ( -1.506 0.424 -1.226) 1.987 16.247 ( 5.640 -3.878 -1.276) 6.962 16.470 ( -2.730 2.716 4.078) 5.609 17.536 ( -2.819 1.514 2.288) 3.933 17.899 ( -3.502 3.877 -2.034) 5.606 18.101 ( 7.615 3.450 -4.614) 9.548 18.368 ( 4.358 1.111 -5.474) 7.085 18.743 ( -1.802 0.879 5.909) 6.240 18.969 ( -13.411 -2.430 -1.127) 13.676 19.399 ( 10.706 3.634 -0.904) 11.342 20.367 ( 0.660 -2.379 4.875) 5.465 27.543 ( -0.527 -0.223 -0.929) 1.091 28.428 ( 1.608 -1.398 3.107) 3.767 29.309 ( -5.038 -1.632 -0.680) 5.340 29.363 ( -0.397 3.188 0.030) 3.213 29.549 ( 5.160 0.684 -4.055) 6.598 29.668 ( 0.973 -0.969 -0.690) 1.536 29.767 ( -1.970 -8.061 2.310) 8.613 29.951 ( 2.190 -0.924 0.250) 2.391 30.523 ( 1.343 2.689 2.200) 3.724 30.664 ( -1.906 -2.693 -1.572) 3.655 31.207 ( 2.912 -0.180 -2.460) 3.816 31.564 ( -6.295 -1.532 7.107) 9.617 32.621 ( -2.403 0.240 -1.640) 2.919 33.817 ( 1.090 9.287 0.050) 9.351 34.689 ( 9.931 3.511 8.829) 13.745 35.881 ( -9.333 3.580 -18.633) 21.145 ======================= Grid point 123 (56/160) ======================= q-point: ( 0.44 0.44 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 2.769 0.000 -5.040) 5.751 2.246 ( 1.651 0.000 -4.846) 5.119 2.465 ( -2.020 -0.000 1.008) 2.258 2.504 ( 8.215 0.000 -1.654) 8.380 2.646 ( 1.718 0.000 4.987) 5.274 3.075 ( -3.217 -0.000 -19.721) 19.982 3.139 ( 0.069 0.000 -5.362) 5.363 3.226 ( 10.185 0.000 -10.042) 14.303 3.267 ( -0.610 -0.000 -1.276) 1.414 3.634 ( 10.260 0.000 11.766) 15.611 3.705 ( -0.740 -0.000 4.704) 4.762 3.816 ( -12.275 -0.000 21.775) 24.996 4.085 ( -4.291 -0.000 -2.999) 5.235 4.680 ( -3.424 -0.000 -3.435) 4.850 4.951 ( 1.183 0.000 1.748) 2.111 5.374 ( -2.600 -0.000 1.011) 2.790 5.544 ( -0.691 -0.000 -5.391) 5.436 5.688 ( 2.886 0.000 1.907) 3.459 6.150 ( -1.880 -0.000 0.023) 1.880 6.302 ( 22.826 0.000 13.981) 26.768 6.399 ( -21.711 -0.000 -11.210) 24.435 6.700 ( 0.709 0.000 1.737) 1.876 6.794 ( -0.474 -0.000 -0.106) 0.486 6.986 ( 3.386 0.000 -1.909) 3.887 7.117 ( -0.233 -0.000 3.048) 3.057 7.364 ( -1.974 -0.000 4.692) 5.091 7.816 ( 1.228 0.000 1.346) 1.822 8.233 ( -1.437 -0.000 -7.232) 7.373 8.387 ( -2.327 -0.000 4.203) 4.805 8.479 ( 3.870 0.000 -1.357) 4.101 8.544 ( -0.845 -0.000 3.987) 4.076 9.308 ( -4.441 -0.000 2.390) 5.043 9.339 ( 3.897 0.000 -2.195) 4.473 9.625 ( -3.010 -0.000 -4.913) 5.762 9.649 ( 0.940 0.000 1.624) 1.877 9.751 ( 0.134 0.000 0.088) 0.160 9.949 ( 4.730 0.000 -1.805) 5.063 10.101 ( 1.553 0.000 0.883) 1.787 10.494 ( -0.824 -0.000 0.582) 1.009 11.196 ( -1.167 -0.000 -1.358) 1.791 11.363 ( 0.429 0.000 -0.360) 0.560 11.839 ( 0.753 0.000 -0.933) 1.199 12.444 ( -2.470 -0.000 1.450) 2.864 12.873 ( -2.434 -0.000 -7.409) 7.799 13.517 ( -0.066 -0.000 1.691) 1.693 13.786 ( -0.336 -0.000 1.002) 1.056 14.508 ( -1.185 -0.000 -0.974) 1.534 15.117 ( -2.019 -0.000 -1.426) 2.472 16.000 ( 0.358 0.000 -0.419) 0.551 16.013 ( 2.064 0.000 -10.452) 10.654 16.171 ( 2.154 0.000 2.843) 3.567 16.181 ( -3.804 -0.000 -1.194) 3.987 16.229 ( -0.051 -0.000 4.292) 4.292 16.930 ( 1.180 0.000 -0.902) 1.485 17.690 ( 2.776 0.000 1.445) 3.130 17.799 ( -1.129 -0.000 3.975) 4.132 17.957 ( 0.317 0.000 1.806) 1.834 18.377 ( 3.302 0.000 -3.497) 4.810 18.970 ( 15.285 0.000 3.432) 15.666 19.153 ( -7.611 -0.000 1.814) 7.825 19.347 ( -11.553 -0.000 1.388) 11.636 20.505 ( 0.211 0.000 -1.352) 1.369 27.757 ( 1.572 0.000 -0.472) 1.642 28.397 ( 0.851 0.000 -3.523) 3.625 29.252 ( -1.649 -0.000 2.473) 2.972 29.403 ( 0.501 0.000 1.339) 1.429 29.587 ( 0.395 0.000 1.403) 1.457 29.632 ( -0.319 -0.000 0.157) 0.356 29.736 ( 0.116 0.000 -0.470) 0.484 30.379 ( -0.900 -0.000 -1.249) 1.539 30.616 ( 2.705 0.000 -0.636) 2.778 30.712 ( -0.889 -0.000 -0.662) 1.108 31.466 ( 6.675 0.000 -11.020) 12.884 31.959 ( -0.363 -0.000 0.139) 0.388 32.113 ( 0.353 0.000 -0.584) 0.682 32.346 ( -2.255 -0.000 8.113) 8.421 32.577 ( -4.158 -0.000 7.498) 8.574 35.648 ( -2.095 -0.000 -3.123) 3.760 ======================= Grid point 124 (57/160) ======================= q-point: (-0.44 -0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( 6.063 -39.823 -8.732) 41.217 2.566 ( 6.679 0.743 5.606) 8.751 2.628 ( -12.608 -36.342 -6.718) 39.049 2.674 ( -1.352 -20.567 -3.757) 20.951 2.915 ( 4.213 -11.513 -12.430) 17.459 3.084 ( 7.893 -22.779 -2.590) 24.247 3.124 ( -0.124 -22.688 -1.929) 22.770 3.352 ( -3.303 -17.426 -1.858) 17.834 3.633 ( -6.294 -6.653 7.821) 12.043 3.659 ( 8.675 -27.409 -4.440) 29.090 3.850 ( -5.571 -3.061 19.035) 20.068 4.008 ( -0.735 -17.472 7.343) 18.967 4.287 ( 2.529 -24.956 -1.338) 25.120 4.644 ( -3.233 -4.434 -6.712) 8.670 4.929 ( -3.597 0.689 0.486) 3.695 5.389 ( 0.560 0.768 1.047) 1.414 5.549 ( 6.478 -0.918 -1.754) 6.774 5.667 ( 0.134 4.025 1.820) 4.419 6.107 ( -5.348 1.638 -1.442) 5.777 6.207 ( -14.611 -4.009 -4.380) 15.772 6.552 ( 17.919 0.097 7.992) 19.620 6.667 ( 1.309 8.688 1.154) 8.862 6.721 ( -0.576 5.595 1.560) 5.837 6.995 ( 2.022 1.395 0.914) 2.621 7.139 ( 1.217 1.478 5.134) 5.479 7.284 ( -0.742 9.443 1.289) 9.559 7.890 ( -0.386 -5.546 3.772) 6.718 8.155 ( -0.181 0.939 -8.162) 8.218 8.395 ( -1.354 0.379 3.353) 3.636 8.524 ( 1.459 -3.607 -1.313) 4.106 8.603 ( -0.892 -3.872 5.109) 6.473 9.253 ( 1.943 6.759 -0.687) 7.067 9.363 ( -3.137 -5.649 2.851) 7.062 9.566 ( -0.399 -1.569 -8.362) 8.517 9.639 ( -0.940 3.234 -2.450) 4.165 9.883 ( 0.516 -14.062 1.430) 14.144 10.144 ( 0.206 -3.082 1.082) 3.273 10.214 ( 4.697 -23.302 2.726) 23.927 10.499 ( 0.403 0.699 2.091) 2.242 11.111 ( -5.434 2.835 -5.632) 8.324 11.356 ( 4.004 4.286 2.024) 6.205 11.788 ( -0.033 5.361 -1.387) 5.537 12.424 ( -3.176 0.104 -0.335) 3.196 12.822 ( 1.686 -1.452 -9.229) 9.493 13.535 ( -0.207 -0.472 2.066) 2.129 13.778 ( -0.060 1.360 1.352) 1.918 14.489 ( -0.749 0.123 -1.667) 1.832 15.068 ( -1.938 1.658 -3.719) 4.509 15.919 ( 2.872 4.550 -5.067) 7.391 15.967 ( -0.371 4.897 -2.702) 5.606 16.107 ( -2.270 3.569 -2.218) 4.776 16.130 ( 2.592 7.295 2.021) 8.001 16.307 ( 1.634 -2.604 3.490) 4.651 16.874 ( -0.256 5.841 -1.503) 6.037 17.743 ( -2.431 -4.382 1.414) 5.206 17.819 ( 2.370 3.126 6.650) 7.720 17.982 ( -0.706 -1.436 2.161) 2.689 18.366 ( 2.923 0.596 -4.819) 5.668 19.055 ( -14.091 2.518 5.182) 15.224 19.101 ( 9.145 -1.471 -2.237) 9.529 19.281 ( -1.849 2.788 4.260) 5.416 20.472 ( 2.605 4.412 -0.504) 5.148 27.747 ( 1.506 2.578 -0.193) 2.992 28.390 ( 3.795 0.840 -2.203) 4.468 29.245 ( -0.968 1.575 0.657) 1.962 29.324 ( 0.454 4.638 4.253) 6.309 29.592 ( 1.307 1.589 1.436) 2.509 29.706 ( 0.471 2.349 -0.076) 2.397 29.869 ( 0.356 -16.126 2.036) 16.257 30.351 ( -2.824 0.325 -4.020) 4.923 30.578 ( -0.592 2.528 -1.688) 3.097 30.711 ( 3.874 3.306 1.460) 5.298 31.405 ( 5.987 1.406 -6.882) 9.229 31.720 ( -1.146 15.916 -3.330) 16.301 31.956 ( -2.581 9.152 4.603) 10.565 32.822 ( 1.954 -38.629 2.355) 38.750 32.904 ( -1.657 -23.284 13.520) 26.975 35.600 ( -7.447 -5.455 -10.861) 14.255 ======================= Grid point 125 (58/160) ======================= q-point: (-0.33 -0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.338 ( -7.835 -3.227 -18.287) 20.154 2.629 ( -0.151 -3.034 3.678) 4.770 2.889 ( 12.538 -6.642 0.217) 14.191 3.106 ( 6.603 -14.526 2.841) 16.207 3.198 ( -3.912 -27.083 -2.837) 27.511 3.511 ( 3.226 -32.399 -9.219) 33.839 3.568 ( -8.993 -4.818 6.636) 12.171 3.680 ( 1.063 -15.330 -1.203) 15.414 3.878 ( -12.833 -34.153 4.352) 36.743 3.967 ( -0.094 -11.813 13.327) 17.809 4.300 ( -1.388 -26.038 -2.344) 26.180 4.574 ( -3.416 -29.127 -7.944) 30.384 4.610 ( 6.971 -27.051 0.152) 27.935 4.863 ( -5.678 -15.830 1.143) 16.856 5.071 ( 6.234 -31.158 -0.723) 31.783 5.343 ( -0.886 2.475 1.969) 3.285 5.565 ( 0.475 1.138 -7.454) 7.556 5.704 ( 1.438 -7.508 6.014) 9.727 6.074 ( -0.591 0.581 5.481) 5.543 6.190 ( -5.784 -6.032 -3.219) 8.955 6.480 ( -0.285 11.500 1.239) 11.570 6.633 ( -0.140 2.949 1.792) 3.454 6.728 ( 12.882 0.909 1.584) 13.011 6.926 ( -8.152 3.693 3.907) 9.765 7.137 ( 4.777 4.264 -2.961) 7.054 7.209 ( 8.279 3.230 6.407) 10.955 8.006 ( -3.978 -4.664 6.087) 8.639 8.093 ( 0.440 -1.153 -9.040) 9.123 8.405 ( -1.529 -0.937 1.730) 2.491 8.625 ( 3.974 -7.828 -2.018) 9.008 8.711 ( -3.328 -5.636 4.934) 8.196 9.153 ( -3.900 4.835 0.035) 6.211 9.425 ( -3.150 -2.461 0.696) 4.057 9.513 ( 3.452 2.320 -3.600) 5.501 9.636 ( 1.144 -7.645 -8.550) 11.527 10.172 ( -1.697 -11.136 0.030) 11.264 10.189 ( -1.266 -6.422 1.655) 6.751 10.516 ( 3.168 -0.147 6.009) 6.794 10.701 ( 5.427 -19.719 7.941) 21.940 10.971 ( -5.172 2.196 -5.621) 7.948 11.304 ( 3.829 6.970 1.624) 8.117 11.651 ( -0.453 8.709 -1.492) 8.848 12.390 ( -2.463 -0.155 -2.690) 3.651 12.808 ( 3.773 -1.510 -8.328) 9.266 13.556 ( 0.190 -0.249 2.167) 2.189 13.771 ( 0.333 0.842 1.770) 1.988 14.472 ( -0.365 -0.022 -1.524) 1.568 14.986 ( -0.800 2.631 -5.132) 5.822 15.789 ( -1.528 11.808 -3.162) 12.319 15.836 ( 1.424 5.458 -0.457) 5.659 15.982 ( 2.102 9.405 0.676) 9.661 16.060 ( 1.026 1.752 -3.775) 4.286 16.366 ( 2.100 0.011 1.235) 2.437 16.727 ( -1.709 8.605 -1.085) 8.840 17.758 ( -4.130 4.235 5.578) 8.131 17.847 ( -1.702 -3.578 1.385) 4.197 18.030 ( 0.247 -3.005 1.855) 3.540 18.350 ( 3.786 -0.255 -4.805) 6.122 18.934 ( -13.796 1.927 5.330) 14.914 19.094 ( -1.949 3.764 -2.792) 5.076 19.331 ( 8.123 -0.371 6.063) 10.143 20.403 ( 2.954 5.208 -0.954) 6.063 27.690 ( 0.451 4.399 -1.055) 4.546 28.392 ( 3.858 0.855 -1.810) 4.347 29.221 ( 0.309 0.076 -0.563) 0.647 29.331 ( -1.916 -0.702 5.005) 5.405 29.580 ( 2.228 1.177 -1.083) 2.742 29.669 ( -0.084 2.882 2.427) 3.768 30.013 ( 1.751 3.195 0.017) 3.644 30.240 ( -2.497 5.721 -5.649) 8.419 30.531 ( -0.008 1.315 -0.713) 1.496 30.683 ( 2.341 3.567 1.319) 4.466 31.451 ( -5.237 3.175 -1.973) 6.435 31.556 ( 7.970 -3.991 -0.441) 8.924 31.888 ( -0.981 -3.700 2.609) 4.632 33.362 ( -2.212 -23.528 7.218) 24.710 33.597 ( 9.717 -37.796 13.164) 41.185 35.577 ( -10.040 -12.256 -16.161) 22.631 ======================= Grid point 126 (59/160) ======================= q-point: (-0.22 -0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( -8.156 -5.656 -17.457) 20.081 2.656 ( -0.343 3.255 7.218) 7.926 3.096 ( 14.799 0.787 9.329) 17.512 3.354 ( -1.168 -8.459 6.016) 10.446 3.572 ( -2.723 -20.432 -2.655) 20.783 3.581 ( -9.307 -10.068 0.479) 13.720 3.791 ( -0.865 -9.412 -7.321) 11.955 3.998 ( 0.544 -8.653 0.678) 8.696 4.054 ( -1.284 -14.805 1.329) 14.920 4.356 ( -1.855 -13.069 0.814) 13.225 4.485 ( -4.004 -7.546 -3.811) 9.354 4.733 ( 0.105 -5.342 -0.479) 5.364 5.012 ( -2.713 -5.298 -1.448) 6.126 5.224 ( -2.551 -21.147 -2.083) 21.402 5.341 ( 2.205 -0.194 -3.356) 4.020 5.456 ( 3.502 -9.532 0.081) 10.155 5.752 ( 3.217 -0.018 4.254) 5.333 5.898 ( -6.784 -27.091 -2.396) 28.030 6.140 ( 6.676 -3.436 6.710) 10.069 6.285 ( 2.127 -3.264 -0.068) 3.896 6.435 ( -5.491 -12.471 3.537) 14.078 6.677 ( -1.651 -9.816 -0.388) 9.961 6.763 ( 2.774 -2.133 -0.710) 3.571 6.953 ( 6.464 -2.899 1.889) 7.332 7.149 ( 3.030 -4.825 -1.237) 5.831 7.272 ( 5.921 2.312 7.098) 9.528 8.019 ( -8.995 -3.367 -2.156) 9.843 8.101 ( 1.473 -0.816 -0.533) 1.766 8.432 ( -0.901 -2.996 -0.204) 3.135 8.736 ( -9.833 -2.916 -1.034) 10.309 8.840 ( 9.749 -8.744 -0.659) 13.112 9.022 ( -5.110 3.836 -1.982) 6.690 9.466 ( -1.968 -4.224 1.816) 5.002 9.550 ( 2.091 -4.614 -1.241) 5.215 9.700 ( 4.898 -4.396 -7.565) 10.027 10.073 ( -1.901 7.143 -3.758) 8.292 10.461 ( -0.259 -13.284 4.554) 14.045 10.650 ( 1.820 -5.532 5.160) 7.780 10.799 ( -2.778 3.836 -0.658) 4.782 11.010 ( 2.169 3.565 5.205) 6.672 11.262 ( 4.434 2.545 3.185) 6.023 11.523 ( 0.702 3.931 0.797) 4.072 12.349 ( -1.123 0.549 -4.190) 4.373 12.809 ( 2.995 -1.165 -5.149) 6.069 13.578 ( 1.525 0.205 1.879) 2.429 13.772 ( -0.522 0.424 0.920) 1.140 14.465 ( -0.114 -0.366 -0.540) 0.662 14.901 ( 1.115 3.208 -5.360) 6.345 15.554 ( -2.528 9.208 -1.399) 9.651 15.760 ( -1.664 3.369 0.460) 3.785 15.866 ( 3.343 8.433 3.239) 9.633 16.033 ( 1.408 -1.473 -6.199) 6.525 16.329 ( 1.717 5.286 -3.967) 6.828 16.588 ( -2.730 5.336 2.454) 6.477 17.653 ( -5.846 5.595 2.796) 8.561 17.895 ( -4.804 -3.582 1.108) 6.094 18.108 ( 3.137 -3.056 0.518) 4.410 18.371 ( 5.289 -0.909 -3.177) 6.236 18.845 ( -6.849 3.985 6.446) 10.215 18.963 ( -9.113 3.119 -2.112) 9.861 19.446 ( 8.089 -0.492 3.318) 8.757 20.353 ( 1.982 2.043 -0.695) 2.930 27.605 ( -0.631 3.882 -1.775) 4.315 28.401 ( 2.513 -0.211 -1.255) 2.817 29.233 ( -0.715 -1.856 -0.932) 2.197 29.368 ( -2.246 -1.698 3.825) 4.750 29.585 ( 3.315 -0.305 -1.304) 3.575 29.653 ( -0.423 0.985 3.358) 3.525 29.860 ( 2.011 12.297 -2.709) 12.751 30.076 ( -0.659 6.765 -4.699) 8.263 30.534 ( 0.086 -1.727 -0.043) 1.730 30.649 ( 0.455 2.724 0.780) 2.870 31.316 ( -1.363 5.320 -2.639) 6.093 31.598 ( -3.110 3.000 4.854) 6.499 32.198 ( 5.932 -21.883 0.759) 22.686 33.719 ( -2.705 -14.462 7.077) 16.327 34.345 ( 14.306 -25.199 13.348) 31.903 35.620 ( -8.575 -15.513 -16.601) 24.285 ======================= Grid point 127 (60/160) ======================= q-point: (-0.11 -0.56 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( -1.298 -7.231 -16.833) 18.366 2.635 ( -0.021 8.237 14.388) 16.579 3.174 ( -2.396 0.455 2.118) 3.230 3.475 ( -1.394 -4.544 3.355) 5.818 3.647 ( -4.471 1.402 3.382) 5.779 3.781 ( 1.214 -8.942 -2.845) 9.462 3.964 ( 0.530 -8.490 -3.288) 9.120 4.046 ( 3.186 -7.475 3.581) 8.880 4.330 ( -1.373 -10.976 -1.515) 11.165 4.389 ( 0.914 6.535 -3.808) 7.619 4.531 ( 0.827 -4.320 2.002) 4.833 4.736 ( -0.985 5.435 -0.366) 5.535 4.970 ( -0.758 2.058 -4.011) 4.572 5.315 ( 1.867 -2.850 -8.303) 8.975 5.393 ( -4.183 -1.453 2.849) 5.265 5.482 ( 1.534 5.107 2.272) 5.796 5.728 ( 2.433 0.325 -0.897) 2.614 6.117 ( -3.858 -5.022 2.169) 6.694 6.271 ( -5.120 -0.503 -2.162) 5.580 6.413 ( 9.775 -5.036 5.856) 12.458 6.630 ( -3.456 -8.072 0.590) 8.800 6.874 ( 4.782 -6.741 -6.319) 10.404 6.905 ( -1.476 -11.468 0.942) 11.601 7.075 ( 5.966 -1.814 4.337) 7.596 7.270 ( -0.096 -5.589 0.227) 5.594 7.343 ( 1.326 -1.296 7.000) 7.241 7.979 ( -7.801 -2.493 -7.034) 10.795 8.104 ( -1.087 0.884 4.437) 4.653 8.480 ( 1.061 -1.404 0.477) 1.823 8.616 ( -7.676 4.635 1.199) 9.047 8.951 ( -5.087 -3.204 -5.754) 8.321 9.055 ( 12.418 -4.423 -1.417) 13.258 9.456 ( -1.925 4.870 2.561) 5.829 9.629 ( 6.551 -2.951 -10.694) 12.884 9.851 ( -1.546 -12.629 4.367) 13.451 9.954 ( -0.661 0.414 -2.156) 2.293 10.573 ( -1.218 5.746 2.198) 6.272 10.731 ( 0.021 -3.416 1.580) 3.763 10.782 ( 0.316 -2.220 -0.975) 2.445 10.915 ( -0.255 6.778 2.740) 7.315 11.300 ( 5.061 -1.111 3.968) 6.526 11.473 ( 0.119 8.082 0.017) 8.083 12.311 ( -2.654 -2.104 -1.621) 3.755 12.827 ( 1.343 -1.915 -1.136) 2.601 13.598 ( 2.614 0.882 0.852) 2.887 13.757 ( -2.503 -0.402 -0.996) 2.723 14.473 ( -0.388 -0.689 0.538) 0.957 14.834 ( 1.050 0.857 -2.595) 2.927 15.477 ( -1.052 -0.890 0.204) 1.393 15.701 ( -0.415 4.573 3.002) 5.486 15.811 ( -0.175 1.026 1.104) 1.517 16.027 ( 0.362 -1.144 -3.961) 4.139 16.235 ( 4.136 1.327 -5.511) 7.017 16.521 ( -4.109 3.009 3.710) 6.300 17.552 ( -4.449 2.483 0.914) 5.176 17.901 ( -3.186 -0.095 0.737) 3.272 18.167 ( 5.029 0.124 -1.508) 5.252 18.394 ( 5.483 1.240 -3.771) 6.769 18.799 ( -1.856 2.071 7.624) 8.115 18.843 ( -10.599 0.304 -0.489) 10.614 19.508 ( 6.071 1.547 0.276) 6.271 20.355 ( -0.358 -1.368 0.207) 1.430 27.543 ( -0.212 1.417 -0.993) 1.743 28.419 ( 0.465 -1.401 -0.951) 1.756 29.246 ( -1.534 -1.467 -1.128) 2.403 29.401 ( -1.254 -0.365 3.480) 3.717 29.616 ( 3.222 1.627 -1.136) 3.784 29.664 ( 0.421 1.516 -0.803) 1.766 29.689 ( 0.720 1.961 0.405) 2.128 29.967 ( 0.632 2.282 -2.632) 3.540 30.572 ( -0.645 -2.427 -0.018) 2.511 30.614 ( 0.387 2.269 0.402) 2.336 31.225 ( 1.131 2.541 -2.980) 4.076 31.561 ( -5.641 1.214 6.432) 8.641 32.532 ( 3.301 -10.552 0.302) 11.060 33.887 ( -2.405 -2.463 4.740) 5.858 34.771 ( 6.173 -7.211 2.490) 9.813 35.705 ( 0.608 -8.266 -8.045) 11.551 ======================= Grid point 133 (61/160) ======================= q-point: (-0.44 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 6.769 0.000 -4.455) 8.104 1.968 ( -15.280 -0.000 -11.333) 19.024 2.476 ( 0.228 0.000 0.285) 0.365 2.521 ( -20.550 -0.000 -9.427) 22.609 2.734 ( -3.360 -0.000 4.460) 5.584 2.978 ( 26.123 0.000 5.072) 26.611 3.098 ( 3.672 0.000 -3.443) 5.033 3.118 ( 1.273 0.000 -8.207) 8.305 3.255 ( 6.884 0.000 -3.274) 7.623 3.671 ( -10.309 -0.000 1.724) 10.452 3.816 ( -11.137 -0.000 4.520) 12.019 4.042 ( 0.793 0.000 16.644) 16.663 4.115 ( 11.121 0.000 -1.177) 11.183 4.527 ( -5.114 -0.000 -6.841) 8.541 4.886 ( -6.917 -0.000 0.432) 6.930 5.461 ( 6.514 0.000 4.988) 8.204 5.537 ( 0.349 0.000 -6.078) 6.088 5.711 ( -2.578 -0.000 1.063) 2.789 6.088 ( -0.687 -0.000 5.702) 5.743 6.090 ( -2.402 -0.000 -2.741) 3.644 6.688 ( 9.517 0.000 1.585) 9.648 6.726 ( -4.593 -0.000 -2.447) 5.204 6.848 ( 8.218 0.000 4.515) 9.376 7.028 ( 3.150 0.000 -0.652) 3.216 7.213 ( 2.086 0.000 8.817) 9.060 7.421 ( -0.207 -0.000 7.727) 7.729 7.825 ( -2.901 -0.000 1.613) 3.319 8.106 ( -1.817 -0.000 -7.278) 7.502 8.413 ( -0.309 -0.000 0.965) 1.013 8.469 ( -2.302 -0.000 -1.498) 2.747 8.622 ( 0.541 0.000 7.346) 7.366 9.299 ( -0.198 -0.000 1.932) 1.942 9.348 ( 1.089 0.000 -2.344) 2.585 9.462 ( -0.619 -0.000 -11.610) 11.627 9.721 ( 1.892 0.000 4.609) 4.982 9.775 ( 1.559 0.000 0.799) 1.752 9.981 ( 0.292 0.000 1.188) 1.224 10.125 ( -1.329 -0.000 1.392) 1.924 10.535 ( 2.961 0.000 3.518) 4.598 11.040 ( -6.276 -0.000 -7.216) 9.563 11.439 ( 4.017 0.000 1.423) 4.262 11.819 ( -0.889 -0.000 -1.749) 1.962 12.385 ( -2.466 -0.000 -4.321) 4.975 12.765 ( 4.188 0.000 -9.367) 10.261 13.546 ( 0.083 0.000 2.604) 2.606 13.793 ( -0.974 -0.000 1.190) 1.538 14.470 ( -0.537 -0.000 -2.495) 2.552 15.037 ( -1.621 -0.000 -4.741) 5.010 15.913 ( 3.609 0.000 -9.592) 10.249 16.011 ( 1.046 0.000 -0.003) 1.046 16.119 ( -2.157 -0.000 -0.140) 2.162 16.251 ( 2.548 0.000 2.574) 3.622 16.305 ( 2.396 0.000 2.332) 3.344 16.906 ( -1.459 -0.000 -1.911) 2.404 17.691 ( -3.648 -0.000 2.150) 4.235 17.918 ( 1.805 0.000 6.255) 6.511 17.976 ( -2.180 -0.000 3.732) 4.322 18.356 ( 1.918 0.000 -4.691) 5.067 18.936 ( -18.561 -0.000 2.516) 18.731 19.143 ( 6.894 0.000 -3.890) 7.916 19.408 ( 6.676 0.000 11.894) 13.639 20.530 ( 3.736 0.000 -2.181) 4.326 27.794 ( 3.171 0.000 0.675) 3.242 28.416 ( 5.340 0.000 -3.631) 6.457 29.257 ( -1.349 -0.000 2.054) 2.457 29.520 ( 3.875 0.000 9.005) 9.804 29.635 ( 0.215 0.000 0.314) 0.381 29.646 ( 2.219 0.000 3.773) 4.377 29.726 ( -0.056 -0.000 -0.900) 0.902 30.296 ( -2.767 -0.000 -4.271) 5.089 30.563 ( -2.961 -0.000 -1.937) 3.538 30.804 ( 6.177 0.000 2.043) 6.506 31.437 ( 8.693 0.000 -10.159) 13.370 31.961 ( 0.251 0.000 0.235) 0.344 32.103 ( -0.152 -0.000 -1.000) 1.012 32.293 ( -0.183 -0.000 -6.296) 6.298 32.814 ( -5.118 -0.000 29.671) 30.109 35.364 ( -12.943 -0.000 -18.081) 22.236 ======================= Grid point 134 (62/160) ======================= q-point: (-0.33 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -8.967 -16.479 -18.606) 26.423 2.272 ( -11.414 -35.697 -4.441) 37.740 2.416 ( -14.816 -36.320 -4.535) 39.487 2.717 ( 2.844 -22.010 1.248) 22.228 3.010 ( -1.938 -26.521 -0.633) 26.599 3.103 ( 0.964 -8.707 0.069) 8.761 3.287 ( 4.717 -14.897 1.429) 15.691 3.335 ( 17.899 -10.995 8.398) 22.622 3.555 ( -11.861 -6.828 0.183) 13.687 3.714 ( 4.415 -26.823 -2.493) 27.298 3.822 ( -9.345 -24.991 -6.743) 27.520 4.150 ( -1.016 -2.326 10.503) 10.805 4.290 ( 2.212 -11.686 -4.542) 12.731 4.559 ( -1.317 -13.147 2.744) 13.494 4.871 ( -1.607 -3.541 1.903) 4.329 5.432 ( 3.977 5.526 -1.405) 6.952 5.576 ( 1.215 2.461 -0.902) 2.889 5.687 ( 0.723 -1.760 5.009) 5.358 6.070 ( -2.314 -1.819 -2.205) 3.677 6.168 ( 7.025 1.158 6.094) 9.372 6.630 ( -6.161 4.896 0.483) 7.884 6.715 ( 5.677 5.748 -0.762) 8.115 6.859 ( 3.168 4.441 -1.327) 5.614 7.007 ( 2.575 3.550 2.879) 5.246 7.274 ( 5.534 6.086 2.341) 8.552 7.391 ( 5.902 6.492 7.566) 11.585 7.907 ( -6.679 -7.253 6.137) 11.613 8.017 ( -2.961 0.365 -7.338) 7.922 8.393 ( -1.780 0.314 -0.764) 1.962 8.492 ( -3.766 -5.702 -1.055) 6.914 8.702 ( 2.828 -1.677 6.720) 7.481 9.237 ( -2.165 8.314 -0.803) 8.629 9.367 ( -0.057 -2.451 -1.222) 2.740 9.438 ( 3.362 -8.525 -7.825) 12.050 9.593 ( -1.224 9.070 -3.127) 9.672 9.922 ( 0.605 -13.666 2.499) 13.906 10.129 ( -3.005 -1.986 -0.127) 3.605 10.385 ( 5.328 -30.076 10.755) 32.383 10.594 ( 4.258 0.659 5.680) 7.129 10.921 ( -5.309 1.809 -7.153) 9.090 11.438 ( 3.162 4.279 0.272) 5.327 11.750 ( -1.600 5.150 -2.055) 5.772 12.331 ( -0.193 -0.631 -8.348) 8.374 12.752 ( 3.942 -1.584 -7.861) 8.935 13.571 ( 0.637 -0.191 2.787) 2.865 13.789 ( -1.112 0.228 0.998) 1.512 14.449 ( -0.650 -0.430 -2.720) 2.829 14.978 ( -0.481 1.560 -4.946) 5.209 15.863 ( 3.128 2.113 -8.375) 9.186 15.968 ( 0.755 5.852 0.342) 5.910 16.056 ( -0.627 5.181 -0.837) 5.285 16.202 ( 2.795 7.830 1.570) 8.461 16.375 ( 2.227 -2.116 0.941) 3.212 16.822 ( -2.730 5.849 -2.009) 6.760 17.711 ( -5.532 -4.001 3.094) 7.496 17.903 ( -2.654 5.012 1.544) 5.878 18.007 ( -1.094 -1.376 4.763) 5.077 18.345 ( 2.802 -0.290 -2.229) 3.592 18.840 ( -13.171 -1.332 3.981) 13.824 19.145 ( 3.450 2.244 -3.368) 5.318 19.514 ( 7.041 5.402 13.995) 16.572 20.490 ( 3.049 4.573 -5.099) 7.498 27.783 ( 3.136 5.073 -0.049) 5.964 28.416 ( 4.482 0.851 -5.123) 6.860 29.247 ( 0.427 1.992 0.513) 2.101 29.404 ( -1.217 7.539 6.266) 9.879 29.638 ( 2.105 3.677 0.307) 4.248 29.720 ( 0.275 0.888 1.821) 2.045 29.952 ( 3.347 -14.481 4.410) 15.504 30.239 ( -2.347 1.556 -3.907) 4.817 30.528 ( -2.568 -0.106 -1.289) 2.875 30.808 ( 5.315 6.142 0.015) 8.122 31.406 ( 5.835 1.637 -8.189) 10.187 31.678 ( 2.437 12.461 -1.898) 12.838 31.966 ( -2.514 8.633 2.702) 9.389 32.844 ( 7.866 -40.963 -5.549) 42.079 33.237 ( -3.736 -26.029 34.703) 43.540 35.161 ( -15.231 -7.942 -22.484) 28.295 ======================= Grid point 135 (63/160) ======================= q-point: (-0.22 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -17.906 -7.947 -16.002) 25.295 2.591 ( -1.916 -14.598 1.337) 14.784 2.973 ( -15.675 -18.211 -14.865) 28.255 3.125 ( -1.614 -28.987 0.406) 29.035 3.230 ( 0.893 -7.682 1.907) 7.965 3.383 ( -6.209 -11.079 3.778) 13.250 3.591 ( 0.640 -24.780 -1.051) 24.811 3.677 ( 8.376 -17.432 1.818) 19.425 3.856 ( 1.586 -30.943 5.664) 31.497 3.981 ( -9.136 -14.942 -1.581) 17.585 4.283 ( -0.591 -9.211 8.264) 12.389 4.448 ( 1.526 -29.108 -2.687) 29.272 4.717 ( 7.387 -35.620 -2.200) 36.444 4.795 ( -5.367 -12.988 3.135) 14.398 5.190 ( 10.162 -29.200 -1.621) 30.960 5.402 ( 2.008 -0.775 3.007) 3.698 5.452 ( 0.092 5.145 -4.413) 6.779 5.814 ( 1.408 -3.441 3.044) 4.805 6.101 ( -1.319 -3.755 0.273) 3.989 6.190 ( 1.458 -0.105 1.187) 1.883 6.491 ( -4.599 7.805 6.630) 11.226 6.613 ( -4.091 3.565 -0.520) 5.451 6.789 ( 4.087 3.794 -1.533) 5.783 7.046 ( 8.549 1.519 3.585) 9.394 7.174 ( 6.479 6.474 -4.513) 10.210 7.402 ( 2.133 3.814 4.640) 6.374 7.879 ( -8.754 -1.028 -4.396) 9.850 8.068 ( -1.278 -4.718 3.716) 6.141 8.387 ( -0.496 -1.683 0.331) 1.785 8.559 ( -5.709 -6.991 -1.853) 9.214 8.797 ( 1.440 -1.981 2.127) 3.244 9.094 ( -1.193 5.039 2.089) 5.583 9.381 ( -0.286 -4.477 -5.709) 7.261 9.475 ( 0.523 -0.004 -4.330) 4.362 9.613 ( 5.401 -8.228 -2.048) 10.053 10.106 ( -3.219 1.602 -1.556) 3.917 10.208 ( -2.006 -17.049 2.742) 17.385 10.652 ( 2.336 -0.216 4.664) 5.221 10.811 ( -2.228 1.722 -1.940) 3.419 11.042 ( 10.703 -19.896 17.812) 28.769 11.360 ( 2.155 6.081 -0.525) 6.473 11.615 ( -0.931 6.403 -1.561) 6.656 12.289 ( 2.499 -1.553 -11.361) 11.736 12.760 ( 2.251 -2.127 -5.626) 6.422 13.597 ( 0.375 0.044 2.265) 2.296 13.783 ( -0.542 0.274 -0.055) 0.610 14.440 ( -0.548 -1.244 -1.959) 2.384 14.917 ( 1.949 1.946 -4.975) 5.686 15.721 ( -0.926 11.158 -3.977) 11.882 15.856 ( 0.479 7.763 1.515) 7.924 15.973 ( 1.852 1.390 -5.189) 5.682 16.087 ( 2.806 9.376 1.988) 9.987 16.386 ( 1.383 2.658 -2.781) 4.088 16.670 ( -3.902 6.715 -0.338) 7.774 17.715 ( -8.009 5.068 2.048) 9.696 17.799 ( -4.839 -2.601 0.823) 5.555 18.078 ( 1.290 -3.509 2.727) 4.628 18.384 ( 4.310 -0.920 0.631) 4.452 18.815 ( -8.165 -1.735 4.305) 9.392 19.050 ( -1.204 8.633 -0.053) 8.717 19.551 ( 3.144 4.208 8.921) 10.352 20.388 ( 1.227 3.519 -6.017) 7.078 27.681 ( 0.691 6.985 -2.045) 7.311 28.397 ( 2.180 0.142 -4.687) 5.171 29.220 ( 1.028 1.088 -0.804) 1.699 29.369 ( -2.671 0.697 5.156) 5.849 29.605 ( 2.416 1.393 -0.953) 2.947 29.713 ( 0.306 2.454 3.310) 4.131 30.040 ( 1.596 6.884 -1.041) 7.143 30.138 ( -1.344 5.593 -3.600) 6.786 30.512 ( -1.524 -0.639 -0.270) 1.675 30.724 ( 2.484 5.216 -1.538) 5.978 31.338 ( -3.448 1.879 -3.832) 5.487 31.679 ( 3.338 2.792 3.184) 5.392 31.953 ( 6.756 -11.555 1.659) 13.487 33.427 ( 0.446 -24.579 4.974) 25.081 34.068 ( 12.300 -34.555 22.377) 42.965 35.123 ( -9.495 -19.877 -17.847) 28.351 ======================= Grid point 136 (64/160) ======================= q-point: (-0.11 -0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -9.310 -13.172 -13.139) 20.804 2.781 ( -16.524 -1.486 -2.890) 16.840 2.801 ( -12.366 -12.530 -8.210) 19.425 3.404 ( 2.014 -9.259 -0.417) 9.484 3.557 ( -4.089 -14.285 6.587) 16.253 3.572 ( 0.701 -14.797 -0.634) 14.827 3.883 ( 8.096 -8.364 7.636) 13.922 4.023 ( 1.991 -11.616 0.369) 11.791 4.084 ( 0.974 -9.735 1.999) 9.986 4.386 ( 1.740 -15.211 2.873) 15.577 4.511 ( 7.013 -5.450 4.018) 9.748 4.701 ( -1.815 -8.737 -1.183) 9.001 4.924 ( -4.078 -4.347 0.963) 6.038 5.187 ( 5.303 -13.988 -8.204) 17.061 5.321 ( -1.723 3.505 3.436) 5.202 5.560 ( 4.473 -4.855 -0.479) 6.619 5.672 ( -7.753 -10.593 -4.632) 13.920 5.898 ( 6.592 -11.535 -0.373) 13.291 6.133 ( 0.196 -11.497 -4.111) 12.211 6.404 ( -7.626 2.000 7.382) 10.800 6.486 ( 3.842 -19.748 5.062) 20.745 6.614 ( -4.022 -9.541 2.539) 10.661 6.775 ( 2.401 -1.384 -4.917) 5.644 7.123 ( 5.091 -0.970 3.298) 6.143 7.150 ( 0.796 -3.782 -3.513) 5.223 7.386 ( -1.231 0.808 3.876) 4.146 7.811 ( -3.342 -2.758 -10.180) 11.064 8.128 ( -1.506 -1.253 5.167) 5.526 8.464 ( 2.703 -3.605 3.851) 5.928 8.574 ( -6.648 -2.353 -1.787) 7.275 8.776 ( -5.555 -0.832 -3.384) 6.557 9.157 ( 11.372 -2.891 4.618) 12.610 9.436 ( -1.864 -6.435 -3.770) 7.687 9.531 ( 1.451 -6.790 -4.516) 8.282 9.715 ( 4.215 -1.363 -0.926) 4.525 10.003 ( -1.504 5.549 -1.656) 5.983 10.478 ( -2.720 -15.205 1.525) 15.522 10.666 ( -2.892 0.051 -0.512) 2.937 10.811 ( 3.055 0.737 2.847) 4.240 11.146 ( 2.009 12.930 4.223) 13.750 11.384 ( 2.190 2.788 3.949) 5.307 11.637 ( 7.501 1.552 10.991) 13.397 12.241 ( 1.741 -0.268 -11.927) 12.057 12.779 ( 0.422 -2.603 -3.059) 4.038 13.600 ( -2.489 0.013 0.380) 2.518 13.761 ( 1.325 1.570 -2.113) 2.947 14.451 ( -0.420 -1.388 -0.695) 1.608 14.865 ( 2.989 2.689 -4.411) 5.968 15.515 ( -1.675 7.113 0.825) 7.354 15.770 ( 0.222 4.361 3.360) 5.510 15.955 ( 0.373 -1.647 -6.311) 6.533 15.971 ( 3.921 8.839 3.140) 10.166 16.277 ( 1.314 5.582 -6.319) 8.534 16.558 ( -5.087 3.506 2.010) 6.497 17.564 ( -6.060 3.947 -0.319) 7.239 17.853 ( -2.966 -3.894 2.479) 5.487 18.165 ( 2.039 -2.957 0.870) 3.696 18.430 ( 3.936 0.055 -0.618) 3.985 18.791 ( -7.186 1.874 0.828) 7.472 18.911 ( -0.435 5.438 6.817) 8.731 19.558 ( -0.728 1.139 2.479) 2.824 20.325 ( -0.654 0.198 -4.101) 4.158 27.573 ( -0.337 3.509 -1.530) 3.842 28.382 ( -0.030 -0.959 -3.940) 4.056 29.221 ( 1.435 -0.575 -0.987) 1.834 29.393 ( -1.772 -1.432 4.084) 4.677 29.616 ( 1.942 -0.869 -0.724) 2.247 29.696 ( 0.051 2.314 2.720) 3.572 29.862 ( 2.160 12.167 -1.689) 12.472 30.001 ( -0.787 4.985 -4.063) 6.479 30.513 ( -2.351 -1.518 -0.724) 2.891 30.673 ( 1.978 2.233 -0.169) 2.988 31.255 ( -0.794 2.842 -2.883) 4.125 31.612 ( -4.367 4.784 5.459) 8.471 32.344 ( 9.663 -17.788 1.486) 20.298 33.774 ( -3.536 -12.801 7.472) 15.238 34.572 ( -3.289 -14.979 -7.576) 17.105 35.513 ( 16.938 -22.260 6.376) 28.689 ======================= Grid point 143 (65/160) ======================= q-point: (-0.33 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -19.268 -0.000 -13.419) 23.480 1.705 ( -0.492 -0.000 -3.602) 3.635 1.916 ( -33.792 -0.000 -7.813) 34.684 2.503 ( -0.457 -0.000 0.400) 0.607 2.672 ( -3.418 -0.000 -0.164) 3.422 3.072 ( -1.844 -0.000 -12.215) 12.353 3.146 ( 5.033 0.000 0.256) 5.040 3.264 ( -22.758 -0.000 -16.210) 27.940 3.390 ( 9.695 0.000 -2.236) 9.950 3.541 ( -4.860 -0.000 2.864) 5.641 3.666 ( 22.609 0.000 14.724) 26.981 4.105 ( -14.978 -0.000 7.122) 16.585 4.298 ( 12.923 0.000 -2.619) 13.186 4.477 ( -0.252 -0.000 11.601) 11.603 4.860 ( 2.082 0.000 1.713) 2.696 5.525 ( 5.731 0.000 -2.042) 6.084 5.641 ( 6.719 0.000 1.224) 6.830 5.686 ( -3.675 -0.000 5.321) 6.467 6.052 ( 2.751 0.000 0.696) 2.838 6.288 ( 7.151 0.000 5.248) 8.870 6.596 ( -7.554 -0.000 -1.813) 7.769 6.809 ( 1.519 0.000 -5.084) 5.306 6.913 ( 7.202 0.000 -2.128) 7.510 7.056 ( 2.378 0.000 -1.675) 2.908 7.410 ( 8.159 0.000 4.482) 9.309 7.617 ( 4.351 0.000 11.928) 12.697 7.769 ( -6.699 -0.000 1.505) 6.866 7.947 ( -7.437 -0.000 -3.635) 8.278 8.378 ( -1.036 -0.000 -2.078) 2.322 8.382 ( -5.928 -0.000 -0.716) 5.971 8.770 ( 3.246 0.000 7.570) 8.236 9.279 ( -0.337 -0.000 -7.700) 7.708 9.350 ( 2.743 0.000 -5.548) 6.189 9.355 ( 3.110 0.000 2.417) 3.939 9.798 ( 1.976 0.000 0.120) 1.979 9.831 ( 1.449 0.000 3.830) 4.095 10.009 ( -3.922 -0.000 6.887) 7.925 10.095 ( -3.510 -0.000 0.784) 3.597 10.684 ( 4.212 0.000 6.273) 7.556 10.847 ( -2.991 -0.000 -6.248) 6.927 11.493 ( 2.292 0.000 -1.165) 2.571 11.761 ( -2.806 -0.000 -2.080) 3.493 12.252 ( 2.329 0.000 -13.942) 14.135 12.715 ( 2.741 0.000 -5.927) 6.530 13.600 ( 1.126 0.000 3.295) 3.482 13.778 ( -2.127 -0.000 -0.295) 2.147 14.414 ( -1.095 -0.000 -3.066) 3.256 14.958 ( 0.439 0.000 -4.236) 4.259 15.834 ( 3.123 0.000 -9.863) 10.345 16.014 ( -0.145 -0.000 -0.734) 0.748 16.127 ( 1.425 0.000 2.125) 2.559 16.320 ( 2.467 0.000 1.055) 2.683 16.355 ( 2.082 0.000 -0.284) 2.101 16.835 ( -3.641 -0.000 -1.896) 4.105 17.648 ( -5.875 -0.000 2.777) 6.499 17.909 ( -5.119 -0.000 -1.045) 5.225 18.035 ( -1.494 -0.000 5.345) 5.549 18.365 ( 3.540 0.000 1.932) 4.033 18.773 ( -7.964 -0.000 4.385) 9.091 19.164 ( 3.112 0.000 -3.854) 4.953 19.762 ( 7.845 0.000 19.498) 21.017 20.514 ( 3.807 0.000 -8.704) 9.501 27.876 ( 5.947 0.000 -0.108) 5.948 28.412 ( 4.277 0.000 -8.112) 9.170 29.281 ( 1.112 0.000 1.885) 2.189 29.647 ( 0.570 0.000 0.405) 0.699 29.673 ( 1.628 0.000 4.045) 4.360 29.710 ( -0.111 -0.000 -0.971) 0.977 29.792 ( 2.993 0.000 8.915) 9.404 30.221 ( -1.070 -0.000 -0.663) 1.259 30.486 ( -3.799 -0.000 -1.269) 4.006 30.918 ( 5.808 0.000 -0.331) 5.818 31.437 ( 13.068 0.000 -16.389) 20.961 31.973 ( 0.727 0.000 0.256) 0.771 32.083 ( -0.465 -0.000 -0.962) 1.069 32.226 ( 6.221 0.000 -8.398) 10.451 33.226 ( -12.703 -0.000 48.251) 49.895 34.774 ( -18.018 -0.000 -26.688) 32.201 ======================= Grid point 144 (66/160) ======================= q-point: (-0.22 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( -24.958 -9.647 -13.115) 29.799 2.034 ( -19.769 -42.904 -3.832) 47.395 2.168 ( -5.045 -47.969 -0.921) 48.243 2.723 ( -19.084 -11.196 -16.762) 27.759 2.835 ( -12.850 -33.003 -7.248) 36.150 2.891 ( -8.493 -27.572 -9.342) 30.325 3.195 ( 3.851 -1.513 0.602) 4.181 3.350 ( 5.646 -15.076 0.241) 16.101 3.652 ( -5.400 -20.476 9.045) 23.027 3.830 ( 8.957 -31.111 -2.162) 32.447 3.893 ( 6.325 -2.815 3.208) 7.631 4.160 ( 2.076 -10.120 17.134) 20.007 4.461 ( 11.958 -7.997 1.559) 14.469 4.613 ( -1.883 -6.885 5.657) 9.108 4.953 ( 8.096 -7.745 -0.126) 11.205 5.490 ( 5.601 5.925 -4.477) 9.302 5.602 ( 0.557 7.353 4.488) 8.632 5.760 ( 0.413 -3.488 -0.251) 3.522 6.117 ( 6.428 -0.181 5.100) 8.207 6.276 ( 0.100 8.519 -0.759) 8.554 6.533 ( -7.892 -0.380 2.569) 8.309 6.672 ( -6.320 6.434 -2.859) 9.461 6.909 ( 11.091 5.751 -7.206) 14.422 7.094 ( 4.520 -2.204 -2.152) 5.470 7.413 ( 3.686 13.537 4.041) 14.600 7.495 ( -0.428 5.920 -2.445) 6.420 7.812 ( -6.685 3.595 -1.096) 7.669 7.959 ( -3.501 -10.802 5.999) 12.843 8.376 ( 1.299 -1.389 1.960) 2.731 8.395 ( -5.137 -5.733 -0.539) 7.717 8.830 ( 1.232 2.332 4.400) 5.130 9.206 ( 0.910 5.288 -0.490) 5.388 9.273 ( -0.604 1.923 -7.675) 7.936 9.474 ( 1.871 -1.484 -2.586) 3.520 9.526 ( -0.402 1.573 0.962) 1.887 9.945 ( -1.890 -11.643 -0.245) 11.798 10.078 ( -2.406 -1.943 1.465) 3.422 10.680 ( -0.179 -3.965 -1.464) 4.230 10.737 ( 9.619 -39.213 18.542) 44.430 10.845 ( 5.840 0.557 4.022) 7.112 11.459 ( 1.427 4.262 -2.453) 5.120 11.679 ( -3.297 4.517 -2.146) 5.990 12.178 ( 4.376 -1.990 -18.113) 18.740 12.708 ( 1.351 -1.346 -4.091) 4.514 13.627 ( 0.216 0.755 3.337) 3.428 13.761 ( -1.610 -0.989 -1.914) 2.690 14.399 ( -0.390 -1.120 -1.664) 2.043 14.926 ( 1.613 1.072 -4.251) 4.671 15.773 ( 0.992 1.658 -9.020) 9.224 15.965 ( -0.245 4.652 -1.142) 4.796 16.085 ( 2.247 8.155 2.717) 8.885 16.264 ( 3.329 6.961 0.200) 7.719 16.395 ( 1.155 -0.680 -1.953) 2.369 16.738 ( -4.542 5.614 -1.126) 7.308 17.659 ( -5.982 -3.863 2.946) 7.706 17.804 ( -6.523 5.468 -1.556) 8.653 18.067 ( 0.354 -1.170 4.034) 4.215 18.419 ( 3.118 -0.296 3.143) 4.437 18.769 ( -3.900 -1.229 4.171) 5.841 19.140 ( 0.837 2.555 -2.036) 3.373 19.824 ( 1.188 14.966 17.360) 22.951 20.408 ( 1.268 5.089 -10.670) 11.889 27.820 ( 3.665 9.720 -4.235) 11.218 28.374 ( 1.761 0.341 -7.270) 7.488 29.277 ( 2.752 3.745 -0.019) 4.648 29.442 ( -2.846 8.177 3.659) 9.400 29.656 ( 1.039 3.287 -0.856) 3.553 29.765 ( 0.808 0.338 2.112) 2.286 30.047 ( 1.584 -8.293 1.810) 8.635 30.199 ( -0.676 3.030 1.613) 3.499 30.466 ( -2.973 -2.028 -0.860) 3.700 30.850 ( 4.301 9.883 -6.248) 12.458 31.299 ( 0.952 3.970 -13.882) 14.470 31.790 ( 9.062 3.326 3.205) 10.171 31.966 ( -0.601 5.730 1.707) 6.009 32.933 ( 13.781 -42.516 -6.156) 45.116 33.777 ( -4.323 -29.720 45.704) 54.688 34.571 ( -12.788 -17.682 -19.079) 28.986 ======================= Grid point 145 (67/160) ======================= q-point: (-0.11 -0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -17.773 -16.511 -7.519) 25.398 2.112 ( -37.093 -14.450 -26.859) 48.022 2.718 ( 2.544 -20.286 8.971) 22.327 3.112 ( -1.404 -27.981 1.086) 28.037 3.281 ( 5.634 -9.464 -5.670) 12.387 3.301 ( -3.381 -33.601 -5.345) 34.191 3.454 ( -13.700 -45.252 3.854) 47.437 3.737 ( 1.176 -23.970 -0.958) 24.018 3.855 ( -9.377 -8.779 3.690) 13.364 4.109 ( 7.863 -13.852 8.947) 18.269 4.433 ( 2.399 -17.874 3.126) 18.303 4.568 ( 11.400 -12.448 5.853) 17.866 4.739 ( -1.986 -17.152 4.576) 17.863 4.899 ( 9.621 -26.335 1.840) 28.098 5.291 ( 7.962 -23.338 -5.855) 25.344 5.386 ( 2.450 2.813 -6.682) 7.653 5.515 ( 1.451 6.427 5.443) 8.546 5.786 ( -1.263 -3.937 -3.505) 5.420 6.037 ( -2.880 5.808 -5.867) 8.743 6.281 ( 1.805 -6.420 7.250) 9.851 6.473 ( -13.058 3.030 7.222) 15.226 6.547 ( -0.537 2.369 -0.009) 2.429 6.805 ( 3.757 6.208 -7.596) 10.505 7.122 ( 1.698 -0.034 -5.463) 5.721 7.184 ( -5.237 8.909 -1.099) 10.392 7.422 ( -0.962 2.627 2.280) 3.609 7.730 ( 3.303 0.645 -7.695) 8.398 8.104 ( -1.990 -4.913 5.859) 7.901 8.451 ( -3.124 -3.650 2.209) 5.288 8.479 ( 2.923 -4.712 4.324) 7.032 8.739 ( -6.029 3.445 -1.421) 7.088 9.199 ( 4.149 -2.012 0.359) 4.626 9.270 ( -0.150 -6.022 -2.619) 6.569 9.421 ( 1.923 -2.436 -5.661) 6.456 9.710 ( 4.750 -6.641 2.306) 8.485 10.021 ( -4.137 -1.606 -1.833) 4.802 10.217 ( -1.546 -12.796 2.495) 13.129 10.623 ( -2.712 -0.435 -2.936) 4.021 10.903 ( 5.431 2.614 5.638) 8.253 11.345 ( 0.942 7.949 -2.352) 8.343 11.483 ( -0.094 3.626 6.298) 7.268 11.749 ( 18.659 -17.671 25.014) 35.863 12.133 ( 9.525 -3.926 -24.183) 26.286 12.718 ( 0.146 -1.990 -2.697) 3.355 13.605 ( -4.222 3.219 2.188) 5.742 13.761 ( 2.352 -1.218 -4.032) 4.824 14.420 ( 0.750 -1.667 0.012) 1.828 14.887 ( 1.909 1.433 -4.994) 5.535 15.642 ( -2.311 7.541 -3.081) 8.468 15.874 ( 0.550 2.922 -2.088) 3.633 15.967 ( 2.719 9.248 2.290) 9.907 16.170 ( 3.619 7.962 1.468) 8.868 16.335 ( 0.364 5.053 -5.223) 7.276 16.597 ( -5.570 5.331 0.903) 7.762 17.588 ( -7.557 5.769 -0.477) 9.519 17.768 ( -1.780 -5.514 2.499) 6.310 18.133 ( 0.378 -2.831 2.448) 3.762 18.448 ( 0.660 0.116 -0.272) 0.723 18.790 ( -2.087 0.761 3.070) 3.789 19.049 ( -1.497 6.728 2.616) 7.372 19.603 ( -11.715 8.961 4.747) 15.495 20.298 ( -0.317 1.430 -5.648) 5.835 27.632 ( -1.227 6.647 -4.544) 8.144 28.336 ( -0.464 -0.374 -4.933) 4.969 29.236 ( 2.559 1.474 -0.867) 3.078 29.400 ( -0.525 0.336 2.980) 3.044 29.623 ( 1.414 0.985 -0.963) 1.973 29.758 ( -0.139 2.199 2.008) 2.981 30.032 ( -0.022 6.903 -0.992) 6.974 30.083 ( -1.680 8.836 -1.468) 9.113 30.470 ( -1.996 -0.899 -1.582) 2.701 30.712 ( 1.195 2.576 -3.800) 4.744 31.242 ( -1.400 -1.384 -3.561) 4.069 31.734 ( -2.789 8.828 4.706) 10.385 32.157 ( 14.321 -15.768 1.441) 21.350 33.524 ( 1.020 -21.702 6.704) 22.736 34.157 ( -11.302 -15.669 -15.537) 24.793 35.311 ( 31.646 -38.563 24.312) 55.495 ======================= Grid point 153 (68/160) ======================= q-point: (-0.22 -0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.965 ( -25.594 -0.000 -7.582) 26.693 1.287 ( -40.422 -0.000 5.143) 40.748 1.667 ( 1.498 0.000 -0.519) 1.586 2.029 ( -46.084 -0.000 -40.055) 61.059 2.360 ( -9.916 -0.000 -4.778) 11.007 2.711 ( 2.533 0.000 1.782) 3.097 3.230 ( 5.466 0.000 -1.300) 5.618 3.244 ( 5.908 0.000 -0.275) 5.914 3.437 ( 1.695 0.000 1.650) 2.366 3.655 ( 7.661 0.000 3.518) 8.430 3.877 ( -7.967 -0.000 3.083) 8.543 4.344 ( 10.049 0.000 24.551) 26.528 4.429 ( 9.840 0.000 -4.633) 10.877 4.617 ( 0.374 0.000 3.876) 3.894 4.964 ( 8.230 0.000 -0.612) 8.253 5.547 ( 2.719 0.000 -4.923) 5.623 5.678 ( 3.420 0.000 -4.066) 5.313 5.778 ( 1.341 0.000 7.859) 7.973 6.227 ( 9.800 0.000 5.974) 11.477 6.406 ( 5.758 0.000 -9.978) 11.521 6.440 ( -9.772 -0.000 -0.019) 9.772 6.639 ( -8.404 -0.000 1.483) 8.533 6.991 ( 9.001 0.000 -11.372) 14.504 7.057 ( 2.470 0.000 -3.451) 4.244 7.515 ( 3.719 0.000 -5.558) 6.687 7.659 ( -9.353 -0.000 1.437) 9.462 7.749 ( -4.631 -0.000 -1.962) 5.029 7.869 ( 1.846 0.000 8.275) 8.479 8.276 ( -5.958 -0.000 -0.167) 5.961 8.420 ( 4.428 0.000 4.499) 6.312 8.942 ( 5.492 0.000 6.724) 8.682 9.187 ( -0.427 -0.000 -2.031) 2.076 9.345 ( 3.893 0.000 -2.983) 4.905 9.461 ( 4.599 0.000 3.479) 5.767 9.799 ( -0.480 -0.000 -2.836) 2.877 9.864 ( 0.212 0.000 -0.496) 0.540 10.031 ( -6.192 -0.000 5.744) 8.446 10.083 ( -1.612 -0.000 3.723) 4.057 10.640 ( -3.247 -0.000 -5.039) 5.994 10.962 ( 7.480 0.000 8.136) 11.052 11.481 ( 0.948 0.000 -4.024) 4.134 11.674 ( -4.677 -0.000 -1.204) 4.829 12.053 ( 2.158 0.000 -17.807) 17.938 12.682 ( 0.828 0.000 -2.440) 2.577 13.662 ( 0.740 0.000 2.372) 2.485 13.714 ( -3.641 -0.000 -0.459) 3.670 14.386 ( 0.891 0.000 0.596) 1.072 14.911 ( 0.684 0.000 -4.870) 4.918 15.719 ( -0.094 -0.000 -9.077) 9.078 15.999 ( -0.276 -0.000 -0.604) 0.664 16.208 ( 3.139 0.000 3.483) 4.689 16.352 ( 2.194 0.000 -1.937) 2.927 16.375 ( 2.159 0.000 -1.473) 2.614 16.746 ( -4.890 -0.000 -0.584) 4.925 17.597 ( -4.490 -0.000 2.076) 4.947 17.796 ( -5.878 -0.000 -0.328) 5.887 18.097 ( 1.438 0.000 3.644) 3.918 18.452 ( 0.173 0.000 1.453) 1.463 18.777 ( 0.947 0.000 4.394) 4.495 19.142 ( -0.826 -0.000 -1.022) 1.314 20.178 ( 4.577 0.000 21.037) 21.529 20.428 ( 6.168 0.000 -11.799) 13.314 27.935 ( 8.944 0.000 -12.111) 15.055 28.334 ( 0.372 0.000 -6.458) 6.469 29.348 ( 4.129 0.000 1.415) 4.365 29.663 ( 0.645 0.000 0.347) 0.733 29.697 ( -0.100 -0.000 -0.619) 0.628 29.728 ( 1.394 0.000 0.780) 1.597 29.896 ( -0.505 -0.000 1.821) 1.889 30.239 ( -0.941 -0.000 3.868) 3.981 30.411 ( -3.456 -0.000 -0.385) 3.477 30.961 ( 7.393 0.000 -11.146) 13.375 31.248 ( 11.392 0.000 -41.721) 43.248 31.990 ( 0.971 0.000 0.202) 0.992 32.063 ( -0.621 -0.000 -0.554) 0.833 32.327 ( 11.323 0.000 5.346) 12.522 33.774 ( -20.541 -0.000 45.980) 50.360 34.173 ( -14.033 -0.000 5.185) 14.960 ======================= Grid point 154 (69/160) ======================= q-point: (-0.11 -0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.912 ( -25.930 -14.445 0.040) 29.682 1.362 ( -42.141 -14.242 -23.365) 50.245 1.968 ( -23.395 -75.251 -2.226) 78.835 2.185 ( 3.158 -46.156 4.012) 46.438 2.653 ( -11.131 -40.771 -3.479) 42.406 2.845 ( 0.443 -11.129 0.565) 11.152 3.247 ( 5.268 -0.306 -3.694) 6.441 3.449 ( 5.631 -14.592 -0.019) 15.641 3.728 ( -2.178 -19.195 3.603) 19.651 3.865 ( -0.961 -14.789 -0.408) 14.826 3.946 ( 5.011 -23.284 2.867) 23.989 4.546 ( 6.871 -7.305 8.076) 12.876 4.631 ( -0.501 -6.183 1.998) 6.517 4.668 ( 7.492 -6.724 9.642) 13.939 5.063 ( 7.092 -7.048 -4.214) 10.850 5.457 ( 2.470 6.732 -8.321) 10.985 5.671 ( 3.864 2.632 -1.605) 4.943 5.773 ( 1.151 6.039 1.147) 6.254 6.106 ( -8.542 12.361 -11.315) 18.810 6.344 ( 4.118 1.577 7.175) 8.422 6.377 ( -10.193 -0.777 -3.326) 10.750 6.588 ( -5.309 2.102 0.580) 5.739 6.904 ( 4.953 6.091 -8.713) 11.728 7.086 ( 1.363 -0.408 -5.132) 5.325 7.316 ( -6.375 14.441 -5.001) 16.559 7.507 ( 0.346 5.128 3.574) 6.260 7.718 ( -1.809 -0.290 -4.551) 4.905 8.025 ( -0.793 -7.247 6.698) 9.900 8.319 ( -3.873 -8.483 1.131) 9.393 8.504 ( 3.991 -1.202 5.438) 6.851 8.829 ( -5.231 16.053 -1.053) 16.917 9.143 ( -2.230 1.387 -4.193) 4.948 9.280 ( 1.252 2.150 3.778) 4.524 9.394 ( -0.106 2.173 -3.325) 3.974 9.621 ( 4.019 -8.963 3.679) 10.489 9.849 ( -4.574 -8.445 -3.769) 10.317 10.096 ( -0.806 -4.806 2.216) 5.353 10.576 ( -1.092 -0.000 -4.693) 4.818 11.049 ( 6.341 2.857 6.387) 9.443 11.395 ( 14.244 -16.905 -5.421) 22.761 11.480 ( 35.323 -44.659 1.313) 56.955 11.596 ( -0.088 -1.351 -3.672) 3.913 11.993 ( -3.028 -1.841 10.405) 10.992 12.682 ( 0.388 -0.842 -1.424) 1.699 13.664 ( -0.930 2.246 2.052) 3.182 13.714 ( -0.350 -1.506 1.607) 2.229 14.416 ( 1.685 -0.863 1.953) 2.720 14.872 ( -0.677 0.386 -4.255) 4.325 15.647 ( -2.016 1.044 -6.304) 6.701 15.947 ( -0.101 5.320 -0.621) 5.357 16.189 ( 3.877 7.870 4.534) 9.875 16.301 ( 1.840 5.232 -2.795) 6.211 16.372 ( 1.929 1.761 -2.732) 3.779 16.655 ( -5.237 5.268 0.696) 7.461 17.601 ( -5.235 0.375 0.910) 5.326 17.715 ( -3.188 1.404 0.918) 3.602 18.130 ( 1.083 0.050 2.591) 2.809 18.432 ( -2.422 0.221 -3.551) 4.304 18.830 ( 3.123 0.530 3.647) 4.831 19.120 ( -2.724 2.186 0.707) 3.564 19.854 ( -25.287 40.902 0.576) 48.091 20.288 ( 0.244 1.231 -3.301) 3.531 27.699 ( -3.004 10.844 -14.969) 18.727 28.298 ( -0.812 0.154 -3.057) 3.167 29.313 ( 1.266 7.530 -1.255) 7.738 29.434 ( -0.774 2.893 0.243) 3.004 29.657 ( 0.710 2.563 -0.852) 2.793 29.783 ( -0.327 0.409 -0.642) 0.828 30.073 ( 0.060 -3.224 0.593) 3.278 30.209 ( -2.316 6.711 1.669) 7.293 30.419 ( -0.979 -2.396 -0.966) 2.763 30.712 ( 2.021 3.465 -18.984) 19.404 31.127 ( -0.553 -6.016 -6.978) 9.230 31.919 ( -1.409 10.662 3.505) 11.311 32.080 ( 13.281 -8.555 0.334) 15.801 33.123 ( 17.778 -39.209 -2.021) 43.098 33.708 ( -17.018 -7.702 -19.101) 26.717 35.088 ( 34.940 -52.552 57.202) 85.174 ======================= Grid point 163 (70/160) ======================= q-point: (-0.11 -0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.507 ( -27.818 -0.000 8.638) 29.128 0.726 ( -48.369 -0.000 -14.181) 50.405 0.830 ( -44.346 -0.000 22.180) 49.583 1.768 ( 5.003 0.000 6.315) 8.056 2.133 ( -9.788 -0.000 -2.451) 10.090 2.750 ( -0.021 -0.000 1.308) 1.308 3.267 ( 4.915 0.000 -3.316) 5.929 3.307 ( 3.059 0.000 -1.371) 3.352 3.465 ( 4.995 0.000 -8.385) 9.760 3.783 ( -3.384 -0.000 -5.428) 6.397 3.833 ( 1.747 0.000 10.306) 10.453 4.498 ( 6.851 0.000 -3.667) 7.771 4.624 ( -2.771 -0.000 6.748) 7.295 4.772 ( 0.395 0.000 13.134) 13.140 5.026 ( 5.125 0.000 -5.872) 7.794 5.482 ( 4.463 0.000 -12.815) 13.570 5.706 ( 5.486 0.000 -1.510) 5.690 5.855 ( -1.221 -0.000 -10.276) 10.349 6.011 ( -16.058 -0.000 -22.867) 27.942 6.290 ( -7.764 -0.000 0.399) 7.774 6.449 ( 4.763 0.000 5.252) 7.090 6.519 ( -7.471 -0.000 -18.573) 20.019 6.967 ( 3.187 0.000 3.255) 4.555 7.042 ( 4.062 0.000 -5.501) 6.838 7.457 ( 1.880 0.000 -5.274) 5.599 7.531 ( -8.865 -0.000 2.280) 9.153 7.634 ( -2.603 -0.000 -2.982) 3.958 7.995 ( -0.515 -0.000 4.379) 4.409 8.194 ( -3.551 -0.000 -0.398) 3.574 8.581 ( 4.507 0.000 7.893) 9.089 9.007 ( 1.925 0.000 -9.376) 9.572 9.267 ( 1.000 0.000 2.966) 3.130 9.379 ( 3.711 0.000 -1.904) 4.171 9.598 ( 5.096 0.000 4.502) 6.800 9.700 ( -3.614 -0.000 -4.688) 5.919 9.792 ( -9.718 -0.000 -34.362) 35.710 9.867 ( 1.143 0.000 -0.855) 1.427 10.095 ( -1.140 -0.000 -0.761) 1.371 10.562 ( -0.402 -0.000 -0.847) 0.938 11.164 ( 3.267 0.000 4.137) 5.271 11.430 ( 2.064 0.000 -3.609) 4.158 11.597 ( -4.637 -0.000 1.550) 4.889 12.274 ( 20.215 0.000 72.067) 74.849 12.673 ( 0.706 0.000 -0.106) 0.714 13.648 ( 2.007 0.000 -1.056) 2.268 13.823 ( 4.666 0.000 21.019) 21.531 14.439 ( 1.113 0.000 2.519) 2.754 14.867 ( 1.086 0.000 10.515) 10.570 15.599 ( -2.494 -0.000 -3.349) 4.176 15.991 ( 0.050 0.000 -0.214) 0.220 16.291 ( 0.183 0.000 0.162) 0.245 16.359 ( 4.512 0.000 -0.637) 4.557 16.382 ( 2.124 0.000 -2.291) 3.124 16.669 ( -4.667 -0.000 0.657) 4.713 17.569 ( -0.824 -0.000 -0.720) 1.094 17.726 ( -4.212 -0.000 1.653) 4.525 18.169 ( 1.568 0.000 0.380) 1.613 18.363 ( -3.253 -0.000 -9.041) 9.608 18.888 ( 4.662 0.000 0.824) 4.734 19.104 ( -7.149 -0.000 -2.719) 7.649 20.260 ( 0.725 0.000 -17.265) 17.280 20.407 ( -5.109 -0.000 -23.183) 23.739 27.624 ( -8.332 -0.000 -28.721) 29.905 28.286 ( -0.650 -0.000 -1.176) 1.343 29.435 ( 4.083 0.000 -0.298) 4.093 29.643 ( -12.195 -0.000 -31.257) 33.552 29.676 ( 0.565 0.000 0.229) 0.610 29.690 ( -0.208 -0.000 -0.095) 0.229 29.771 ( -0.314 -0.000 -4.056) 4.068 30.261 ( -2.179 -0.000 1.163) 2.470 30.356 ( -8.727 -0.000 -26.910) 28.289 30.424 ( -2.601 -0.000 -4.538) 5.230 31.040 ( -0.591 -0.000 -0.326) 0.675 32.009 ( 0.950 0.000 0.200) 0.971 32.047 ( -0.694 -0.000 -0.133) 0.707 32.729 ( 15.536 0.000 15.055) 21.633 33.376 ( -12.859 -0.000 -19.070) 23.001 35.239 ( 23.913 0.000 80.938) 84.396 ======================= Grid point 164 (71/160) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -2.682 -0.000 26.684) 26.819 1.134 ( -6.811 -0.000 30.247) 31.005 2.059 ( -7.375 -0.000 9.822) 12.282 2.242 ( 8.572 0.000 8.018) 11.738 2.331 ( 17.733 0.000 56.306) 59.033 2.721 ( -2.706 -0.000 -7.242) 7.731 2.917 ( -3.233 -0.000 -27.233) 27.424 3.007 ( 2.052 0.000 -11.770) 11.948 3.283 ( 0.222 0.000 -3.779) 3.786 3.509 ( 3.087 0.000 3.214) 4.457 4.157 ( -6.353 -0.000 9.058) 11.063 4.517 ( -16.404 -0.000 -6.106) 17.504 4.522 ( 6.651 0.000 -2.949) 7.275 4.659 ( -10.840 -0.000 -8.035) 13.493 4.971 ( 7.989 0.000 -9.321) 12.276 5.419 ( -2.397 -0.000 -15.863) 16.043 5.606 ( -5.691 -0.000 -7.760) 9.623 5.888 ( 3.788 0.000 7.360) 8.277 5.965 ( 9.106 0.000 5.655) 10.719 6.261 ( 0.012 0.000 1.088) 1.088 6.340 ( 28.361 0.000 -0.479) 28.365 6.449 ( -9.586 -0.000 -2.652) 9.946 6.929 ( 6.739 0.000 -5.567) 8.741 7.138 ( 5.907 0.000 1.967) 6.226 7.387 ( -0.151 -0.000 -2.723) 2.728 7.544 ( -1.733 -0.000 3.152) 3.597 7.653 ( 2.638 0.000 -4.544) 5.254 7.979 ( -6.026 -0.000 2.241) 6.430 8.134 ( 0.276 0.000 -1.250) 1.280 8.744 ( -9.541 -0.000 -4.173) 10.414 8.874 ( 1.378 0.000 5.948) 6.106 9.121 ( 7.403 0.000 1.802) 7.619 9.341 ( -3.561 -0.000 -0.160) 3.565 9.535 ( -3.318 -0.000 -0.736) 3.399 9.753 ( -1.330 -0.000 9.026) 9.123 9.788 ( 1.670 0.000 -6.346) 6.562 9.832 ( 3.680 0.000 3.674) 5.200 9.940 ( -1.548 -0.000 -2.346) 2.810 10.634 ( 2.429 0.000 1.046) 2.644 11.002 ( -5.346 -0.000 -4.285) 6.852 11.547 ( 2.597 0.000 1.423) 2.962 11.675 ( -0.245 -0.000 4.666) 4.672 12.666 ( 1.424 0.000 -0.081) 1.426 13.235 ( -0.721 -0.000 1.101) 1.316 13.536 ( -6.320 -0.000 -4.108) 7.538 13.933 ( -4.260 -0.000 -0.172) 4.263 14.541 ( -2.370 -0.000 4.219) 4.840 15.296 ( -9.779 -0.000 -6.691) 11.850 15.982 ( 9.668 0.000 -3.032) 10.132 16.004 ( 0.603 0.000 0.842) 1.036 16.146 ( -1.160 -0.000 -4.295) 4.449 16.428 ( -11.076 -0.000 -0.175) 11.077 16.526 ( 2.019 0.000 2.963) 3.585 16.621 ( -1.574 -0.000 -0.026) 1.574 17.426 ( 2.086 0.000 1.730) 2.710 17.715 ( -0.905 -0.000 -0.806) 1.212 17.976 ( 4.080 0.000 -3.232) 5.205 18.125 ( 4.808 0.000 -7.407) 8.830 18.692 ( 4.605 0.000 6.458) 7.932 18.949 ( 5.213 0.000 0.101) 5.214 19.837 ( -3.924 -0.000 4.057) 5.644 20.554 ( 5.393 0.000 8.186) 9.803 27.764 ( 4.689 0.000 -10.297) 11.314 28.940 ( 9.011 0.000 14.653) 17.202 29.357 ( 10.353 0.000 -2.490) 10.649 29.590 ( 12.286 0.000 0.903) 12.320 29.689 ( -0.773 -0.000 0.289) 0.826 29.695 ( 0.763 0.000 0.297) 0.818 29.697 ( 1.408 0.000 -2.570) 2.930 30.077 ( -3.381 -0.000 -0.961) 3.515 30.271 ( -2.723 -0.000 1.082) 2.931 30.783 ( 16.335 0.000 2.739) 16.563 31.025 ( -0.504 -0.000 -0.505) 0.713 32.026 ( -0.616 -0.000 0.344) 0.705 32.044 ( 0.677 0.000 0.139) 0.692 32.227 ( -12.736 -0.000 -17.269) 21.458 33.898 ( 25.969 0.000 14.932) 29.956 34.638 ( -53.796 -0.000 -2.819) 53.870 ======================= Grid point 165 (72/160) ======================= q-point: ( 0.11 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 11.120 -6.713 24.983) 28.158 1.971 ( 3.101 -56.138 21.025) 60.026 2.321 ( -2.996 -15.075 -2.819) 15.626 2.598 ( 2.539 -19.771 -2.561) 20.097 2.768 ( 2.895 -12.940 7.814) 15.391 2.909 ( -1.243 -31.977 -5.465) 32.464 3.055 ( 13.205 -22.739 27.544) 38.080 3.187 ( 3.379 -26.228 -12.152) 29.104 3.528 ( -0.177 -26.130 -0.708) 26.140 3.646 ( 6.241 -10.410 6.569) 13.801 4.249 ( -13.696 -6.320 -0.519) 15.093 4.395 ( -11.771 -8.361 -8.329) 16.669 4.516 ( -12.928 -10.543 -8.017) 18.508 4.633 ( 0.473 -12.400 -2.741) 12.708 5.016 ( 7.138 -7.599 -7.931) 13.099 5.259 ( 2.161 7.304 -10.113) 12.661 5.490 ( -2.890 2.715 -5.920) 7.126 5.910 ( 2.974 4.767 3.777) 6.770 6.038 ( -1.982 -1.926 2.639) 3.821 6.215 ( -0.672 4.607 -0.107) 4.657 6.336 ( 1.580 5.217 1.847) 5.756 6.527 ( 12.286 2.267 -1.192) 12.550 6.815 ( 9.887 11.514 -6.524) 16.520 7.186 ( 3.424 0.902 -0.343) 3.558 7.387 ( 1.187 -1.069 0.841) 1.805 7.510 ( -1.564 4.729 1.661) 5.251 7.681 ( -2.066 -6.673 -7.994) 10.616 7.990 ( -2.952 -3.185 4.673) 6.379 8.188 ( 2.752 -5.266 -2.051) 6.286 8.598 ( -8.189 4.338 0.788) 9.300 8.877 ( -2.371 2.820 5.033) 6.237 9.200 ( 2.318 1.454 -0.771) 2.843 9.289 ( 2.690 -0.084 3.680) 4.559 9.448 ( -0.869 5.483 -2.431) 6.060 9.756 ( -0.685 -9.599 3.843) 10.363 9.938 ( -1.001 -8.679 -3.517) 9.418 9.980 ( 2.711 -8.749 2.793) 9.576 10.201 ( 1.424 -24.451 -7.312) 25.561 10.644 ( -0.281 0.073 -2.357) 2.375 10.935 ( -3.097 1.097 -1.010) 3.437 11.526 ( 0.493 4.549 0.572) 4.612 11.675 ( 1.133 4.038 3.384) 5.389 12.668 ( -1.093 0.091 -0.272) 1.130 13.214 ( -10.633 -0.426 2.852) 11.017 13.449 ( 2.046 3.794 -1.793) 4.668 13.905 ( -3.615 -0.289 0.181) 3.631 14.550 ( -2.291 0.270 4.180) 4.774 15.187 ( -7.249 -0.905 -3.122) 7.945 15.929 ( 4.556 9.101 -0.474) 10.188 16.008 ( -1.272 9.251 -4.722) 10.464 16.069 ( 5.333 0.674 1.410) 5.557 16.342 ( -6.007 1.283 1.077) 6.236 16.514 ( -6.786 1.380 2.688) 7.428 16.604 ( 3.682 4.512 0.588) 5.853 17.479 ( 1.679 -3.179 0.363) 3.613 17.716 ( 2.618 0.192 -0.107) 2.628 17.919 ( 0.499 3.830 -3.173) 4.999 18.133 ( 4.193 -2.345 -6.430) 8.027 18.752 ( 0.672 0.840 4.053) 4.194 19.021 ( 10.654 -2.035 -2.586) 11.151 19.644 ( -6.874 17.328 6.894) 19.875 20.609 ( 2.659 3.259 5.883) 7.232 27.684 ( 3.127 4.456 -6.306) 8.331 28.848 ( 0.521 17.520 11.045) 20.718 29.293 ( 0.632 5.065 -1.734) 5.390 29.386 ( -2.502 2.272 -1.839) 3.847 29.652 ( 1.914 3.202 -0.376) 3.749 29.700 ( -0.485 0.308 -1.843) 1.930 30.047 ( 1.150 1.183 -0.955) 1.906 30.200 ( 2.477 -1.479 1.877) 3.442 30.362 ( 0.111 -20.556 0.936) 20.577 30.861 ( 10.435 6.938 -1.679) 12.643 31.046 ( 5.942 -5.060 -1.938) 8.041 31.932 ( -2.557 6.641 -0.004) 7.116 32.133 ( -10.843 -8.601 -5.635) 14.944 32.337 ( 8.933 -29.409 -11.184) 32.708 34.127 ( -12.635 -11.246 3.140) 17.204 34.637 ( -5.450 -24.023 5.119) 25.159 ======================= Grid point 166 (73/160) ======================= q-point: ( 0.22 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( 22.733 -8.735 11.292) 26.844 2.321 ( 0.290 -3.882 -6.678) 7.730 2.782 ( 3.557 -19.625 2.511) 20.102 3.085 ( 7.949 -27.252 19.650) 34.525 3.132 ( 2.751 -17.789 3.969) 18.432 3.523 ( -6.750 -28.313 -10.218) 30.848 3.595 ( -1.521 -25.570 3.889) 25.908 3.641 ( 1.236 -27.626 -3.228) 27.841 3.923 ( -1.124 -18.142 -0.229) 18.178 4.101 ( 4.705 -20.783 10.382) 23.704 4.168 ( -14.132 -6.239 -2.666) 15.676 4.462 ( 2.283 -23.758 -6.368) 24.702 4.635 ( -5.396 -10.997 -1.646) 12.360 4.991 ( -1.439 -4.021 -4.663) 6.323 5.162 ( 0.775 -19.377 -6.022) 20.306 5.325 ( 0.222 -32.489 -2.376) 32.577 5.432 ( 2.531 -0.627 -0.369) 2.633 5.902 ( 8.074 -0.354 -0.507) 8.097 6.019 ( -7.002 -2.978 -3.460) 8.358 6.174 ( 0.236 3.757 3.425) 5.089 6.297 ( 0.457 2.648 4.212) 4.996 6.441 ( 0.853 5.160 -1.068) 5.338 6.734 ( 10.998 4.903 -8.975) 15.018 7.144 ( -5.222 1.535 -0.900) 5.517 7.406 ( -2.895 1.821 0.565) 3.466 7.464 ( 2.408 1.203 8.752) 9.156 7.707 ( -2.197 -5.657 -10.075) 11.761 8.081 ( -0.483 -4.458 3.915) 5.953 8.304 ( 4.535 -6.140 -1.523) 7.784 8.509 ( -2.437 2.351 2.784) 4.384 8.853 ( -2.297 1.080 4.261) 4.959 9.123 ( -4.660 1.261 -4.265) 6.442 9.361 ( -0.757 -0.008 -3.014) 3.108 9.427 ( 6.540 -3.656 3.001) 8.071 9.883 ( 1.781 -0.327 1.261) 2.207 10.078 ( 0.040 -11.693 -0.015) 11.693 10.255 ( -0.411 -15.820 2.133) 15.968 10.467 ( 2.311 -10.957 -5.472) 12.464 10.637 ( -2.766 -6.652 -5.346) 8.971 10.885 ( -0.398 4.030 0.287) 4.060 11.424 ( -1.153 6.796 -0.251) 6.898 11.603 ( 1.395 7.708 1.309) 7.942 12.632 ( -4.800 1.175 -0.677) 4.988 13.128 ( -7.158 4.731 5.984) 10.461 13.445 ( 5.452 -0.439 -1.416) 5.650 13.870 ( -4.701 0.618 -0.865) 4.820 14.552 ( -1.871 0.761 3.220) 3.801 15.156 ( -4.802 -0.808 0.361) 4.883 15.726 ( 1.619 17.618 -0.242) 17.693 15.799 ( 1.991 9.181 -1.929) 9.590 16.086 ( 4.868 2.667 -3.086) 6.350 16.237 ( -5.406 7.753 0.859) 9.490 16.449 ( -6.938 0.761 1.333) 7.105 16.563 ( 5.260 6.429 5.299) 9.853 17.544 ( 0.623 -2.372 0.459) 2.495 17.738 ( 1.947 0.101 1.604) 2.524 17.885 ( 5.204 -1.248 -4.083) 6.731 18.167 ( 1.787 -4.108 -5.923) 7.426 18.760 ( -3.676 -1.403 2.655) 4.747 19.103 ( 8.480 0.373 -5.724) 10.238 19.399 ( -2.902 10.128 8.827) 13.745 20.581 ( -1.123 4.390 2.802) 5.328 27.604 ( 2.497 3.759 -2.208) 5.024 28.654 ( -2.701 9.856 2.522) 10.526 29.260 ( -0.357 -0.648 0.033) 0.741 29.314 ( -4.799 1.012 -1.712) 5.195 29.615 ( 1.924 3.285 0.512) 3.841 29.665 ( -0.879 0.797 -2.193) 2.494 30.018 ( 4.651 5.005 -0.311) 6.840 30.170 ( 1.776 5.640 2.428) 6.392 30.549 ( -3.188 -2.274 3.497) 5.250 30.760 ( 0.909 6.764 -2.350) 7.218 31.190 ( 6.322 -3.915 -1.962) 7.690 31.819 ( -4.947 5.141 5.085) 8.762 32.216 ( -11.831 -15.988 -2.177) 20.008 32.900 ( 11.288 -34.818 -11.758) 38.444 34.271 ( -17.050 -21.517 -5.428) 27.985 35.110 ( 10.988 -20.616 5.629) 24.030 ======================= Grid point 167 (74/160) ======================= q-point: ( 0.33 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 16.595 1.516 -13.217) 21.269 2.574 ( 8.076 -13.350 19.380) 24.880 3.036 ( -2.564 -9.429 -8.327) 12.838 3.405 ( -0.754 -14.357 -4.314) 15.010 3.423 ( -7.922 -7.614 -2.517) 11.272 3.709 ( -3.742 -7.986 -6.570) 10.997 3.853 ( 5.820 -10.934 12.344) 17.487 4.047 ( -3.024 -12.709 7.219) 14.926 4.150 ( -2.120 -8.741 5.301) 10.440 4.264 ( -1.299 -25.118 -5.899) 25.834 4.509 ( -3.040 -2.998 3.142) 5.301 4.618 ( 6.995 -9.581 2.495) 12.122 4.818 ( 3.370 10.969 -1.095) 11.527 5.109 ( 5.106 -22.173 0.313) 22.756 5.293 ( -0.766 -1.924 -9.861) 10.076 5.609 ( 5.821 -8.753 -2.076) 10.714 5.771 ( -6.085 -5.441 5.411) 9.793 5.961 ( -1.464 -2.016 1.178) 2.756 6.133 ( 5.170 -14.058 -3.814) 15.456 6.245 ( 4.768 -9.743 2.107) 11.050 6.352 ( -6.566 -18.790 -4.358) 20.375 6.560 ( -1.591 -15.859 1.784) 16.038 6.701 ( 3.502 -4.732 -5.433) 8.010 7.068 ( -5.170 0.451 0.002) 5.190 7.366 ( -3.741 0.544 1.145) 3.950 7.559 ( 2.258 -0.093 10.944) 11.175 7.672 ( -7.004 -4.930 -13.079) 15.634 8.173 ( 1.994 -2.257 3.936) 4.956 8.409 ( 1.368 -2.674 1.160) 3.220 8.540 ( 3.394 -4.984 -2.593) 6.563 8.881 ( 2.400 -1.786 3.755) 4.801 9.045 ( -2.290 2.088 -0.760) 3.191 9.364 ( -2.969 -4.362 -3.799) 6.502 9.554 ( 3.199 -4.450 1.901) 5.801 9.848 ( 5.996 5.454 -1.478) 8.239 10.267 ( -0.997 -7.407 2.182) 7.785 10.437 ( -0.363 -6.805 -3.222) 7.538 10.567 ( -6.036 -3.606 0.485) 7.048 10.725 ( -0.309 -4.046 -1.757) 4.422 10.833 ( 4.031 -1.562 0.578) 4.361 11.302 ( -2.452 4.750 -1.749) 5.625 11.471 ( 1.473 8.854 0.092) 8.976 12.544 ( -5.638 3.939 0.693) 6.913 13.036 ( -1.224 7.331 4.488) 8.682 13.505 ( 3.512 -3.112 -1.521) 4.932 13.791 ( -5.727 2.188 -2.070) 6.470 14.538 ( -1.817 1.314 1.873) 2.922 15.061 ( -2.635 9.256 -0.921) 9.668 15.537 ( 1.487 5.037 3.509) 6.316 15.684 ( 2.989 5.383 -0.266) 6.163 15.957 ( -5.058 8.121 -5.719) 11.147 16.112 ( 2.189 4.704 1.418) 5.379 16.371 ( 2.418 6.951 -1.116) 7.444 16.546 ( -2.891 2.042 5.703) 6.712 17.558 ( -1.329 0.784 1.115) 1.904 17.793 ( 1.293 -3.971 0.692) 4.233 17.970 ( 9.014 -4.559 -3.887) 10.823 18.219 ( 2.107 -4.375 -3.867) 6.207 18.790 ( -5.118 -3.579 2.515) 6.733 19.050 ( 1.228 5.462 1.417) 5.775 19.403 ( 5.396 -0.852 3.327) 6.396 20.488 ( -4.213 4.821 -0.642) 6.434 27.567 ( 2.443 2.328 0.318) 3.389 28.504 ( -3.860 5.064 -2.376) 6.796 29.249 ( -2.880 0.319 -1.279) 3.167 29.315 ( 0.228 -4.305 1.092) 4.448 29.575 ( 1.727 3.749 0.952) 4.236 29.643 ( -0.671 -0.813 -1.838) 2.119 29.923 ( 1.216 8.988 -0.676) 9.095 30.086 ( 2.880 7.786 1.056) 8.368 30.559 ( -1.147 -0.603 2.263) 2.608 30.649 ( -1.304 3.650 -2.196) 4.455 31.218 ( 4.121 2.902 -1.628) 5.297 31.750 ( -6.317 3.264 7.101) 10.049 32.415 ( -8.037 -16.205 0.549) 18.097 33.447 ( 4.637 -28.393 -5.724) 29.333 34.451 ( -12.717 -18.502 -8.303) 23.938 35.538 ( 13.688 -13.107 6.075) 19.901 ======================= Grid point 168 (75/160) ======================= q-point: (-0.56 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 9.022 5.393 -10.518) 14.869 2.757 ( -18.370 5.927 -13.092) 23.324 3.022 ( 8.124 -5.210 8.721) 13.008 3.485 ( -5.965 -1.760 -3.099) 6.949 3.598 ( 0.976 -11.372 1.989) 11.586 3.771 ( -1.866 -6.978 1.096) 7.306 4.045 ( -0.002 -7.571 -0.028) 7.571 4.233 ( 2.835 -3.332 7.638) 8.802 4.383 ( 0.760 -9.897 2.093) 10.145 4.500 ( -0.363 -0.061 3.554) 3.573 4.641 ( 2.855 4.182 13.479) 14.398 4.684 ( 10.630 -8.033 -5.290) 14.335 4.738 ( 3.097 1.600 1.399) 3.756 5.207 ( 2.654 4.349 -6.184) 8.012 5.347 ( 0.769 -6.164 -2.077) 6.549 5.606 ( -2.155 8.680 -1.900) 9.143 5.685 ( 0.541 1.025 1.134) 1.622 6.094 ( -7.108 -4.487 -3.926) 9.278 6.188 ( 1.834 -2.956 3.469) 4.913 6.510 ( 7.794 -7.881 0.087) 11.085 6.637 ( -1.686 -13.568 0.155) 13.673 6.713 ( -4.585 -3.031 -6.325) 8.379 6.848 ( -2.914 -9.762 -1.443) 10.289 7.149 ( -0.227 -8.376 1.525) 8.517 7.313 ( -4.693 1.310 -1.079) 4.991 7.552 ( -13.257 -0.637 -4.062) 13.880 7.671 ( 7.157 -0.161 0.836) 7.208 8.242 ( 3.601 -0.004 3.956) 5.350 8.458 ( -0.595 -4.072 -2.266) 4.698 8.592 ( -0.560 -0.295 -1.699) 1.813 8.992 ( 0.774 3.918 6.608) 7.721 9.062 ( 10.284 -8.211 0.763) 13.182 9.364 ( -3.453 -1.824 -1.750) 4.279 9.610 ( 4.054 4.951 0.876) 6.459 9.870 ( 5.688 -4.319 -4.079) 8.225 10.196 ( -7.999 13.121 1.763) 15.468 10.506 ( 0.712 -4.614 1.413) 4.878 10.578 ( -0.672 -7.606 -0.171) 7.637 10.860 ( 1.396 -7.358 -1.142) 7.576 10.894 ( 0.451 -2.976 -0.288) 3.024 11.195 ( -3.560 1.804 -3.713) 5.451 11.401 ( 2.822 0.945 0.845) 3.093 12.424 ( -4.557 6.941 3.258) 8.920 12.909 ( -0.746 7.894 -1.079) 8.002 13.560 ( -0.253 -2.121 -1.755) 2.764 13.703 ( -2.257 1.252 -2.074) 3.311 14.508 ( -1.455 1.605 0.953) 2.367 14.889 ( 1.031 7.086 -0.976) 7.227 15.525 ( -0.517 3.209 2.476) 4.086 15.695 ( 1.313 -3.325 0.592) 3.624 15.791 ( -2.969 0.842 -1.122) 3.284 16.085 ( 2.906 1.903 -0.339) 3.490 16.241 ( 5.637 11.255 -0.103) 12.588 16.523 ( -6.458 -0.702 1.872) 6.760 17.537 ( -2.227 0.848 1.888) 3.040 17.867 ( 1.126 -2.969 -0.594) 3.230 18.100 ( 7.507 -4.782 -2.947) 9.376 18.285 ( 3.218 -3.518 -2.602) 5.432 18.800 ( -6.530 -0.503 3.137) 7.262 19.033 ( 1.756 0.887 5.266) 5.621 19.493 ( 4.661 -2.028 2.164) 5.524 20.354 ( -5.873 4.113 -3.154) 7.833 27.564 ( 2.096 1.317 1.830) 3.079 28.387 ( -3.238 2.847 -3.872) 5.795 29.223 ( -0.438 0.216 -0.902) 1.026 29.430 ( 0.830 -7.107 1.130) 7.245 29.538 ( 1.696 2.418 0.242) 2.964 29.661 ( -0.818 -3.190 -0.115) 3.295 29.759 ( -0.714 8.497 -0.920) 8.577 29.976 ( 2.179 7.164 -1.409) 7.619 30.556 ( -1.267 1.671 -2.422) 3.204 30.627 ( 0.363 -2.194 2.733) 3.524 31.179 ( 2.318 2.544 -1.487) 3.749 31.705 ( -6.217 1.876 6.775) 9.385 32.590 ( -2.044 -7.412 1.740) 7.883 33.802 ( -1.148 -15.224 -3.114) 15.582 34.529 ( -9.921 -7.328 -6.885) 14.125 35.853 ( 15.958 -5.468 4.812) 17.542 ======================= Grid point 169 (76/160) ======================= q-point: (-0.44 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 1.120 10.746 -4.946) 11.883 2.304 ( -21.735 14.270 -10.775) 28.145 3.174 ( 5.619 -0.321 1.249) 5.765 3.352 ( -3.213 7.017 -1.839) 7.934 3.773 ( -2.054 4.297 0.682) 4.812 3.789 ( -0.837 0.168 9.869) 9.906 4.206 ( 1.068 -0.934 4.519) 4.736 4.295 ( 2.953 5.876 -0.429) 6.590 4.338 ( -0.535 10.253 0.835) 10.301 4.466 ( 5.922 2.074 -1.830) 6.537 4.648 ( -1.179 -2.849 3.857) 4.938 4.765 ( 5.035 -0.944 4.644) 6.914 4.950 ( 1.549 -7.646 -1.725) 7.990 5.145 ( 4.442 3.195 -2.123) 5.869 5.380 ( -0.130 -2.016 -5.386) 5.752 5.474 ( -3.388 3.287 1.813) 5.056 5.700 ( 1.870 1.133 4.786) 5.261 5.976 ( -3.222 7.057 -4.039) 8.746 6.297 ( 2.370 -0.074 4.823) 5.375 6.564 ( -3.291 7.263 1.782) 8.171 6.613 ( -1.202 2.104 -8.428) 8.769 6.716 ( 3.963 3.169 -0.462) 5.095 6.843 ( -1.451 6.506 -0.776) 6.711 7.120 ( -11.759 0.623 -8.773) 14.684 7.212 ( -6.480 9.701 -1.060) 11.714 7.451 ( -1.570 0.176 -0.820) 1.779 7.710 ( 8.550 5.015 4.059) 10.712 8.281 ( 4.686 2.546 1.451) 5.527 8.491 ( -0.664 -1.544 -3.166) 3.585 8.574 ( -1.403 -1.314 1.154) 2.242 8.928 ( -0.737 9.511 8.584) 12.833 9.258 ( 7.466 -2.071 -4.706) 9.065 9.405 ( 1.922 -3.711 -2.148) 4.700 9.518 ( 2.291 5.265 2.500) 6.262 9.872 ( -5.674 11.232 1.347) 12.656 9.966 ( 1.758 -0.797 2.019) 2.794 10.610 ( -0.929 -5.137 0.284) 5.228 10.664 ( -0.149 10.849 -3.100) 11.284 10.804 ( -0.045 -6.980 2.232) 7.328 11.070 ( 1.058 -1.974 1.874) 2.920 11.298 ( 4.958 -25.204 -15.741) 30.126 11.433 ( 1.520 -0.097 0.803) 1.722 12.334 ( -3.147 2.327 10.976) 11.653 12.776 ( -0.258 4.891 -3.259) 5.884 13.529 ( -5.408 0.651 -1.159) 5.569 13.701 ( 3.609 -0.747 -1.988) 4.187 14.484 ( -0.330 1.147 1.225) 1.711 14.832 ( 1.417 1.135 -0.178) 1.824 15.497 ( -0.757 -0.744 1.899) 2.176 15.737 ( -1.380 -4.987 -1.439) 5.371 15.865 ( 1.533 -2.861 -0.969) 3.387 16.080 ( 2.294 -0.598 -3.610) 4.319 16.150 ( 5.869 5.153 9.048) 11.952 16.496 ( -6.562 -1.934 -0.641) 6.871 17.525 ( -2.538 0.403 2.924) 3.893 17.895 ( 1.068 -0.192 -1.657) 1.981 18.172 ( 2.599 -1.124 -3.004) 4.128 18.334 ( 2.683 -1.555 -4.680) 5.614 18.780 ( -5.433 -0.036 5.552) 7.768 19.077 ( 0.790 -0.532 1.845) 2.077 19.562 ( -0.420 -0.812 4.227) 4.324 20.237 ( -4.411 1.286 -3.004) 5.490 27.576 ( 1.035 0.865 2.468) 2.812 28.304 ( -1.753 1.551 -3.111) 3.893 29.223 ( 2.682 0.159 -0.738) 2.787 29.483 ( -0.753 2.210 0.516) 2.391 29.576 ( 0.458 -4.370 -2.427) 5.020 29.657 ( 0.784 0.496 -1.317) 1.611 29.757 ( -0.947 -7.561 3.760) 8.497 29.884 ( 1.599 2.950 -2.728) 4.325 30.492 ( -1.732 2.547 -0.843) 3.193 30.689 ( 1.349 -1.456 1.181) 2.310 31.165 ( 0.353 -0.827 -1.104) 1.424 31.693 ( -5.459 -0.693 6.562) 8.564 32.637 ( 4.404 4.399 1.416) 6.384 33.885 ( -4.843 -1.362 -5.748) 7.639 34.430 ( -6.147 7.329 -2.181) 9.811 36.048 ( 18.594 1.191 0.654) 18.644 ======================= Grid point 170 (77/160) ======================= q-point: (-0.33 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( -7.163 16.034 1.396) 17.617 1.837 ( -17.176 18.963 5.790) 26.232 3.099 ( -4.518 4.162 -10.020) 11.753 3.280 ( 7.279 8.066 8.025) 13.507 3.563 ( -2.275 16.341 -4.569) 17.120 3.666 ( -0.507 18.774 1.575) 18.846 3.955 ( -1.142 24.422 1.766) 24.513 4.082 ( 1.795 16.902 0.394) 17.002 4.288 ( -7.362 4.647 11.403) 14.347 4.478 ( -1.028 18.471 1.831) 18.590 4.674 ( -2.133 6.313 0.738) 6.704 4.759 ( 1.775 -1.858 -3.749) 4.545 4.981 ( -1.117 -2.019 -5.006) 5.512 5.124 ( 12.069 2.615 3.486) 12.832 5.315 ( 2.998 6.152 -9.599) 11.789 5.494 ( -1.570 -2.265 6.446) 7.011 5.708 ( -2.823 19.501 -1.821) 19.788 5.771 ( 8.440 1.221 2.039) 8.768 6.184 ( 4.828 23.043 0.608) 23.551 6.234 ( -11.738 11.057 -6.072) 17.231 6.597 ( -1.900 8.798 -2.968) 9.477 6.620 ( -5.637 -0.271 -3.574) 6.680 6.712 ( 5.698 5.335 6.493) 10.153 6.880 ( -6.490 4.090 -10.840) 13.279 7.058 ( -5.405 0.677 3.106) 6.270 7.455 ( 0.530 -0.839 -0.191) 1.010 7.740 ( 9.940 3.335 4.865) 11.559 8.242 ( -0.064 3.909 -0.123) 3.911 8.492 ( 1.549 -0.738 -0.948) 1.960 8.600 ( 0.054 -0.092 -1.521) 1.525 8.786 ( -5.514 8.825 4.413) 11.303 9.200 ( 1.814 6.883 -2.417) 7.518 9.354 ( 4.569 5.188 -2.175) 7.247 9.545 ( 0.951 4.586 3.623) 5.921 9.764 ( -1.483 -4.971 0.201) 5.192 10.065 ( 0.945 -0.462 6.152) 6.241 10.402 ( -0.926 14.162 -2.235) 14.367 10.617 ( -2.132 2.765 -1.305) 3.728 10.926 ( 1.092 -5.603 0.726) 5.754 11.132 ( 0.155 -5.901 -5.501) 8.069 11.438 ( -0.245 -2.625 -1.578) 3.072 11.513 ( 8.996 -3.858 -21.425) 23.555 12.605 ( 5.614 -16.458 17.389) 24.591 12.709 ( 4.091 1.093 2.519) 4.927 13.471 ( -7.597 -1.750 -0.784) 7.835 13.729 ( 5.859 0.379 -1.525) 6.066 14.485 ( 0.374 0.345 2.154) 2.214 14.863 ( 1.062 -2.894 3.275) 4.497 15.553 ( -2.247 -3.397 1.966) 4.522 15.827 ( 2.222 -2.509 -1.664) 3.742 15.867 ( 0.540 -6.481 -2.626) 7.014 16.111 ( 2.411 -2.440 -0.439) 3.459 16.287 ( 6.177 -3.608 9.563) 11.942 16.485 ( -7.096 -4.635 -0.704) 8.505 17.522 ( -3.243 -0.124 3.294) 4.624 17.868 ( 1.775 3.161 -2.152) 4.216 18.146 ( -2.355 0.431 -5.155) 5.684 18.297 ( 0.779 2.074 -7.307) 7.636 18.793 ( -5.541 -1.199 5.735) 8.064 19.065 ( -0.941 1.609 -3.312) 3.801 19.557 ( -9.260 0.502 5.011) 10.541 20.223 ( 0.308 -2.224 1.381) 2.636 27.584 ( -0.349 0.594 2.642) 2.731 28.267 ( 0.468 0.470 -0.430) 0.791 29.247 ( 4.746 0.315 -0.392) 4.772 29.430 ( -1.161 2.083 -1.706) 2.932 29.570 ( 0.750 -0.092 -3.422) 3.505 29.709 ( -0.673 -3.492 -1.244) 3.767 29.896 ( 1.346 -5.007 -1.020) 5.284 29.934 ( -1.754 -9.850 4.485) 10.964 30.446 ( -0.866 1.182 1.135) 1.853 30.702 ( 0.918 1.256 -0.092) 1.559 31.185 ( -0.546 -1.539 -0.956) 1.892 31.739 ( -4.769 -4.112 6.339) 8.935 32.544 ( 10.014 13.359 -0.267) 16.697 33.693 ( -7.622 10.247 -12.353) 17.767 34.176 ( 0.825 19.913 3.765) 20.283 36.112 ( 18.749 6.728 -7.881) 21.422 ======================= Grid point 171 (78/160) ======================= q-point: (-0.22 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.201 ( -9.582 17.404 11.802) 23.109 1.534 ( -7.733 17.775 28.725) 34.654 2.860 ( -7.607 13.849 -8.316) 17.856 3.073 ( -1.019 28.103 0.042) 28.122 3.202 ( -2.054 28.672 0.946) 28.761 3.294 ( 2.406 24.142 3.943) 24.580 3.465 ( -2.902 47.776 11.241) 49.167 3.666 ( -4.935 18.033 -4.963) 19.343 3.825 ( 1.142 20.854 2.133) 20.994 4.266 ( 0.827 37.879 -10.556) 39.331 4.474 ( 1.105 2.381 7.711) 8.145 4.757 ( -4.283 -0.988 -5.273) 6.865 4.860 ( -4.789 8.530 -1.557) 9.906 5.050 ( 6.089 22.770 -4.827) 24.059 5.215 ( 8.016 27.800 -0.477) 28.937 5.316 ( 8.273 -4.978 -1.045) 9.712 5.631 ( 1.749 -2.034 5.298) 5.938 5.696 ( 1.003 4.216 2.006) 4.775 5.870 ( -7.693 5.191 -5.462) 10.769 6.102 ( -0.808 -2.774 -6.308) 6.938 6.364 ( -5.527 7.858 -0.334) 9.613 6.573 ( 0.219 -3.490 -4.539) 5.729 6.727 ( -5.211 -1.851 -6.775) 8.745 6.902 ( 5.910 -6.869 4.502) 10.118 7.134 ( 1.263 -6.152 5.647) 8.446 7.486 ( -0.340 -3.319 -0.817) 3.435 7.794 ( 7.256 4.030 3.763) 9.113 8.164 ( -4.025 3.769 0.313) 5.523 8.436 ( -5.324 8.393 -5.292) 11.260 8.564 ( 1.095 -4.186 -0.052) 4.327 8.725 ( -0.550 0.410 5.773) 5.814 9.096 ( 3.023 4.981 -1.300) 5.970 9.320 ( 0.371 0.901 -0.033) 0.975 9.494 ( 0.375 3.255 2.316) 4.012 9.836 ( -0.333 0.097 2.000) 2.030 9.992 ( -0.089 13.521 5.778) 14.704 10.182 ( -1.407 8.802 -2.801) 9.343 10.514 ( 2.137 5.468 -4.698) 7.519 11.000 ( 0.858 -1.372 -7.818) 7.983 11.120 ( 2.139 3.209 -16.314) 16.763 11.391 ( 5.784 2.723 -7.080) 9.539 11.522 ( -2.326 -5.655 3.392) 6.992 12.658 ( 1.240 0.536 -1.971) 2.389 13.111 ( 17.513 -3.524 11.761) 21.388 13.502 ( -10.832 -12.417 -1.827) 16.578 13.797 ( 9.738 -2.641 1.878) 10.263 14.503 ( -0.129 -0.074 2.927) 2.931 15.049 ( 7.289 -10.528 11.918) 17.493 15.584 ( -2.104 -3.422 1.873) 4.432 15.890 ( 2.068 -3.521 2.655) 4.871 16.012 ( -1.203 -10.807 -6.337) 12.586 16.222 ( 5.173 -6.514 3.334) 8.961 16.394 ( 3.658 0.530 1.562) 4.013 16.579 ( -3.786 -8.995 5.972) 11.442 17.518 ( -5.934 -0.759 2.635) 6.537 17.785 ( 1.751 6.114 -2.717) 6.915 18.045 ( -8.342 -0.112 -10.280) 13.239 18.204 ( 2.261 3.369 -6.263) 7.463 18.785 ( -12.365 -1.307 3.616) 12.949 18.965 ( 1.065 5.082 -5.260) 7.391 19.521 ( -13.078 -3.977 7.372) 15.530 20.313 ( 2.833 -2.909 6.209) 7.419 27.603 ( 0.196 -1.177 3.421) 3.623 28.298 ( 3.928 -0.742 4.723) 6.188 29.274 ( 3.053 0.532 0.143) 3.102 29.382 ( 1.138 0.550 -4.012) 4.206 29.578 ( 1.215 -2.336 -1.916) 3.256 29.727 ( -0.134 -0.845 -1.530) 1.753 30.003 ( -1.926 -6.388 -0.262) 6.677 30.099 ( -2.676 -7.981 3.830) 9.248 30.461 ( 0.285 -0.108 4.408) 4.418 30.671 ( 2.780 3.857 -0.580) 4.790 31.151 ( -0.279 4.923 -1.598) 5.183 31.840 ( -4.082 -7.147 4.611) 9.434 32.379 ( 12.191 14.918 -2.400) 19.415 33.253 ( -8.566 19.799 -20.298) 29.621 33.877 ( 10.966 24.641 8.030) 28.141 35.952 ( 6.263 13.970 -22.636) 27.327 ======================= Grid point 172 (79/160) ======================= q-point: (-0.11 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( -10.192 9.594 22.634) 26.612 1.498 ( 5.167 25.536 35.217) 43.807 2.212 ( -5.025 52.838 31.535) 61.737 2.436 ( -11.063 33.765 2.135) 35.595 2.517 ( 5.207 39.163 7.792) 40.268 2.885 ( -0.537 12.477 1.511) 12.580 3.172 ( -4.955 8.962 -16.173) 19.143 3.369 ( -0.109 22.886 -11.042) 25.411 3.510 ( 3.670 13.518 -1.146) 14.054 3.567 ( 3.012 24.129 -5.813) 25.001 4.307 ( -1.675 19.929 7.914) 21.509 4.605 ( 5.679 13.710 -4.508) 15.509 4.683 ( -7.906 5.045 -2.702) 9.760 4.750 ( -9.674 -1.009 0.582) 9.744 5.001 ( 8.233 3.894 -9.796) 13.376 5.462 ( 1.387 -8.910 -11.761) 14.820 5.711 ( -10.799 -1.689 -9.196) 14.284 5.743 ( 11.104 -2.175 8.622) 14.225 5.803 ( 9.249 -0.553 9.506) 13.274 6.136 ( 7.652 -3.192 -3.657) 9.062 6.264 ( -3.170 0.441 1.678) 3.614 6.555 ( -4.252 2.788 -1.387) 5.270 6.801 ( 3.989 -11.990 -7.357) 14.622 7.060 ( 4.931 -2.539 3.812) 6.730 7.311 ( 2.779 -7.481 2.723) 8.432 7.537 ( -1.063 -3.052 -1.104) 3.415 7.734 ( 2.949 9.011 0.623) 9.502 8.055 ( -7.099 3.383 0.017) 7.863 8.221 ( -2.624 7.220 -3.231) 8.334 8.704 ( -2.294 -9.918 1.382) 10.273 8.788 ( 1.677 -1.782 6.361) 6.816 9.080 ( 4.183 0.165 -0.689) 4.242 9.319 ( -4.069 -2.325 2.067) 5.122 9.489 ( -0.944 -2.847 0.458) 3.034 9.726 ( -2.129 11.011 2.118) 11.413 9.848 ( 3.980 8.714 6.331) 11.482 10.024 ( -2.249 5.244 -3.628) 6.761 10.309 ( 6.741 24.285 -16.754) 30.264 10.685 ( 0.386 12.967 -5.083) 13.933 11.057 ( -4.717 -2.716 -5.106) 7.463 11.467 ( 4.582 -3.752 2.307) 6.356 11.618 ( -1.963 -3.849 4.386) 6.156 12.655 ( 1.997 0.223 -0.796) 2.161 13.222 ( 7.433 3.054 2.759) 8.497 13.572 ( -6.683 -5.934 -4.765) 10.128 13.936 ( 1.289 -3.837 -1.080) 4.190 14.525 ( -1.180 -0.217 3.663) 3.855 15.337 ( 0.807 -6.305 -1.241) 6.476 15.798 ( 11.920 -12.374 4.432) 17.744 15.975 ( 1.414 -2.020 2.197) 3.303 16.112 ( -1.526 -8.061 -5.485) 9.869 16.410 ( 3.834 -4.807 1.512) 6.333 16.426 ( 1.670 -4.058 2.684) 5.144 16.696 ( -2.965 -0.047 2.132) 3.652 17.451 ( -6.513 3.108 0.908) 7.273 17.715 ( -2.709 -1.101 1.355) 3.223 17.936 ( -0.307 -1.292 -5.604) 5.759 18.147 ( 3.946 0.981 -6.751) 7.881 18.683 ( -10.567 1.801 3.346) 11.229 18.919 ( 4.999 1.444 -0.289) 5.212 19.649 ( -8.514 -14.729 9.274) 19.376 20.435 ( 3.568 -1.821 8.847) 9.712 27.703 ( 4.939 -6.548 -1.617) 8.360 28.491 ( 13.176 -9.294 16.706) 23.218 29.276 ( 0.872 0.025 0.421) 0.969 29.396 ( 3.599 -2.616 -2.340) 5.027 29.634 ( 1.291 -3.889 -0.893) 4.194 29.721 ( 0.567 0.511 -1.403) 1.597 30.036 ( 1.661 2.860 -1.495) 3.629 30.182 ( -3.622 0.941 1.919) 4.206 30.380 ( -3.510 15.411 1.073) 15.842 30.652 ( 10.313 2.113 3.484) 11.089 31.038 ( -0.141 3.426 -1.174) 3.624 31.963 ( -2.478 -7.276 1.385) 7.810 32.198 ( 7.935 14.668 -3.365) 17.013 32.650 ( -11.066 20.049 -23.618) 32.897 33.719 ( 22.983 16.690 12.891) 31.193 35.351 ( -32.902 22.113 -24.292) 46.493 ======================= Grid point 174 (80/160) ======================= q-point: ( 0.11 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.426 ( 4.486 0.000 19.272) 19.788 1.665 ( 15.994 0.000 31.610) 35.426 2.115 ( -4.877 -0.000 7.522) 8.965 2.432 ( 3.050 0.000 1.300) 3.315 2.529 ( 1.233 0.000 -7.971) 8.066 2.554 ( 7.177 0.000 -25.691) 26.675 2.972 ( 7.431 0.000 -5.128) 9.028 3.226 ( -1.059 -0.000 -2.492) 2.707 3.287 ( 10.370 0.000 21.075) 23.488 3.753 ( 16.426 0.000 24.209) 29.256 4.108 ( -12.500 -0.000 -21.432) 24.811 4.115 ( -13.146 -0.000 7.411) 15.091 4.241 ( -19.094 -0.000 -3.551) 19.421 4.517 ( -0.701 -0.000 -4.807) 4.858 4.945 ( 1.618 0.000 -7.044) 7.228 5.292 ( 4.648 0.000 -6.246) 7.786 5.477 ( 0.977 0.000 -2.935) 3.093 5.973 ( -8.699 -0.000 4.936) 10.001 6.008 ( -1.362 -0.000 -2.762) 3.080 6.165 ( -6.147 -0.000 -3.058) 6.865 6.438 ( 7.772 0.000 4.103) 8.789 6.713 ( 20.337 0.000 -8.915) 22.206 6.941 ( 4.570 0.000 -5.513) 7.161 7.170 ( -3.772 -0.000 -6.166) 7.228 7.347 ( -0.880 -0.000 -2.449) 2.602 7.530 ( -3.285 -0.000 -3.162) 4.560 7.596 ( 2.826 0.000 2.104) 3.523 7.979 ( -2.016 -0.000 3.902) 4.392 8.161 ( 4.920 0.000 -0.813) 4.987 8.583 ( -6.182 -0.000 4.175) 7.460 8.898 ( -6.078 -0.000 2.377) 6.526 9.231 ( 0.307 0.000 -5.496) 5.504 9.372 ( 9.953 0.000 5.302) 11.277 9.490 ( -3.974 -0.000 2.428) 4.657 9.702 ( 0.094 0.000 -6.001) 6.002 9.831 ( -2.138 -0.000 5.156) 5.582 9.869 ( -2.339 -0.000 -0.543) 2.402 9.952 ( 3.923 0.000 0.389) 3.942 10.644 ( -1.022 -0.000 -2.346) 2.559 10.932 ( 0.008 0.000 2.291) 2.291 11.566 ( -0.876 -0.000 -0.263) 0.915 11.743 ( 1.716 0.000 2.189) 2.781 12.641 ( -4.626 -0.000 -0.872) 4.708 13.158 ( -8.527 -0.000 4.793) 9.781 13.488 ( 2.248 0.000 -0.394) 2.283 13.870 ( -4.855 -0.000 0.891) 4.936 14.564 ( -2.246 -0.000 4.191) 4.755 15.116 ( -3.613 -0.000 -0.292) 3.625 16.033 ( 0.697 0.000 1.684) 1.823 16.074 ( -0.841 -0.000 -3.167) 3.277 16.082 ( 7.160 0.000 -5.796) 9.212 16.326 ( -5.342 -0.000 6.738) 8.598 16.475 ( -6.805 -0.000 0.164) 6.807 16.706 ( 6.784 0.000 1.054) 6.865 17.459 ( 1.776 0.000 -0.593) 1.873 17.745 ( 6.254 0.000 -1.347) 6.398 17.927 ( -2.085 -0.000 -0.777) 2.225 18.097 ( 3.117 0.000 -6.874) 7.547 18.761 ( -5.536 -0.000 1.761) 5.809 19.072 ( 12.271 0.000 -5.183) 13.321 19.790 ( -9.108 -0.000 4.810) 10.300 20.690 ( 1.546 0.000 1.352) 2.054 27.701 ( 3.791 0.000 -6.794) 7.780 29.039 ( -12.721 -0.000 5.928) 14.035 29.298 ( -4.471 -0.000 -4.130) 6.086 29.576 ( -1.367 -0.000 -5.800) 5.959 29.675 ( -1.205 -0.000 0.149) 1.214 29.706 ( -1.772 -0.000 -3.357) 3.796 29.713 ( 0.855 0.000 0.227) 0.885 30.237 ( 15.531 0.000 -0.157) 15.532 30.270 ( 0.097 0.000 2.136) 2.138 30.978 ( 0.090 0.000 -3.728) 3.729 31.104 ( 23.442 0.000 -8.224) 24.843 31.945 ( -3.588 -0.000 -1.071) 3.744 32.010 ( -1.504 -0.000 0.173) 1.514 32.067 ( 1.453 0.000 0.118) 1.457 33.700 ( -42.858 -0.000 2.157) 42.912 34.719 ( 25.123 0.000 18.316) 31.091 ======================= Grid point 175 (81/160) ======================= q-point: ( 0.22 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.000 ( 27.247 -5.825 12.614) 30.585 2.201 ( 2.700 -31.942 5.396) 32.507 2.331 ( 8.062 -19.727 2.729) 21.485 2.605 ( -2.069 -29.640 1.674) 29.759 2.656 ( -0.097 -28.231 -4.251) 28.549 2.921 ( 3.038 -35.103 -1.616) 35.272 3.164 ( 6.617 -17.426 -6.072) 19.604 3.387 ( -2.520 -7.807 -2.914) 8.706 3.526 ( 0.698 -26.926 -1.941) 27.005 3.878 ( -6.560 -8.330 -23.775) 26.032 4.023 ( -16.265 -0.969 10.009) 19.123 4.235 ( 21.175 -7.393 27.853) 35.760 4.324 ( -14.207 -22.422 6.004) 27.215 4.556 ( -4.265 -11.974 -3.358) 13.147 4.942 ( -1.829 -7.490 -6.537) 10.108 5.246 ( 6.144 6.705 -2.446) 9.417 5.471 ( 4.278 1.467 0.230) 4.529 5.888 ( -11.906 -1.335 -3.813) 12.573 5.953 ( 0.182 1.016 -2.444) 2.653 6.171 ( -1.897 -2.238 2.989) 4.189 6.468 ( 7.412 8.023 2.732) 11.259 6.636 ( 6.252 11.013 -7.279) 14.607 6.831 ( 4.134 8.213 -12.239) 15.308 7.092 ( -5.668 -0.150 -3.167) 6.495 7.363 ( -3.483 -3.638 -0.445) 5.056 7.515 ( -4.339 -1.958 -0.660) 4.805 7.617 ( 4.027 1.839 0.447) 4.449 8.041 ( 1.956 -4.014 4.686) 6.473 8.243 ( 6.584 -4.486 -0.951) 8.023 8.562 ( -4.164 2.496 5.706) 7.492 8.841 ( -7.427 -0.133 0.339) 7.435 9.114 ( -1.515 5.450 -3.625) 6.718 9.411 ( -1.031 6.727 0.113) 6.806 9.490 ( 8.689 0.170 3.167) 9.250 9.798 ( -0.539 -11.019 3.487) 11.570 9.892 ( 0.938 -10.852 -2.276) 11.127 10.028 ( 2.717 -10.176 -1.803) 10.685 10.109 ( -3.881 -17.755 -3.488) 18.506 10.597 ( -1.952 1.225 -1.136) 2.569 10.956 ( 2.482 1.865 3.808) 4.913 11.508 ( -2.230 4.603 -1.323) 5.283 11.730 ( 1.870 4.528 0.783) 4.961 12.588 ( -6.327 0.116 -0.550) 6.352 13.143 ( -5.967 -0.485 5.046) 7.829 13.491 ( 2.729 1.391 0.063) 3.064 13.833 ( -5.056 0.571 0.320) 5.098 14.569 ( -2.104 0.495 2.800) 3.537 15.119 ( -1.492 -0.788 3.085) 3.516 15.926 ( 0.215 9.743 -4.097) 10.572 15.992 ( 1.866 8.031 1.585) 8.396 16.109 ( 3.082 -0.323 -6.655) 7.341 16.314 ( -4.819 3.950 4.207) 7.518 16.410 ( -6.592 0.382 1.651) 6.807 16.730 ( 5.721 4.100 2.027) 7.325 17.506 ( 2.707 -3.271 -0.047) 4.246 17.805 ( 8.010 -0.436 -0.175) 8.024 17.888 ( -1.262 2.666 0.391) 2.975 18.089 ( 4.117 -2.015 -6.117) 7.644 18.718 ( -6.005 -0.474 0.817) 6.079 19.126 ( 9.784 -0.578 -7.359) 12.256 19.637 ( -7.297 11.643 8.311) 16.058 20.648 ( -2.048 4.052 -1.400) 4.751 27.667 ( 3.585 2.602 -3.365) 5.563 28.791 ( -12.420 11.551 -4.210) 17.476 29.257 ( -1.355 0.428 0.832) 1.647 29.329 ( -1.471 7.179 -1.020) 7.399 29.640 ( -1.359 0.699 -2.327) 2.784 29.682 ( 0.525 2.080 -0.097) 2.147 30.016 ( -2.929 -12.956 -1.308) 13.347 30.278 ( 2.768 2.456 2.662) 4.558 30.416 ( 4.178 -9.826 0.725) 10.702 30.872 ( -1.019 7.385 -4.288) 8.600 31.179 ( 14.610 0.011 -7.451) 16.400 31.906 ( -1.230 3.364 2.463) 4.346 31.951 ( -8.178 0.294 1.847) 8.389 32.394 ( 9.738 -27.769 -3.438) 29.627 33.616 ( -31.061 -23.714 -1.771) 39.119 35.111 ( 21.821 -7.753 15.588) 27.915 ======================= Grid point 176 (82/160) ======================= q-point: ( 0.33 0.11 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.099 ( 20.867 5.402 -16.315) 27.033 2.621 ( 16.370 -11.900 24.286) 31.613 2.769 ( -1.635 -12.917 -10.810) 16.923 3.000 ( -0.876 -20.285 -8.372) 21.962 3.245 ( -1.407 -11.353 -1.497) 11.537 3.435 ( -4.755 -21.240 -4.596) 22.246 3.583 ( -0.160 -31.417 -4.656) 31.761 3.653 ( 4.232 -37.201 6.237) 37.957 3.826 ( -4.731 -19.469 0.686) 20.047 4.032 ( -11.076 -8.261 11.749) 18.137 4.223 ( 4.130 -34.077 -3.374) 34.492 4.539 ( -0.553 -6.224 1.080) 6.341 4.744 ( 9.999 -17.080 12.760) 23.548 4.862 ( -6.640 -20.311 -4.212) 21.780 5.168 ( 7.384 5.276 0.746) 9.106 5.252 ( -4.682 -39.490 -0.279) 39.767 5.522 ( 4.824 -3.652 0.814) 6.105 5.864 ( -8.462 -6.264 1.746) 10.672 5.958 ( 0.038 -6.866 -7.381) 10.081 6.166 ( 0.656 5.873 -0.073) 5.910 6.351 ( 3.450 5.689 -0.509) 6.673 6.512 ( 6.309 6.747 2.439) 9.554 6.667 ( 1.749 2.216 -6.923) 7.477 7.004 ( -6.912 1.351 -4.506) 8.361 7.357 ( -5.234 0.360 0.201) 5.250 7.447 ( -11.018 -1.532 -7.921) 13.656 7.674 ( 7.165 -0.056 5.907) 9.286 8.174 ( 4.859 -3.858 3.777) 7.264 8.376 ( 4.304 -4.552 0.059) 6.264 8.506 ( -2.791 1.885 0.268) 3.379 8.840 ( -4.473 -6.019 0.480) 7.515 9.036 ( -0.295 0.957 0.062) 1.004 9.321 ( 2.008 3.473 -1.189) 4.185 9.550 ( 2.812 -0.221 1.113) 3.032 9.940 ( 1.068 -1.254 1.913) 2.524 10.103 ( 2.068 -13.074 0.822) 13.262 10.228 ( -3.099 -11.759 -0.264) 12.163 10.354 ( 0.868 -16.329 -9.581) 18.952 10.607 ( -2.904 -5.044 3.725) 6.910 10.947 ( 3.994 5.190 3.593) 7.470 11.369 ( -3.505 6.929 -2.296) 8.097 11.635 ( 1.579 8.430 -0.162) 8.578 12.536 ( -5.429 0.566 0.919) 5.535 13.124 ( -5.418 1.736 2.902) 6.387 13.499 ( 2.775 0.212 0.042) 2.784 13.765 ( -4.724 2.052 -1.692) 5.422 14.553 ( -2.124 0.983 1.301) 2.678 15.121 ( -2.509 2.293 1.868) 3.878 15.724 ( 2.112 11.001 -1.240) 11.270 15.855 ( 2.719 10.638 1.450) 11.075 16.019 ( -1.450 6.745 -6.833) 9.710 16.193 ( -3.027 5.094 -0.501) 5.946 16.393 ( -4.003 -1.022 1.812) 4.511 16.683 ( 2.136 7.580 2.439) 8.244 17.577 ( 2.457 -0.714 1.245) 2.846 17.799 ( 2.206 2.431 0.538) 3.327 17.936 ( 5.838 -4.827 -1.038) 7.646 18.151 ( 6.548 -3.265 -2.841) 7.849 18.721 ( -2.696 -2.826 2.378) 4.573 19.123 ( 4.250 2.192 -5.423) 7.230 19.514 ( -1.423 5.442 9.584) 11.113 20.519 ( -5.130 5.294 -3.705) 8.250 27.636 ( 3.116 2.651 -0.130) 4.093 28.525 ( -7.142 5.944 -6.265) 11.207 29.235 ( -1.799 1.443 -0.518) 2.363 29.278 ( 0.153 -1.410 1.416) 2.004 29.606 ( -1.660 -0.164 -1.557) 2.282 29.646 ( 0.294 2.727 0.317) 2.761 30.059 ( 0.799 4.319 -0.912) 4.486 30.250 ( 4.174 6.611 1.439) 7.950 30.541 ( -2.191 -2.824 1.875) 4.036 30.703 ( -1.546 6.514 -3.897) 7.746 31.263 ( 7.400 -1.981 -3.821) 8.560 31.814 ( -7.012 4.645 6.373) 10.553 32.024 ( -9.691 -15.721 0.480) 18.474 32.959 ( 9.969 -30.639 -3.123) 32.371 33.864 ( -18.317 -29.084 -4.633) 34.682 35.515 ( 15.731 -10.531 10.304) 21.552 ======================= Grid point 177 (83/160) ======================= q-point: ( 0.44 0.11 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( 16.276 5.783 -12.124) 21.103 2.628 ( -8.303 4.467 -18.648) 20.896 3.058 ( 8.477 -7.756 13.877) 18.016 3.303 ( 3.586 -12.910 -3.798) 13.927 3.457 ( -3.469 -10.038 -4.994) 11.736 3.500 ( -1.115 -16.412 7.775) 18.194 3.972 ( -6.966 -8.490 8.092) 13.641 4.038 ( -1.425 -19.933 -5.796) 20.808 4.127 ( -3.988 -13.666 2.867) 14.522 4.440 ( 3.576 -17.030 6.944) 18.736 4.578 ( 5.862 -7.240 6.542) 11.383 4.781 ( 5.357 -6.737 2.175) 8.878 4.889 ( 4.765 0.515 -0.127) 4.795 5.129 ( -0.457 -16.532 -2.009) 16.660 5.219 ( 1.986 -3.467 -2.462) 4.693 5.605 ( 2.822 0.269 -3.767) 4.714 5.731 ( -5.916 -8.502 1.169) 10.423 5.950 ( -4.459 -3.492 2.002) 6.007 6.091 ( -5.949 -22.325 0.717) 23.115 6.218 ( 6.122 -12.441 -4.049) 14.445 6.422 ( 6.789 -9.414 4.483) 12.442 6.582 ( 4.154 -6.583 0.893) 7.835 6.683 ( -0.240 -4.424 -2.783) 5.232 6.941 ( -6.975 -7.627 -4.622) 11.322 7.255 ( -9.841 0.453 -5.588) 11.325 7.367 ( -8.123 -3.267 -1.809) 8.940 7.776 ( 8.040 0.066 4.534) 9.231 8.283 ( 4.230 -2.671 0.286) 5.011 8.384 ( -3.313 0.229 0.471) 3.354 8.545 ( 2.768 -4.065 -2.510) 5.522 8.978 ( 4.016 -9.262 0.181) 10.097 9.067 ( -1.963 -2.016 5.550) 6.223 9.308 ( 2.769 -0.414 -1.366) 3.115 9.596 ( 0.181 -5.057 0.707) 5.109 9.912 ( 3.804 4.594 -2.956) 6.657 10.265 ( -1.774 0.821 -0.787) 2.107 10.394 ( -5.639 -9.442 2.094) 11.195 10.433 ( -1.846 -7.266 -2.349) 7.856 10.745 ( 1.748 -5.151 1.778) 5.723 10.942 ( 5.170 1.450 2.510) 5.927 11.217 ( -4.068 4.866 -2.514) 6.823 11.495 ( 1.228 7.953 -0.063) 8.047 12.490 ( -4.035 2.467 3.095) 5.652 13.009 ( -5.522 6.619 -2.773) 9.055 13.522 ( 0.624 -0.764 -0.126) 0.995 13.693 ( -0.802 1.062 -2.161) 2.538 14.525 ( -1.789 1.153 0.490) 2.184 15.008 ( -1.053 7.659 -2.389) 8.092 15.634 ( 2.312 4.938 4.861) 7.305 15.728 ( 2.342 6.358 -1.311) 6.901 15.815 ( -3.889 6.977 -2.853) 8.481 16.116 ( 0.260 1.939 -3.057) 3.630 16.395 ( -0.859 -0.211 1.051) 1.374 16.549 ( -1.308 9.590 1.129) 9.744 17.581 ( 1.432 2.512 2.713) 3.965 17.838 ( 3.336 -2.379 -0.061) 4.098 18.060 ( 5.361 -4.742 -1.014) 7.229 18.235 ( 4.729 -3.129 -2.409) 6.161 18.782 ( -0.482 -1.609 5.217) 5.480 19.078 ( 1.292 1.620 -1.903) 2.814 19.535 ( -0.564 0.035 7.557) 7.578 20.351 ( -5.966 5.068 -4.772) 9.167 27.625 ( 2.210 1.980 1.457) 3.305 28.373 ( -3.307 2.645 -5.177) 6.688 29.214 ( 0.145 -0.318 -0.812) 0.884 29.347 ( 0.949 -4.592 1.584) 4.949 29.592 ( -0.219 1.405 -2.658) 3.015 29.610 ( -1.198 -0.178 2.366) 2.658 29.911 ( -0.631 10.606 -1.544) 10.736 30.136 ( 2.862 9.939 -1.256) 10.418 30.546 ( -0.783 0.214 -2.172) 2.319 30.624 ( -0.891 0.208 1.951) 2.155 31.262 ( 4.581 4.470 -1.947) 6.690 31.741 ( -7.140 2.886 6.411) 10.021 32.293 ( -8.606 -21.988 1.164) 23.641 33.471 ( 5.635 -22.738 -0.962) 23.446 34.162 ( -11.132 -22.189 -2.440) 24.944 35.851 ( 11.394 -10.278 3.604) 15.762 ======================= Grid point 178 (84/160) ======================= q-point: (-0.44 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 10.501 9.955 -5.950) 15.645 2.344 ( -5.758 10.304 -7.311) 13.885 3.133 ( -4.341 -0.055 -7.577) 8.733 3.410 ( 1.863 -3.797 4.647) 6.284 3.699 ( 1.444 -10.036 6.339) 11.958 3.858 ( -3.177 -8.530 12.554) 15.507 4.011 ( -2.202 -8.370 -1.828) 8.846 4.237 ( -1.256 -8.815 -2.057) 9.139 4.401 ( 0.215 -14.409 -0.338) 14.415 4.523 ( -0.669 3.309 1.913) 3.880 4.689 ( -1.331 5.310 -1.724) 5.739 4.825 ( 6.544 -3.341 -3.478) 8.129 4.939 ( 5.058 6.355 4.949) 9.512 5.203 ( 6.228 1.012 -1.967) 6.609 5.309 ( -0.390 -3.888 -1.613) 4.228 5.503 ( -0.735 5.606 -4.157) 7.018 5.813 ( 3.759 -1.186 9.281) 10.083 5.939 ( -8.543 -1.229 -0.293) 8.636 6.329 ( 3.393 -3.286 5.862) 7.528 6.476 ( -5.257 -11.955 -6.656) 14.659 6.595 ( 2.952 -2.358 -0.453) 3.805 6.684 ( 1.967 -7.395 -1.139) 7.736 6.826 ( 0.442 -7.747 0.795) 7.800 6.951 ( -7.465 -3.033 -7.341) 10.900 7.223 ( -5.672 -2.940 -0.082) 6.389 7.388 ( -3.891 -5.897 0.393) 7.076 7.856 ( 8.004 1.592 2.564) 8.554 8.328 ( -0.421 -2.024 -3.045) 3.681 8.416 ( 3.487 -3.066 0.915) 4.732 8.579 ( 1.660 0.640 -1.189) 2.140 9.083 ( -4.181 2.198 6.297) 7.871 9.178 ( 4.727 -9.026 -3.684) 10.834 9.337 ( 3.501 -0.565 0.736) 3.622 9.701 ( 4.199 2.573 2.101) 5.354 9.904 ( 3.721 -6.117 -2.896) 7.724 10.021 ( -11.808 12.306 -2.829) 17.288 10.544 ( -0.285 -3.936 3.030) 4.975 10.573 ( 0.042 -11.907 0.875) 11.939 10.870 ( 1.084 -11.661 -1.863) 11.858 10.909 ( 3.670 8.914 0.004) 9.640 11.103 ( -3.218 3.196 -1.657) 4.829 11.445 ( 1.765 0.090 0.104) 1.770 12.425 ( -4.034 4.396 5.974) 8.443 12.831 ( -1.748 5.405 -5.494) 7.902 13.513 ( -2.367 1.243 0.617) 2.744 13.699 ( 3.540 -1.346 -1.473) 4.064 14.500 ( -1.039 0.634 0.461) 1.302 14.882 ( 0.839 4.444 -2.168) 5.015 15.543 ( -1.228 5.735 1.412) 6.033 15.676 ( -0.735 0.766 -0.956) 1.428 15.806 ( 1.695 -4.925 1.545) 5.433 16.073 ( 1.342 0.899 -4.108) 4.414 16.378 ( 1.654 9.849 5.069) 11.199 16.409 ( -4.081 -1.566 -1.621) 4.662 17.574 ( 0.989 2.605 4.414) 5.220 17.889 ( 3.836 -0.845 -2.155) 4.480 18.141 ( 2.058 -2.156 -2.461) 3.865 18.289 ( 2.020 -2.386 -3.683) 4.831 18.819 ( -1.042 1.958 7.683) 7.997 19.072 ( 2.032 -0.859 -2.568) 3.386 19.565 ( -6.619 -0.475 4.882) 8.239 20.219 ( -2.220 2.553 -2.022) 3.941 27.619 ( 0.508 1.437 1.367) 2.048 28.299 ( -0.169 1.320 -2.447) 2.786 29.233 ( 2.919 -1.119 -0.732) 3.211 29.453 ( 0.514 -5.546 0.302) 5.578 29.535 ( -1.097 2.204 -1.591) 2.931 29.660 ( -0.148 -3.892 1.701) 4.250 29.730 ( -1.408 7.062 -0.750) 7.240 29.976 ( 1.515 8.321 -2.885) 8.936 30.516 ( -0.207 1.405 -1.081) 1.785 30.664 ( -0.177 -2.624 1.746) 3.157 31.198 ( 2.461 4.265 -1.333) 5.101 31.697 ( -6.369 1.056 6.295) 9.016 32.567 ( -3.685 -14.016 0.980) 14.526 33.759 ( 2.273 -8.349 -1.668) 8.812 34.366 ( -6.015 -9.746 2.556) 11.734 36.085 ( 9.419 -7.411 -4.168) 12.689 ======================= Grid point 179 (85/160) ======================= q-point: (-0.33 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 7.473 15.948 0.567) 17.621 2.111 ( -1.959 14.200 10.595) 17.825 3.009 ( -8.369 1.009 -8.836) 12.212 3.492 ( 4.741 3.391 5.733) 8.176 3.685 ( -3.185 10.075 -5.476) 11.901 3.892 ( -1.641 3.002 5.369) 6.366 4.218 ( -6.422 -5.055 4.888) 9.523 4.313 ( -2.113 1.848 0.407) 2.837 4.350 ( 1.157 11.581 0.195) 11.640 4.489 ( 4.556 1.066 -5.362) 7.116 4.649 ( -2.927 -2.062 1.414) 3.850 4.808 ( -2.248 -0.731 -5.644) 6.119 4.937 ( 3.174 1.835 1.201) 3.858 5.259 ( 7.299 0.926 -2.468) 7.760 5.305 ( 1.963 1.158 -4.042) 4.640 5.459 ( -0.022 -2.357 5.614) 6.089 5.792 ( -6.138 5.453 -2.919) 8.714 5.952 ( 7.222 -0.442 2.815) 7.764 6.325 ( -3.636 7.539 -0.577) 8.390 6.404 ( -10.074 3.488 -8.398) 13.571 6.618 ( 3.075 8.659 5.479) 10.699 6.742 ( 4.793 1.088 -1.625) 5.176 6.878 ( 3.502 5.013 4.097) 7.360 6.919 ( 1.047 2.167 0.451) 2.448 7.109 ( -7.874 8.403 2.570) 11.799 7.443 ( -0.921 -1.356 -0.493) 1.712 7.897 ( 7.850 2.263 2.454) 8.530 8.285 ( -3.046 2.789 -2.364) 4.759 8.497 ( 5.982 -0.753 -3.802) 7.128 8.566 ( -1.071 -0.374 0.126) 1.142 8.954 ( -7.422 11.407 3.444) 14.038 9.273 ( 3.224 -1.234 -2.237) 4.114 9.429 ( 4.070 -4.998 -1.569) 6.633 9.585 ( 0.788 9.449 -1.295) 9.570 9.779 ( -2.859 6.568 -2.072) 7.457 10.061 ( 0.377 -6.949 8.288) 10.823 10.576 ( -1.371 0.141 -2.040) 2.462 10.660 ( 2.560 10.969 0.236) 11.266 10.819 ( -1.591 -7.038 0.796) 7.259 11.007 ( -1.654 -3.082 -8.992) 9.648 11.215 ( 6.019 -17.510 -6.449) 19.607 11.446 ( 0.392 0.814 -1.067) 1.398 12.465 ( -3.416 -8.627 10.829) 14.260 12.755 ( 2.130 0.663 -0.021) 2.231 13.461 ( -2.524 3.128 1.326) 4.232 13.753 ( 5.061 -1.758 -0.764) 5.412 14.496 ( -0.743 -0.236 1.126) 1.370 14.850 ( 1.194 -0.945 0.180) 1.533 15.515 ( -1.354 -0.911 2.718) 3.170 15.687 ( -0.920 -4.959 -3.025) 5.881 15.876 ( 2.763 0.540 -1.887) 3.389 16.084 ( 3.230 -3.632 -1.396) 5.056 16.302 ( -7.706 -1.967 3.080) 8.528 16.421 ( 2.714 1.211 3.486) 4.581 17.567 ( -0.136 2.723 4.872) 5.583 17.896 ( 4.018 0.885 -4.192) 5.874 18.112 ( -1.645 2.450 -6.002) 6.688 18.289 ( 1.243 0.303 -4.388) 4.571 18.816 ( -3.917 2.417 7.185) 8.533 19.083 ( 4.875 1.004 -2.870) 5.745 19.493 ( -14.370 0.494 0.283) 14.381 20.225 ( 3.083 -1.476 4.314) 5.504 27.602 ( -1.384 0.799 0.395) 1.646 28.292 ( 2.695 0.302 1.540) 3.119 29.283 ( 5.275 -0.908 -0.181) 5.355 29.456 ( -0.377 3.634 -2.499) 4.427 29.517 ( -3.283 -2.709 -2.795) 5.092 29.651 ( 0.757 -0.924 -1.144) 1.654 29.798 ( -1.445 -8.276 4.570) 9.564 29.879 ( 2.018 1.953 -1.968) 3.430 30.482 ( -0.120 2.171 1.471) 2.626 30.705 ( 0.039 -1.324 -0.443) 1.397 31.161 ( 1.029 0.481 -1.170) 1.630 31.699 ( -5.851 -1.518 6.899) 9.173 32.688 ( 0.513 -1.548 -0.724) 1.784 33.761 ( 0.870 7.169 -3.849) 8.183 34.418 ( -0.589 4.301 6.648) 7.940 36.169 ( 6.860 -1.451 -13.888) 15.558 ======================= Grid point 180 (86/160) ======================= q-point: (-0.22 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( 4.940 19.617 4.593) 20.745 2.040 ( 7.377 14.308 32.710) 36.457 2.823 ( -11.223 3.909 -10.751) 16.026 3.314 ( -3.663 15.121 -7.783) 17.396 3.509 ( 1.249 11.618 -0.363) 11.690 3.682 ( 3.645 18.837 1.683) 19.260 4.054 ( 1.667 22.300 5.625) 23.059 4.125 ( 1.408 14.417 1.629) 14.577 4.266 ( -9.034 12.046 4.906) 15.836 4.476 ( -5.876 14.655 6.451) 17.056 4.553 ( -3.640 -4.416 -10.331) 11.811 4.698 ( 0.523 11.158 -3.247) 11.632 4.929 ( 1.427 -0.271 -7.805) 7.939 5.201 ( -3.447 0.130 -8.254) 8.945 5.282 ( 4.907 4.474 0.327) 6.649 5.616 ( 3.484 0.913 5.360) 6.458 5.639 ( 5.185 0.469 -4.334) 6.774 5.985 ( -3.628 21.099 2.883) 21.602 6.023 ( 5.109 12.158 -1.582) 13.283 6.175 ( -1.620 7.334 -3.472) 8.275 6.439 ( -0.040 10.289 -1.177) 10.356 6.582 ( -2.833 20.608 0.270) 20.803 6.691 ( -3.198 5.423 -5.477) 8.345 6.977 ( 7.058 -0.302 10.996) 13.070 7.116 ( 2.325 -4.134 8.222) 9.491 7.435 ( -1.429 -0.672 -1.083) 1.915 7.940 ( 8.020 2.897 0.470) 8.540 8.185 ( -5.017 3.476 -0.931) 6.174 8.462 ( -3.837 5.434 -4.837) 8.225 8.525 ( 0.325 0.078 -3.720) 3.735 8.784 ( -4.222 3.529 6.249) 8.326 9.254 ( 4.857 7.123 2.379) 8.944 9.349 ( 1.365 4.708 -6.995) 8.542 9.569 ( -1.642 3.493 -0.074) 3.860 9.747 ( 1.097 -7.591 -0.692) 7.701 10.183 ( -0.474 2.484 7.974) 8.365 10.399 ( 1.298 15.618 1.835) 15.778 10.570 ( 0.293 2.745 -2.782) 3.919 10.898 ( -2.521 -3.673 -2.913) 5.323 11.008 ( 1.735 -4.806 -13.015) 13.982 11.359 ( 3.011 -3.676 -7.043) 8.496 11.457 ( 0.235 -3.340 -0.710) 3.422 12.636 ( -0.256 -3.722 -0.944) 3.849 12.982 ( -0.521 -20.985 9.544) 23.059 13.392 ( -1.083 4.415 1.588) 4.815 13.833 ( 6.094 -2.554 0.679) 6.643 14.509 ( -1.113 -0.731 2.301) 2.659 14.973 ( 3.864 -10.149 5.767) 12.296 15.528 ( -3.229 -0.991 1.062) 3.541 15.776 ( -1.721 -9.219 -5.808) 11.031 15.892 ( 4.751 -1.731 1.057) 5.166 16.193 ( 5.219 -4.716 1.829) 7.268 16.342 ( -7.962 -7.792 -1.803) 11.285 16.475 ( -0.561 -2.338 7.936) 8.292 17.547 ( -1.428 2.920 4.153) 5.274 17.863 ( 3.108 3.453 -5.022) 6.841 17.960 ( -3.641 4.611 -9.085) 10.819 18.248 ( 3.436 2.782 -4.330) 6.189 18.774 ( -6.288 3.076 5.575) 8.949 19.063 ( 7.626 5.159 -2.656) 9.583 19.383 ( -15.364 -3.021 1.250) 15.708 20.343 ( 3.809 -3.100 7.722) 9.152 27.587 ( -1.682 -0.919 -0.271) 1.936 28.357 ( 4.844 -1.419 5.990) 7.833 29.315 ( 1.185 1.910 0.432) 2.289 29.386 ( 3.566 1.338 -4.330) 5.767 29.521 ( -2.044 -3.410 -1.970) 4.437 29.682 ( -0.014 -2.446 -1.297) 2.768 29.902 ( -0.100 -3.854 -0.062) 3.856 29.972 ( -0.438 -8.633 3.944) 9.502 30.483 ( 0.189 -0.389 3.691) 3.716 30.708 ( 0.811 0.113 -1.029) 1.315 31.171 ( 0.813 -0.826 -1.166) 1.644 31.749 ( -5.732 -3.928 6.705) 9.656 32.622 ( 1.312 8.312 -2.732) 8.848 33.482 ( 1.666 21.693 -8.575) 23.386 34.330 ( 5.954 14.259 9.119) 17.942 35.992 ( -1.792 10.053 -25.376) 27.353 ======================= Grid point 181 (87/160) ======================= q-point: (-0.11 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 5.075 17.017 13.923) 22.565 2.190 ( 16.670 14.707 40.523) 46.220 2.569 ( -9.000 4.701 -11.470) 15.318 2.944 ( -1.423 19.202 -7.988) 20.846 3.160 ( -4.060 24.572 1.169) 24.933 3.461 ( 3.361 31.309 10.151) 33.084 3.535 ( -2.270 44.592 5.997) 45.050 3.711 ( 3.462 28.875 2.594) 29.197 3.874 ( 1.017 20.335 2.833) 20.557 4.078 ( -2.727 34.235 -10.070) 35.789 4.459 ( -10.323 2.140 -7.281) 12.812 4.558 ( -4.970 0.697 1.742) 5.312 4.789 ( -1.280 9.332 -7.473) 12.024 5.118 ( 1.757 24.399 -2.131) 24.555 5.178 ( 1.232 -4.392 -10.575) 11.516 5.298 ( 2.159 30.340 -1.038) 30.434 5.565 ( -4.584 1.814 -10.997) 12.051 5.787 ( 5.856 -0.045 0.635) 5.890 5.987 ( 8.352 -1.005 14.194) 16.500 6.091 ( 2.079 1.026 -1.297) 2.657 6.290 ( -5.105 3.448 1.637) 6.374 6.519 ( -3.063 -9.264 -6.252) 11.588 6.600 ( 8.402 -0.152 -2.826) 8.866 7.109 ( 5.253 -1.477 5.925) 8.056 7.288 ( 4.430 -4.606 8.058) 10.284 7.450 ( -2.194 -3.635 -0.691) 4.302 7.873 ( 1.914 7.194 -7.724) 10.727 8.073 ( -6.362 4.549 2.493) 8.209 8.296 ( -0.522 6.235 -3.201) 7.028 8.549 ( -3.391 -5.119 -0.125) 6.141 8.806 ( -1.512 -1.626 6.575) 6.940 9.194 ( 6.579 5.315 0.965) 8.512 9.282 ( -1.251 0.424 -2.056) 2.444 9.467 ( -2.508 2.949 -2.605) 4.666 9.850 ( 0.318 0.171 1.147) 1.203 10.088 ( -1.048 9.522 2.088) 9.805 10.169 ( 1.442 15.968 5.162) 16.844 10.485 ( 5.002 6.009 -7.309) 10.703 10.823 ( -2.276 8.652 -12.325) 15.230 10.950 ( -1.866 -1.457 -6.345) 6.772 11.419 ( 1.610 -5.468 0.218) 5.705 11.555 ( 0.285 -6.104 3.076) 6.841 12.663 ( 0.952 -0.626 -0.360) 1.195 13.267 ( -14.732 -9.583 0.381) 17.579 13.354 ( 7.533 -0.578 0.320) 7.561 13.911 ( 1.403 -1.447 -0.053) 2.016 14.531 ( -1.634 -0.599 3.362) 3.786 15.226 ( -1.296 -6.049 1.234) 6.308 15.637 ( 4.028 -14.948 3.141) 15.797 15.882 ( -2.527 -10.872 -5.833) 12.594 15.990 ( 4.720 -2.215 2.578) 5.816 16.330 ( -1.253 -5.833 -1.782) 6.227 16.402 ( 3.266 -3.995 4.200) 6.653 16.573 ( -10.088 -6.809 3.360) 12.626 17.511 ( 0.249 3.283 2.982) 4.442 17.734 ( -1.947 4.483 -1.664) 5.163 17.883 ( 3.615 -0.815 -6.244) 7.261 18.193 ( 5.164 3.812 -5.227) 8.278 18.721 ( -1.789 2.523 5.472) 6.286 19.018 ( 8.114 4.670 -2.023) 9.578 19.409 ( -11.153 -10.530 5.969) 16.459 20.482 ( 2.762 -3.179 8.163) 9.185 27.616 ( 0.579 -4.153 -1.987) 4.640 28.521 ( 5.694 -6.912 10.525) 13.819 29.275 ( -1.154 0.842 -0.505) 1.515 29.388 ( 2.287 -0.435 -2.827) 3.662 29.576 ( 1.339 -3.989 -0.390) 4.226 29.703 ( -0.187 -1.353 -1.792) 2.254 29.972 ( 0.275 -4.520 -0.315) 4.539 30.123 ( -0.646 -6.260 3.091) 7.012 30.527 ( -1.565 0.839 5.120) 5.420 30.731 ( 4.410 -1.996 -0.328) 4.852 31.142 ( 2.356 5.504 -1.560) 6.188 31.832 ( -4.853 -6.207 4.394) 9.021 32.413 ( -3.785 11.903 -3.923) 13.092 32.951 ( 5.804 32.992 -17.027) 37.578 34.217 ( 11.974 14.934 10.794) 21.975 35.396 ( -19.075 27.637 -26.272) 42.636 ======================= Grid point 184 (88/160) ======================= q-point: ( 0.22 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( 4.872 0.000 -0.917) 4.957 2.049 ( -2.336 -0.000 1.740) 2.913 2.368 ( 19.649 0.000 -21.759) 29.318 2.472 ( 16.655 0.000 27.965) 32.549 2.517 ( 2.110 0.000 0.245) 2.124 2.529 ( 3.263 0.000 2.466) 4.090 3.066 ( 10.995 0.000 -3.747) 11.616 3.191 ( -1.011 -0.000 0.090) 1.015 3.261 ( -2.460 -0.000 -14.394) 14.602 3.574 ( -4.252 -0.000 -25.518) 25.870 3.969 ( -16.320 -0.000 6.340) 17.509 4.085 ( -15.366 -0.000 17.805) 23.519 4.375 ( -6.397 -0.000 -5.948) 8.735 4.569 ( 17.726 0.000 25.072) 30.705 4.846 ( -2.897 -0.000 -2.887) 4.090 5.361 ( 8.789 0.000 3.776) 9.566 5.551 ( 7.246 0.000 3.322) 7.971 5.722 ( -15.034 -0.000 -4.614) 15.726 5.913 ( -1.155 -0.000 -7.964) 8.047 6.171 ( -0.957 -0.000 4.821) 4.915 6.630 ( 1.941 0.000 -20.787) 20.878 6.640 ( 7.648 0.000 4.759) 9.008 6.922 ( 3.458 0.000 -5.863) 6.807 7.013 ( -5.927 -0.000 -0.663) 5.964 7.272 ( -4.813 -0.000 -1.592) 5.069 7.450 ( -6.846 -0.000 -0.008) 6.846 7.683 ( 4.740 0.000 1.298) 4.914 8.077 ( 6.289 0.000 6.475) 9.027 8.259 ( 7.885 0.000 -0.567) 7.906 8.580 ( -6.662 -0.000 4.854) 8.242 8.752 ( -10.793 -0.000 -2.885) 11.172 9.189 ( 4.721 0.000 -3.552) 5.908 9.467 ( -5.603 -0.000 4.564) 7.226 9.603 ( 9.668 0.000 2.127) 9.899 9.640 ( 0.163 0.000 -2.644) 2.649 9.805 ( -2.610 -0.000 -2.069) 3.330 9.830 ( -1.838 -0.000 -0.342) 1.869 10.010 ( 3.369 0.000 -0.295) 3.382 10.573 ( -3.022 -0.000 -1.349) 3.309 11.036 ( 4.607 0.000 4.967) 6.775 11.510 ( -3.561 -0.000 -2.641) 4.434 11.788 ( 2.209 0.000 -0.165) 2.215 12.539 ( -5.544 -0.000 0.495) 5.566 13.111 ( -6.129 -0.000 1.303) 6.266 13.515 ( -0.213 -0.000 1.109) 1.129 13.816 ( -3.526 -0.000 1.680) 3.905 14.571 ( -2.329 -0.000 1.420) 2.728 15.143 ( -0.097 -0.000 4.897) 4.898 16.019 ( -0.743 -0.000 -1.798) 1.945 16.035 ( 3.178 0.000 -9.750) 10.255 16.087 ( 1.344 0.000 2.562) 2.893 16.339 ( -6.856 -0.000 3.866) 7.871 16.361 ( -6.441 -0.000 -0.832) 6.494 16.818 ( 5.663 0.000 0.210) 5.667 17.502 ( 4.384 0.000 0.407) 4.403 17.833 ( 3.676 0.000 0.642) 3.732 17.936 ( -0.872 -0.000 0.167) 0.888 18.102 ( 11.759 0.000 -1.454) 11.849 18.673 ( -4.076 -0.000 0.919) 4.178 19.143 ( 7.743 0.000 -6.360) 10.020 19.713 ( -10.722 -0.000 6.774) 12.682 20.641 ( -3.479 -0.000 -4.789) 5.919 27.695 ( 3.484 0.000 -2.588) 4.340 28.709 ( -16.227 -0.000 -10.735) 19.457 29.266 ( -1.201 -0.000 2.816) 3.062 29.479 ( -2.636 -0.000 -3.178) 4.129 29.623 ( -2.267 -0.000 -2.173) 3.140 29.657 ( -1.166 -0.000 0.092) 1.169 29.727 ( 0.634 0.000 -0.099) 0.641 30.327 ( 2.073 0.000 2.879) 3.548 30.422 ( 8.132 0.000 0.177) 8.134 30.879 ( -3.550 -0.000 -5.323) 6.398 31.263 ( 16.056 0.000 -13.669) 21.087 31.988 ( -1.378 -0.000 0.114) 1.383 32.081 ( 6.397 0.000 13.527) 14.963 32.089 ( 1.290 0.000 -0.206) 1.307 33.123 ( -30.588 -0.000 -0.090) 30.588 35.332 ( 18.515 0.000 14.406) 23.460 ======================= Grid point 185 (89/160) ======================= q-point: ( 0.33 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.077 ( 7.655 -27.193 -15.818) 32.377 2.314 ( 9.640 -8.731 -17.780) 22.029 2.603 ( 5.783 -45.197 2.062) 45.612 2.722 ( 3.423 -16.651 4.876) 17.684 2.858 ( 9.244 -18.599 17.270) 27.012 2.947 ( 7.477 -31.984 3.632) 33.047 3.078 ( 2.288 -4.772 -8.075) 9.655 3.302 ( -1.544 -6.246 -8.132) 10.369 3.420 ( -0.512 -18.543 -4.708) 19.138 3.625 ( 7.867 -32.645 -10.435) 35.163 3.939 ( -15.732 -4.956 12.319) 20.587 4.216 ( -13.167 -16.104 10.935) 23.501 4.421 ( -6.107 -17.674 -2.968) 18.934 4.804 ( 5.260 -1.958 9.861) 11.346 4.844 ( -1.561 -5.166 -1.704) 5.659 5.403 ( 7.009 8.657 3.681) 11.731 5.567 ( 0.468 0.692 2.633) 2.763 5.707 ( -4.451 -4.891 1.978) 6.902 5.850 ( 2.609 -0.304 -4.903) 5.563 6.211 ( -1.004 -1.460 3.874) 4.260 6.481 ( 6.701 5.037 -11.821) 14.492 6.668 ( 4.041 5.336 3.609) 7.604 6.792 ( 3.735 10.281 -1.061) 10.990 6.941 ( -8.245 1.502 -5.294) 9.913 7.251 ( -8.344 -1.968 -3.880) 9.410 7.374 ( -5.707 2.407 1.486) 6.370 7.749 ( 5.433 -1.426 3.130) 6.430 8.193 ( 6.046 -1.770 2.944) 6.954 8.354 ( 6.971 -3.451 0.529) 7.797 8.516 ( -8.164 2.704 1.502) 8.731 8.677 ( -8.052 -4.250 -1.688) 9.260 9.116 ( 4.808 6.602 -1.262) 8.264 9.419 ( -0.881 4.024 2.888) 5.030 9.590 ( 2.361 2.233 -1.593) 3.619 9.824 ( -5.009 -10.568 2.902) 12.050 9.888 ( -0.824 -11.912 -1.501) 12.035 9.988 ( 5.825 -19.567 -5.592) 21.167 10.078 ( 2.305 -5.118 0.257) 5.619 10.556 ( -3.249 -1.394 1.099) 3.702 11.084 ( 4.847 3.091 4.434) 7.260 11.415 ( -4.492 4.447 -3.755) 7.352 11.760 ( 2.043 4.876 -0.869) 5.358 12.510 ( -3.984 -0.063 1.944) 4.433 13.060 ( -8.219 -1.378 -3.383) 8.994 13.522 ( -0.326 -0.158 1.909) 1.943 13.779 ( -2.043 2.875 0.733) 3.602 14.553 ( -2.343 0.451 0.065) 2.387 15.154 ( -1.931 1.541 2.357) 3.414 15.885 ( 1.913 8.198 -4.198) 9.407 16.029 ( -0.044 1.022 -5.830) 5.919 16.048 ( 1.763 7.411 1.646) 7.794 16.239 ( -5.536 4.959 -0.646) 7.460 16.337 ( -5.496 -2.024 0.646) 5.893 16.818 ( 3.755 4.655 -0.178) 5.984 17.584 ( 5.434 -3.167 1.953) 6.585 17.855 ( -3.040 2.206 -0.011) 3.756 17.914 ( 4.068 -1.334 1.387) 4.500 18.204 ( 11.970 0.760 0.129) 11.995 18.697 ( 2.675 -2.023 3.749) 5.031 19.148 ( 4.407 1.429 -3.741) 5.954 19.626 ( -9.527 4.354 6.867) 12.525 20.531 ( -4.153 4.350 -5.525) 8.167 27.693 ( 2.819 1.553 -0.817) 3.320 28.485 ( -8.269 3.420 -9.638) 13.152 29.274 ( -1.154 1.429 2.817) 3.363 29.296 ( -0.401 5.992 -0.874) 6.069 29.589 ( -1.327 0.765 -0.870) 1.761 29.687 ( 0.408 1.565 -0.217) 1.632 29.941 ( -4.009 -16.783 -0.322) 17.258 30.364 ( 2.737 1.058 2.325) 3.744 30.488 ( 4.030 -1.669 -0.174) 4.366 30.761 ( -2.734 5.304 -5.694) 8.248 31.250 ( 10.029 0.660 -9.421) 13.776 31.863 ( -6.886 8.451 1.698) 11.033 31.960 ( -0.607 6.183 5.077) 8.024 32.569 ( 8.806 -26.157 7.573) 28.619 33.183 ( -19.153 -28.468 -2.343) 34.391 35.574 ( 11.084 -4.196 8.529) 14.602 ======================= Grid point 186 (90/160) ======================= q-point: ( 0.44 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 17.743 2.331 -13.318) 22.308 2.469 ( 3.134 -6.337 -18.583) 19.882 2.970 ( 2.351 -15.897 0.005) 16.070 3.134 ( -5.553 -6.352 -7.833) 11.513 3.273 ( 1.605 -20.164 5.527) 20.970 3.309 ( 9.267 -4.430 12.322) 16.042 3.477 ( 3.688 -38.816 -8.886) 39.990 3.704 ( -1.707 -22.204 1.390) 22.313 3.947 ( 1.063 -41.873 10.058) 43.077 4.034 ( -9.433 -10.491 12.600) 18.916 4.259 ( 6.121 -38.120 -2.289) 38.676 4.539 ( -2.468 -23.124 -0.263) 23.257 4.730 ( -4.520 -13.132 -0.288) 13.891 4.906 ( 0.024 -4.530 1.355) 4.728 5.120 ( -6.349 -34.689 -4.286) 35.524 5.330 ( 5.342 1.115 2.953) 6.205 5.638 ( -2.674 -0.447 -0.989) 2.886 5.665 ( -5.822 -10.212 -3.659) 12.312 5.947 ( 7.422 -0.015 6.838) 10.092 6.257 ( 6.333 1.435 1.784) 6.734 6.429 ( 6.538 1.021 -1.368) 6.757 6.622 ( -4.131 2.710 1.809) 5.262 6.692 ( 4.749 6.577 3.956) 9.026 6.807 ( -4.522 0.635 -4.492) 6.405 7.121 ( -6.890 1.463 -7.846) 10.544 7.316 ( -7.371 1.933 3.519) 8.394 7.844 ( 6.686 -1.564 1.511) 7.031 8.226 ( -2.091 -1.432 -4.485) 5.152 8.417 ( -0.582 0.782 5.705) 5.787 8.498 ( 3.067 -2.458 -0.997) 4.055 8.764 ( -2.792 -11.820 0.021) 12.145 9.094 ( 4.682 0.620 0.752) 4.783 9.386 ( 4.045 4.143 1.646) 6.020 9.549 ( -1.557 0.017 -2.131) 2.639 9.878 ( -7.647 -4.719 -4.284) 9.955 10.136 ( 0.556 -12.589 2.839) 12.918 10.235 ( -0.160 -12.372 0.186) 12.374 10.307 ( 7.468 -8.138 -1.946) 11.216 10.610 ( -3.316 -9.103 3.777) 10.398 11.074 ( 4.070 5.250 2.873) 7.237 11.256 ( -4.286 6.211 -3.347) 8.255 11.649 ( 1.308 8.713 -1.127) 8.882 12.502 ( -3.275 0.092 3.439) 4.750 12.962 ( -8.922 0.078 -8.267) 12.163 13.539 ( -0.023 0.141 2.310) 2.314 13.717 ( 1.066 3.150 -0.395) 3.349 14.523 ( -2.014 0.575 -0.666) 2.197 15.083 ( -2.356 4.741 -2.482) 5.847 15.759 ( 3.430 5.818 -1.098) 6.842 15.897 ( -1.999 9.445 -4.938) 10.844 15.917 ( 0.921 10.071 2.793) 10.492 16.121 ( -2.247 2.805 -2.808) 4.561 16.345 ( -2.753 -2.199 -0.080) 3.524 16.723 ( 1.879 8.674 -0.501) 8.889 17.670 ( 4.296 1.752 4.109) 6.198 17.826 ( 1.482 -1.846 0.008) 2.367 18.010 ( 1.380 -4.285 2.689) 5.244 18.248 ( 6.665 1.141 -3.234) 7.495 18.821 ( 7.517 -2.205 6.919) 10.452 19.106 ( 0.629 3.385 -1.550) 3.776 19.551 ( -9.942 0.541 4.998) 11.141 20.377 ( -2.461 5.923 -3.884) 7.498 27.678 ( 1.562 1.950 -0.185) 2.505 28.351 ( -1.558 1.716 -5.399) 5.875 29.212 ( 0.076 1.245 -0.830) 1.499 29.315 ( 0.184 -1.829 3.226) 3.713 29.564 ( -0.417 0.198 -1.738) 1.799 29.657 ( -0.426 2.416 1.566) 2.910 30.030 ( -1.695 3.010 -1.077) 3.619 30.312 ( 2.491 8.635 -1.815) 9.169 30.524 ( -0.876 -0.458 -1.297) 1.630 30.642 ( -0.128 1.970 -0.965) 2.198 31.321 ( 7.517 -3.045 -4.208) 9.137 31.733 ( -12.082 -0.951 4.098) 12.793 31.942 ( -3.371 -5.516 1.884) 6.733 33.149 ( 8.628 -25.458 8.976) 28.339 33.587 ( -10.623 -32.900 -1.824) 34.621 35.771 ( 4.564 -8.170 0.124) 9.359 ======================= Grid point 187 (91/160) ======================= q-point: ( 0.56 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( 18.068 6.219 -6.748) 20.265 2.407 ( 3.509 3.125 -5.666) 7.361 3.021 ( -7.353 -0.695 -9.685) 12.180 3.274 ( 1.170 -15.379 -0.011) 15.423 3.599 ( 4.391 -9.766 9.401) 14.249 3.636 ( -0.952 -17.248 7.600) 18.872 3.916 ( -1.930 -15.213 -4.551) 15.996 4.043 ( 1.750 -14.615 4.683) 15.446 4.070 ( -7.795 -10.289 2.891) 13.228 4.513 ( -0.688 -9.367 3.377) 9.981 4.687 ( -0.628 -5.283 -1.548) 5.541 4.762 ( -5.401 -2.868 -6.048) 8.601 4.929 ( 4.948 -15.158 -2.625) 16.160 5.111 ( 2.019 -19.241 0.327) 19.349 5.312 ( 11.488 0.183 4.038) 12.178 5.556 ( -3.891 -0.656 -5.687) 6.922 5.696 ( -2.569 -19.086 1.860) 19.348 5.870 ( -8.654 -6.288 3.664) 11.307 6.119 ( 6.125 -14.984 -1.174) 16.230 6.298 ( 3.940 -5.151 3.493) 7.366 6.514 ( -8.187 -3.139 -0.539) 8.785 6.580 ( 2.084 -6.531 0.107) 6.856 6.709 ( 0.773 -6.640 0.527) 6.706 6.854 ( 7.714 -2.267 2.303) 8.364 7.076 ( -3.346 -5.392 -1.188) 6.456 7.253 ( -9.107 -2.512 1.945) 9.645 7.926 ( 8.226 -1.254 -2.253) 8.620 8.216 ( -3.114 -3.716 -2.796) 5.597 8.449 ( 1.133 -0.002 3.209) 3.403 8.566 ( 4.428 -3.354 -1.369) 5.721 8.969 ( -2.179 -12.664 -0.967) 12.886 9.127 ( 0.368 1.609 2.322) 2.849 9.370 ( 6.416 -0.422 -3.847) 7.492 9.607 ( -1.841 -9.127 3.300) 9.878 9.819 ( -6.492 -0.008 -6.342) 9.075 10.169 ( -2.081 11.364 -5.339) 12.727 10.368 ( 1.261 -11.361 2.946) 11.804 10.523 ( 1.104 -7.823 10.113) 12.833 10.793 ( 1.386 -5.046 0.692) 5.279 11.040 ( 2.130 2.111 -0.294) 3.013 11.120 ( -1.805 5.005 -0.628) 5.358 11.506 ( 0.765 6.713 -0.549) 6.778 12.484 ( -4.699 2.100 3.841) 6.422 12.820 ( -3.145 1.667 -9.336) 9.991 13.541 ( -0.278 1.564 2.198) 2.712 13.706 ( 3.521 0.150 -0.245) 3.533 14.496 ( -1.462 0.265 -0.666) 1.628 14.950 ( -0.431 5.650 -4.164) 7.032 15.665 ( -2.716 10.298 -2.966) 11.056 15.742 ( 2.832 1.952 2.815) 4.444 15.792 ( -0.343 5.071 1.532) 5.308 16.062 ( -0.163 0.629 -4.029) 4.081 16.343 ( -2.123 -0.100 -3.018) 3.691 16.581 ( 1.513 8.866 1.877) 9.188 17.678 ( 2.201 3.661 5.485) 6.952 17.893 ( 3.746 -1.822 -0.325) 4.178 18.096 ( -0.594 -3.326 1.044) 3.536 18.249 ( 3.700 -0.622 -5.321) 6.511 18.938 ( 3.196 3.651 10.051) 11.161 19.057 ( 2.746 -0.549 -2.972) 4.084 19.488 ( -13.574 -1.125 0.334) 13.624 20.268 ( 1.256 4.143 0.307) 4.340 27.647 ( -0.309 1.869 -1.020) 2.152 28.310 ( 1.978 0.715 -1.500) 2.583 29.221 ( 1.918 -1.768 -0.917) 2.765 29.387 ( -0.257 -3.521 3.334) 4.856 29.539 ( 0.051 0.895 -3.469) 3.583 29.641 ( -0.891 0.127 3.703) 3.810 29.869 ( -0.922 10.895 -2.076) 11.129 30.125 ( 0.919 10.743 -4.508) 11.687 30.509 ( 0.641 -0.604 -1.844) 2.043 30.649 ( -0.568 -0.504 2.251) 2.376 31.307 ( 3.986 6.190 -1.688) 7.553 31.704 ( -7.402 0.366 5.101) 8.997 32.186 ( -5.485 -23.537 0.442) 24.171 33.620 ( 5.884 -14.964 7.902) 17.916 34.041 ( -3.851 -26.364 3.112) 26.824 35.924 ( 0.937 -10.638 -8.141) 13.428 ======================= Grid point 188 (92/160) ======================= q-point: (-0.33 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( 14.157 11.116 -8.156) 19.761 2.403 ( 7.010 6.634 16.529) 19.140 2.909 ( -7.190 1.136 -4.577) 8.599 3.500 ( 1.408 -8.407 2.207) 8.805 3.775 ( 2.635 1.306 -1.862) 3.481 3.897 ( -9.727 0.772 7.627) 12.385 3.958 ( -2.123 -18.018 0.266) 18.144 4.174 ( -1.663 -8.301 -4.151) 9.429 4.401 ( -0.153 -17.176 -0.965) 17.204 4.529 ( -2.735 4.988 1.638) 5.920 4.587 ( -4.419 3.672 -6.428) 8.621 4.760 ( -0.567 -0.830 -3.575) 3.714 5.023 ( 2.803 1.925 -0.772) 3.487 5.284 ( 4.407 0.280 -6.083) 7.517 5.387 ( 6.732 5.231 -0.518) 8.541 5.490 ( -0.344 -0.478 3.265) 3.318 5.765 ( -7.316 4.288 -1.584) 8.627 5.944 ( 2.889 -6.396 2.909) 7.597 6.317 ( -3.558 -4.157 -2.745) 6.122 6.366 ( -2.415 -1.061 0.988) 2.817 6.685 ( 1.190 -6.562 2.863) 7.257 6.719 ( 3.928 -10.142 0.528) 10.889 6.892 ( 4.251 -8.305 3.799) 10.074 6.962 ( 4.064 -1.798 7.537) 8.749 7.130 ( -5.082 -2.301 1.095) 5.685 7.345 ( -2.839 -9.061 1.498) 9.613 7.976 ( 7.481 0.483 -2.800) 8.002 8.233 ( -4.495 -2.491 -1.768) 5.434 8.483 ( 2.173 -1.619 -1.197) 2.963 8.630 ( 6.286 2.385 -0.187) 6.726 9.004 ( -10.545 1.989 1.182) 10.796 9.170 ( 1.936 -8.288 -6.154) 10.503 9.415 ( 6.719 1.277 -3.817) 7.832 9.717 ( -12.835 0.066 -3.240) 13.238 9.789 ( 3.670 -0.820 0.840) 3.853 9.964 ( 1.441 -2.806 0.094) 3.156 10.570 ( -0.066 -1.646 2.268) 2.803 10.648 ( 2.182 -5.400 5.628) 8.099 10.815 ( -1.477 0.232 -4.098) 4.362 10.979 ( -0.514 6.390 -0.045) 6.411 11.080 ( 3.406 -2.090 2.889) 4.931 11.461 ( 1.054 1.131 -0.981) 1.831 12.429 ( -4.888 0.528 3.353) 5.950 12.764 ( 2.206 -0.513 -2.926) 3.700 13.517 ( -0.106 2.771 2.201) 3.541 13.751 ( 3.735 -1.814 0.016) 4.152 14.486 ( -1.087 -0.470 0.251) 1.210 14.855 ( 0.381 2.007 -2.964) 3.600 15.525 ( -1.613 2.045 -0.247) 2.617 15.676 ( -0.341 5.236 1.921) 5.588 15.844 ( 0.222 -5.074 1.063) 5.188 16.039 ( 1.473 -1.222 -3.785) 4.241 16.248 ( -3.356 3.471 -6.053) 7.742 16.521 ( 1.392 3.380 5.458) 6.569 17.659 ( -1.247 3.969 5.757) 7.103 17.920 ( 4.821 0.946 -3.408) 5.979 18.104 ( -1.353 1.262 -2.566) 3.164 18.261 ( 2.922 -1.511 -4.225) 5.354 18.889 ( -4.978 4.732 5.805) 8.993 19.134 ( 8.325 -1.037 1.506) 8.523 19.363 ( -14.693 0.648 -4.047) 15.254 20.273 ( 3.325 -0.177 4.468) 5.573 27.599 ( -1.835 1.387 -1.921) 2.997 28.332 ( 3.632 -0.366 1.734) 4.042 29.284 ( 3.574 -3.478 -0.434) 5.006 29.436 ( -3.683 -0.982 -0.015) 3.812 29.502 ( 1.803 1.995 -1.080) 2.898 29.674 ( 0.658 3.710 -2.082) 4.304 29.710 ( -2.555 -2.059 3.376) 4.707 29.951 ( 1.839 6.674 -3.866) 7.929 30.519 ( 1.188 0.298 0.385) 1.284 30.666 ( -1.302 -1.553 0.185) 2.035 31.213 ( 1.617 5.265 -1.389) 5.680 31.685 ( -5.940 -0.192 6.017) 8.458 32.511 ( -2.570 -16.541 -0.625) 16.751 33.843 ( 3.236 -1.463 5.224) 6.317 34.409 ( 2.608 -12.206 7.745) 14.690 36.002 ( -1.311 -7.925 -15.577) 17.526 ======================= Grid point 189 (93/160) ======================= q-point: (-0.22 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( 12.071 14.984 -4.583) 19.779 2.511 ( 6.085 5.504 23.508) 24.899 2.787 ( -1.954 7.893 3.591) 8.888 3.492 ( -3.126 12.948 -2.300) 13.517 3.641 ( 0.763 3.731 -1.922) 4.266 3.933 ( 2.728 3.691 2.024) 5.017 4.127 ( -7.064 -5.915 -2.358) 9.511 4.215 ( -8.755 -4.157 -2.717) 10.065 4.359 ( -1.195 13.422 -0.158) 13.476 4.476 ( 0.766 -2.251 -3.607) 4.320 4.608 ( -2.297 -4.752 -0.801) 5.338 4.708 ( -2.241 2.037 -2.366) 3.843 4.912 ( -1.606 7.397 -9.591) 12.218 5.208 ( 2.665 6.631 -3.456) 7.939 5.346 ( 3.633 -0.567 -1.533) 3.984 5.586 ( -4.780 -5.407 3.072) 7.843 5.676 ( 4.588 0.153 -1.677) 4.887 6.044 ( 6.160 -0.440 -0.608) 6.205 6.233 ( -2.869 8.910 3.766) 10.090 6.319 ( 1.096 7.527 -2.316) 7.951 6.665 ( -0.211 5.724 0.446) 5.745 6.847 ( 4.500 8.256 3.004) 9.871 6.926 ( 0.478 14.196 -0.534) 14.214 7.018 ( -3.977 -0.105 2.930) 4.941 7.188 ( 6.088 -3.308 13.767) 15.413 7.419 ( -2.271 -0.608 1.926) 3.039 8.003 ( 6.323 0.433 -5.311) 8.269 8.186 ( -5.882 1.868 0.442) 6.187 8.501 ( -0.278 -0.049 -3.384) 3.396 8.553 ( 1.881 8.836 -0.318) 9.040 8.857 ( -6.587 5.705 2.608) 9.097 9.243 ( -0.299 -5.338 -10.355) 11.654 9.467 ( 2.691 -7.321 -2.313) 8.136 9.505 ( -2.384 10.786 0.104) 11.046 9.783 ( 5.200 5.227 -2.327) 7.732 10.179 ( -1.999 -10.192 8.812) 13.620 10.527 ( -0.801 2.007 -2.189) 3.076 10.702 ( 0.150 6.801 -3.283) 7.553 10.777 ( 0.156 -0.523 0.742) 0.921 10.898 ( -0.316 -1.274 -2.465) 2.793 11.252 ( 4.716 -8.020 -1.205) 9.382 11.412 ( -1.193 1.358 -2.872) 3.393 12.498 ( -3.951 -8.929 3.553) 10.391 12.827 ( 1.428 -5.353 3.761) 6.696 13.483 ( 1.551 3.643 2.013) 4.442 13.820 ( 2.419 -3.115 0.211) 3.950 14.498 ( -1.068 -1.134 1.876) 2.439 14.874 ( 1.159 -6.024 0.100) 6.136 15.524 ( -2.310 0.331 2.336) 3.302 15.632 ( -0.369 -1.422 -2.109) 2.570 15.911 ( 3.301 -1.715 -0.010) 3.720 16.106 ( -4.523 -8.579 -1.595) 9.829 16.164 ( 1.235 -1.966 -3.965) 4.595 16.525 ( -1.049 1.902 5.732) 6.130 17.611 ( -3.886 3.252 4.387) 6.702 17.900 ( 4.564 2.423 -5.027) 7.209 17.995 ( -0.413 6.537 -5.210) 8.369 18.274 ( 3.772 0.256 -3.595) 5.217 18.825 ( -4.676 3.043 5.780) 8.033 19.198 ( -9.066 2.164 -5.768) 10.961 19.214 ( 4.595 -0.272 2.817) 5.397 20.368 ( 2.486 -3.114 5.978) 7.184 27.555 ( -1.741 0.070 -1.802) 2.506 28.401 ( 3.626 -1.919 3.895) 5.657 29.367 ( 2.119 1.122 1.960) 3.097 29.399 ( -6.286 -2.842 -1.735) 7.114 29.432 ( 4.687 3.270 -4.414) 7.221 29.652 ( 0.674 -1.153 -0.235) 1.356 29.812 ( -2.512 -6.787 1.648) 7.422 29.907 ( 3.197 -1.620 -0.242) 3.592 30.519 ( 0.706 1.503 2.483) 2.987 30.680 ( -1.054 -1.787 -1.735) 2.704 31.162 ( 1.432 0.729 -1.402) 2.133 31.703 ( -6.121 -1.985 6.992) 9.502 32.648 ( -1.867 -2.484 -1.947) 3.667 33.791 ( 2.733 13.522 1.444) 13.871 34.588 ( 6.910 2.496 8.883) 11.528 35.903 ( -4.755 2.314 -21.406) 22.050 ======================= Grid point 190 (94/160) ======================= q-point: (-0.11 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 15.402 15.042 2.310) 21.652 2.484 ( -8.359 4.680 -4.609) 10.631 2.823 ( 17.328 11.289 31.966) 38.072 3.196 ( 1.627 17.022 -0.747) 17.116 3.469 ( -2.264 14.980 -1.546) 15.229 3.810 ( 2.149 13.893 4.128) 14.651 4.027 ( -10.916 10.157 -8.264) 17.047 4.083 ( -7.022 6.579 -3.384) 10.200 4.154 ( -1.465 11.352 0.621) 11.463 4.379 ( -2.192 15.588 -4.497) 16.371 4.526 ( -0.376 15.940 2.276) 16.106 4.587 ( -4.744 1.981 -3.749) 6.362 4.833 ( 1.311 -7.770 -6.207) 10.031 5.045 ( 2.440 13.876 -4.504) 14.792 5.402 ( 4.212 -0.798 -0.439) 4.309 5.530 ( 1.946 7.896 -6.055) 10.138 5.838 ( 5.733 -6.175 3.643) 9.180 5.858 ( -7.132 22.200 2.853) 23.491 6.148 ( 6.522 7.537 -3.634) 10.609 6.170 ( 1.806 6.027 -0.038) 6.292 6.445 ( -1.726 25.164 -2.825) 25.381 6.527 ( -1.466 14.670 4.402) 15.386 6.697 ( 4.685 6.940 -0.362) 8.381 7.110 ( -1.208 -4.886 2.766) 5.744 7.353 ( 3.582 -0.319 12.296) 12.811 7.399 ( -2.293 -0.219 0.375) 2.333 7.909 ( -0.650 6.049 -11.642) 13.136 8.127 ( -3.177 2.609 4.105) 5.810 8.386 ( -0.687 5.661 -0.341) 5.712 8.502 ( 2.175 1.797 -0.876) 2.954 8.815 ( -2.080 -0.177 5.296) 5.693 9.189 ( -3.119 -0.842 -10.504) 10.990 9.391 ( 4.098 5.856 3.423) 7.925 9.510 ( -1.437 4.765 -2.482) 5.562 9.785 ( 4.134 -5.871 -0.808) 7.226 10.247 ( -1.263 6.879 3.481) 7.813 10.459 ( -0.000 7.983 1.803) 8.184 10.569 ( 1.685 7.190 1.088) 7.464 10.790 ( -2.043 -3.578 -4.864) 6.375 10.865 ( 0.001 1.490 -7.968) 8.106 11.339 ( 0.361 -3.763 -1.327) 4.006 11.455 ( 0.615 -7.408 -0.369) 7.443 12.615 ( -2.829 -5.147 0.231) 5.877 13.002 ( -4.411 -10.751 4.839) 12.588 13.450 ( 3.993 3.785 0.532) 5.528 13.877 ( -1.354 -2.537 -0.619) 2.941 14.527 ( -1.392 -1.122 2.937) 3.439 15.084 ( 0.651 -13.172 2.183) 13.368 15.500 ( -1.593 -2.294 1.550) 3.194 15.681 ( -0.162 -6.533 -3.530) 7.427 16.001 ( 5.962 -3.068 0.999) 6.779 16.150 ( -7.642 -8.853 -3.498) 12.207 16.325 ( 4.270 -10.291 1.191) 11.205 16.512 ( -4.441 1.963 5.737) 7.516 17.567 ( -2.522 1.671 2.796) 4.120 17.799 ( -1.794 6.353 -1.802) 6.842 17.901 ( 7.832 2.953 -6.112) 10.364 18.249 ( 3.163 2.863 -4.562) 6.245 18.790 ( -2.260 2.975 5.533) 6.676 19.093 ( -2.857 -0.742 -4.471) 5.357 19.273 ( 2.507 -1.064 3.993) 4.834 20.484 ( 0.499 -4.016 5.306) 6.673 27.553 ( 0.150 -2.124 -1.391) 2.544 28.509 ( 1.807 -4.680 4.559) 6.779 29.300 ( -0.730 3.509 -0.448) 3.612 29.355 ( -4.300 -0.212 -1.950) 4.726 29.517 ( 4.445 -4.916 -0.563) 6.651 29.668 ( 0.200 -0.854 -1.254) 1.530 29.905 ( 0.996 -5.266 -0.115) 5.360 30.027 ( 1.219 -7.360 2.545) 7.882 30.533 ( -0.761 -0.784 3.545) 3.710 30.694 ( -0.044 -2.610 -2.000) 3.288 31.182 ( 2.693 -1.243 -1.229) 3.210 31.749 ( -6.209 -3.438 6.864) 9.873 32.538 ( -5.554 9.989 -2.129) 11.626 33.453 ( 5.422 28.215 -6.083) 29.368 34.571 ( 5.260 11.784 5.539) 14.043 35.528 ( -6.741 18.249 -18.076) 26.556 ======================= Grid point 194 (95/160) ======================= q-point: ( 0.33 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 2.855 0.000 -10.644) 11.020 2.156 ( 5.510 0.000 -0.675) 5.551 2.271 ( 14.975 0.000 -17.910) 23.345 2.481 ( 1.681 0.000 -2.126) 2.711 2.647 ( 0.294 0.000 5.414) 5.422 2.976 ( 13.866 0.000 -10.678) 17.501 3.096 ( -6.578 -0.000 -8.361) 10.638 3.114 ( 1.025 0.000 -5.918) 6.006 3.234 ( 4.261 0.000 1.777) 4.617 3.433 ( 18.245 0.000 8.793) 20.253 3.816 ( -11.371 -0.000 5.471) 12.618 4.139 ( -14.296 -0.000 20.954) 25.367 4.176 ( -7.596 -0.000 -5.130) 9.165 4.750 ( -6.251 -0.000 -1.676) 6.471 4.903 ( 5.179 0.000 4.552) 6.895 5.471 ( -9.033 -0.000 -1.302) 9.127 5.570 ( 0.477 0.000 -4.779) 4.802 5.635 ( -0.928 -0.000 -0.541) 1.074 6.022 ( 20.356 0.000 15.896) 25.827 6.194 ( -2.974 -0.000 2.028) 3.600 6.475 ( 4.728 0.000 -10.153) 11.200 6.786 ( 2.342 0.000 2.680) 3.559 6.826 ( -13.336 -0.000 -2.547) 13.577 6.899 ( 5.020 0.000 -5.288) 7.292 7.176 ( -6.055 -0.000 3.391) 6.940 7.410 ( -1.049 -0.000 5.327) 5.429 7.778 ( 4.169 0.000 1.593) 4.463 8.226 ( 0.956 0.000 -3.015) 3.163 8.376 ( 7.474 0.000 -1.052) 7.547 8.478 ( -7.991 -0.000 2.040) 8.247 8.596 ( -3.867 -0.000 3.146) 4.985 9.245 ( 5.778 0.000 -2.648) 6.356 9.423 ( -7.446 -0.000 3.686) 8.308 9.638 ( 1.148 0.000 1.140) 1.618 9.657 ( -2.535 -0.000 -4.747) 5.381 9.755 ( -0.745 -0.000 -0.522) 0.910 9.828 ( 7.212 0.000 -3.598) 8.059 10.066 ( 3.150 0.000 1.047) 3.319 10.522 ( -2.227 -0.000 0.187) 2.235 11.176 ( 3.548 0.000 2.937) 4.606 11.387 ( -4.109 -0.000 -3.940) 5.693 11.811 ( 2.034 0.000 -1.393) 2.465 12.499 ( -2.922 -0.000 2.723) 3.994 12.929 ( -8.935 -0.000 -9.280) 12.883 13.528 ( -0.454 -0.000 2.057) 2.106 13.804 ( -1.435 -0.000 1.828) 2.324 14.533 ( -2.290 -0.000 -1.173) 2.573 15.155 ( -3.212 -0.000 -0.957) 3.351 15.932 ( 2.155 0.000 -10.126) 10.353 15.994 ( -0.020 -0.000 -0.789) 0.790 16.154 ( 1.593 0.000 3.338) 3.699 16.251 ( -5.310 -0.000 -1.039) 5.410 16.260 ( -3.008 -0.000 0.241) 3.017 16.887 ( 3.548 0.000 -1.058) 3.702 17.614 ( 6.566 0.000 2.118) 6.899 17.855 ( -3.287 -0.000 2.574) 4.175 17.945 ( 2.583 0.000 2.601) 3.666 18.292 ( 6.412 0.000 -1.269) 6.536 18.767 ( 10.419 0.000 5.153) 11.623 19.192 ( 3.066 0.000 2.706) 4.089 19.591 ( -14.730 -0.000 2.192) 14.892 20.509 ( -2.005 -0.000 -4.309) 4.753 27.720 ( 2.416 0.000 -1.169) 2.684 28.392 ( -3.713 -0.000 -8.051) 8.866 29.293 ( -1.340 -0.000 3.509) 3.756 29.411 ( -1.328 -0.000 -0.353) 1.374 29.593 ( -0.566 -0.000 1.305) 1.422 29.643 ( -0.823 -0.000 0.197) 0.846 29.730 ( 0.337 0.000 -0.598) 0.687 30.382 ( 0.371 0.000 0.250) 0.448 30.535 ( 6.146 0.000 -0.001) 6.146 30.738 ( -2.771 -0.000 -5.516) 6.173 31.280 ( 9.557 0.000 -11.321) 14.816 31.971 ( -0.955 -0.000 0.181) 0.972 32.100 ( 0.864 0.000 -0.726) 1.129 32.413 ( 1.863 0.000 16.082) 16.190 32.736 ( -14.218 -0.000 1.680) 14.317 35.640 ( 3.053 0.000 2.122) 3.719 ======================= Grid point 195 (96/160) ======================= q-point: ( 0.44 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 7.824 -34.055 -12.413) 37.082 2.331 ( 19.724 -1.955 -6.112) 20.741 2.620 ( 3.876 -40.140 -8.531) 41.219 2.764 ( -5.416 -21.287 0.520) 21.971 2.881 ( 4.317 -15.092 -6.943) 17.165 2.969 ( -6.733 -3.443 -10.510) 12.948 3.108 ( 5.504 -40.164 3.876) 40.724 3.384 ( -0.633 -16.333 -0.382) 16.350 3.483 ( 9.796 -21.228 1.304) 23.416 3.702 ( 3.769 -16.059 6.377) 17.685 3.920 ( 0.432 -12.047 7.890) 14.407 4.195 ( -14.391 -7.495 13.778) 21.286 4.301 ( -4.419 -23.562 0.017) 23.973 4.703 ( -7.221 -4.366 -5.130) 9.875 4.947 ( 2.318 1.758 2.432) 3.792 5.425 ( -2.049 -0.042 2.313) 3.090 5.476 ( -3.218 -0.315 -8.469) 9.066 5.650 ( 2.550 2.372 2.570) 4.328 6.126 ( 2.805 4.538 1.925) 5.671 6.333 ( 12.230 -3.186 10.936) 16.713 6.412 ( -5.086 0.011 -7.714) 9.239 6.706 ( -8.820 4.396 1.426) 9.957 6.744 ( -0.613 5.399 2.081) 5.818 6.892 ( 8.354 2.491 -1.283) 8.812 7.132 ( -0.087 4.822 1.624) 5.088 7.374 ( -4.712 7.099 6.889) 10.957 7.858 ( 4.763 -2.951 0.651) 5.640 8.153 ( -3.832 0.004 -6.412) 7.469 8.448 ( -2.315 0.001 3.488) 4.187 8.473 ( 3.402 -3.861 -0.981) 5.239 8.634 ( -0.402 -3.123 5.474) 6.315 9.180 ( 5.279 5.411 -2.055) 7.833 9.437 ( -3.143 -2.844 2.598) 4.972 9.555 ( -0.468 4.022 -4.978) 6.417 9.668 ( -5.961 -3.538 -5.967) 9.146 9.894 ( -0.855 -16.118 3.180) 16.451 10.091 ( 9.117 -18.291 0.174) 20.438 10.134 ( 2.814 -5.956 1.344) 6.723 10.526 ( -2.541 -1.613 1.922) 3.571 11.160 ( -2.303 2.983 -2.698) 4.634 11.317 ( 0.853 4.308 -0.118) 4.393 11.770 ( 1.385 5.173 -1.688) 5.615 12.495 ( -4.059 -0.191 2.600) 4.825 12.800 ( -5.828 -1.734 -12.834) 14.201 13.547 ( -0.184 -0.534 2.155) 2.227 13.784 ( -0.054 2.625 1.605) 3.078 14.504 ( -1.865 0.094 -1.814) 2.604 15.092 ( -3.108 1.990 -4.190) 5.584 15.846 ( 2.676 3.664 -6.808) 8.181 15.962 ( -0.324 3.700 -2.013) 4.225 16.110 ( 1.341 7.923 2.942) 8.557 16.151 ( -3.894 4.887 -1.050) 6.336 16.296 ( 0.240 -2.592 0.355) 2.628 16.852 ( 2.039 5.485 -1.639) 6.077 17.722 ( 5.584 -4.260 2.691) 7.522 17.833 ( -0.768 2.675 3.306) 4.321 17.999 ( 0.610 -1.383 4.810) 5.042 18.292 ( 3.046 1.705 -3.934) 5.260 18.910 ( 12.094 -1.899 3.500) 12.733 19.206 ( 0.297 5.085 7.940) 9.434 19.459 ( -16.584 0.045 -1.047) 16.617 20.441 ( 0.651 4.347 -2.005) 4.831 27.715 ( 1.876 1.601 -1.562) 2.920 28.335 ( 1.361 0.581 -3.729) 4.012 29.263 ( -1.052 5.101 -0.253) 5.215 29.337 ( 0.738 1.571 5.387) 5.659 29.581 ( 0.416 2.280 0.522) 2.376 29.696 ( 0.658 0.869 0.366) 1.150 29.896 ( -2.286 -15.787 1.669) 16.039 30.376 ( -1.953 0.388 -3.040) 3.634 30.543 ( 3.624 2.923 -1.263) 4.824 30.673 ( 1.129 2.471 -2.570) 3.740 31.263 ( 7.299 -1.477 -7.415) 10.509 31.769 ( -5.849 13.141 -0.484) 14.393 32.001 ( -1.033 7.319 2.420) 7.777 32.833 ( -0.255 -33.575 5.921) 34.094 32.981 ( -2.100 -22.577 10.953) 25.182 35.650 ( -3.694 -4.019 -6.815) 8.732 ======================= Grid point 196 (97/160) ======================= q-point: ( 0.56 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( 9.389 -4.241 -17.163) 20.017 2.520 ( 18.937 0.533 9.282) 21.097 2.839 ( -10.040 -5.383 -7.426) 13.599 2.994 ( 4.444 -16.616 -3.156) 17.487 3.267 ( -2.162 -28.167 -0.780) 28.261 3.408 ( 3.396 -37.934 -9.306) 39.206 3.656 ( 2.834 -4.537 9.112) 10.566 3.674 ( -2.836 -16.433 2.691) 16.892 4.048 ( -4.494 -29.102 9.135) 30.831 4.125 ( -5.922 -14.703 7.224) 17.419 4.271 ( 0.235 -37.754 -5.541) 38.160 4.491 ( 2.613 -28.685 0.978) 28.820 4.635 ( -4.660 -9.325 -2.304) 10.677 4.928 ( -3.133 -17.462 -2.961) 17.986 5.005 ( 2.418 -28.126 1.797) 28.287 5.403 ( -6.914 -5.550 -1.594) 9.008 5.478 ( 7.157 2.650 -3.421) 8.363 5.696 ( 0.511 -7.669 3.469) 8.432 6.098 ( 2.006 0.311 0.260) 2.047 6.312 ( -5.959 -1.218 -3.554) 7.044 6.495 ( -2.247 7.481 4.307) 8.920 6.554 ( 4.769 1.649 2.712) 5.729 6.669 ( -1.784 3.221 3.190) 4.872 6.937 ( 7.059 -0.543 -1.348) 7.207 7.097 ( 6.964 4.851 5.789) 10.274 7.222 ( -10.804 5.757 4.639) 13.091 7.930 ( 8.250 -1.853 -5.791) 10.248 8.131 ( -3.714 -2.654 0.624) 4.607 8.452 ( -2.801 -0.871 2.048) 3.578 8.544 ( 4.014 -2.763 -0.299) 4.882 8.774 ( -0.912 -8.637 3.464) 9.351 9.165 ( 2.605 0.703 -0.168) 2.703 9.416 ( 1.465 6.072 -7.420) 9.699 9.489 ( -0.923 -4.778 0.044) 4.867 9.663 ( -7.419 -6.293 -4.940) 10.911 10.191 ( -0.742 -6.089 -2.699) 6.701 10.216 ( 0.036 -10.650 6.008) 12.228 10.492 ( 5.401 -6.793 8.465) 12.123 10.628 ( 2.866 -15.937 2.143) 16.333 11.036 ( -5.549 2.894 -5.071) 8.054 11.251 ( 3.514 6.780 2.041) 7.905 11.644 ( 0.509 8.727 -1.721) 8.910 12.463 ( -7.070 -0.393 -1.099) 7.166 12.727 ( 0.834 -2.026 -9.760) 10.003 13.566 ( -0.284 -0.042 2.024) 2.044 13.760 ( 2.029 2.164 1.603) 3.372 14.478 ( -1.217 -0.125 -1.591) 2.007 14.986 ( -1.925 3.712 -5.467) 6.883 15.770 ( 1.855 4.356 -4.646) 6.633 15.827 ( -0.734 8.785 0.090) 8.816 15.969 ( 0.267 9.918 1.352) 10.013 16.054 ( -1.390 3.153 -1.050) 3.602 16.327 ( 1.932 -0.063 -1.805) 2.644 16.732 ( 0.520 7.920 -1.028) 8.003 17.804 ( 2.193 4.444 5.246) 7.216 17.861 ( 1.254 -5.199 1.814) 5.647 18.056 ( -1.950 -1.824 4.234) 5.006 18.249 ( 3.867 1.434 -6.312) 7.541 19.052 ( 7.349 -2.353 -0.527) 7.734 19.142 ( -2.373 8.493 12.129) 14.996 19.338 ( -12.544 -1.601 -2.486) 12.888 20.361 ( 2.005 4.800 -0.588) 5.236 27.673 ( 0.638 2.829 -2.309) 3.707 28.330 ( 3.060 0.269 -1.211) 3.302 29.209 ( 0.749 0.485 -0.801) 1.199 29.381 ( -0.801 -0.897 6.483) 6.593 29.542 ( 1.338 1.964 -2.201) 3.239 29.682 ( -0.251 1.890 2.648) 3.263 30.001 ( -0.235 4.056 -0.182) 4.067 30.250 ( -1.760 7.789 -6.219) 10.122 30.511 ( 1.638 1.646 -1.049) 2.548 30.660 ( 1.240 0.269 0.825) 1.513 31.403 ( 8.929 -3.932 -2.338) 10.032 31.581 ( -10.761 -4.002 1.117) 11.535 31.928 ( -2.051 -0.770 1.684) 2.763 33.429 ( -3.228 -25.576 5.219) 26.302 33.523 ( 7.626 -32.331 14.381) 36.197 35.644 ( -6.897 -9.919 -14.294) 18.716 ======================= Grid point 197 (98/160) ======================= q-point: (-0.33 -0.67 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 2.887 0.575 -15.054) 15.339 2.687 ( 3.488 4.455 14.733) 15.782 2.885 ( 11.314 -3.610 4.402) 12.665 3.306 ( 4.936 -16.586 -1.997) 17.420 3.645 ( -3.696 -19.187 2.079) 19.650 3.707 ( -3.266 -5.885 -0.997) 6.804 3.818 ( -5.491 -11.457 -0.102) 12.705 3.997 ( -1.674 -15.196 -0.748) 15.307 4.096 ( -2.468 -5.995 1.201) 6.594 4.430 ( -9.527 -8.482 -4.395) 13.492 4.537 ( -3.126 -6.105 -2.678) 7.363 4.722 ( 1.691 -3.988 -0.152) 4.334 4.971 ( 3.884 -11.650 -2.829) 12.602 5.201 ( 5.053 -13.906 -1.745) 14.898 5.377 ( -5.685 -2.332 -3.069) 6.868 5.403 ( -0.029 -12.171 -5.516) 13.363 5.773 ( -1.425 -20.546 7.219) 21.824 5.877 ( 8.198 -4.257 6.284) 11.172 6.145 ( -0.540 -6.407 -1.785) 6.673 6.307 ( -8.406 -1.105 -1.657) 8.639 6.458 ( 5.099 -12.652 2.739) 13.913 6.608 ( 1.997 -5.467 -0.220) 5.824 6.762 ( 2.519 -9.238 1.623) 9.712 6.961 ( -4.267 0.405 1.626) 4.584 7.132 ( 0.583 -5.657 2.192) 6.094 7.220 ( 3.500 -0.814 11.018) 11.589 7.979 ( 7.049 -2.473 -8.572) 11.370 8.156 ( -3.839 -2.238 2.585) 5.141 8.459 ( -1.973 -1.249 0.363) 2.363 8.660 ( 8.340 -5.420 -1.548) 10.066 8.894 ( -6.651 -6.060 -0.347) 9.004 9.090 ( -4.471 5.861 -2.494) 7.782 9.384 ( 7.124 -5.232 -8.427) 12.213 9.613 ( -6.269 -6.579 4.975) 10.360 9.651 ( -1.009 -4.771 -3.703) 6.123 10.078 ( -0.858 9.782 -4.287) 10.714 10.472 ( 2.101 -11.312 5.872) 12.917 10.667 ( -1.431 -6.506 6.784) 9.508 10.825 ( 0.812 4.286 0.521) 4.393 10.986 ( 0.226 -1.676 -0.188) 1.701 11.200 ( 4.750 3.797 3.254) 6.897 11.507 ( 0.921 4.972 -0.967) 5.148 12.392 ( -5.833 -0.519 -3.960) 7.070 12.737 ( 3.285 -2.288 -3.442) 5.280 13.569 ( 0.347 1.263 1.707) 2.151 13.767 ( 2.149 0.443 1.064) 2.438 14.469 ( -0.594 -0.647 -0.406) 0.968 14.874 ( -0.495 3.406 -5.072) 6.129 15.587 ( -2.295 8.736 -1.752) 9.200 15.784 ( -0.894 0.296 0.577) 1.105 15.839 ( 2.009 7.758 3.511) 8.749 16.001 ( -0.436 0.061 -3.654) 3.680 16.275 ( 1.811 5.019 -6.189) 8.172 16.622 ( -0.335 4.794 2.101) 5.245 17.757 ( -3.589 5.219 5.006) 8.073 17.937 ( 1.310 -1.479 0.173) 1.983 18.086 ( -1.297 -1.102 0.614) 1.809 18.243 ( 6.272 -0.744 -4.869) 7.975 18.984 ( -5.394 7.137 4.610) 10.064 19.140 ( -10.264 -1.335 2.551) 10.661 19.303 ( 6.880 0.856 -0.382) 6.944 20.324 ( 1.878 1.209 0.910) 2.411 27.604 ( -0.670 2.811 -2.684) 3.944 28.355 ( 2.917 -0.837 0.135) 3.038 29.233 ( 0.707 -2.910 -0.974) 3.149 29.422 ( -2.374 -0.105 3.695) 4.394 29.528 ( 2.972 -0.133 -0.327) 2.993 29.678 ( -0.802 0.209 3.025) 3.136 29.830 ( 0.135 12.239 -2.381) 12.469 30.055 ( 0.279 8.238 -5.664) 10.001 30.519 ( 1.614 -1.130 0.240) 1.985 30.656 ( -0.801 0.945 0.170) 1.251 31.324 ( 0.237 7.663 -1.339) 7.782 31.674 ( -4.198 -1.792 4.467) 6.386 32.147 ( 0.331 -22.700 0.221) 22.703 33.791 ( -1.635 -13.346 8.447) 15.878 34.196 ( 10.511 -25.389 11.818) 29.913 35.669 ( -7.088 -13.087 -18.058) 23.401 ======================= Grid point 198 (99/160) ======================= q-point: (-0.22 -0.67 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( 2.239 1.922 -13.176) 13.502 2.685 ( -1.409 5.811 10.198) 11.822 3.103 ( 14.790 3.652 19.031) 24.377 3.530 ( -1.189 -6.065 1.542) 6.370 3.736 ( -0.362 4.666 -2.755) 5.431 3.784 ( -9.210 -9.132 -2.922) 13.295 3.964 ( 0.771 -14.162 0.311) 14.186 4.055 ( -5.749 -3.136 -1.016) 6.627 4.321 ( -1.303 -6.948 -7.895) 10.597 4.396 ( -2.765 -7.587 -3.489) 8.797 4.543 ( -0.947 1.847 2.273) 3.078 4.744 ( -0.053 2.769 -0.980) 2.937 4.955 ( -1.008 4.916 -7.447) 8.980 5.232 ( 3.584 -1.138 -7.515) 8.403 5.454 ( 1.721 5.440 1.245) 5.841 5.477 ( -2.342 -4.736 1.204) 5.418 5.712 ( -1.947 5.878 2.163) 6.559 6.176 ( 11.485 3.371 6.840) 13.786 6.241 ( -2.181 -10.441 -3.340) 11.177 6.332 ( -1.855 -2.863 0.410) 3.436 6.687 ( -2.009 -2.864 0.156) 3.502 6.798 ( 3.093 -16.425 0.462) 16.720 6.967 ( -4.039 -4.224 0.101) 5.845 6.994 ( 3.122 -7.331 2.200) 8.266 7.254 ( 3.004 -3.093 5.234) 6.781 7.385 ( -1.391 -5.403 10.617) 11.993 7.993 ( 2.641 -1.618 -9.036) 9.552 8.169 ( -3.916 0.017 4.010) 5.605 8.475 ( 0.064 -1.348 -0.324) 1.388 8.723 ( 0.236 6.907 -1.885) 7.164 8.880 ( 1.082 -1.630 1.219) 2.305 9.005 ( -4.593 -5.937 -10.885) 13.222 9.436 ( 5.701 1.447 -6.774) 8.971 9.574 ( -5.437 -0.045 2.527) 5.996 9.850 ( 3.508 -2.565 0.097) 4.346 9.967 ( -1.571 -10.528 0.398) 10.652 10.601 ( -0.776 7.545 2.362) 7.944 10.738 ( -0.967 2.647 -1.167) 3.051 10.767 ( 2.087 -6.468 2.399) 7.208 10.936 ( -1.568 4.423 0.300) 4.702 11.235 ( 5.395 0.564 5.378) 7.639 11.452 ( 1.130 5.076 -2.722) 5.869 12.369 ( -4.357 -4.676 -0.384) 6.403 12.793 ( 2.369 -3.067 0.125) 3.877 13.560 ( 1.957 2.189 1.276) 3.201 13.785 ( -0.409 -1.434 -0.329) 1.527 14.484 ( -0.479 -1.213 1.151) 1.740 14.811 ( 0.168 -0.476 -2.952) 2.995 15.498 ( -1.322 -0.339 0.073) 1.367 15.719 ( -0.045 7.192 4.426) 8.445 15.841 ( -2.131 -3.873 1.084) 4.552 15.998 ( 0.584 -2.282 -4.352) 4.949 16.147 ( 2.937 3.543 -7.054) 8.422 16.585 ( -1.613 2.145 3.688) 4.561 17.657 ( -6.967 4.230 3.248) 8.774 17.939 ( 1.098 1.681 -1.593) 2.563 18.070 ( 3.216 3.331 -2.352) 5.193 18.280 ( 5.558 -0.435 -3.173) 6.415 18.887 ( -4.307 3.679 6.655) 8.739 19.046 ( -14.215 -0.226 -0.996) 14.252 19.358 ( 11.521 2.757 -0.191) 11.848 20.361 ( 0.546 -2.633 2.116) 3.422 27.544 ( -0.714 1.421 -1.859) 2.446 28.403 ( 1.599 -2.212 0.623) 2.800 29.282 ( -2.776 -3.809 -1.199) 4.864 29.415 ( 1.479 0.910 1.093) 2.052 29.551 ( 2.768 5.890 1.337) 6.644 29.649 ( 0.420 2.613 -1.467) 3.026 29.711 ( -2.102 -3.236 1.540) 4.155 29.930 ( 2.149 3.024 -3.642) 5.199 30.560 ( 1.796 -0.589 1.618) 2.488 30.629 ( -1.882 -0.164 -1.445) 2.378 31.206 ( 0.170 4.676 -1.505) 4.915 31.682 ( -5.257 -0.529 6.013) 8.005 32.491 ( 1.301 -14.446 -0.308) 14.508 33.947 ( -1.526 0.263 6.490) 6.672 34.652 ( 9.734 -9.680 7.258) 15.528 35.683 ( -4.055 -7.921 -16.440) 18.694 ======================= Grid point 199 (100/160) ======================= q-point: (-0.11 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 7.318 2.434 -12.960) 15.081 2.628 ( 2.230 10.742 12.835) 16.885 3.202 ( 0.941 4.993 5.565) 7.536 3.507 ( -1.447 8.334 6.718) 10.802 3.613 ( 2.071 6.218 4.506) 7.953 3.886 ( -8.188 3.690 -11.667) 14.723 3.950 ( -2.971 -8.799 -1.247) 9.370 4.060 ( 2.757 10.326 1.266) 10.762 4.348 ( -0.099 1.586 2.368) 2.851 4.438 ( -1.084 -1.292 0.516) 1.764 4.567 ( -1.960 -5.145 -0.115) 5.507 4.661 ( 2.246 8.117 -2.861) 8.895 4.762 ( -1.775 6.973 -4.803) 8.651 5.255 ( 6.376 -0.684 -6.932) 9.443 5.335 ( 1.095 5.405 -1.057) 5.615 5.590 ( -1.088 -9.632 4.160) 10.549 5.694 ( 1.702 -0.462 -2.110) 2.750 6.139 ( -1.740 9.068 2.990) 9.706 6.271 ( -3.790 1.703 -2.638) 4.922 6.332 ( 11.333 8.209 0.783) 14.016 6.659 ( -0.782 5.037 -0.400) 5.113 6.865 ( -3.875 14.618 -2.746) 15.370 6.914 ( -2.157 9.144 0.484) 9.408 7.043 ( 3.061 -0.593 3.084) 4.386 7.361 ( -0.153 -3.499 1.284) 3.730 7.476 ( -1.737 1.043 11.691) 11.865 7.903 ( -4.302 4.018 -11.187) 12.641 8.165 ( -1.662 0.972 4.540) 4.932 8.455 ( -0.499 3.868 0.621) 3.949 8.603 ( 1.888 4.321 0.526) 4.745 8.886 ( 5.114 5.636 2.887) 8.140 9.022 ( -2.602 -6.972 -9.730) 12.250 9.436 ( -2.399 -1.969 -1.155) 3.311 9.545 ( 3.803 0.533 -0.116) 3.842 9.834 ( 5.525 5.528 -3.131) 8.420 10.236 ( -4.203 -12.721 5.798) 14.598 10.494 ( 0.177 2.381 -1.216) 2.679 10.616 ( -0.537 3.749 -4.202) 5.657 10.836 ( 0.422 8.743 2.987) 9.249 10.887 ( -0.118 0.034 0.591) 0.604 11.300 ( 0.527 1.700 -3.294) 3.744 11.346 ( 0.755 -3.376 -0.779) 3.546 12.467 ( -4.615 -8.485 1.965) 9.856 12.890 ( 0.979 -6.098 2.420) 6.633 13.541 ( 3.158 3.198 0.005) 4.494 13.800 ( -3.803 -2.847 -1.462) 4.970 14.513 ( -1.160 -1.470 1.855) 2.636 14.884 ( 0.653 -9.433 -0.450) 9.466 15.511 ( -1.822 -0.013 1.512) 2.368 15.641 ( 1.521 3.617 1.742) 4.293 15.914 ( -7.008 -7.524 -2.081) 10.491 16.005 ( 4.714 -1.813 -0.736) 5.105 16.197 ( 4.946 -8.325 -3.162) 10.187 16.557 ( -3.762 2.073 4.394) 6.145 17.576 ( -5.114 1.427 1.951) 5.656 17.875 ( -0.950 4.618 -0.835) 4.788 18.012 ( 8.940 5.700 -4.251) 11.423 18.281 ( 3.116 1.854 -3.550) 5.074 18.869 ( -3.266 3.770 6.511) 8.202 18.963 ( -8.119 -4.033 0.697) 9.093 19.382 ( 9.187 3.460 -0.859) 9.855 20.432 ( -1.832 -4.318 1.619) 4.962 27.528 ( 0.726 -0.622 -0.416) 1.043 28.458 ( -0.776 -3.570 -0.092) 3.655 29.279 ( -4.387 -1.128 -1.555) 4.789 29.402 ( -0.438 6.651 2.170) 7.010 29.487 ( 5.648 -1.997 -1.649) 6.214 29.664 ( 0.298 0.293 0.459) 0.621 29.785 ( -1.418 -7.470 -0.495) 7.619 29.951 ( 2.492 -4.541 -0.328) 5.190 30.568 ( 0.858 2.160 2.290) 3.263 30.627 ( -1.786 -2.540 -2.035) 3.713 31.167 ( 1.885 -0.557 -1.545) 2.500 31.705 ( -6.142 -2.027 6.980) 9.516 32.603 ( -1.549 1.358 -0.097) 2.062 33.833 ( -0.256 15.774 0.833) 15.798 34.750 ( -0.163 4.906 -2.913) 5.708 35.625 ( 4.357 4.806 -6.103) 8.906 ======================= Grid point 204 (101/160) ======================= q-point: ( 0.44 0.44 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 7.397 0.000 -6.127) 9.605 2.074 ( -3.383 -0.000 -10.746) 11.266 2.490 ( -1.883 -0.000 0.673) 2.000 2.516 ( 29.804 0.000 1.955) 29.868 2.773 ( 4.217 0.000 7.117) 8.272 2.785 ( -14.671 -0.000 -8.013) 16.716 2.971 ( 11.811 0.000 -13.371) 17.841 3.005 ( -0.089 -0.000 -7.337) 7.337 3.241 ( -3.150 -0.000 -1.796) 3.626 3.802 ( -3.119 -0.000 5.174) 6.041 3.892 ( 7.944 0.000 10.590) 13.239 4.007 ( -1.627 -0.000 -5.093) 5.347 4.202 ( -12.111 -0.000 17.129) 20.978 4.582 ( -6.093 -0.000 -4.580) 7.623 4.974 ( -2.929 -0.000 0.967) 3.084 5.426 ( 0.439 0.000 4.338) 4.360 5.433 ( 4.617 0.000 -7.140) 8.503 5.722 ( 1.767 0.000 0.817) 1.947 6.133 ( -4.323 -0.000 -1.752) 4.664 6.246 ( -12.168 -0.000 -3.095) 12.555 6.537 ( 10.920 0.000 9.532) 14.495 6.752 ( 4.293 0.000 2.713) 5.078 6.775 ( -2.444 -0.000 -1.725) 2.992 6.951 ( 5.588 0.000 -1.753) 5.857 7.226 ( 1.460 0.000 8.691) 8.813 7.509 ( -3.646 -0.000 10.255) 10.884 7.848 ( 1.092 0.000 1.764) 2.075 8.073 ( -0.876 -0.000 -8.571) 8.616 8.442 ( -2.465 -0.000 1.493) 2.881 8.450 ( 3.542 0.000 -1.446) 3.826 8.674 ( -1.164 -0.000 8.975) 9.050 9.275 ( 4.591 0.000 -4.492) 6.423 9.355 ( -5.260 -0.000 2.265) 5.727 9.463 ( -4.978 -0.000 -11.172) 12.231 9.706 ( 2.230 0.000 3.983) 4.564 9.760 ( 0.637 0.000 0.939) 1.135 9.912 ( 7.397 0.000 -1.620) 7.572 10.132 ( 1.383 0.000 2.084) 2.501 10.519 ( 0.583 0.000 2.351) 2.423 11.110 ( -6.197 -0.000 -6.786) 9.190 11.384 ( 3.582 0.000 1.796) 4.007 11.812 ( 0.847 0.000 -1.828) 2.015 12.450 ( -7.265 -0.000 -3.127) 7.909 12.674 ( 1.215 0.000 -10.681) 10.750 13.557 ( 0.002 0.000 2.299) 2.299 13.812 ( -0.759 -0.000 1.518) 1.697 14.475 ( -1.398 -0.000 -2.398) 2.776 15.049 ( -2.589 -0.000 -5.460) 6.043 15.831 ( 2.031 0.000 -8.104) 8.354 15.995 ( 0.794 0.000 -0.010) 0.794 16.161 ( -3.367 -0.000 -0.958) 3.501 16.233 ( 1.403 0.000 3.531) 3.799 16.268 ( 2.199 0.000 0.099) 2.201 16.901 ( 1.019 0.000 -2.002) 2.246 17.720 ( 1.800 0.000 1.896) 2.614 17.903 ( 2.541 0.000 4.541) 5.203 18.030 ( -0.859 -0.000 6.691) 6.746 18.292 ( 1.502 0.000 -4.904) 5.129 18.996 ( 10.306 0.000 0.142) 10.307 19.278 ( -20.866 -0.000 2.602) 21.027 19.367 ( 4.031 0.000 8.887) 9.758 20.478 ( 1.675 0.000 -2.092) 2.680 27.738 ( 3.142 0.000 -1.852) 3.647 28.339 ( 3.046 0.000 -2.069) 3.682 29.295 ( -2.403 -0.000 1.363) 2.763 29.502 ( 3.889 0.000 10.206) 10.922 29.632 ( 1.221 0.000 3.044) 3.280 29.637 ( -0.317 -0.000 0.393) 0.505 29.721 ( 0.099 0.000 -1.003) 1.008 30.324 ( -2.939 -0.000 -4.098) 5.043 30.577 ( 0.502 0.000 -2.568) 2.617 30.711 ( 5.401 0.000 -0.795) 5.459 31.267 ( 7.163 0.000 -8.969) 11.478 31.963 ( -0.373 -0.000 0.286) 0.470 32.096 ( 0.344 0.000 -1.096) 1.149 32.325 ( -7.914 -0.000 -7.046) 10.596 32.972 ( 2.173 0.000 30.210) 30.288 35.476 ( -10.367 -0.000 -15.595) 18.726 ======================= Grid point 205 (102/160) ======================= q-point: (-0.44 -0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 4.401 -27.038 -12.144) 29.965 2.451 ( -7.470 -44.490 -7.122) 45.671 2.624 ( -13.507 -9.875 -2.861) 16.975 2.696 ( -1.525 -16.413 1.763) 16.577 2.794 ( 24.382 -5.069 2.101) 24.992 2.997 ( 14.450 -8.058 1.258) 16.592 3.215 ( -2.980 -40.726 4.559) 41.089 3.318 ( -2.275 -21.764 -1.334) 21.923 3.521 ( 7.374 -41.030 -6.646) 42.214 3.791 ( -7.262 2.577 3.818) 8.600 3.984 ( -9.287 -13.192 -3.298) 16.467 4.142 ( 0.163 -12.957 0.683) 12.976 4.328 ( -3.193 -13.817 9.514) 17.077 4.560 ( -1.118 -4.807 0.373) 4.949 4.951 ( -4.225 -0.796 1.686) 4.618 5.349 ( 2.830 3.954 -7.379) 8.836 5.531 ( 3.747 -1.701 0.651) 4.166 5.691 ( 1.261 2.177 1.508) 2.933 6.100 ( -1.417 -1.488 -1.188) 2.374 6.181 ( -7.850 -0.590 2.423) 8.237 6.640 ( 5.253 1.356 3.036) 6.216 6.708 ( -0.440 7.096 2.388) 7.499 6.746 ( 3.326 3.990 0.614) 5.231 6.971 ( 5.492 1.136 -3.265) 6.490 7.294 ( 1.953 2.013 9.930) 10.318 7.362 ( -4.032 15.832 6.593) 17.618 7.928 ( 5.146 -2.117 -2.388) 6.055 8.049 ( -3.617 -4.074 -0.042) 5.448 8.426 ( -2.541 -0.252 -0.150) 2.558 8.505 ( 1.025 -4.158 -0.877) 4.372 8.727 ( -0.845 -1.119 7.454) 7.585 9.215 ( 3.913 4.031 -3.589) 6.666 9.346 ( -2.224 -1.713 -9.969) 10.356 9.445 ( -4.565 -8.160 2.001) 9.561 9.583 ( 0.777 10.134 -3.236) 10.666 9.937 ( -0.625 -16.294 4.430) 16.897 10.164 ( -1.075 -2.527 0.453) 2.784 10.289 ( 10.172 -26.077 5.001) 28.434 10.563 ( 2.054 -0.400 4.853) 5.285 10.984 ( -6.466 2.059 -7.517) 10.127 11.388 ( 3.372 4.173 1.220) 5.502 11.755 ( -0.068 5.399 -1.926) 5.733 12.351 ( -6.529 -1.108 -9.308) 11.423 12.659 ( 3.656 -1.753 -5.141) 6.547 13.577 ( 0.075 -0.196 2.194) 2.204 13.807 ( -0.259 1.030 1.352) 1.720 14.451 ( -0.945 -0.371 -2.211) 2.433 14.975 ( -1.865 1.872 -5.478) 6.082 15.789 ( 2.128 0.806 -6.151) 6.558 15.957 ( 0.766 5.436 0.174) 5.492 16.075 ( -2.282 6.249 -1.419) 6.802 16.180 ( 1.241 7.186 2.845) 7.828 16.328 ( 3.074 -1.624 -0.927) 3.598 16.838 ( -0.315 5.592 -2.032) 5.958 17.784 ( -1.254 -4.817 2.636) 5.633 17.922 ( 1.844 3.103 2.515) 4.399 18.067 ( -2.793 0.538 7.211) 7.752 18.257 ( 3.674 1.036 -5.834) 6.972 19.074 ( 5.889 -0.914 -0.552) 5.985 19.125 ( -18.999 -1.045 1.312) 19.073 19.444 ( 7.232 6.706 13.349) 16.597 20.433 ( 1.456 3.674 -4.098) 5.693 27.724 ( 3.121 3.208 -2.350) 5.055 28.347 ( 2.679 0.159 -1.833) 3.250 29.248 ( -0.300 3.731 -0.202) 3.749 29.452 ( -0.454 4.800 8.043) 9.377 29.604 ( 2.001 4.664 -0.210) 5.080 29.719 ( 0.611 0.022 1.373) 1.503 29.936 ( 1.234 -14.124 5.328) 15.146 30.263 ( -2.844 1.806 -4.358) 5.508 30.546 ( -0.278 1.303 -1.492) 2.000 30.713 ( 5.642 3.647 -2.050) 7.024 31.279 ( 5.910 -5.185 -5.707) 9.715 31.671 ( -2.970 15.899 -2.107) 16.311 32.005 ( -1.299 7.069 1.000) 7.256 32.760 ( 0.117 -41.506 -4.547) 41.755 33.387 ( 3.504 -17.084 32.576) 36.951 35.289 ( -13.144 -6.452 -22.171) 26.570 ======================= Grid point 206 (103/160) ======================= q-point: (-0.33 -0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.029 ( -8.679 -4.439 -13.168) 16.384 2.658 ( -5.996 -9.754 2.234) 11.665 2.982 ( 4.943 -14.459 -0.168) 15.281 3.098 ( 12.383 -14.473 1.599) 19.114 3.220 ( -2.796 -31.468 3.597) 31.796 3.408 ( 13.196 -18.769 1.843) 23.018 3.619 ( -10.301 -12.434 -2.496) 16.338 3.649 ( -7.843 -11.458 -4.976) 14.750 3.937 ( -8.090 -33.546 3.214) 34.657 4.091 ( -3.842 -12.366 1.202) 13.005 4.270 ( 3.804 -22.408 -1.965) 22.813 4.503 ( -5.343 -30.769 3.698) 31.448 4.599 ( 2.687 -19.653 -1.226) 19.874 4.898 ( -0.680 -20.954 1.536) 21.021 5.049 ( 3.234 -20.241 -1.377) 20.544 5.343 ( 2.558 -13.371 -6.282) 14.993 5.433 ( 0.684 9.133 -1.370) 9.260 5.831 ( 1.595 -8.509 6.033) 10.552 6.129 ( -1.559 -3.372 -1.765) 4.113 6.163 ( -0.383 -0.825 2.173) 2.355 6.518 ( 0.100 9.736 2.398) 10.027 6.678 ( -2.841 3.782 3.153) 5.684 6.722 ( 6.843 1.990 -1.564) 7.296 6.976 ( 3.604 0.092 -0.846) 3.703 7.109 ( -3.131 8.180 2.798) 9.194 7.376 ( 4.465 2.591 9.101) 10.463 7.917 ( 1.761 -0.159 -9.260) 9.428 8.124 ( -2.967 -3.208 6.409) 7.757 8.414 ( -2.654 -1.486 -0.444) 3.074 8.584 ( 1.205 -5.599 -2.684) 6.325 8.801 ( -1.130 -2.681 4.127) 5.049 9.150 ( -3.279 4.507 -0.392) 5.587 9.311 ( 3.141 -2.341 -9.628) 10.395 9.456 ( -0.119 -2.464 -3.782) 4.516 9.580 ( -0.936 -6.209 2.424) 6.731 10.141 ( -1.680 1.567 -1.455) 2.719 10.273 ( -3.694 -16.694 5.234) 17.881 10.631 ( 2.281 -1.224 5.618) 6.186 10.854 ( -1.453 -0.771 -0.933) 1.891 10.886 ( 11.199 -19.643 4.724) 23.100 11.323 ( 2.414 6.189 0.478) 6.660 11.617 ( -0.387 8.042 -1.997) 8.296 12.268 ( -4.472 -2.609 -9.427) 10.755 12.697 ( 3.033 -2.680 -2.705) 4.868 13.593 ( 0.566 0.218 1.619) 1.729 13.798 ( -0.266 0.883 0.781) 1.209 14.444 ( -0.656 -1.131 -1.304) 1.847 14.886 ( -0.521 2.891 -4.643) 5.494 15.717 ( -0.477 6.846 -3.231) 7.585 15.849 ( 1.126 6.990 1.306) 7.200 15.938 ( -0.105 4.398 -3.590) 5.678 16.076 ( 0.243 8.297 3.511) 9.013 16.329 ( 3.277 2.913 -4.671) 6.406 16.711 ( -1.535 6.199 -0.528) 6.408 17.843 ( -5.190 5.397 2.439) 7.875 17.879 ( -3.423 -4.453 2.027) 5.971 18.074 ( -0.782 -0.378 2.313) 2.471 18.267 ( 8.090 -0.050 -2.953) 8.612 19.022 ( -14.528 -1.427 2.417) 14.797 19.086 ( -1.326 4.062 2.702) 5.056 19.468 ( 10.083 6.944 7.751) 14.490 20.352 ( 0.506 2.288 -4.045) 4.674 27.651 ( 1.327 4.828 -2.908) 5.791 28.355 ( 1.594 -0.634 -1.633) 2.369 29.207 ( 0.369 0.485 -0.784) 0.993 29.441 ( -3.086 1.414 4.942) 5.996 29.560 ( 2.847 1.764 -0.030) 3.349 29.719 ( 0.361 1.846 2.362) 3.020 30.012 ( 1.183 7.788 -0.192) 7.880 30.141 ( -1.200 6.841 -4.092) 8.061 30.523 ( 0.220 0.122 -0.068) 0.260 30.681 ( 1.775 2.296 -1.567) 3.298 31.415 ( -7.676 2.551 -1.740) 8.274 31.561 ( 10.368 -11.590 0.975) 15.581 31.925 ( -0.679 -1.425 1.290) 2.038 33.419 ( 0.847 -33.973 0.716) 33.991 34.003 ( 9.958 -22.431 26.293) 35.967 35.205 ( -11.257 -15.429 -22.189) 29.277 ======================= Grid point 207 (104/160) ======================= q-point: (-0.22 -0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -9.710 -4.633 -10.203) 14.827 2.791 ( 2.265 -3.484 7.587) 8.651 3.140 ( -16.926 -8.375 -9.751) 21.253 3.362 ( 0.505 -11.054 -5.013) 12.148 3.527 ( 1.644 -14.236 3.318) 14.709 3.694 ( -6.697 -11.744 4.150) 14.142 3.750 ( 11.122 -11.422 6.988) 17.407 4.001 ( 1.010 -16.683 0.382) 16.718 4.082 ( 0.350 -2.503 1.938) 3.185 4.346 ( 5.639 -2.723 -0.934) 6.331 4.481 ( -3.448 -10.745 3.989) 11.968 4.710 ( -1.164 -4.851 -2.740) 5.691 4.969 ( 2.081 -2.349 -2.913) 4.281 5.119 ( -3.956 -15.365 -5.524) 16.801 5.326 ( 2.138 -2.256 1.672) 3.530 5.457 ( 7.202 -15.504 -2.158) 17.231 5.843 ( -0.663 -0.509 4.815) 4.887 5.850 ( -13.104 -21.955 -2.180) 25.661 6.120 ( -0.668 -9.800 -5.252) 11.139 6.368 ( 11.092 -4.350 5.684) 13.201 6.519 ( -1.143 -7.680 2.465) 8.147 6.655 ( 3.291 -5.496 -1.515) 6.583 6.741 ( -4.279 -6.023 -0.708) 7.422 7.018 ( 7.542 -0.068 4.916) 9.003 7.142 ( -0.857 -9.227 0.480) 9.280 7.421 ( -0.712 -0.038 7.810) 7.842 7.854 ( -4.353 -2.846 -12.105) 13.175 8.178 ( -1.522 -0.523 4.191) 4.489 8.446 ( 0.493 -3.053 2.078) 3.726 8.645 ( -2.217 -4.970 -6.256) 8.292 8.835 ( -3.112 -0.268 0.190) 3.130 9.038 ( 3.821 5.096 2.886) 6.993 9.359 ( 5.380 -6.376 -9.242) 12.450 9.563 ( -5.276 -6.740 0.802) 8.597 9.672 ( 2.513 -6.004 3.035) 7.182 10.018 ( -0.993 8.080 -1.853) 8.349 10.538 ( -3.271 -14.010 2.742) 14.646 10.701 ( -0.570 -1.745 1.159) 2.171 10.790 ( -0.749 2.435 0.446) 2.587 11.103 ( 5.509 10.314 2.892) 12.046 11.344 ( 5.482 0.648 4.862) 7.356 11.526 ( 5.555 1.631 -2.003) 6.127 12.238 ( -4.171 -4.576 -4.894) 7.892 12.752 ( 1.588 -3.206 -1.430) 3.853 13.602 ( 1.359 0.657 0.672) 1.652 13.771 ( -2.046 1.233 -1.132) 2.643 14.459 ( -0.660 -1.767 -0.187) 1.896 14.815 ( 1.197 2.298 -2.872) 3.868 15.546 ( -1.611 7.497 0.504) 7.685 15.784 ( -0.482 2.428 2.076) 3.230 15.909 ( 2.343 -1.486 -2.615) 3.813 15.958 ( -0.449 8.150 2.548) 8.551 16.214 ( 2.613 6.883 -7.433) 10.461 16.626 ( -2.395 2.773 1.448) 3.940 17.691 ( -8.842 5.493 1.463) 10.512 17.927 ( -3.970 -2.205 1.657) 4.834 18.109 ( 4.086 -0.629 -0.421) 4.156 18.316 ( 7.948 0.476 -2.524) 8.353 18.947 ( -10.871 0.858 0.735) 10.929 18.991 ( -4.441 5.812 7.995) 10.836 19.490 ( 9.065 3.578 0.549) 9.761 20.325 ( -0.739 -1.399 -1.627) 2.270 27.567 ( 0.131 3.164 -1.810) 3.647 28.370 ( 0.053 -1.743 -1.725) 2.453 29.213 ( -0.750 -1.662 -1.042) 2.100 29.434 ( -0.821 -0.152 1.970) 2.140 29.586 ( 1.271 -1.482 1.505) 2.466 29.706 ( -0.087 1.763 1.962) 2.639 29.818 ( 2.157 13.312 -0.904) 13.516 29.986 ( 0.204 6.203 -4.651) 7.755 30.539 ( -0.901 -1.772 -0.019) 1.988 30.644 ( 1.125 1.938 -0.685) 2.343 31.279 ( -2.919 5.477 -1.191) 6.320 31.693 ( -2.337 1.057 4.767) 5.413 32.209 ( 6.842 -21.559 0.289) 22.620 33.855 ( -2.539 -15.169 6.633) 16.749 34.532 ( 6.071 -15.859 2.454) 17.157 35.354 ( 2.667 -19.347 -7.382) 20.879 ======================= Grid point 208 (105/160) ======================= q-point: (-0.11 -0.56 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( -2.282 -4.799 -9.844) 11.186 2.883 ( -2.070 3.141 6.898) 7.857 2.996 ( -17.249 -9.151 -12.275) 23.064 3.508 ( -1.850 -6.543 -2.843) 7.370 3.709 ( -4.436 1.826 4.733) 6.739 3.765 ( 2.332 -5.779 -2.074) 6.567 4.054 ( 6.493 2.137 8.700) 11.064 4.181 ( 8.460 -16.514 11.681) 21.925 4.286 ( 7.174 5.703 -1.243) 9.248 4.345 ( -1.397 -8.975 0.088) 9.083 4.582 ( 0.358 1.205 3.744) 3.949 4.709 ( -0.091 1.721 -2.247) 2.831 4.894 ( 3.280 7.541 -2.640) 8.637 5.168 ( 1.390 -2.347 -5.966) 6.560 5.449 ( -3.152 3.332 0.988) 4.691 5.484 ( 0.424 -3.038 -0.769) 3.163 5.722 ( -1.276 3.389 -0.491) 3.654 6.087 ( -5.703 -12.272 -3.392) 13.951 6.255 ( -1.684 1.016 -0.062) 1.968 6.491 ( 10.437 -0.386 1.216) 10.514 6.665 ( -1.645 -4.931 2.365) 5.711 6.768 ( -3.114 -8.757 -4.762) 10.444 6.898 ( -2.367 -8.356 -1.240) 8.773 7.164 ( 7.257 -1.303 5.142) 8.989 7.275 ( -2.293 -6.576 -0.346) 6.973 7.508 ( -2.967 -3.798 9.856) 10.972 7.763 ( -7.802 -3.325 -15.163) 17.374 8.197 ( -0.153 -0.214 3.588) 3.598 8.510 ( 1.993 0.694 1.146) 2.401 8.621 ( -4.753 0.007 -1.676) 5.040 8.837 ( -1.410 -6.366 1.079) 6.609 9.093 ( 13.869 3.951 1.493) 14.498 9.415 ( 4.330 -0.079 -6.507) 7.817 9.528 ( -4.948 -0.272 1.671) 5.230 9.905 ( 3.370 2.820 -1.435) 4.622 9.937 ( -3.797 -18.270 2.721) 18.857 10.612 ( -1.154 8.269 1.596) 8.501 10.711 ( -0.262 -0.693 -1.918) 2.056 10.785 ( -0.647 -2.895 0.417) 2.995 10.987 ( 2.811 5.796 3.606) 7.382 11.369 ( 3.208 1.344 3.162) 4.701 11.411 ( 2.605 14.719 -7.725) 16.826 12.304 ( -4.462 -8.008 2.352) 9.464 12.812 ( 0.502 -4.563 -1.202) 4.746 13.597 ( 1.024 1.295 -0.782) 1.827 13.724 ( -3.273 -0.390 -2.207) 3.967 14.484 ( -1.098 -1.805 0.568) 2.187 14.805 ( 1.963 -1.465 -0.446) 2.490 15.489 ( -0.829 -0.227 1.017) 1.331 15.768 ( -2.020 3.046 2.117) 4.224 15.840 ( 0.208 6.276 2.349) 6.705 15.979 ( 3.136 -5.692 0.537) 6.521 16.115 ( 4.190 -0.015 -6.565) 7.788 16.577 ( -4.444 1.706 1.936) 5.139 17.570 ( -6.535 2.241 1.498) 7.069 17.914 ( -1.901 1.381 0.083) 2.352 18.130 ( 6.484 2.562 -2.247) 7.325 18.324 ( 5.160 2.309 -3.341) 6.567 18.854 ( -9.874 0.308 1.797) 10.041 18.973 ( -0.322 1.942 9.315) 9.521 19.493 ( 6.838 3.023 -1.672) 7.661 20.344 ( -3.222 -3.344 -1.286) 4.819 27.534 ( 0.886 0.494 0.408) 1.094 28.385 ( -1.810 -2.531 -2.529) 4.010 29.224 ( -1.284 -1.356 -1.009) 2.123 29.463 ( 0.750 -1.244 2.024) 2.492 29.585 ( 1.608 8.556 -1.470) 8.829 29.658 ( 0.115 -2.917 0.620) 2.984 29.714 ( 0.557 2.980 1.824) 3.538 29.907 ( 1.447 -0.586 -3.584) 3.909 30.552 ( -2.508 -2.347 -2.021) 3.985 30.634 ( 2.208 1.785 1.880) 3.405 31.183 ( -0.286 2.736 -1.346) 3.062 31.687 ( -5.144 -0.035 6.202) 8.058 32.543 ( 4.331 -10.102 0.866) 11.025 33.977 ( -3.968 1.738 3.274) 5.430 34.667 ( -5.847 -6.162 -10.812) 13.750 35.678 ( 16.006 -7.298 4.101) 18.063 ======================= Grid point 214 (106/160) ======================= q-point: (-0.44 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 1.100 0.000 -9.265) 9.330 1.828 ( -10.961 -0.000 -3.062) 11.381 2.379 ( -25.264 -0.000 -2.732) 25.411 2.483 ( 1.597 0.000 0.261) 1.618 2.778 ( -9.113 -0.000 0.383) 9.121 2.930 ( 12.599 0.000 -8.584) 15.245 3.051 ( 9.518 0.000 -1.630) 9.656 3.197 ( 5.619 0.000 -2.324) 6.081 3.243 ( 24.633 0.000 14.780) 28.727 3.683 ( -21.903 -0.000 -14.871) 26.474 3.713 ( -11.157 -0.000 3.001) 11.553 4.072 ( 12.691 0.000 -3.418) 13.143 4.314 ( -6.309 -0.000 12.586) 14.079 4.530 ( -1.192 -0.000 5.878) 5.998 4.914 ( -5.629 -0.000 1.741) 5.892 5.380 ( 7.334 0.000 -10.608) 12.897 5.556 ( 5.084 0.000 4.335) 6.681 5.729 ( 0.206 0.000 0.599) 0.634 6.041 ( -1.641 -0.000 -1.907) 2.516 6.214 ( 2.063 0.000 6.706) 7.016 6.694 ( -5.106 -0.000 -0.798) 5.168 6.717 ( 4.851 0.000 1.292) 5.020 6.856 ( 4.083 0.000 -2.584) 4.832 6.997 ( 3.708 0.000 -2.421) 4.428 7.377 ( -0.045 -0.000 7.058) 7.058 7.624 ( 0.751 0.000 12.975) 12.997 7.857 ( -3.019 -0.000 1.566) 3.400 7.993 ( -0.389 -0.000 -4.516) 4.533 8.396 ( -2.292 -0.000 -2.757) 3.585 8.444 ( -1.916 -0.000 -1.098) 2.208 8.783 ( -0.502 -0.000 8.431) 8.446 9.244 ( 0.129 0.000 -9.718) 9.719 9.283 ( 2.039 0.000 -3.840) 4.348 9.342 ( -0.288 -0.000 2.338) 2.355 9.769 ( 1.513 0.000 0.006) 1.513 9.823 ( 1.801 0.000 4.204) 4.574 10.013 ( 4.697 0.000 1.371) 4.893 10.143 ( -1.985 -0.000 0.374) 2.020 10.634 ( 5.020 0.000 6.883) 8.519 10.892 ( -6.103 -0.000 -8.193) 10.217 11.452 ( 2.476 0.000 -0.044) 2.476 11.785 ( -1.064 -0.000 -1.605) 1.925 12.217 ( -4.003 -0.000 -11.982) 12.633 12.645 ( 3.219 0.000 -2.953) 4.369 13.595 ( 0.731 0.000 2.272) 2.386 13.813 ( -1.592 -0.000 0.646) 1.718 14.422 ( -1.140 -0.000 -2.196) 2.474 14.944 ( -0.936 -0.000 -4.355) 4.454 15.763 ( 1.556 0.000 -5.870) 6.072 16.009 ( 0.505 0.000 -0.144) 0.525 16.122 ( -0.347 -0.000 0.318) 0.471 16.299 ( 1.229 0.000 2.197) 2.517 16.301 ( 3.291 0.000 -2.049) 3.877 16.868 ( -1.403 -0.000 -1.881) 2.347 17.740 ( -3.253 -0.000 2.552) 4.134 17.957 ( -0.995 -0.000 0.127) 1.003 18.107 ( -4.197 -0.000 5.919) 7.256 18.269 ( 6.615 0.000 -2.855) 7.205 18.984 ( -15.238 -0.000 2.049) 15.375 19.106 ( 4.100 0.000 0.118) 4.101 19.689 ( 9.516 0.000 16.754) 19.267 20.434 ( 1.264 0.000 -8.039) 8.137 27.773 ( 5.100 0.000 -3.118) 5.978 28.349 ( 1.533 0.000 -2.493) 2.927 29.285 ( -0.615 -0.000 0.964) 1.143 29.643 ( 0.155 0.000 0.527) 0.550 29.667 ( 1.014 0.000 3.399) 3.547 29.707 ( 0.008 0.000 -1.042) 1.042 29.782 ( 3.734 0.000 11.310) 11.911 30.241 ( -1.577 -0.000 -0.035) 1.577 30.529 ( -2.320 -0.000 -1.534) 2.782 30.792 ( 7.857 0.000 -5.001) 9.314 31.241 ( 5.123 0.000 -9.585) 10.868 31.967 ( 0.209 0.000 0.311) 0.375 32.083 ( -0.069 -0.000 -1.003) 1.005 32.142 ( -0.249 -0.000 -7.249) 7.253 33.517 ( 0.672 0.000 42.602) 42.607 34.926 ( -16.169 -0.000 -28.182) 32.491 ======================= Grid point 215 (107/160) ======================= q-point: (-0.33 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( -12.787 -15.508 -10.639) 22.741 2.243 ( -10.977 -37.651 1.621) 39.252 2.383 ( -15.962 -35.734 0.980) 39.149 2.732 ( 3.734 -17.593 0.487) 17.992 2.938 ( 3.223 -14.329 -7.806) 16.633 3.088 ( -11.653 -36.314 -2.228) 38.202 3.270 ( -17.092 -6.148 -12.672) 22.147 3.290 ( -2.429 -14.003 -4.083) 14.787 3.624 ( 12.679 -40.899 -4.024) 43.008 3.646 ( 17.390 -2.239 13.108) 21.892 3.836 ( -5.258 -16.099 5.588) 17.833 4.240 ( 8.109 -13.637 -2.113) 16.006 4.350 ( -6.893 -2.622 11.257) 13.458 4.656 ( 2.267 -9.068 5.796) 10.998 4.902 ( -2.774 -2.634 1.271) 4.031 5.324 ( 10.019 5.396 -9.084) 14.561 5.581 ( 2.641 5.308 0.527) 5.952 5.762 ( 0.902 -3.599 1.075) 3.863 6.059 ( 2.507 -2.058 1.840) 3.729 6.247 ( 2.386 3.706 2.372) 5.005 6.654 ( -6.541 -0.869 1.420) 6.749 6.692 ( 1.666 7.061 -1.159) 7.347 6.807 ( 1.455 3.680 -3.089) 5.020 7.003 ( 4.976 0.320 -3.345) 6.005 7.365 ( 2.195 11.033 7.526) 13.534 7.502 ( 0.147 8.927 2.267) 9.211 7.892 ( -2.902 4.151 -6.060) 7.898 8.046 ( -3.524 -10.485 7.929) 13.610 8.371 ( -0.834 -0.919 -0.995) 1.590 8.467 ( -3.260 -5.321 -1.135) 6.343 8.827 ( 1.136 1.111 5.317) 5.550 9.195 ( -0.286 2.144 -2.804) 3.541 9.210 ( 2.861 0.366 -7.766) 8.284 9.461 ( 0.020 -5.871 3.149) 6.662 9.539 ( -0.971 10.911 -2.002) 11.135 9.984 ( -2.199 -15.253 3.296) 15.760 10.120 ( -2.437 -1.220 -0.345) 2.747 10.550 ( 13.202 -35.030 3.111) 37.564 10.707 ( 2.366 1.208 3.800) 4.637 10.805 ( -0.728 -0.553 -2.068) 2.261 11.427 ( 1.413 4.106 -1.389) 4.558 11.713 ( -1.899 5.464 -1.527) 5.983 12.127 ( -3.126 -1.927 -9.166) 9.874 12.663 ( 2.296 -1.642 -2.326) 3.658 13.617 ( 1.390 0.212 1.654) 2.171 13.797 ( -2.355 0.197 0.085) 2.364 14.407 ( -1.155 -0.936 -1.208) 1.915 14.899 ( 0.088 1.798 -2.794) 3.323 15.733 ( 0.330 0.279 -4.777) 4.796 15.965 ( -0.171 4.818 -0.637) 4.863 16.060 ( 1.560 8.204 0.918) 8.401 16.230 ( 1.420 6.380 1.339) 6.672 16.348 ( 2.768 -0.254 -3.208) 4.245 16.791 ( -2.498 5.332 -1.116) 5.993 17.767 ( -5.294 -4.771 2.309) 7.492 17.900 ( -5.191 4.468 -0.946) 6.914 18.088 ( -1.742 0.733 2.731) 3.321 18.326 ( 8.334 0.147 0.200) 8.338 18.911 ( -11.175 -1.465 2.897) 11.636 19.135 ( 0.820 0.331 2.157) 2.332 19.787 ( 9.776 11.442 12.399) 19.499 20.350 ( 0.243 2.296 -8.299) 8.614 27.735 ( 3.642 5.336 -4.713) 7.997 28.340 ( 0.369 -0.202 -2.254) 2.293 29.249 ( 0.844 3.935 -0.104) 4.026 29.506 ( -3.003 6.438 3.724) 8.021 29.632 ( 1.677 4.342 -0.611) 4.694 29.754 ( 1.262 -0.635 1.091) 1.785 30.033 ( 1.298 -8.181 2.590) 8.679 30.222 ( -0.797 3.799 3.197) 5.029 30.504 ( -2.382 -0.736 -1.228) 2.779 30.737 ( 5.170 4.903 -8.357) 10.982 31.240 ( 0.215 -6.385 -7.620) 9.944 31.675 ( 5.621 10.997 1.402) 12.430 31.995 ( -1.394 6.584 0.845) 6.783 32.752 ( 6.259 -44.958 -3.499) 45.526 33.982 ( 2.889 -13.873 40.019) 42.454 34.686 ( -13.640 -12.465 -25.551) 31.533 ======================= Grid point 216 (108/160) ======================= q-point: (-0.22 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( -18.407 -7.801 -4.492) 20.490 2.555 ( -25.290 -16.000 -13.513) 32.836 2.761 ( -6.799 -14.879 2.194) 16.505 3.133 ( -0.141 -27.666 -0.105) 27.667 3.176 ( 2.339 -7.065 -6.729) 10.033 3.321 ( -2.335 -32.811 -5.275) 33.315 3.625 ( -2.634 -25.571 2.071) 25.790 3.747 ( -2.532 -28.504 4.436) 28.958 3.970 ( 5.452 -21.396 5.486) 22.751 4.054 ( -3.593 -8.230 7.912) 11.968 4.370 ( 9.900 -27.103 -2.183) 28.937 4.476 ( -2.197 -11.049 7.110) 13.321 4.722 ( 9.365 -26.736 3.954) 28.604 4.853 ( -5.397 -10.203 3.547) 12.075 5.125 ( 9.072 -21.262 -5.308) 23.718 5.294 ( 3.964 -8.180 -7.828) 11.996 5.504 ( 3.171 4.392 3.271) 6.328 5.806 ( -3.627 -4.050 -2.758) 6.096 6.079 ( -3.946 6.690 -2.919) 8.298 6.261 ( 4.486 -8.403 5.525) 11.011 6.548 ( 0.540 7.393 -1.628) 7.589 6.641 ( -5.326 -1.749 1.945) 5.934 6.741 ( 0.762 4.056 -0.272) 4.136 7.023 ( 5.535 -1.626 -6.050) 8.360 7.216 ( 2.693 10.475 6.733) 12.741 7.443 ( -1.212 0.441 0.509) 1.387 7.725 ( -6.191 3.471 -10.114) 12.356 8.172 ( -3.094 -2.289 3.860) 5.450 8.428 ( 3.363 -3.309 4.489) 6.512 8.527 ( -2.996 -4.761 -0.866) 5.692 8.818 ( -3.301 1.267 0.095) 3.537 9.142 ( 2.216 1.612 0.924) 2.892 9.242 ( 1.821 -4.479 -4.259) 6.443 9.391 ( -0.947 -2.967 -3.140) 4.422 9.657 ( 3.494 -6.189 3.716) 8.020 10.083 ( -3.886 1.343 -0.718) 4.173 10.268 ( -3.588 -15.293 2.991) 15.990 10.657 ( -3.314 -1.329 -3.291) 4.856 10.838 ( 5.125 1.020 4.121) 6.655 11.284 ( 17.830 -9.127 1.627) 20.096 11.345 ( 7.047 -6.402 -2.064) 9.741 11.576 ( -0.529 5.743 -2.546) 6.304 12.108 ( -3.772 -3.707 0.203) 5.292 12.698 ( 1.097 -2.641 -2.033) 3.509 13.629 ( 1.211 0.847 0.810) 1.685 13.761 ( -3.039 1.246 -1.729) 3.711 14.420 ( -0.501 -1.764 0.169) 1.842 14.852 ( 1.019 2.383 -1.183) 2.849 15.665 ( -1.809 5.225 -1.482) 5.725 15.864 ( -0.246 4.165 -1.639) 4.483 15.929 ( 2.826 8.565 1.378) 9.124 16.140 ( 1.348 7.548 3.486) 8.423 16.289 ( 2.048 5.328 -6.694) 8.797 16.672 ( -3.267 4.795 0.405) 5.817 17.727 ( -9.187 6.713 0.190) 11.380 17.833 ( -4.814 -5.343 1.672) 7.383 18.119 ( 2.162 -1.540 1.669) 3.135 18.375 ( 7.051 1.048 -2.237) 7.471 18.880 ( -7.914 -1.050 2.415) 8.340 19.115 ( -2.999 4.935 6.216) 8.485 19.666 ( 4.295 11.584 0.852) 12.384 20.290 ( -0.856 0.047 -2.557) 2.697 27.621 ( 0.192 5.027 -3.332) 6.034 28.330 ( -0.807 -0.698 -2.375) 2.604 29.203 ( 0.901 1.400 -0.889) 1.887 29.441 ( -2.527 1.306 2.209) 3.602 29.595 ( 1.399 1.127 -0.503) 1.865 29.758 ( 0.915 1.690 1.022) 2.177 30.021 ( 0.883 7.954 -0.486) 8.018 30.097 ( -0.753 10.255 -0.899) 10.322 30.498 ( -2.145 -1.255 -1.646) 2.981 30.675 ( 1.464 1.026 -2.582) 3.140 31.277 ( -5.086 -1.974 -2.299) 5.921 31.748 ( 6.136 -0.222 3.701) 7.169 31.970 ( 6.713 -10.107 0.240) 12.136 33.485 ( 4.866 -33.604 2.011) 34.014 34.269 ( -9.097 -10.422 -10.381) 17.296 35.027 ( 14.860 -28.619 14.679) 35.431 ======================= Grid point 217 (109/160) ======================= q-point: (-0.11 -0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -10.063 -10.041 -2.944) 14.517 2.391 ( -33.739 -14.258 -17.923) 40.778 3.012 ( 7.197 -6.167 10.474) 14.126 3.281 ( -0.220 -9.749 -9.677) 13.738 3.574 ( 0.431 -21.747 1.653) 21.814 3.657 ( -2.466 -10.164 2.952) 10.868 3.992 ( -1.092 -19.079 1.685) 19.184 4.050 ( 3.405 -14.329 1.090) 14.768 4.173 ( 1.164 -0.227 8.505) 8.587 4.441 ( 1.141 -14.147 2.614) 14.431 4.640 ( 6.485 -0.996 8.672) 10.874 4.677 ( 3.273 -4.277 -0.896) 5.460 4.959 ( -1.608 -7.356 2.907) 8.072 5.052 ( 4.906 -4.802 -4.911) 8.440 5.401 ( 0.653 -7.378 -0.833) 7.453 5.439 ( 0.975 -3.975 -5.231) 6.642 5.653 ( -4.447 -9.934 1.594) 11.000 5.864 ( -2.390 -5.141 -3.395) 6.608 6.076 ( 4.974 -18.762 -1.136) 19.443 6.462 ( -6.741 -7.008 -1.781) 9.885 6.567 ( 4.600 -7.949 2.664) 9.563 6.666 ( -4.236 -6.555 -0.002) 7.805 6.679 ( 2.083 0.057 -1.526) 2.582 7.087 ( -2.728 -9.424 -3.510) 10.420 7.186 ( -1.813 -1.002 0.409) 2.112 7.478 ( -4.789 -1.869 5.985) 7.890 7.572 ( 3.507 -0.722 -11.686) 12.222 8.201 ( 0.815 -1.780 1.927) 2.747 8.519 ( -0.653 -0.898 -0.210) 1.130 8.568 ( 0.382 -2.210 2.103) 3.075 8.788 ( -4.084 -1.986 4.318) 6.267 9.197 ( 7.111 -2.584 -0.901) 7.620 9.313 ( 4.116 -6.200 -5.165) 9.059 9.499 ( -2.641 -7.124 1.669) 7.779 9.753 ( 0.969 -1.241 2.612) 3.050 10.002 ( -0.200 5.167 1.517) 5.389 10.475 ( -3.540 -13.417 -2.028) 14.024 10.668 ( -3.487 -1.999 0.607) 4.065 10.859 ( 3.738 3.333 2.205) 5.472 11.168 ( 1.062 9.595 -0.734) 9.682 11.435 ( 0.066 3.439 1.811) 3.888 11.629 ( 17.911 5.573 -18.072) 26.047 12.219 ( -1.020 -3.089 14.935) 15.285 12.734 ( -0.138 -3.060 -2.520) 3.967 13.597 ( -4.225 2.228 -0.670) 4.824 13.704 ( 0.782 0.484 -3.214) 3.343 14.453 ( -0.072 -1.646 1.036) 1.946 14.824 ( 1.419 1.503 0.207) 2.077 15.546 ( -1.155 5.861 2.192) 6.363 15.837 ( 1.571 4.984 2.922) 5.987 15.854 ( 0.243 -2.450 -4.265) 4.924 16.063 ( 2.678 6.663 6.914) 9.968 16.151 ( 2.752 5.726 -6.230) 8.897 16.583 ( -4.863 2.853 0.565) 5.666 17.573 ( -7.306 3.509 1.584) 8.258 17.885 ( -2.480 -2.918 0.438) 3.855 18.168 ( 2.838 -0.672 -0.457) 2.952 18.368 ( 4.323 1.406 -5.603) 7.215 18.826 ( -7.370 2.162 2.950) 8.228 19.065 ( -1.816 2.657 7.175) 7.864 19.570 ( 1.717 2.974 -0.513) 3.472 20.269 ( -2.935 -0.697 -1.691) 3.458 27.558 ( 0.089 1.207 0.504) 1.311 28.317 ( -1.793 -1.280 -2.953) 3.684 29.203 ( 1.626 -0.554 -0.838) 1.911 29.446 ( -1.020 -1.595 1.454) 2.387 29.597 ( 1.013 -0.935 -1.998) 2.428 29.723 ( 0.130 4.244 0.142) 4.248 29.874 ( 1.938 9.804 2.610) 10.329 29.925 ( -0.383 6.408 -3.149) 7.150 30.485 ( -2.544 -1.475 -1.879) 3.490 30.677 ( 1.724 -0.007 0.684) 1.855 31.219 ( -2.171 2.906 -0.936) 3.746 31.721 ( -3.551 3.479 5.562) 7.460 32.362 ( 11.018 -18.289 0.394) 21.355 33.890 ( -3.989 -10.281 2.856) 11.392 34.311 ( -8.098 -17.321 -15.531) 24.634 35.697 ( 24.889 -15.869 9.829) 31.111 ======================= Grid point 224 (110/160) ======================= q-point: (-0.33 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.285 ( -16.333 -0.000 -6.515) 17.584 1.707 ( -5.613 -0.000 3.461) 6.594 1.928 ( -34.330 -0.000 8.244) 35.306 2.483 ( -5.608 -0.000 -1.605) 5.833 2.562 ( -36.659 -0.000 -29.732) 47.200 2.680 ( 0.199 0.000 1.030) 1.049 3.133 ( 3.020 0.000 -5.788) 6.529 3.140 ( 6.264 0.000 -0.941) 6.335 3.324 ( 9.704 0.000 -3.880) 10.451 3.658 ( -3.238 -0.000 8.374) 8.978 3.882 ( 10.521 0.000 6.985) 12.628 4.220 ( 12.768 0.000 -5.339) 13.839 4.367 ( -1.508 -0.000 16.993) 17.060 4.653 ( 0.132 0.000 6.586) 6.587 4.881 ( 0.574 0.000 1.564) 1.666 5.408 ( 10.074 0.000 -9.384) 13.767 5.619 ( 1.862 0.000 -3.251) 3.747 5.773 ( 2.502 0.000 2.052) 3.236 6.108 ( 7.435 0.000 4.405) 8.642 6.317 ( 2.364 0.000 -1.107) 2.610 6.591 ( -8.140 -0.000 1.595) 8.294 6.722 ( -2.207 -0.000 -4.284) 4.818 6.848 ( 3.896 0.000 -3.300) 5.106 7.001 ( 2.466 0.000 -3.867) 4.586 7.455 ( 1.554 0.000 -0.407) 1.606 7.798 ( -6.741 -0.000 1.320) 6.869 7.802 ( -0.880 -0.000 5.798) 5.864 7.898 ( -2.391 -0.000 -1.531) 2.839 8.369 ( -5.342 -0.000 -0.575) 5.373 8.376 ( 2.886 0.000 2.968) 4.140 8.897 ( 2.870 0.000 3.661) 4.652 9.170 ( 1.436 0.000 -0.358) 1.480 9.273 ( 2.663 0.000 -3.637) 4.507 9.409 ( 3.563 0.000 2.962) 4.634 9.782 ( 1.100 0.000 -1.382) 1.767 9.863 ( -0.397 -0.000 -1.087) 1.157 10.045 ( 1.277 0.000 -6.821) 6.940 10.124 ( -1.636 -0.000 2.179) 2.725 10.675 ( -4.207 -0.000 -6.162) 7.461 10.877 ( 7.400 0.000 8.296) 11.117 11.454 ( 0.466 0.000 -2.847) 2.885 11.734 ( -3.132 -0.000 -0.591) 3.187 12.043 ( -2.803 -0.000 -1.579) 3.217 12.649 ( 1.836 0.000 -2.115) 2.801 13.638 ( 1.574 0.000 -0.189) 1.585 13.781 ( -3.070 -0.000 1.740) 3.529 14.388 ( -0.585 -0.000 0.574) 0.820 14.899 ( -0.231 -0.000 -1.356) 1.375 15.698 ( -0.727 -0.000 -4.201) 4.263 16.001 ( -0.399 -0.000 -0.621) 0.738 16.165 ( 3.305 0.000 1.873) 3.799 16.316 ( 3.346 0.000 -2.996) 4.492 16.326 ( 0.563 0.000 -0.558) 0.793 16.811 ( -3.341 -0.000 -0.437) 3.369 17.690 ( -5.749 -0.000 1.162) 5.865 17.891 ( -5.651 -0.000 -0.721) 5.696 18.102 ( -0.538 -0.000 2.250) 2.313 18.395 ( 6.832 0.000 0.172) 6.834 18.843 ( -7.280 -0.000 2.430) 7.675 19.158 ( 0.045 0.000 3.452) 3.452 20.096 ( 14.091 0.000 9.280) 16.872 20.310 ( 0.509 0.000 -8.419) 8.434 27.778 ( 4.579 0.000 -8.856) 9.970 28.325 ( -0.513 -0.000 -1.388) 1.479 29.309 ( 1.697 0.000 1.211) 2.085 29.655 ( 0.463 0.000 0.365) 0.589 29.695 ( 0.012 0.000 -0.527) 0.527 29.709 ( 1.224 0.000 0.279) 1.255 29.907 ( -0.012 -0.000 1.261) 1.261 30.282 ( -1.232 -0.000 6.058) 6.182 30.459 ( -3.406 -0.000 -1.713) 3.813 30.746 ( 5.865 0.000 -20.847) 21.656 31.129 ( -1.409 -0.000 -7.761) 7.888 31.978 ( 0.677 0.000 0.200) 0.705 32.068 ( -0.348 -0.000 -0.467) 0.583 32.177 ( 9.210 0.000 3.596) 9.887 34.110 ( -12.125 -0.000 2.990) 12.488 34.352 ( -1.091 -0.000 20.342) 20.371 ======================= Grid point 225 (111/160) ======================= q-point: (-0.22 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.321 ( -22.701 -12.151 1.217) 25.777 1.932 ( -37.019 -13.821 -11.981) 41.291 2.203 ( -3.695 -44.910 5.370) 45.381 2.370 ( -25.752 -50.911 -4.951) 57.268 2.821 ( 2.541 -17.107 1.012) 17.325 2.839 ( -12.424 -38.070 -0.055) 40.046 3.134 ( 5.777 -1.154 -5.578) 8.113 3.355 ( 5.517 -15.862 0.818) 16.814 3.684 ( 5.513 -37.883 -6.690) 38.862 3.902 ( 3.330 -15.831 7.133) 17.680 3.918 ( -3.535 -3.983 1.686) 5.586 4.391 ( 11.905 -13.946 -0.495) 18.343 4.568 ( 9.847 -3.588 11.400) 15.486 4.717 ( -3.076 -4.548 8.377) 10.015 4.949 ( 4.418 -5.032 1.068) 6.781 5.335 ( 6.683 6.662 -11.492) 14.870 5.606 ( 2.504 1.255 -3.129) 4.200 5.760 ( 1.240 3.536 -0.420) 3.771 6.168 ( -1.053 7.005 -1.475) 7.236 6.274 ( 3.537 -0.634 2.464) 4.357 6.533 ( -8.939 -0.256 -0.581) 8.961 6.651 ( -2.830 2.682 -3.950) 5.550 6.810 ( 3.230 3.961 -0.523) 5.138 7.015 ( 4.044 -0.946 -5.274) 6.713 7.383 ( -5.151 7.924 -7.599) 12.127 7.536 ( -0.054 9.765 7.749) 12.466 7.731 ( -3.274 7.018 -6.177) 9.906 8.079 ( -2.485 -9.297 4.424) 10.591 8.393 ( -4.580 -7.152 0.239) 8.496 8.456 ( 4.746 -1.620 5.678) 7.575 8.862 ( -0.890 7.469 -1.867) 7.750 9.139 ( 0.023 4.141 -5.291) 6.719 9.242 ( 4.553 -0.721 4.938) 6.755 9.434 ( -4.420 11.699 -0.706) 12.526 9.577 ( 3.404 -8.538 3.162) 9.720 9.916 ( -5.581 -11.287 -2.263) 12.793 10.120 ( -0.922 -4.333 1.972) 4.849 10.556 ( 0.630 -6.260 -10.291) 12.062 10.829 ( 18.954 -38.477 -11.510) 44.410 10.994 ( 8.367 -3.649 7.740) 11.968 11.396 ( -0.089 3.925 -3.991) 5.599 11.658 ( -3.629 5.229 0.472) 6.383 12.091 ( -0.218 -2.886 16.237) 16.492 12.660 ( 1.374 -1.296 -1.961) 2.723 13.642 ( 1.093 -0.587 -2.154) 2.485 13.767 ( -2.264 2.289 3.238) 4.566 14.407 ( 0.626 -0.820 2.287) 2.509 14.882 ( -0.729 1.038 0.830) 1.516 15.662 ( -2.133 0.169 -2.510) 3.298 15.947 ( -0.295 5.305 -0.607) 5.347 16.137 ( 4.270 8.229 2.585) 9.624 16.267 ( 1.465 4.508 0.203) 4.745 16.322 ( 1.963 1.789 -5.133) 5.779 16.733 ( -4.042 4.943 0.619) 6.415 17.692 ( -6.078 -3.970 0.147) 7.261 17.793 ( -5.546 4.961 0.514) 7.459 18.124 ( 0.978 -0.742 2.121) 2.450 18.415 ( 2.911 1.081 -4.213) 5.234 18.829 ( -2.907 -1.228 1.722) 3.595 19.183 ( -2.317 0.961 6.036) 6.536 19.968 ( 3.724 21.390 -8.491) 23.313 20.291 ( -0.532 1.623 3.196) 3.624 27.672 ( -0.543 5.137 -7.974) 9.501 28.305 ( -1.208 0.458 -1.546) 2.015 29.272 ( 2.207 5.946 -0.294) 6.349 29.480 ( -3.765 6.011 0.239) 7.097 29.639 ( 1.028 3.386 -1.286) 3.765 29.774 ( 0.787 -0.617 -1.381) 1.705 30.065 ( 0.980 -5.819 -0.171) 5.903 30.253 ( -1.694 7.305 1.484) 7.644 30.437 ( -2.561 -1.756 -1.991) 3.689 30.618 ( 0.414 -3.665 -12.157) 12.704 31.124 ( -2.200 -6.203 -3.820) 7.610 31.858 ( 10.541 3.479 3.255) 11.568 31.988 ( -0.860 5.356 0.953) 5.507 32.873 ( 12.135 -44.993 0.359) 46.602 33.887 ( -16.470 -6.603 -24.926) 30.597 34.926 ( 16.923 -21.322 42.169) 50.192 ======================= Grid point 226 (112/160) ======================= q-point: (-0.11 -0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.364 ( -18.805 -12.630 4.214) 23.041 1.743 ( -35.394 -16.602 -8.785) 40.069 2.907 ( 3.905 -24.355 9.129) 26.301 3.073 ( -2.420 -21.246 -4.972) 21.954 3.186 ( 6.636 -13.456 -1.866) 15.119 3.242 ( -3.520 -37.306 -0.157) 37.472 3.522 ( -13.683 -44.867 3.953) 47.074 3.748 ( 0.808 -22.324 1.838) 22.415 3.898 ( -10.282 -14.803 -1.405) 18.078 4.258 ( 9.670 -14.310 3.458) 17.614 4.384 ( 0.254 -26.227 -1.879) 26.295 4.702 ( 5.755 -5.559 4.561) 9.211 4.876 ( 6.128 -18.117 9.083) 21.173 4.997 ( 1.894 -13.644 8.374) 16.120 5.143 ( 7.378 -17.930 -9.214) 21.466 5.197 ( 5.066 -3.406 -11.646) 13.149 5.581 ( 1.528 2.243 1.940) 3.336 5.747 ( -2.214 -5.312 -1.385) 5.920 5.956 ( -3.298 6.285 -1.908) 7.350 6.310 ( -2.759 0.603 -6.498) 7.085 6.499 ( -8.550 -5.404 -1.818) 10.277 6.563 ( 0.439 -0.194 2.533) 2.579 6.768 ( 0.098 5.601 1.826) 5.892 6.963 ( 0.300 1.605 -9.566) 9.704 7.156 ( -6.676 5.839 -3.027) 9.372 7.485 ( -2.288 2.683 2.641) 4.406 7.625 ( 8.332 2.582 -0.455) 8.735 8.178 ( -0.743 -3.148 2.208) 3.916 8.483 ( -1.437 -3.375 1.158) 3.847 8.561 ( 2.417 -3.126 2.105) 4.477 8.728 ( -5.754 -0.049 0.119) 5.755 9.116 ( 0.687 -4.219 -4.451) 6.171 9.296 ( 1.335 0.991 1.306) 2.114 9.399 ( 2.935 -5.032 4.239) 7.204 9.766 ( 3.414 -5.091 3.178) 6.904 10.004 ( -4.828 -5.407 0.286) 7.255 10.241 ( -2.323 -9.401 -0.554) 9.699 10.563 ( -1.317 -4.833 -3.478) 6.099 10.984 ( 5.526 4.595 1.758) 7.398 11.266 ( -0.071 4.728 -6.414) 7.969 11.486 ( 19.006 -17.496 -28.146) 38.203 11.531 ( -3.079 6.588 1.692) 7.466 12.426 ( 16.744 -3.633 30.697) 35.155 12.679 ( 0.641 -1.457 -2.108) 2.641 13.632 ( -3.164 5.057 0.059) 5.966 13.695 ( 0.914 1.448 -1.916) 2.570 14.449 ( 1.098 -0.914 2.705) 3.059 14.873 ( 0.061 1.986 4.092) 4.549 15.616 ( -2.940 2.032 0.089) 3.576 15.848 ( 0.640 4.475 -0.008) 4.521 16.024 ( 4.097 10.800 2.120) 11.744 16.183 ( -0.406 5.546 -2.411) 6.061 16.263 ( 5.064 4.049 0.830) 6.537 16.617 ( -4.912 5.324 1.266) 7.354 17.597 ( -7.812 5.204 1.487) 9.504 17.794 ( -1.406 -5.432 0.117) 5.612 18.162 ( 0.120 -1.205 0.751) 1.425 18.350 ( -0.248 0.932 -9.727) 9.775 18.834 ( -2.331 1.074 2.071) 3.298 19.125 ( -6.841 4.299 1.860) 8.291 19.624 ( -7.115 7.045 -0.020) 10.013 20.261 ( -1.528 2.218 0.893) 2.837 27.575 ( -1.501 1.086 0.064) 1.854 28.276 ( -1.174 0.015 -1.923) 2.253 29.221 ( 2.940 1.276 -0.664) 3.273 29.426 ( -1.544 -0.222 -0.178) 1.570 29.592 ( 1.387 1.431 -2.722) 3.374 29.758 ( -0.225 0.959 -1.786) 2.040 30.020 ( 0.059 7.816 -0.770) 7.854 30.090 ( -1.984 10.047 3.022) 10.678 30.437 ( -1.469 -1.129 -0.646) 1.962 30.661 ( 0.707 -3.342 -1.435) 3.705 31.193 ( -2.119 -3.939 -1.657) 4.770 31.827 ( -2.328 7.358 4.669) 9.020 32.163 ( 15.573 -16.241 -0.809) 22.515 33.624 ( 4.901 -25.070 3.676) 25.807 33.772 ( -11.173 -19.380 -22.123) 31.462 35.698 ( 28.590 -18.811 12.465) 36.423 ======================= Grid point 234 (113/160) ======================= q-point: (-0.22 -0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.948 ( -22.271 -0.000 5.886) 23.035 1.419 ( -44.636 -0.000 -11.954) 46.209 1.605 ( -40.342 -0.000 17.817) 44.101 1.751 ( 0.513 0.000 8.772) 8.787 2.301 ( -11.556 -0.000 -0.991) 11.598 2.742 ( 2.307 0.000 1.508) 2.756 3.150 ( 6.992 0.000 -4.585) 8.361 3.227 ( 5.851 0.000 -2.033) 6.194 3.344 ( 4.442 0.000 -7.604) 8.807 3.835 ( 4.122 0.000 11.726) 12.429 3.837 ( -7.156 -0.000 -8.236) 10.911 4.327 ( 11.016 0.000 -5.812) 12.456 4.654 ( 2.285 0.000 2.185) 3.162 4.804 ( 8.160 0.000 15.781) 17.766 4.957 ( -0.262 -0.000 6.096) 6.101 5.337 ( 4.187 0.000 -16.033) 16.571 5.611 ( 4.622 0.000 -2.807) 5.408 5.821 ( 2.285 0.000 -2.934) 3.719 6.172 ( -11.272 -0.000 -7.339) 13.451 6.303 ( 7.067 0.000 1.515) 7.228 6.501 ( -8.061 -0.000 6.578) 10.404 6.557 ( -6.776 -0.000 -15.643) 17.048 6.913 ( 5.581 0.000 3.460) 6.567 6.966 ( 2.047 0.000 -5.783) 6.135 7.404 ( 1.372 0.000 -4.071) 4.295 7.682 ( -5.714 -0.000 -5.909) 8.220 7.688 ( -8.871 -0.000 1.424) 8.984 8.007 ( 2.826 0.000 6.697) 7.269 8.269 ( -5.706 -0.000 -0.580) 5.735 8.528 ( 5.560 0.000 5.584) 7.880 8.930 ( 2.823 0.000 -5.768) 6.422 9.243 ( 1.866 0.000 -3.863) 4.290 9.318 ( 4.630 0.000 7.604) 8.903 9.532 ( 5.444 0.000 3.735) 6.602 9.730 ( -2.642 -0.000 -4.171) 4.937 9.796 ( -5.787 -0.000 -19.069) 19.928 9.838 ( 1.528 0.000 -2.031) 2.542 10.117 ( -1.998 -0.000 -0.894) 2.189 10.566 ( -0.876 -0.000 -2.094) 2.270 11.114 ( 5.971 0.000 7.106) 9.281 11.396 ( -0.127 -0.000 -4.210) 4.212 11.677 ( -4.277 -0.000 1.354) 4.487 12.269 ( 9.403 0.000 33.236) 34.540 12.650 ( 1.839 0.000 -1.365) 2.290 13.618 ( 0.606 0.000 -2.361) 2.437 13.833 ( 1.852 0.000 7.185) 7.420 14.432 ( 1.395 0.000 3.593) 3.854 14.902 ( -0.577 -0.000 6.390) 6.416 15.634 ( -2.600 -0.000 0.052) 2.601 15.989 ( -0.067 -0.000 -0.377) 0.383 16.267 ( 4.934 0.000 2.707) 5.628 16.299 ( -0.025 -0.000 -3.543) 3.543 16.324 ( 3.143 0.000 -3.111) 4.422 16.752 ( -4.700 -0.000 1.108) 4.829 17.605 ( -4.273 -0.000 -1.310) 4.470 17.809 ( -4.776 -0.000 1.589) 5.033 18.142 ( 1.737 0.000 0.943) 1.976 18.381 ( -2.731 -0.000 -8.447) 8.877 18.823 ( 2.142 0.000 0.161) 2.148 19.211 ( -4.425 -0.000 5.899) 7.375 20.113 ( 6.811 0.000 -21.086) 22.159 20.393 ( 0.911 0.000 1.811) 2.027 27.635 ( -3.570 -0.000 -9.747) 10.380 28.294 ( -1.113 -0.000 -1.714) 2.043 29.373 ( 3.667 0.000 1.258) 3.877 29.667 ( 0.681 0.000 -0.046) 0.682 29.689 ( -4.772 -0.000 -11.430) 12.386 29.693 ( -0.131 -0.000 0.304) 0.331 29.758 ( -2.550 -0.000 -11.344) 11.627 30.299 ( -1.386 -0.000 -0.775) 1.588 30.394 ( -3.885 -0.000 1.418) 4.135 30.463 ( -5.076 -0.000 -6.347) 8.127 31.055 ( -1.510 -0.000 -0.346) 1.549 31.993 ( 1.006 0.000 0.083) 1.009 32.058 ( -0.632 -0.000 0.104) 0.640 32.519 ( 17.088 0.000 12.340) 21.078 33.501 ( -14.589 -0.000 -26.927) 30.625 35.200 ( 15.558 0.000 44.903) 47.522 ======================= Grid point 235 (114/160) ======================= q-point: (-0.11 -0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.029 ( -26.197 -10.795 10.740) 30.301 1.224 ( -27.631 -15.221 13.926) 34.483 2.114 ( -19.410 -67.333 14.748) 71.609 2.315 ( 2.805 -45.770 9.158) 46.761 2.622 ( -13.553 -40.781 0.461) 42.976 2.868 ( 0.183 -10.543 1.571) 10.661 3.199 ( 8.031 -1.345 0.022) 8.143 3.451 ( 4.577 -15.837 -0.330) 16.488 3.602 ( -1.056 -31.057 -11.281) 33.059 3.720 ( -3.116 -9.141 -13.496) 16.595 4.137 ( 4.510 -20.036 10.877) 23.240 4.529 ( 9.814 -19.393 -3.511) 22.017 4.683 ( 0.178 -0.978 3.267) 3.415 4.950 ( 4.060 -4.634 -6.894) 9.246 4.993 ( -7.330 1.284 13.003) 14.982 5.260 ( 12.473 2.577 -5.682) 13.947 5.644 ( 6.032 0.186 -0.253) 6.040 5.733 ( -2.865 5.743 -4.040) 7.584 5.988 ( -12.330 4.164 -1.240) 13.073 6.273 ( -4.255 4.139 -14.265) 15.451 6.367 ( -7.374 -1.454 -3.235) 8.183 6.537 ( -0.240 -2.378 3.663) 4.373 6.865 ( 2.618 5.079 -3.061) 6.482 6.985 ( 1.313 3.647 -2.066) 4.393 7.271 ( -0.524 11.444 -0.538) 11.469 7.549 ( -0.010 4.169 -0.924) 4.271 7.681 ( -0.433 -2.431 1.939) 3.139 8.111 ( -2.376 -4.703 2.884) 6.007 8.326 ( -4.343 -10.296 -0.807) 11.204 8.601 ( 4.933 1.922 4.379) 6.871 8.778 ( -2.722 9.944 -2.966) 10.728 9.083 ( 0.293 4.362 -2.526) 5.049 9.347 ( -4.538 4.112 3.151) 6.887 9.424 ( 2.860 0.755 5.464) 6.214 9.697 ( 4.425 -8.215 4.668) 10.433 9.790 ( -5.151 -10.880 -2.017) 12.205 10.100 ( -2.026 -5.348 -1.564) 5.929 10.434 ( 5.763 -11.729 -14.186) 19.288 10.805 ( 10.444 -34.526 -21.676) 42.083 11.155 ( 0.857 1.790 0.304) 2.008 11.359 ( 3.601 2.378 -0.899) 4.408 11.618 ( -3.931 4.401 2.625) 6.459 12.635 ( 4.617 -2.023 2.263) 5.525 12.759 ( 22.310 -4.839 26.596) 35.050 13.636 ( 2.405 -1.428 -1.432) 3.142 13.838 ( 4.364 9.012 4.658) 11.044 14.472 ( 1.022 -0.336 3.650) 3.805 14.994 ( 7.332 2.922 15.953) 17.799 15.620 ( -2.123 1.100 3.126) 3.936 15.945 ( 0.236 4.673 0.526) 4.709 16.214 ( 0.033 6.761 -5.392) 8.648 16.271 ( 4.539 5.601 3.324) 7.939 16.336 ( 4.723 0.034 -0.336) 4.735 16.683 ( -4.304 4.190 2.287) 6.427 17.593 ( -4.710 -1.535 -1.700) 5.237 17.743 ( -3.860 2.645 2.126) 5.140 18.153 ( -0.418 0.332 -0.384) 0.658 18.255 ( -5.396 0.539 -13.965) 14.981 18.853 ( 3.130 -0.175 -0.110) 3.137 19.101 ( -17.307 5.459 -7.270) 19.550 19.734 ( -13.096 17.921 -3.088) 22.410 20.320 ( -1.289 3.476 3.565) 5.144 27.578 ( -0.895 0.067 3.535) 3.647 28.270 ( 0.308 0.438 0.013) 0.536 29.290 ( -0.081 6.406 -1.020) 6.487 29.401 ( -1.046 -0.087 -3.218) 3.385 29.632 ( 1.226 3.801 -1.767) 4.367 29.740 ( 0.097 -0.851 -2.638) 2.773 30.045 ( 1.538 -9.372 -3.784) 10.223 30.225 ( -4.070 5.949 1.926) 7.461 30.412 ( -2.640 -3.285 3.226) 5.308 30.514 ( 2.177 -11.213 -2.095) 11.613 31.066 ( -1.149 -4.528 -1.280) 4.843 31.974 ( -1.881 7.810 2.171) 8.322 32.072 ( 11.232 -8.166 -1.101) 13.930 33.106 ( 6.506 -33.604 -7.428) 35.025 33.336 ( -2.036 -12.631 -10.894) 16.804 35.689 ( 17.762 -14.159 6.219) 23.550 ======================= Grid point 244 (115/160) ======================= q-point: (-0.11 -0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.832 ( -15.340 -0.000 22.351) 27.109 0.942 ( -20.261 -0.000 27.183) 33.903 1.525 ( -21.424 -0.000 45.948) 50.697 1.955 ( 4.122 0.000 12.532) 13.193 2.133 ( -8.908 -0.000 2.107) 9.154 2.775 ( -0.183 -0.000 0.511) 0.543 3.188 ( 1.609 0.000 -12.856) 12.956 3.237 ( 3.157 0.000 -3.439) 4.669 3.313 ( 2.867 0.000 -3.951) 4.881 3.536 ( -2.240 -0.000 -15.998) 16.154 4.053 ( 0.788 0.000 11.384) 11.411 4.426 ( 10.168 0.000 -3.952) 10.909 4.698 ( -0.593 -0.000 1.327) 1.453 4.861 ( -8.938 -0.000 -3.049) 9.443 5.007 ( -0.152 -0.000 -3.279) 3.282 5.426 ( 20.354 0.000 9.038) 22.270 5.710 ( 7.844 0.000 2.234) 8.156 5.719 ( -6.758 -0.000 -1.925) 7.027 5.900 ( -14.189 -0.000 -5.739) 15.306 6.153 ( 2.609 0.000 -15.726) 15.942 6.297 ( -4.616 -0.000 0.134) 4.618 6.549 ( -2.564 -0.000 4.727) 5.377 6.917 ( 4.548 0.000 -7.010) 8.356 7.039 ( 3.019 0.000 2.496) 3.917 7.423 ( 1.644 0.000 -1.906) 2.517 7.578 ( -7.296 -0.000 2.376) 7.673 7.585 ( 3.891 0.000 -1.147) 4.056 8.066 ( -4.749 -0.000 2.599) 5.414 8.180 ( -3.619 -0.000 -1.026) 3.761 8.709 ( 6.673 0.000 5.961) 8.948 8.844 ( 0.123 0.000 -4.973) 4.975 9.157 ( -1.154 -0.000 -7.951) 8.035 9.382 ( -4.857 -0.000 3.069) 5.746 9.618 ( -2.983 -0.000 -3.404) 4.526 9.647 ( -1.466 -0.000 6.786) 6.942 9.685 ( 5.569 0.000 4.090) 6.910 9.834 ( 1.848 0.000 -2.930) 3.465 10.031 ( -2.716 -0.000 -4.566) 5.312 10.577 ( 1.622 0.000 1.554) 2.246 11.154 ( -3.580 -0.000 -4.165) 5.492 11.435 ( 5.594 0.000 3.225) 6.457 11.647 ( -3.508 -0.000 3.491) 4.949 12.642 ( 2.333 0.000 -1.179) 2.614 13.045 ( 18.068 0.000 13.072) 22.301 13.636 ( 2.111 0.000 -1.442) 2.556 13.992 ( 5.090 0.000 -2.042) 5.485 14.503 ( 0.101 0.000 4.006) 4.008 15.315 ( 21.471 0.000 10.950) 24.102 15.717 ( 12.404 0.000 13.023) 17.985 15.989 ( 0.329 0.000 0.122) 0.351 16.229 ( -0.982 -0.000 -4.540) 4.645 16.373 ( 7.743 0.000 3.477) 8.488 16.399 ( 6.117 0.000 2.804) 6.729 16.687 ( -5.443 -0.000 1.176) 5.569 17.501 ( -6.215 -0.000 -4.437) 7.636 17.773 ( -4.472 -0.000 2.858) 5.308 18.066 ( -13.760 -0.000 -12.847) 18.825 18.167 ( 4.168 0.000 -5.811) 7.152 18.851 ( -10.418 -0.000 -8.871) 13.683 18.903 ( -14.091 -0.000 -4.046) 14.661 19.851 ( -5.465 -0.000 -2.514) 6.015 20.377 ( 0.060 0.000 5.929) 5.930 27.690 ( 13.266 0.000 7.318) 15.151 28.337 ( 11.091 0.000 11.960) 16.311 29.299 ( -6.946 -0.000 -3.968) 8.000 29.473 ( 3.082 0.000 1.424) 3.395 29.678 ( 0.869 0.000 -0.007) 0.869 29.695 ( -0.521 -0.000 0.552) 0.758 29.721 ( 1.820 0.000 -3.185) 3.668 30.220 ( -9.973 -0.000 1.155) 10.040 30.314 ( -4.816 -0.000 1.426) 5.022 30.528 ( 5.353 0.000 7.629) 9.320 31.038 ( -0.593 -0.000 -0.153) 0.613 32.012 ( 1.150 0.000 0.142) 1.159 32.049 ( -0.906 -0.000 0.312) 0.959 32.726 ( -9.159 -0.000 -17.878) 20.088 33.254 ( 20.827 0.000 9.697) 22.974 35.535 ( -19.126 -0.000 -12.294) 22.736 ======================= Grid point 245 (116/160) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -1.928 -0.000 15.922) 16.039 1.682 ( -2.438 -0.000 25.961) 26.075 2.180 ( 0.954 0.000 1.768) 2.009 2.387 ( 2.012 0.000 5.470) 5.828 2.388 ( -1.296 -0.000 -25.644) 25.677 2.508 ( -2.978 -0.000 -9.329) 9.793 2.883 ( 1.062 0.000 -3.314) 3.480 3.224 ( 0.090 0.000 -1.903) 1.905 3.235 ( 9.904 0.000 30.859) 32.410 3.644 ( 9.800 0.000 17.321) 19.902 4.222 ( -17.077 -0.000 -30.691) 35.122 4.313 ( -6.934 -0.000 7.430) 10.163 4.442 ( 7.176 0.000 -5.477) 9.027 4.521 ( -12.699 -0.000 -0.344) 12.703 4.795 ( 9.514 0.000 -7.405) 12.056 5.222 ( 0.085 0.000 -4.610) 4.611 5.469 ( -0.883 -0.000 -4.275) 4.365 6.054 ( 3.798 0.000 9.442) 10.177 6.122 ( -9.458 -0.000 7.272) 11.930 6.229 ( -1.548 -0.000 -5.386) 5.604 6.310 ( 21.332 0.000 -2.484) 21.476 6.399 ( -4.918 -0.000 -1.560) 5.160 6.856 ( 2.893 0.000 -1.915) 3.469 7.156 ( 2.801 0.000 0.309) 2.818 7.357 ( -0.295 -0.000 -0.506) 0.585 7.551 ( -0.993 -0.000 -4.272) 4.386 7.586 ( -0.568 -0.000 1.189) 1.318 8.018 ( -1.321 -0.000 1.307) 1.858 8.115 ( 0.139 0.000 -0.584) 0.600 8.684 ( -4.584 -0.000 -1.684) 4.884 8.956 ( 0.717 0.000 2.338) 2.446 9.173 ( 5.968 0.000 2.467) 6.458 9.328 ( -3.976 -0.000 -0.939) 4.085 9.551 ( -2.187 -0.000 2.207) 3.107 9.664 ( 1.442 0.000 -5.547) 5.731 9.879 ( -0.562 -0.000 3.747) 3.789 9.886 ( 2.714 0.000 1.828) 3.272 9.916 ( -1.678 -0.000 -0.716) 1.824 10.637 ( 1.023 0.000 -0.309) 1.068 10.954 ( -2.191 -0.000 -1.094) 2.449 11.567 ( 0.782 0.000 0.585) 0.976 11.737 ( 0.055 0.000 1.740) 1.741 12.668 ( 0.811 0.000 0.156) 0.826 13.255 ( -0.448 -0.000 0.739) 0.865 13.478 ( -2.171 -0.000 -1.796) 2.817 13.926 ( -1.083 -0.000 -0.291) 1.122 14.608 ( -0.931 -0.000 2.321) 2.501 15.163 ( -3.034 -0.000 -5.193) 6.014 15.972 ( 4.185 0.000 0.686) 4.240 16.028 ( 0.843 0.000 1.840) 2.024 16.076 ( -1.030 -0.000 -3.129) 3.294 16.421 ( -4.382 -0.000 -0.388) 4.399 16.565 ( 1.230 0.000 1.111) 1.658 16.620 ( -1.093 -0.000 -0.052) 1.094 17.444 ( 0.228 0.000 0.350) 0.417 17.678 ( 0.245 0.000 -1.926) 1.941 17.957 ( -1.139 -0.000 0.680) 1.327 18.022 ( 3.499 0.000 -3.338) 4.836 18.813 ( 0.580 0.000 5.569) 5.600 18.924 ( 3.132 0.000 -2.659) 4.109 19.898 ( -2.044 -0.000 1.940) 2.818 20.665 ( 2.026 0.000 3.121) 3.721 27.630 ( 1.340 0.000 -3.689) 3.925 29.173 ( 3.262 0.000 9.326) 9.880 29.311 ( 2.365 0.000 -2.912) 3.751 29.551 ( 2.530 0.000 -3.135) 4.028 29.693 ( -0.343 -0.000 0.129) 0.367 29.693 ( 3.075 0.000 0.982) 3.228 29.700 ( 0.338 0.000 0.131) 0.363 30.058 ( -2.245 -0.000 -0.773) 2.375 30.286 ( -1.108 -0.000 0.450) 1.196 30.824 ( 5.137 0.000 1.315) 5.302 31.017 ( -0.378 -0.000 -0.315) 0.492 31.994 ( -4.725 -0.000 -6.641) 8.150 32.032 ( -0.354 -0.000 0.169) 0.392 32.046 ( 0.382 0.000 0.046) 0.384 34.107 ( 14.185 0.000 6.372) 15.551 34.585 ( -21.536 -0.000 -2.153) 21.643 ======================= Grid point 246 (117/160) ======================= q-point: ( 0.11 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 11.744 2.938 3.881) 12.713 2.163 ( 2.485 -5.739 -1.698) 6.481 2.272 ( 1.564 -49.542 4.962) 49.814 2.610 ( 0.723 -19.058 2.187) 19.196 2.699 ( -3.155 -39.478 -1.339) 39.627 2.883 ( 0.669 -41.356 -1.094) 41.376 3.035 ( 5.215 -18.292 -2.568) 19.194 3.417 ( -1.559 -6.826 -0.652) 7.032 3.516 ( 0.168 -29.180 -0.412) 29.184 3.907 ( -10.981 -6.487 -25.961) 28.925 4.033 ( 16.422 -9.144 27.670) 33.450 4.320 ( -11.556 -0.908 7.033) 13.558 4.502 ( -1.254 -9.356 -1.675) 9.587 4.622 ( -8.213 -21.627 3.728) 23.433 4.858 ( 7.230 -8.003 -7.844) 13.336 5.157 ( 3.157 6.896 -1.202) 7.679 5.428 ( 1.059 1.994 0.111) 2.260 5.960 ( -4.135 9.361 -0.840) 10.268 6.070 ( -6.080 1.638 1.209) 6.412 6.231 ( -4.543 -3.088 2.156) 5.901 6.346 ( 7.203 3.632 -3.988) 8.999 6.470 ( 8.478 -1.653 -2.430) 8.973 6.714 ( 3.235 13.752 -3.313) 14.511 7.155 ( -2.530 -0.499 -2.304) 3.458 7.403 ( -1.303 -4.325 0.138) 4.519 7.549 ( -0.751 -2.604 0.303) 2.727 7.576 ( 1.204 2.661 -0.039) 2.921 8.051 ( -0.491 -3.523 1.748) 3.963 8.160 ( 2.880 -4.189 -0.603) 5.119 8.635 ( -1.831 3.555 2.931) 4.958 8.937 ( -3.348 1.485 0.726) 3.734 9.155 ( -4.523 2.102 -3.234) 5.944 9.354 ( 7.199 -0.543 1.565) 7.387 9.425 ( 0.156 8.975 0.908) 9.023 9.790 ( 1.027 -12.117 -0.151) 12.161 9.893 ( -0.849 -8.145 -0.120) 8.190 9.988 ( 1.326 -9.848 -0.777) 9.967 10.162 ( -2.471 -17.998 -0.704) 18.180 10.612 ( -0.427 1.762 -0.280) 1.834 10.943 ( 0.661 1.208 1.353) 1.930 11.528 ( -0.765 4.514 -0.492) 4.605 11.710 ( 0.754 4.423 0.309) 4.498 12.659 ( -2.475 0.059 -0.614) 2.550 13.258 ( -5.436 -1.726 1.478) 5.892 13.434 ( 3.852 4.663 0.680) 6.087 13.907 ( -2.879 0.509 0.332) 2.943 14.607 ( -1.113 0.669 1.284) 1.826 15.152 ( -1.043 -2.068 1.030) 2.535 15.899 ( 0.618 7.985 -3.089) 8.584 15.965 ( 1.397 10.374 0.888) 10.505 16.063 ( 0.554 0.332 -1.445) 1.582 16.382 ( -1.403 3.689 2.436) 4.638 16.523 ( -7.521 0.848 -1.405) 7.698 16.637 ( 7.161 2.377 2.719) 8.020 17.484 ( 0.344 -3.776 0.124) 3.794 17.694 ( 4.090 -0.887 -0.830) 4.267 17.910 ( -0.814 4.655 0.698) 4.777 18.039 ( 0.142 -3.085 -3.200) 4.447 18.817 ( -4.041 0.557 1.668) 4.407 18.950 ( 6.590 -1.401 -4.071) 7.872 19.743 ( -2.473 14.862 3.183) 15.399 20.660 ( -0.295 2.512 -0.601) 2.600 27.607 ( 1.856 1.796 -1.421) 2.948 28.939 ( -6.162 19.502 -2.129) 20.563 29.274 ( -0.365 1.091 0.307) 1.190 29.361 ( -2.436 3.624 -0.765) 4.433 29.648 ( -0.476 0.524 -0.664) 0.971 29.674 ( 0.420 2.337 -0.178) 2.381 30.031 ( 0.197 -0.656 -0.718) 0.992 30.225 ( 3.300 -3.217 0.583) 4.645 30.384 ( 0.486 -23.926 1.072) 23.955 30.809 ( 4.201 5.373 -3.743) 7.780 31.024 ( 2.544 -2.799 -0.470) 3.812 31.926 ( -0.356 2.075 0.931) 2.302 32.091 ( -8.383 -8.837 1.104) 12.230 32.234 ( 8.884 -18.861 -1.340) 20.892 34.094 ( -25.867 -12.103 -5.519) 29.087 34.802 ( 21.023 -12.698 10.697) 26.789 ======================= Grid point 247 (118/160) ======================= q-point: ( 0.22 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( 15.050 1.109 -12.590) 19.653 2.453 ( 13.862 -13.170 14.034) 23.719 2.755 ( -1.283 -15.843 -6.873) 17.317 2.982 ( -4.184 -17.452 -16.314) 24.253 3.242 ( 0.777 -15.012 -3.947) 15.541 3.515 ( -3.246 -29.626 4.450) 30.133 3.583 ( -1.229 -30.594 1.311) 30.646 3.635 ( 0.639 -33.740 3.081) 33.887 3.891 ( -4.018 -19.453 -2.326) 19.999 4.098 ( 3.409 -34.850 -7.344) 35.779 4.295 ( -8.328 -0.786 12.176) 14.773 4.535 ( 4.067 -8.781 9.315) 13.432 4.661 ( 6.010 -14.010 5.844) 16.327 4.952 ( -6.209 -10.767 0.169) 12.430 5.061 ( 4.610 -1.318 -1.183) 4.939 5.313 ( -2.051 -44.580 -0.501) 44.630 5.454 ( 4.054 -1.948 2.762) 5.278 5.853 ( 5.693 -1.769 -3.841) 7.091 6.003 ( -6.125 -0.114 0.610) 6.157 6.177 ( -2.378 6.834 -5.060) 8.830 6.326 ( 0.322 -0.082 -0.018) 0.333 6.460 ( 0.515 3.159 1.740) 3.643 6.574 ( 5.391 0.925 -4.379) 7.007 7.106 ( -6.898 -0.521 -2.952) 7.522 7.417 ( -2.401 0.355 -0.830) 2.565 7.496 ( -1.395 0.661 -9.993) 10.111 7.654 ( 0.899 -2.843 9.898) 10.338 8.139 ( 1.375 -4.130 2.288) 4.918 8.289 ( 5.171 -7.139 0.275) 8.820 8.553 ( -1.541 6.342 1.444) 6.684 8.901 ( -2.696 -0.521 -0.102) 2.748 9.082 ( -4.309 -0.774 0.199) 4.382 9.293 ( -0.152 2.082 -2.741) 3.446 9.489 ( 5.699 -2.747 2.519) 6.809 9.893 ( 3.360 2.004 -0.298) 3.923 10.088 ( 0.660 -12.681 1.071) 12.743 10.236 ( 0.501 -15.041 -0.652) 15.064 10.370 ( -5.518 -14.653 -6.416) 16.921 10.655 ( -0.018 -5.900 5.603) 8.136 10.913 ( 1.940 5.727 2.255) 6.453 11.408 ( -2.370 6.732 -1.423) 7.278 11.610 ( 1.200 8.049 -0.637) 8.163 12.620 ( -4.425 0.705 -0.321) 4.492 13.221 ( -5.019 3.925 3.416) 7.229 13.425 ( 6.182 1.126 -0.288) 6.290 13.854 ( -5.794 1.780 -0.846) 6.120 14.587 ( -1.299 1.116 0.144) 1.719 15.174 ( -2.790 1.646 1.647) 3.634 15.691 ( 0.685 11.820 -2.889) 12.188 15.809 ( 3.612 11.260 2.712) 12.132 16.004 ( -0.790 4.072 -4.127) 5.851 16.268 ( -4.403 7.965 1.298) 9.193 16.438 ( -2.044 2.670 -1.685) 3.761 16.664 ( 3.021 3.979 4.113) 6.471 17.558 ( 0.650 -3.212 0.914) 3.402 17.743 ( 4.428 -0.571 -0.431) 4.486 17.844 ( 3.017 1.194 -1.003) 3.396 18.094 ( 0.020 -5.341 -1.146) 5.462 18.804 ( -4.957 -2.778 1.917) 5.997 18.997 ( 6.571 -1.328 -5.345) 8.574 19.538 ( 2.572 10.895 5.472) 12.461 20.573 ( -3.406 4.054 -3.616) 6.412 27.588 ( 2.526 2.060 0.663) 3.326 28.614 ( -6.862 9.027 -6.242) 12.943 29.271 ( -0.475 0.068 1.231) 1.321 29.292 ( -3.586 0.424 -0.773) 3.693 29.616 ( -0.076 1.377 -2.845) 3.161 29.646 ( 0.078 2.011 2.465) 3.183 30.011 ( 4.003 4.946 -0.367) 6.374 30.193 ( 2.729 6.195 -0.082) 6.770 30.610 ( -4.503 -2.837 2.771) 6.000 30.689 ( 0.823 5.642 -5.184) 7.706 31.154 ( 4.084 -5.715 -1.652) 7.216 31.898 ( -1.201 2.852 2.665) 4.083 32.230 ( -13.257 -16.580 3.440) 21.505 32.776 ( 10.956 -33.440 -0.282) 35.190 34.154 ( -19.605 -21.132 -6.569) 29.565 35.285 ( 18.336 -13.841 11.837) 25.844 ======================= Grid point 248 (119/160) ======================= q-point: ( 0.33 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 12.030 -1.509 -9.620) 15.477 2.679 ( -10.169 -3.164 -28.176) 30.122 2.894 ( 17.133 -8.433 9.705) 21.420 3.230 ( 4.170 -18.647 1.361) 19.156 3.491 ( -0.994 -10.397 1.059) 10.497 3.593 ( -9.109 -13.124 -2.647) 16.193 4.079 ( -4.723 -20.080 -2.795) 20.816 4.089 ( -4.691 -17.018 1.840) 17.748 4.233 ( -1.444 -0.010 13.759) 13.834 4.364 ( 6.619 -15.584 8.791) 19.077 4.593 ( -3.191 -2.026 4.388) 5.792 4.674 ( 8.101 -14.716 2.608) 17.000 4.835 ( 4.305 5.851 1.607) 7.440 5.125 ( 5.920 -13.212 3.048) 14.795 5.164 ( -4.171 -5.137 -3.602) 7.534 5.570 ( 1.321 -4.026 -1.326) 4.440 5.783 ( 0.408 -5.300 -4.221) 6.788 5.958 ( 0.669 1.729 -1.977) 2.710 6.100 ( 1.303 -10.632 0.719) 10.735 6.204 ( -0.241 -30.058 -4.214) 30.353 6.357 ( 0.383 -7.141 3.816) 8.105 6.580 ( -2.402 -13.491 0.687) 13.720 6.649 ( 2.957 -7.042 0.374) 7.646 7.042 ( -7.112 -3.715 -3.762) 8.862 7.340 ( -4.606 1.267 -9.816) 10.917 7.432 ( -2.093 -2.498 -4.502) 5.557 7.752 ( -1.352 -0.608 8.132) 8.266 8.229 ( 2.664 -2.752 1.830) 4.245 8.438 ( -2.220 0.733 1.747) 2.918 8.476 ( 4.424 -4.799 -2.042) 6.839 8.921 ( 2.486 -2.935 -0.038) 3.847 9.132 ( -1.352 -2.718 7.941) 8.502 9.285 ( -1.766 -4.910 -4.119) 6.648 9.585 ( 1.584 -4.179 1.231) 4.635 9.807 ( 6.156 9.240 -2.592) 11.401 10.271 ( -0.123 -6.373 -1.414) 6.529 10.433 ( 0.084 -7.691 2.778) 8.178 10.510 ( -6.260 -11.001 -5.448) 13.780 10.757 ( -1.079 1.731 5.038) 5.435 10.880 ( 3.996 -0.428 3.166) 5.116 11.269 ( -3.513 5.356 -1.458) 6.569 11.474 ( 1.313 7.755 0.020) 7.866 12.566 ( -3.800 2.422 1.834) 4.865 13.073 ( -2.964 11.096 -1.245) 11.552 13.477 ( 3.877 -2.558 -1.207) 4.799 13.751 ( -6.763 2.228 -2.073) 7.416 14.553 ( -1.351 1.479 -0.442) 2.051 15.020 ( -2.199 10.377 -3.272) 11.100 15.610 ( 3.160 0.042 2.468) 4.010 15.686 ( 2.293 8.352 1.486) 8.788 15.862 ( -3.786 5.915 -3.416) 7.809 16.130 ( -2.838 4.631 0.167) 5.434 16.372 ( 3.595 6.036 1.306) 7.145 16.598 ( -2.950 4.289 -0.847) 5.274 17.588 ( -1.208 -0.070 1.819) 2.185 17.795 ( 1.985 -2.739 -0.299) 3.396 17.927 ( 8.605 -4.136 0.102) 9.548 18.187 ( 1.375 -4.730 0.376) 4.940 18.850 ( -4.451 -3.611 4.290) 7.159 19.019 ( 3.810 -0.766 -4.242) 5.753 19.507 ( 7.341 3.526 6.459) 10.394 20.428 ( -5.841 4.450 -5.572) 9.217 27.590 ( 2.796 1.420 1.912) 3.673 28.419 ( -5.293 3.636 -6.085) 8.847 29.237 ( -3.510 0.354 -0.027) 3.528 29.334 ( 1.374 -4.025 1.190) 4.417 29.571 ( 1.598 2.466 -2.298) 3.731 29.639 ( -0.984 0.004 2.114) 2.331 29.906 ( 0.374 8.765 -0.893) 8.819 30.079 ( 3.008 8.941 -1.816) 9.607 30.556 ( -1.429 2.198 -2.845) 3.869 30.647 ( -0.974 -0.451 2.095) 2.354 31.192 ( 3.043 2.177 -1.087) 3.896 31.846 ( -2.733 3.261 2.457) 4.913 32.454 ( -9.144 -16.315 3.208) 18.976 33.381 ( 4.357 -28.038 -0.034) 28.374 34.336 ( -11.748 -18.437 -4.199) 22.261 35.687 ( 11.775 -9.801 9.530) 18.042 ======================= Grid point 249 (120/160) ======================= q-point: ( 0.44 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 5.910 0.556 -4.389) 7.383 2.430 ( -9.791 2.459 -16.480) 19.326 3.088 ( 7.416 -1.687 -2.742) 8.085 3.438 ( -5.289 -0.797 0.442) 5.367 3.685 ( 6.189 -13.944 5.614) 16.256 3.876 ( 2.240 -16.879 4.834) 17.700 4.110 ( -6.550 9.976 8.134) 14.442 4.298 ( -4.920 -11.773 2.129) 12.936 4.397 ( 0.069 -13.748 -1.426) 13.821 4.543 ( 0.582 3.214 -2.388) 4.046 4.633 ( 6.099 8.982 2.478) 11.136 4.720 ( 2.949 -3.209 1.320) 4.553 4.902 ( 2.842 0.926 5.764) 6.493 5.141 ( 0.045 1.829 -2.332) 2.964 5.289 ( 2.448 -2.784 -2.159) 4.290 5.516 ( -3.578 3.278 -3.775) 6.148 5.808 ( 4.021 0.462 9.364) 10.202 6.004 ( -0.930 -4.636 -5.480) 7.238 6.269 ( 4.743 -4.753 4.614) 8.147 6.496 ( 6.270 -2.207 -0.889) 6.706 6.587 ( -9.419 -13.819 -3.014) 16.994 6.671 ( -0.303 -4.665 -0.214) 4.680 6.846 ( -2.054 -8.688 1.170) 9.004 7.047 ( -8.366 -3.764 -12.108) 15.191 7.268 ( 0.664 -3.009 -2.703) 4.099 7.436 ( -2.156 -1.486 -1.654) 3.097 7.788 ( 0.819 0.815 5.116) 5.245 8.297 ( 2.687 -0.499 2.063) 3.424 8.403 ( -1.672 -1.694 -2.594) 3.520 8.570 ( 0.250 -1.881 -0.083) 1.899 9.065 ( 5.699 -8.578 1.196) 10.368 9.168 ( -0.296 5.267 7.122) 8.863 9.341 ( -3.353 -4.550 -0.621) 5.686 9.622 ( 4.274 6.165 -0.668) 7.531 9.811 ( 6.559 -9.043 -0.389) 11.178 10.169 ( -7.291 10.871 -4.523) 13.849 10.547 ( 1.307 -3.647 2.458) 4.588 10.606 ( -3.316 -8.973 1.870) 9.747 10.829 ( 3.282 -4.355 0.883) 5.524 10.879 ( -0.100 2.473 -1.081) 2.701 11.146 ( -3.053 4.821 -1.892) 6.012 11.422 ( 1.275 0.297 1.188) 1.768 12.504 ( -2.523 4.152 4.724) 6.776 12.835 ( -1.879 8.350 -6.606) 10.811 13.533 ( 1.015 -1.894 -0.982) 2.363 13.673 ( -2.581 0.815 -0.970) 2.875 14.517 ( -0.788 1.193 -0.109) 1.433 14.862 ( 0.416 4.673 -1.648) 4.973 15.566 ( -0.726 5.984 1.142) 6.135 15.669 ( 1.140 -1.471 -1.512) 2.398 15.804 ( -0.862 -3.136 1.731) 3.684 16.051 ( -0.660 2.849 -2.185) 3.651 16.320 ( 6.616 7.567 6.899) 12.192 16.501 ( -6.147 -0.095 -4.628) 7.695 17.592 ( -1.688 0.228 3.115) 3.550 17.838 ( 1.483 -1.542 -1.956) 2.899 18.062 ( 5.471 -3.662 -0.451) 6.599 18.262 ( 1.234 -2.416 -0.089) 2.714 18.889 ( -3.692 -0.349 6.265) 7.280 19.030 ( 1.431 -1.658 -4.715) 5.199 19.592 ( 6.556 0.065 6.527) 9.251 20.271 ( -5.771 3.041 -5.142) 8.307 27.607 ( 1.863 0.750 2.158) 2.948 28.309 ( -2.829 1.488 -3.799) 4.965 29.214 ( -1.142 0.160 -0.100) 1.157 29.440 ( 1.266 -5.621 0.537) 5.787 29.531 ( 1.153 1.808 -0.881) 2.318 29.656 ( 0.588 0.228 -0.788) 1.010 29.771 ( -2.881 3.225 2.465) 4.978 29.931 ( 2.197 8.115 -3.423) 9.078 30.516 ( -0.576 0.383 -1.715) 1.849 30.675 ( -0.079 -1.143 2.069) 2.365 31.161 ( 1.471 2.011 -0.538) 2.549 31.795 ( -2.771 1.747 2.381) 4.049 32.629 ( -2.679 -6.871 2.024) 7.647 33.730 ( -0.266 -12.243 -2.720) 12.545 34.474 ( -5.911 -7.261 -0.508) 9.376 35.931 ( 8.200 -3.919 3.861) 9.874 ======================= Grid point 250 (121/160) ======================= q-point: (-0.44 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( -1.569 5.631 0.661) 5.883 2.229 ( -7.331 7.235 3.582) 10.905 3.083 ( -2.743 0.876 -3.905) 4.852 3.413 ( 5.067 4.198 3.498) 7.452 3.764 ( -7.163 9.020 -2.158) 11.719 3.919 ( -0.738 10.180 1.127) 10.268 4.234 ( 6.944 -12.176 -1.747) 14.125 4.344 ( -0.782 15.289 2.511) 15.514 4.359 ( 7.295 13.192 -2.892) 15.349 4.430 ( -6.877 -4.757 6.016) 10.301 4.674 ( 0.506 -6.227 -0.529) 6.269 4.790 ( 1.189 -2.583 -3.602) 4.589 4.928 ( -2.447 -0.375 0.252) 2.488 5.111 ( 4.938 0.943 -1.166) 5.160 5.297 ( -0.495 0.662 -2.123) 2.279 5.484 ( -0.668 -3.818 0.337) 3.891 5.864 ( -1.825 7.344 8.633) 11.481 5.938 ( -1.169 5.283 -1.587) 5.638 6.344 ( -2.416 3.408 -1.446) 4.421 6.497 ( 2.900 -3.168 -2.232) 4.840 6.574 ( -2.166 13.482 -0.672) 13.672 6.682 ( 1.130 2.373 -2.323) 3.508 6.863 ( 0.749 4.872 3.536) 6.066 6.919 ( -2.073 4.347 -6.754) 8.295 7.226 ( -4.204 6.844 1.784) 8.228 7.437 ( 1.537 0.378 -0.613) 1.697 7.805 ( 3.410 2.819 3.311) 5.526 8.301 ( 1.132 3.266 1.240) 3.673 8.417 ( 1.005 -2.435 -3.972) 4.767 8.580 ( -0.644 -0.473 -0.484) 0.934 9.051 ( -3.111 10.693 3.397) 11.643 9.224 ( 2.222 -3.878 0.202) 4.474 9.362 ( 4.384 3.624 -2.676) 6.286 9.575 ( -1.925 -2.112 3.410) 4.449 9.858 ( -6.656 12.303 -3.207) 14.351 10.049 ( 5.672 -7.888 6.798) 11.858 10.596 ( -2.287 0.889 -2.377) 3.416 10.619 ( 2.304 8.682 -0.644) 9.005 10.845 ( -0.591 -7.207 1.943) 7.488 10.977 ( -0.961 -4.017 -12.917) 13.562 11.118 ( 4.193 -7.491 0.670) 8.611 11.437 ( 0.153 -0.297 -0.322) 0.464 12.531 ( 0.132 -5.695 5.796) 8.127 12.727 ( 1.267 0.880 0.850) 1.762 13.522 ( -3.689 1.232 0.243) 3.896 13.672 ( 3.347 -0.581 -0.904) 3.516 14.506 ( 0.090 0.081 0.973) 0.981 14.837 ( 0.560 -1.434 0.797) 1.733 15.542 ( -0.277 -2.173 2.660) 3.446 15.691 ( -1.077 -3.917 -2.875) 4.977 15.838 ( 0.788 1.761 -1.754) 2.608 16.031 ( 2.352 -2.394 -0.571) 3.404 16.354 ( 5.760 1.542 10.354) 11.949 16.442 ( -6.516 -3.298 -5.109) 8.913 17.594 ( -1.624 0.727 3.226) 3.684 17.844 ( 0.480 -0.355 -2.829) 2.891 18.097 ( -0.098 0.540 -3.885) 3.924 18.275 ( 0.115 0.942 -1.574) 1.838 18.906 ( -3.217 0.744 7.364) 8.070 19.018 ( 0.940 -0.291 -6.414) 6.490 19.648 ( -2.585 0.035 1.965) 3.247 20.205 ( 0.116 -0.995 0.671) 1.206 27.619 ( -0.165 0.261 1.271) 1.308 28.269 ( 0.278 0.302 -0.014) 0.411 29.215 ( 2.193 0.046 -0.165) 2.199 29.464 ( -1.447 2.328 -1.897) 3.333 29.533 ( 0.371 -0.236 -1.432) 1.498 29.643 ( -0.230 -2.791 0.180) 2.806 29.822 ( 1.684 -0.665 -1.323) 2.242 29.855 ( -0.934 -5.571 3.318) 6.551 30.492 ( -0.440 1.452 0.767) 1.700 30.698 ( 0.580 -0.292 -0.343) 0.734 31.156 ( -0.738 -1.311 0.001) 1.505 31.788 ( -1.922 -0.944 3.031) 3.711 32.652 ( 3.856 5.632 -0.156) 6.828 33.753 ( -2.765 4.203 -5.461) 7.425 34.453 ( -0.352 7.601 2.198) 7.920 36.007 ( 6.470 2.041 -3.924) 7.838 ======================= Grid point 251 (122/160) ======================= q-point: (-0.33 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -7.447 9.238 6.817) 13.685 2.140 ( -2.486 10.345 25.094) 27.257 2.970 ( -9.434 4.005 -3.536) 10.841 3.387 ( -7.163 15.316 -2.420) 17.081 3.428 ( 5.567 7.875 -2.661) 10.005 3.643 ( 0.509 21.251 -3.623) 21.564 4.005 ( 5.875 24.920 3.367) 25.824 4.090 ( 3.054 16.639 0.410) 16.922 4.432 ( -6.637 14.250 1.450) 15.786 4.507 ( 4.923 -9.128 -6.983) 12.503 4.607 ( -6.148 3.692 -0.650) 7.201 4.710 ( -4.113 19.365 -0.954) 19.820 4.874 ( -0.846 -2.292 -4.779) 5.367 5.134 ( 9.850 7.825 -1.425) 12.660 5.215 ( -0.376 3.711 -2.743) 4.630 5.580 ( 0.838 -3.367 -1.510) 3.784 5.664 ( -4.458 9.466 5.631) 11.882 5.902 ( 3.671 5.363 5.577) 8.564 6.126 ( -7.227 18.020 -3.432) 19.717 6.178 ( 1.521 22.888 -1.057) 22.963 6.459 ( -5.074 3.010 -7.223) 9.326 6.596 ( -0.237 12.312 -0.977) 12.353 6.711 ( -1.838 4.040 -6.083) 7.530 6.892 ( 8.907 3.589 10.991) 14.595 7.148 ( -0.721 0.102 6.753) 6.792 7.437 ( 0.906 -0.580 -1.326) 1.708 7.820 ( 5.953 2.111 1.353) 6.459 8.243 ( -2.134 2.945 0.070) 3.638 8.452 ( 2.074 -2.789 -1.845) 3.935 8.527 ( -2.486 4.088 -5.023) 6.937 8.876 ( -3.876 7.145 4.448) 9.266 9.202 ( 2.833 10.038 1.457) 10.531 9.291 ( 1.721 -0.105 -4.838) 5.136 9.593 ( -1.192 5.004 0.892) 5.220 9.769 ( -3.520 -9.044 0.956) 9.751 10.204 ( 1.716 1.765 6.829) 7.259 10.385 ( 1.493 14.833 1.824) 15.019 10.558 ( -0.923 5.046 -5.160) 7.276 10.905 ( 3.258 0.877 -6.910) 7.690 10.940 ( -3.350 -5.758 -7.313) 9.892 11.268 ( 5.109 -4.672 -2.679) 7.423 11.468 ( -1.037 -4.877 0.656) 5.029 12.615 ( 1.474 -1.399 -3.145) 3.745 12.961 ( 7.756 -14.653 11.257) 20.040 13.465 ( -6.095 0.123 0.089) 6.097 13.722 ( 6.868 -0.899 0.768) 6.969 14.526 ( 0.379 -0.738 2.066) 2.226 14.943 ( 2.305 -8.236 4.642) 9.731 15.594 ( -3.765 -1.104 2.347) 4.572 15.767 ( 0.033 -9.649 -5.258) 10.989 15.832 ( 2.652 -2.706 0.125) 3.791 16.118 ( 4.495 -4.097 0.993) 6.162 16.405 ( -0.421 0.020 -0.460) 0.624 16.516 ( -0.805 -8.163 6.186) 10.274 17.587 ( -1.962 0.840 2.535) 3.314 17.814 ( -0.038 1.914 -2.719) 3.325 17.999 ( -5.723 2.495 -7.518) 9.772 18.216 ( -0.361 3.811 -2.408) 4.523 18.912 ( -5.674 0.580 6.286) 8.488 18.957 ( 2.238 3.431 -6.399) 7.598 19.596 ( -9.899 -1.880 -1.829) 10.241 20.303 ( 4.863 -3.582 6.618) 8.960 27.616 ( -1.854 -0.578 -0.032) 1.943 28.307 ( 3.837 -1.041 4.749) 6.194 29.242 ( 4.764 0.064 -0.259) 4.772 29.374 ( -2.200 3.031 -3.250) 4.959 29.537 ( 0.012 -0.972 0.431) 1.063 29.681 ( -0.315 -2.047 -1.855) 2.780 29.893 ( 0.978 -7.031 0.429) 7.112 30.020 ( -2.659 -9.542 4.234) 10.772 30.492 ( 0.579 -0.488 3.334) 3.419 30.687 ( 0.903 1.306 -1.620) 2.268 31.179 ( -1.945 -1.564 0.267) 2.510 31.835 ( -1.705 -3.315 3.315) 4.989 32.515 ( 9.883 14.968 -2.714) 18.141 33.470 ( -5.079 19.331 -9.300) 22.045 34.263 ( 6.705 19.594 4.274) 21.146 35.898 ( 1.079 8.064 -12.560) 14.965 ======================= Grid point 252 (123/160) ======================= q-point: (-0.22 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( -10.969 7.395 14.392) 19.548 2.191 ( 5.032 13.880 36.603) 39.469 2.728 ( -14.832 7.157 -6.777) 17.808 2.963 ( -5.633 19.005 -8.878) 21.720 3.217 ( -2.277 20.181 0.645) 20.319 3.409 ( 7.567 19.068 7.379) 21.801 3.600 ( 4.971 28.495 -0.819) 28.936 3.669 ( -3.492 51.951 7.192) 52.563 3.869 ( 0.106 23.398 1.495) 23.446 4.070 ( -2.642 43.775 -7.671) 44.520 4.566 ( -2.925 -4.583 -13.490) 14.544 4.573 ( 5.055 5.701 1.339) 7.736 4.798 ( -8.350 2.765 -4.808) 10.024 4.963 ( 11.578 18.932 -1.916) 22.274 5.189 ( -4.885 -7.820 -10.764) 14.173 5.274 ( 2.626 44.899 3.570) 45.117 5.564 ( -1.727 -1.270 -9.043) 9.294 5.778 ( -3.196 1.333 4.231) 5.468 5.944 ( 4.035 3.544 11.405) 12.606 6.047 ( 2.923 -0.563 0.566) 3.030 6.349 ( -2.166 3.961 -1.651) 4.807 6.488 ( -1.521 -8.293 -2.923) 8.923 6.604 ( -4.822 0.849 -5.174) 7.124 7.024 ( 8.203 -0.953 6.121) 10.279 7.265 ( 3.401 -3.353 9.004) 10.192 7.463 ( 0.296 -3.188 -1.334) 3.468 7.802 ( 2.858 4.260 -4.197) 6.628 8.164 ( -4.055 3.752 -0.454) 5.544 8.329 ( -5.468 7.258 -4.357) 10.078 8.564 ( 1.701 -7.646 -0.058) 7.833 8.841 ( 1.114 1.277 5.594) 5.846 9.091 ( 5.360 5.921 0.109) 7.988 9.293 ( -1.702 -3.216 -2.240) 4.273 9.513 ( -3.159 2.798 -0.123) 4.222 9.872 ( -2.691 -1.424 1.727) 3.500 10.110 ( -1.190 9.626 0.500) 9.712 10.164 ( 2.051 16.999 6.096) 18.175 10.374 ( 4.391 11.166 -7.788) 14.304 10.785 ( 1.385 8.713 -8.716) 12.402 10.972 ( -3.463 -5.375 -4.212) 7.656 11.376 ( 3.844 -5.447 1.597) 6.855 11.580 ( -1.498 -7.051 2.468) 7.619 12.627 ( 2.899 -0.157 -1.091) 3.101 13.232 ( 8.536 -1.160 2.560) 8.986 13.451 ( -8.966 -7.171 -2.866) 11.833 13.833 ( 7.776 -3.120 1.565) 8.523 14.559 ( 0.055 -0.801 2.689) 2.807 15.183 ( 5.529 -8.739 2.195) 10.571 15.633 ( -1.631 -7.875 3.038) 8.597 15.892 ( -1.909 -10.703 -5.834) 12.338 15.942 ( 2.599 -4.281 2.764) 5.720 16.269 ( 6.403 -7.196 1.349) 9.726 16.409 ( -0.544 -1.298 0.935) 1.689 16.681 ( -1.167 -6.423 2.870) 7.132 17.559 ( -3.975 2.277 1.238) 4.746 17.747 ( -1.688 2.186 -0.943) 2.918 17.871 ( -5.148 -0.241 -5.542) 7.568 18.122 ( 0.650 4.657 -3.360) 5.779 18.833 ( -6.085 3.557 -0.394) 7.060 18.916 ( 1.984 2.264 2.030) 3.631 19.592 ( -8.590 -8.430 0.141) 12.036 20.458 ( 4.541 -3.437 7.941) 9.772 27.617 ( -1.588 -1.998 -1.503) 2.962 28.450 ( 8.000 -4.929 10.031) 13.745 29.280 ( 3.302 0.286 0.512) 3.354 29.310 ( 0.673 -0.195 -3.050) 3.129 29.573 ( 0.427 -2.243 1.323) 2.639 29.693 ( 0.320 -1.185 -2.245) 2.559 30.005 ( -3.020 -5.473 0.322) 6.259 30.165 ( -3.130 -7.036 2.791) 8.191 30.572 ( -0.253 -2.765 6.699) 7.252 30.651 ( 4.106 3.785 -1.616) 5.814 31.136 ( -1.885 5.825 0.081) 6.123 31.904 ( -2.185 -4.226 1.867) 5.110 32.313 ( 12.829 15.776 -4.437) 20.812 32.912 ( -8.823 28.338 -14.197) 32.900 34.023 ( 16.246 22.761 7.392) 28.925 35.557 ( -13.345 13.532 -17.702) 25.972 ======================= Grid point 253 (124/160) ======================= q-point: (-0.11 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( -8.752 0.739 22.381) 24.043 2.030 ( 1.650 41.690 21.894) 47.118 2.380 ( -8.632 18.207 -10.167) 22.570 2.602 ( -1.703 21.333 4.707) 21.912 2.800 ( -3.379 20.754 2.620) 21.190 2.886 ( 1.329 36.126 -6.557) 36.740 3.022 ( 5.792 18.131 22.081) 29.152 3.131 ( -3.448 31.953 -4.858) 32.503 3.518 ( 1.398 25.492 -0.276) 25.532 3.563 ( 8.049 9.064 5.701) 13.396 4.415 ( -5.708 10.279 2.669) 12.056 4.489 ( 7.859 7.185 -6.881) 12.678 4.562 ( -13.238 4.336 -16.839) 21.854 4.716 ( -7.016 14.218 -1.900) 15.968 4.807 ( 10.867 6.087 -7.105) 14.339 5.223 ( -3.628 -7.483 -9.380) 12.536 5.504 ( -2.682 -1.742 -8.077) 8.687 5.874 ( 5.730 -6.083 6.384) 10.517 6.102 ( 3.302 -2.838 -0.259) 4.362 6.106 ( 7.903 -0.814 15.227) 17.175 6.282 ( 0.098 2.541 -0.253) 2.555 6.502 ( -6.689 1.273 -3.703) 7.750 6.706 ( 2.123 -13.931 -2.386) 14.292 7.114 ( 5.299 -0.050 2.167) 5.725 7.370 ( 2.008 0.322 3.247) 3.831 7.524 ( 0.834 -3.533 0.072) 3.631 7.674 ( -1.459 5.432 -6.095) 8.294 8.060 ( -3.806 3.530 0.400) 5.206 8.172 ( -2.181 4.720 -1.808) 5.505 8.690 ( -2.672 -6.306 -2.382) 7.251 8.898 ( 3.221 -0.988 4.525) 5.642 9.098 ( 6.812 0.730 2.458) 7.278 9.349 ( -5.571 -4.820 1.071) 7.445 9.466 ( -2.826 -4.792 -2.225) 5.992 9.770 ( -0.340 10.803 1.819) 10.960 9.931 ( 0.896 11.812 -2.140) 12.037 9.966 ( -0.422 6.896 1.091) 6.995 10.141 ( 4.158 17.999 -1.102) 18.506 10.635 ( 0.405 2.246 -2.102) 3.103 10.981 ( -3.669 -2.045 -2.862) 5.082 11.507 ( 2.442 -4.411 1.720) 5.327 11.687 ( -0.871 -4.240 2.658) 5.080 12.650 ( 2.905 0.023 0.224) 2.914 13.259 ( 4.126 2.833 1.184) 5.143 13.483 ( -5.719 -5.685 -4.176) 9.081 13.918 ( 2.160 -1.567 -0.785) 2.782 14.590 ( -0.469 -0.601 2.746) 2.850 15.240 ( -1.579 -0.409 -7.028) 7.215 15.843 ( 4.157 -8.520 2.412) 9.782 16.002 ( 0.133 -4.619 -0.989) 4.726 16.038 ( -0.029 -5.405 -0.609) 5.439 16.414 ( -0.888 -4.971 -0.740) 5.104 16.481 ( 5.506 -3.494 2.746) 7.076 16.688 ( -6.951 1.291 -2.180) 7.399 17.477 ( -1.477 3.807 1.044) 4.215 17.710 ( -3.326 0.071 -1.940) 3.852 17.899 ( 1.134 -5.202 1.238) 5.466 18.043 ( 3.215 3.048 -3.623) 5.723 18.772 ( -1.637 1.183 5.277) 5.650 18.917 ( 2.349 0.632 -0.010) 2.433 19.752 ( -3.390 -13.865 2.259) 14.451 20.590 ( 3.062 -2.108 6.595) 7.571 27.632 ( 0.188 -2.212 -3.644) 4.267 28.787 ( 12.928 -15.807 12.949) 24.179 29.283 ( 0.024 -0.892 0.052) 0.894 29.363 ( 3.158 -4.220 -1.047) 5.373 29.631 ( 1.098 -2.619 0.542) 2.891 29.693 ( 0.220 -0.329 -1.564) 1.613 30.023 ( 1.034 2.947 0.028) 3.123 30.217 ( -4.057 3.081 1.414) 5.287 30.394 ( -2.656 21.394 0.154) 21.559 30.729 ( 4.042 -3.615 4.451) 7.015 31.024 ( -1.106 2.114 -0.387) 2.417 31.965 ( -1.846 -4.860 -1.552) 5.425 32.139 ( 7.776 11.814 -3.077) 14.475 32.309 ( -11.213 18.167 -11.158) 24.088 33.942 ( 26.254 13.291 10.336) 31.189 35.022 ( -30.848 12.890 -13.183) 35.938 ======================= Grid point 255 (125/160) ======================= q-point: ( 0.11 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 3.738 0.000 -6.389) 7.402 1.954 ( 17.733 0.000 -18.941) 25.946 2.116 ( -5.238 -0.000 -0.202) 5.242 2.373 ( 9.915 0.000 23.431) 25.443 2.437 ( 3.384 0.000 -6.468) 7.300 2.521 ( 3.237 0.000 9.170) 9.725 2.914 ( 5.872 0.000 -0.352) 5.883 3.209 ( -0.853 -0.000 0.824) 1.186 3.241 ( -5.446 -0.000 -24.803) 25.393 3.574 ( -8.463 -0.000 -20.002) 21.718 4.244 ( -13.518 -0.000 6.115) 14.837 4.384 ( 18.994 0.000 31.760) 37.006 4.401 ( -0.292 -0.000 -7.289) 7.295 4.415 ( -13.813 -0.000 15.784) 20.975 4.812 ( 5.174 0.000 -5.972) 7.901 5.256 ( 5.872 0.000 2.967) 6.579 5.477 ( 3.236 0.000 3.314) 4.632 5.936 ( -13.796 -0.000 -7.174) 15.550 5.987 ( -11.805 -0.000 -0.601) 11.821 6.207 ( -0.426 -0.000 5.413) 5.429 6.415 ( 11.720 0.000 -20.178) 23.335 6.521 ( 9.599 0.000 4.669) 10.674 6.852 ( 1.742 0.000 -3.726) 4.113 7.099 ( -5.111 -0.000 -2.205) 5.566 7.330 ( -2.962 -0.000 0.741) 3.053 7.528 ( -2.141 -0.000 2.097) 2.996 7.620 ( 3.296 0.000 0.414) 3.322 8.037 ( 1.844 0.000 2.640) 3.220 8.152 ( 4.749 0.000 -0.014) 4.749 8.685 ( -2.438 -0.000 5.932) 6.414 8.896 ( -7.777 -0.000 -2.590) 8.197 9.131 ( -0.468 -0.000 -4.800) 4.823 9.442 ( 9.974 0.000 1.814) 10.138 9.557 ( -2.411 -0.000 3.259) 4.054 9.628 ( -0.308 -0.000 -0.382) 0.490 9.842 ( -3.214 -0.000 -2.231) 3.913 9.872 ( -2.539 -0.000 -1.168) 2.794 9.957 ( 3.083 0.000 0.195) 3.089 10.611 ( -2.292 -0.000 -0.954) 2.483 10.990 ( 3.547 0.000 3.565) 5.029 11.547 ( -2.260 -0.000 -1.739) 2.852 11.755 ( 1.459 0.000 -0.886) 1.707 12.624 ( -4.557 -0.000 -0.654) 4.604 13.206 ( -5.116 -0.000 0.253) 5.122 13.510 ( 2.105 0.000 2.863) 3.553 13.893 ( -4.073 -0.000 1.706) 4.416 14.608 ( -1.445 -0.000 0.107) 1.449 15.164 ( 0.692 0.000 6.104) 6.144 15.962 ( 0.737 0.000 -6.394) 6.436 16.023 ( -0.814 -0.000 -1.920) 2.086 16.079 ( 1.113 0.000 2.917) 3.122 16.436 ( -1.863 -0.000 4.141) 4.541 16.468 ( -7.209 -0.000 -0.844) 7.259 16.717 ( 6.819 0.000 0.053) 6.819 17.455 ( 1.695 0.000 0.128) 1.700 17.732 ( 7.205 0.000 1.052) 7.281 17.953 ( -1.046 -0.000 2.127) 2.370 17.991 ( 0.959 0.000 -3.639) 3.764 18.778 ( -6.746 -0.000 -0.468) 6.762 18.969 ( 8.505 0.000 -4.844) 9.788 19.868 ( -5.387 -0.000 2.634) 5.997 20.658 ( -1.467 -0.000 -4.668) 4.893 27.634 ( 2.517 0.000 -0.282) 2.533 28.968 ( -21.535 -0.000 -12.094) 24.698 29.289 ( -0.276 -0.000 1.116) 1.149 29.505 ( -2.181 -0.000 -1.090) 2.438 29.654 ( -2.600 -0.000 -1.835) 3.182 29.677 ( -1.253 -0.000 0.080) 1.256 29.714 ( 0.910 0.000 -0.214) 0.935 30.242 ( 14.428 0.000 0.403) 14.433 30.307 ( 1.735 0.000 1.550) 2.326 30.853 ( 3.251 0.000 -8.345) 8.955 31.040 ( 4.781 0.000 -0.796) 4.847 32.012 ( -1.571 -0.000 0.119) 1.575 32.039 ( 5.726 0.000 10.963) 12.368 32.065 ( 1.492 0.000 -0.289) 1.520 33.656 ( -35.539 -0.000 -6.191) 36.074 35.021 ( 28.490 0.000 14.336) 31.894 ======================= Grid point 256 (126/160) ======================= q-point: ( 0.22 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( 17.822 -2.014 -21.203) 27.772 2.125 ( 2.708 -31.268 -19.326) 36.858 2.496 ( 9.921 -31.879 8.369) 34.420 2.668 ( 4.046 -15.504 -1.548) 16.098 2.835 ( 4.212 -28.439 18.850) 34.378 2.873 ( 2.619 -34.815 -3.231) 35.063 3.031 ( -1.162 -10.766 -9.582) 14.459 3.251 ( 7.443 -24.908 -5.013) 26.475 3.433 ( -8.590 -7.848 -10.811) 15.883 3.522 ( 0.198 -30.015 -4.085) 30.292 4.248 ( -15.425 -7.135 10.028) 19.733 4.437 ( -5.032 -9.514 2.429) 11.033 4.531 ( -11.225 -17.745 6.117) 21.870 4.708 ( 12.170 -1.630 15.606) 19.857 4.846 ( 2.584 -5.704 -2.433) 6.718 5.288 ( 8.419 7.687 6.878) 13.315 5.534 ( 5.141 2.347 7.284) 9.220 5.799 ( -5.244 -2.571 -4.112) 7.143 5.894 ( -11.690 -1.976 -4.903) 12.830 6.232 ( 1.930 3.253 -1.956) 4.258 6.315 ( 4.914 1.012 -10.463) 11.604 6.596 ( 6.534 3.229 3.529) 8.097 6.719 ( 3.163 11.399 -2.135) 12.021 7.035 ( -5.978 1.152 -2.553) 6.602 7.339 ( -4.146 -1.538 -3.052) 5.373 7.476 ( -5.283 2.306 -0.245) 5.769 7.690 ( 3.569 -2.475 4.346) 6.144 8.117 ( 4.659 -2.871 3.114) 6.296 8.241 ( 6.595 -4.777 0.975) 8.201 8.650 ( -5.659 5.142 3.014) 8.219 8.809 ( -8.917 -2.200 -3.208) 9.729 9.060 ( 0.767 3.610 -1.919) 4.159 9.419 ( 2.066 9.670 0.408) 9.897 9.527 ( 4.991 0.393 0.567) 5.039 9.811 ( 4.173 -14.760 -1.663) 15.428 9.902 ( -1.269 -12.530 2.336) 12.809 9.973 ( -2.051 -9.194 -2.739) 9.810 10.071 ( -2.835 -11.241 -0.581) 11.607 10.607 ( -2.111 -2.821 1.681) 3.904 11.029 ( 4.303 2.823 4.025) 6.533 11.467 ( -3.749 4.435 -2.999) 6.536 11.721 ( 1.980 4.511 -1.639) 5.192 12.586 ( -4.534 -0.105 0.547) 4.568 13.172 ( -6.849 -1.856 -1.843) 7.331 13.527 ( 1.805 1.951 3.549) 4.434 13.844 ( -5.284 2.979 0.792) 6.117 14.586 ( -1.726 0.556 -0.956) 2.050 15.202 ( -1.941 1.263 4.696) 5.236 15.838 ( 0.697 7.994 -5.282) 9.606 16.004 ( 0.100 2.321 -2.706) 3.566 16.041 ( 0.886 7.046 2.226) 7.442 16.340 ( -6.916 5.750 -0.542) 9.010 16.427 ( -4.788 0.132 -0.849) 4.865 16.757 ( 3.704 1.710 0.344) 4.094 17.520 ( 3.494 -4.054 1.368) 5.524 17.816 ( 8.885 0.718 1.623) 9.060 17.890 ( -1.264 3.721 -0.594) 3.974 18.042 ( 5.985 -2.197 1.908) 6.655 18.742 ( -4.722 -1.648 2.195) 5.462 19.008 ( 9.226 0.037 -4.870) 10.433 19.754 ( -3.097 8.765 3.591) 9.966 20.567 ( -3.601 3.167 -6.767) 8.294 27.645 ( 2.650 1.311 0.747) 3.050 28.614 ( -13.839 7.624 -12.973) 20.443 29.288 ( 0.448 0.704 0.496) 0.971 29.315 ( -2.231 6.823 0.604) 7.203 29.610 ( -1.682 1.338 -0.782) 2.287 29.686 ( -0.059 0.911 0.589) 1.086 29.996 ( -2.807 -13.959 -0.629) 14.252 30.307 ( 5.274 3.438 0.118) 6.297 30.434 ( 2.911 -11.712 1.242) 12.132 30.747 ( 0.329 5.615 -8.713) 10.371 31.080 ( 6.193 -2.660 -2.891) 7.334 31.976 ( 0.535 4.357 3.027) 5.333 31.996 ( -7.778 -0.812 2.847) 8.322 32.447 ( 11.013 -21.810 9.772) 26.315 33.539 ( -26.625 -21.473 -6.242) 34.770 35.375 ( 20.116 -5.504 12.765) 24.452 ======================= Grid point 257 (127/160) ======================= q-point: ( 0.33 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( 20.015 -0.182 -16.211) 25.757 2.320 ( 2.039 -10.997 -28.060) 30.207 2.903 ( 6.291 -11.443 -0.560) 13.070 3.083 ( 15.914 -15.879 15.210) 27.143 3.246 ( 1.360 -20.934 0.273) 20.980 3.298 ( -8.771 -6.429 -7.282) 13.088 3.486 ( -6.047 -33.858 -1.603) 34.432 3.730 ( 0.239 -32.650 1.333) 32.678 3.905 ( 4.330 -41.355 2.878) 41.681 4.134 ( 6.719 -45.200 -2.362) 45.758 4.317 ( -14.380 -3.164 14.550) 20.700 4.593 ( -0.811 -5.065 5.492) 7.515 4.801 ( -6.687 -14.927 -1.531) 16.428 4.903 ( 4.135 -4.489 4.341) 7.490 5.186 ( -3.674 -22.180 -3.734) 22.790 5.270 ( 2.767 -14.729 2.586) 15.208 5.586 ( 5.576 0.384 6.251) 8.385 5.784 ( -8.080 -5.939 -9.894) 14.087 5.935 ( -0.604 -8.511 5.940) 10.396 6.102 ( 9.612 8.655 -6.123) 14.311 6.362 ( 2.049 -3.591 3.186) 5.219 6.568 ( 8.559 6.533 2.837) 11.135 6.645 ( 2.424 0.784 3.861) 4.626 6.910 ( -8.883 2.710 -5.566) 10.828 7.225 ( -7.601 1.525 -8.868) 11.779 7.421 ( -4.042 1.513 2.411) 4.943 7.774 ( 1.942 -1.281 2.121) 3.148 8.211 ( 2.318 -2.698 0.238) 3.565 8.411 ( 5.790 -5.813 3.828) 9.054 8.503 ( -4.701 5.767 0.169) 7.442 8.816 ( -3.911 -7.383 -3.046) 8.893 9.049 ( 0.622 -2.687 0.916) 2.906 9.328 ( 3.539 5.162 1.222) 6.377 9.549 ( 0.738 -1.296 -1.313) 1.987 9.926 ( 0.420 0.772 -3.561) 3.668 10.133 ( 1.631 -9.706 2.563) 10.170 10.180 ( 1.686 -16.275 -8.392) 18.388 10.283 ( -2.360 -14.868 6.915) 16.566 10.703 ( -4.479 -7.047 6.014) 10.290 11.018 ( 4.430 5.711 3.870) 8.198 11.316 ( -4.730 5.783 -2.965) 8.038 11.617 ( 1.821 7.914 -1.689) 8.295 12.568 ( -3.244 -0.098 2.504) 4.099 13.096 ( -10.686 0.789 -6.101) 12.331 13.534 ( 3.154 2.570 3.380) 5.289 13.729 ( -4.405 4.008 -2.066) 6.303 14.552 ( -1.807 0.724 -1.438) 2.420 15.117 ( -3.760 6.666 -3.026) 8.230 15.693 ( 3.635 5.696 -2.526) 7.214 15.894 ( 0.733 10.006 1.805) 10.194 15.925 ( -1.015 7.012 -1.339) 7.211 16.175 ( -5.392 5.750 -1.306) 7.991 16.393 ( -3.133 -1.286 -1.787) 3.829 16.694 ( 0.758 6.993 -1.371) 7.166 17.616 ( 3.744 -0.489 2.139) 4.339 17.791 ( 2.619 0.683 -0.910) 2.855 17.963 ( 7.053 -1.989 4.701) 8.707 18.142 ( 4.631 -2.488 1.187) 5.389 18.800 ( -1.001 -3.989 5.821) 7.127 19.033 ( 7.062 1.591 -3.345) 7.974 19.656 ( 0.073 4.372 4.628) 6.367 20.413 ( -4.724 4.761 -6.745) 9.512 27.646 ( 2.320 1.432 0.546) 2.780 28.377 ( -5.515 2.778 -8.114) 10.197 29.224 ( -2.231 1.600 -0.626) 2.816 29.317 ( 1.260 -1.209 2.873) 3.362 29.567 ( -1.000 0.918 -2.140) 2.534 29.674 ( -0.630 1.350 2.263) 2.710 30.038 ( 0.355 5.106 -1.194) 5.256 30.243 ( 4.601 8.230 -2.201) 9.682 30.556 ( -3.684 1.026 -2.126) 4.376 30.630 ( 0.583 -1.234 -1.823) 2.277 31.200 ( 5.287 -5.076 -2.385) 7.708 31.905 ( -3.536 4.625 2.276) 6.251 32.060 ( -13.010 -15.806 3.250) 20.728 33.030 ( 11.165 -25.388 10.803) 29.765 33.788 ( -15.324 -29.549 -3.842) 33.507 35.678 ( 8.690 -7.818 7.163) 13.709 ======================= Grid point 258 (128/160) ======================= q-point: ( 0.44 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 16.977 0.589 -9.547) 19.487 2.296 ( 4.996 -3.340 -13.959) 15.198 3.060 ( 1.045 -3.321 -3.057) 4.633 3.291 ( -6.785 -9.991 -4.259) 12.806 3.559 ( 10.843 -13.848 11.400) 20.959 3.631 ( 2.467 -18.601 4.877) 19.387 3.922 ( -4.831 -24.379 -3.449) 25.091 4.048 ( -1.743 -18.151 0.436) 18.240 4.291 ( -12.558 4.494 10.149) 16.761 4.513 ( 2.005 -10.167 1.104) 10.421 4.663 ( 2.243 -7.960 1.319) 8.374 4.796 ( 3.166 -6.137 -0.449) 6.920 4.867 ( -0.424 -9.161 0.183) 9.173 5.110 ( 5.931 -10.952 0.902) 12.488 5.174 ( -2.727 -3.964 -3.727) 6.086 5.578 ( 0.074 5.374 -0.616) 5.409 5.721 ( -0.474 -17.674 -1.083) 17.713 5.944 ( 3.721 2.983 -5.689) 7.424 6.085 ( -6.671 -32.278 0.212) 32.961 6.232 ( 6.993 -10.895 5.650) 14.125 6.512 ( 4.205 -6.084 5.186) 9.033 6.600 ( 0.414 2.482 1.136) 2.761 6.717 ( 2.811 -5.746 7.110) 9.564 6.807 ( -5.630 -6.330 -7.994) 11.648 7.143 ( -4.693 -5.457 -3.779) 8.129 7.382 ( -5.304 -0.125 1.812) 5.606 7.806 ( 3.485 -1.434 -3.068) 4.859 8.249 ( -1.796 -3.078 -1.702) 3.949 8.427 ( 1.053 2.746 2.234) 3.693 8.540 ( 1.080 -3.167 2.430) 4.135 8.946 ( 2.785 -10.135 -3.075) 10.951 9.158 ( -2.083 -7.097 3.578) 8.216 9.285 ( 2.194 2.629 -1.881) 3.907 9.616 ( 1.187 -7.584 0.621) 7.701 9.835 ( 1.756 5.581 -4.224) 7.216 10.192 ( -3.450 3.800 -6.699) 8.439 10.370 ( -0.554 -12.908 0.379) 12.925 10.548 ( 1.444 -6.587 8.890) 11.158 10.814 ( -2.759 -4.375 5.485) 7.538 10.987 ( 4.287 4.731 2.858) 6.995 11.180 ( -5.185 4.412 -0.889) 6.867 11.489 ( 1.066 6.289 -0.661) 6.413 12.565 ( -2.722 1.405 4.528) 5.466 12.871 ( -8.555 6.448 -11.681) 15.849 13.542 ( 2.574 1.443 1.909) 3.514 13.660 ( -0.106 0.526 -1.107) 1.230 14.517 ( -1.480 0.484 -1.248) 1.995 14.940 ( -0.786 6.904 -4.375) 8.211 15.660 ( 2.094 3.919 -3.926) 5.929 15.734 ( -0.632 6.469 4.288) 7.787 15.807 ( -0.555 4.844 1.573) 5.123 16.068 ( -2.320 2.509 -1.846) 3.884 16.378 ( -3.803 -1.704 -4.338) 6.015 16.555 ( 2.270 8.832 0.563) 9.137 17.638 ( 3.998 1.917 1.882) 4.817 17.835 ( 3.047 -1.077 0.539) 3.277 18.067 ( 4.605 -1.091 2.373) 5.295 18.215 ( 0.199 -3.457 0.229) 3.470 18.911 ( 2.044 -2.671 6.573) 7.383 19.016 ( 3.017 2.623 -2.352) 4.638 19.645 ( -3.422 0.043 2.108) 4.019 20.264 ( -2.013 4.164 -3.267) 5.663 27.640 ( 0.844 0.979 -0.543) 1.402 28.287 ( -0.665 0.774 -3.078) 3.243 29.201 ( -0.430 -0.470 -0.608) 0.881 29.392 ( 1.573 -3.250 3.605) 5.102 29.534 ( -0.905 0.385 -2.583) 2.764 29.669 ( -0.494 0.663 2.985) 3.097 29.880 ( -1.229 9.933 -1.527) 10.125 30.081 ( 2.147 10.555 -4.505) 11.676 30.497 ( -0.251 -0.121 -2.467) 2.482 30.667 ( -0.580 -1.247 1.967) 2.401 31.232 ( 4.016 3.320 -1.274) 5.364 31.821 ( -4.066 2.829 1.674) 5.229 32.325 ( -10.814 -22.001 1.954) 24.593 33.541 ( 7.869 -16.056 8.802) 19.930 34.151 ( -7.785 -24.436 0.337) 25.648 35.876 ( 1.509 -8.046 -0.642) 8.212 ======================= Grid point 259 (129/160) ======================= q-point: ( 0.56 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( 11.206 5.151 -5.216) 13.391 2.343 ( 7.644 1.123 8.140) 11.222 3.027 ( -7.818 0.020 -1.585) 7.977 3.430 ( 4.933 -8.000 -1.862) 9.581 3.794 ( -2.233 -1.222 2.121) 3.314 3.967 ( 2.581 -16.492 -0.714) 16.708 4.077 ( -8.875 9.505 4.343) 13.710 4.218 ( -6.846 -14.563 1.181) 16.135 4.377 ( 1.968 -17.783 -1.799) 17.982 4.534 ( 2.408 4.732 -2.767) 5.987 4.639 ( -3.514 7.487 -0.428) 8.282 4.758 ( -2.075 -0.543 -4.167) 4.686 4.978 ( 2.737 2.759 0.618) 3.935 5.161 ( 8.832 1.583 -2.487) 9.311 5.291 ( 1.367 -0.416 0.541) 1.528 5.496 ( 0.925 2.775 1.655) 3.361 5.863 ( -6.508 -1.391 -8.038) 10.435 5.961 ( 1.612 -3.536 5.241) 6.525 6.313 ( -4.319 -4.750 -5.300) 8.325 6.452 ( -2.109 -1.642 2.309) 3.532 6.637 ( 5.263 -8.239 2.137) 10.007 6.680 ( 1.747 -4.537 2.155) 5.317 6.868 ( 0.288 -7.305 0.809) 7.356 6.925 ( 4.235 -3.817 10.488) 11.937 7.228 ( -4.170 -4.701 0.679) 6.321 7.396 ( -2.834 -4.730 0.552) 5.542 7.845 ( 5.449 -1.444 -4.619) 7.288 8.278 ( -2.458 -3.628 -2.379) 4.986 8.425 ( 3.175 1.829 1.330) 3.898 8.586 ( 0.957 0.064 1.316) 1.629 9.107 ( 1.912 -8.925 -4.605) 10.223 9.160 ( -6.845 3.889 0.783) 7.911 9.320 ( 2.038 -4.196 -1.404) 4.872 9.677 ( 6.768 4.424 -4.729) 9.367 9.913 ( -4.723 -8.650 2.041) 10.064 9.946 ( -3.542 4.415 -2.803) 6.316 10.586 ( -0.991 -4.504 1.732) 4.926 10.626 ( 2.948 -3.975 3.802) 6.240 10.837 ( -2.412 4.680 -1.870) 5.587 10.963 ( 3.097 5.832 6.752) 9.444 11.076 ( -1.781 -0.136 -0.951) 2.023 11.442 ( 0.656 0.893 -0.560) 1.242 12.511 ( -3.610 1.905 0.281) 4.091 12.728 ( 0.529 -0.855 -2.599) 2.787 13.539 ( -0.955 1.801 1.841) 2.747 13.680 ( 4.038 -1.195 -0.359) 4.227 14.502 ( -0.759 -0.507 -0.235) 0.943 14.840 ( 0.076 1.898 -2.001) 2.759 15.544 ( -1.045 2.451 -1.297) 2.963 15.690 ( 0.136 4.488 2.605) 5.191 15.835 ( 1.079 -3.260 1.492) 3.745 16.013 ( -0.152 0.407 -1.858) 1.908 16.295 ( -6.187 -0.410 -8.787) 10.754 16.504 ( 3.960 3.440 5.843) 7.853 17.651 ( 4.014 2.243 1.774) 4.928 17.852 ( 2.083 1.596 -0.356) 2.648 18.092 ( 0.162 1.051 -1.802) 2.093 18.256 ( -1.605 -1.693 -0.061) 2.334 18.966 ( -1.480 3.096 2.611) 4.312 19.008 ( 5.999 -0.690 1.039) 6.128 19.579 ( -11.723 0.025 -3.874) 12.346 20.232 ( 3.619 0.196 3.311) 4.909 27.617 ( -1.264 0.542 -1.834) 2.292 28.286 ( 2.539 -0.341 1.171) 2.817 29.221 ( 2.626 -1.394 -0.657) 3.045 29.477 ( 0.941 -1.059 2.393) 2.781 29.500 ( -2.901 -0.229 -1.044) 3.092 29.655 ( 0.654 3.810 -1.456) 4.131 29.770 ( -2.647 -1.935 3.769) 4.995 29.901 ( 1.766 7.361 -4.958) 9.049 30.504 ( 0.820 -0.698 -0.114) 1.083 30.685 ( -0.913 -0.713 0.267) 1.189 31.180 ( 1.818 3.778 -0.682) 4.248 31.781 ( -2.984 0.119 2.185) 3.700 32.574 ( -5.079 -13.144 -0.212) 14.092 33.795 ( 5.103 -1.441 5.958) 7.976 34.436 ( -1.566 -11.145 3.682) 11.841 35.957 ( -1.227 -4.904 -8.435) 9.834 ======================= Grid point 260 (130/160) ======================= q-point: (-0.33 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( 5.222 9.603 -1.463) 11.028 2.492 ( 9.819 4.851 26.846) 28.994 2.918 ( -11.657 3.438 -1.612) 12.260 3.548 ( 1.775 10.034 -6.211) 11.934 3.578 ( -1.984 6.144 2.905) 7.080 3.895 ( 1.554 10.472 -2.995) 11.002 4.206 ( -1.831 -13.701 -8.675) 16.319 4.343 ( -4.505 2.304 -2.178) 5.509 4.360 ( -1.952 9.724 2.110) 10.140 4.456 ( -0.439 6.683 4.132) 7.869 4.643 ( -1.147 -9.213 -3.499) 9.921 4.703 ( 0.613 2.954 -2.553) 3.952 4.894 ( -1.867 4.716 -8.047) 9.512 5.165 ( 0.383 0.002 -5.318) 5.332 5.276 ( 3.727 2.831 1.159) 4.822 5.566 ( 5.301 -3.622 4.707) 7.960 5.731 ( -8.887 0.943 -4.821) 10.154 5.980 ( 1.035 4.970 4.484) 6.773 6.268 ( 1.812 4.259 -3.673) 5.909 6.363 ( -8.471 7.770 1.345) 11.574 6.666 ( 0.505 8.206 0.337) 8.229 6.750 ( 8.798 5.671 2.183) 10.693 6.889 ( 2.626 9.578 -0.317) 9.937 7.096 ( 1.935 4.611 8.578) 9.929 7.190 ( -2.160 -0.904 9.710) 9.988 7.448 ( 0.206 0.283 2.329) 2.355 7.869 ( 6.254 -0.292 -5.868) 8.581 8.262 ( -3.369 1.495 -0.740) 3.759 8.437 ( 3.417 -0.164 -1.258) 3.645 8.561 ( -0.988 4.402 -0.475) 4.537 8.976 ( -6.604 7.958 -0.987) 10.388 9.201 ( 0.172 -5.533 -7.827) 9.587 9.395 ( 3.143 -0.920 -0.851) 3.384 9.585 ( -2.227 5.509 1.355) 6.095 9.721 ( -2.016 3.962 -2.214) 4.967 10.214 ( 1.825 -9.896 6.424) 11.938 10.535 ( -1.281 3.357 -2.012) 4.118 10.669 ( 2.531 6.464 -2.605) 7.415 10.790 ( -1.788 0.469 -0.417) 1.895 10.887 ( 0.592 0.009 -0.957) 1.125 11.189 ( 3.331 -6.933 1.052) 7.763 11.414 ( -0.741 0.280 -2.280) 2.413 12.538 ( -0.260 -5.981 -1.258) 6.117 12.829 ( 1.040 -8.981 5.971) 10.835 13.494 ( -1.666 3.636 1.957) 4.453 13.750 ( 5.812 -2.291 0.527) 6.269 14.519 ( -0.320 -1.478 1.228) 1.948 14.858 ( 0.704 -5.134 0.629) 5.220 15.565 ( -1.166 -3.922 1.280) 4.287 15.640 ( -1.535 1.592 -0.521) 2.272 15.848 ( 3.470 1.298 -1.170) 3.885 16.078 ( 3.114 -5.523 0.353) 6.350 16.233 ( -7.885 -6.731 -6.727) 12.358 16.545 ( 2.221 0.464 6.090) 6.499 17.647 ( 2.804 3.154 1.840) 4.604 17.821 ( 0.299 1.790 -2.124) 2.793 18.001 ( -2.633 5.683 -4.281) 7.587 18.243 ( -0.871 1.294 -1.162) 1.945 18.920 ( -3.500 2.051 2.469) 4.749 19.048 ( 7.503 3.465 -0.005) 8.265 19.439 ( -14.430 -1.406 -4.794) 15.271 20.336 ( 4.888 -3.224 6.149) 8.491 27.581 ( -2.440 -0.153 -2.291) 3.351 28.352 ( 4.414 -1.795 4.244) 6.381 29.274 ( 5.883 -1.103 -0.974) 6.064 29.420 ( -1.499 6.049 -0.729) 6.274 29.484 ( -4.520 -2.635 -0.518) 5.257 29.647 ( 0.069 -1.191 0.805) 1.439 29.830 ( 2.057 -1.379 -3.053) 3.931 29.882 ( -1.244 -7.785 3.719) 8.717 30.518 ( 0.714 0.419 2.192) 2.343 30.683 ( -0.289 -0.419 -1.972) 2.037 31.148 ( -0.082 0.120 -0.250) 0.289 31.797 ( -2.327 -2.136 2.989) 4.349 32.658 ( -0.261 -0.366 -2.185) 2.231 33.748 ( 3.156 15.089 2.426) 15.605 34.539 ( 4.154 3.865 5.679) 8.027 35.879 ( -3.845 2.518 -15.087) 15.772 ======================= Grid point 261 (131/160) ======================= q-point: (-0.22 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( 2.350 10.350 3.935) 11.319 2.651 ( -14.286 6.194 -3.720) 16.009 2.724 ( 12.068 10.671 31.098) 35.022 3.190 ( -1.556 18.128 -1.682) 18.273 3.495 ( -1.309 13.956 -1.532) 14.100 3.734 ( 8.755 11.375 3.518) 14.779 4.113 ( -1.605 15.029 -2.908) 15.391 4.151 ( 1.743 16.201 -0.226) 16.296 4.188 ( -9.059 10.678 -8.944) 16.616 4.375 ( -0.768 1.891 -8.277) 8.525 4.571 ( -4.843 18.525 -0.022) 19.148 4.669 ( -0.373 2.295 1.161) 2.599 4.769 ( -0.940 -4.695 -6.386) 7.982 5.031 ( -5.294 8.914 -6.965) 12.490 5.296 ( 9.276 3.470 0.204) 9.906 5.534 ( -3.423 8.414 -3.265) 9.652 5.736 ( 2.657 5.704 6.227) 8.853 5.979 ( 0.189 -7.142 -2.939) 7.726 6.078 ( -2.851 18.703 4.863) 19.534 6.149 ( 0.492 14.157 0.028) 14.165 6.423 ( 3.881 18.189 -0.854) 18.618 6.591 ( -4.132 13.172 0.451) 13.812 6.633 ( 3.382 12.622 -0.161) 13.068 7.110 ( 2.835 -2.598 3.087) 4.931 7.347 ( 3.958 -0.673 13.644) 14.223 7.432 ( -0.366 1.920 2.297) 3.017 7.832 ( 2.678 3.076 -10.232) 11.015 8.195 ( -2.940 3.000 0.750) 4.267 8.404 ( -2.770 8.591 -1.480) 9.148 8.476 ( 1.036 -3.176 -1.223) 3.558 8.878 ( -2.586 0.596 3.249) 4.195 9.175 ( -0.906 -0.400 -9.930) 9.980 9.326 ( 5.322 8.050 4.837) 10.794 9.551 ( -3.680 4.314 -1.968) 6.002 9.742 ( -0.078 -9.562 0.369) 9.569 10.265 ( -0.079 7.895 1.540) 8.044 10.448 ( 0.560 6.584 -2.318) 7.003 10.554 ( 2.921 12.308 5.960) 13.984 10.793 ( -0.647 -8.945 -5.766) 10.662 10.849 ( -1.620 5.327 -4.637) 7.245 11.314 ( 2.350 -5.285 0.093) 5.785 11.456 ( -0.774 -7.284 -0.100) 7.326 12.619 ( 1.800 -3.164 -0.514) 3.676 13.077 ( -2.127 -14.699 1.481) 14.926 13.425 ( -0.725 4.873 1.626) 5.188 13.848 ( 4.871 -2.857 0.805) 5.705 14.555 ( -0.383 -1.512 2.115) 2.628 15.054 ( 3.488 -13.299 2.770) 14.025 15.553 ( -3.701 0.603 1.258) 3.955 15.674 ( -1.219 -7.653 -4.655) 9.040 15.917 ( 4.802 -3.960 1.716) 6.456 16.187 ( 1.928 -6.548 -2.806) 7.380 16.314 ( -2.960 -9.837 0.287) 10.276 16.595 ( -2.371 -1.801 3.536) 4.622 17.613 ( -0.034 3.896 2.083) 4.418 17.777 ( 0.834 1.908 -3.213) 3.828 17.841 ( -2.728 5.111 -2.758) 6.417 18.191 ( 1.551 3.790 -1.819) 4.481 18.869 ( -3.836 3.500 4.343) 6.770 19.013 ( 5.567 4.809 -2.734) 7.848 19.379 ( -9.846 -6.366 -1.215) 11.787 20.478 ( 3.307 -4.099 5.613) 7.697 27.560 ( -1.827 -1.365 -1.928) 2.986 28.477 ( 4.719 -4.575 5.700) 8.700 29.313 ( -0.297 3.094 -1.908) 3.648 29.326 ( 4.761 0.511 -0.399) 4.805 29.518 ( -3.529 -4.859 1.127) 6.110 29.658 ( 0.459 -0.544 -1.228) 1.420 29.899 ( -0.206 -5.162 -0.193) 5.170 30.035 ( -1.038 -8.452 2.386) 8.843 30.556 ( 0.258 -2.509 3.748) 4.517 30.674 ( 1.052 -0.490 -2.348) 2.619 31.161 ( -0.432 -0.985 -0.020) 1.076 31.845 ( -2.498 -2.980 2.960) 4.887 32.565 ( 1.766 9.225 -2.795) 9.799 33.363 ( 1.758 32.399 -3.616) 32.648 34.483 ( 9.224 13.359 6.964) 17.664 35.575 ( -9.343 13.429 -17.172) 23.717 ======================= Grid point 262 (132/160) ======================= q-point: (-0.11 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( 4.791 4.428 8.735) 10.902 2.335 ( -6.446 9.640 -8.612) 14.444 2.754 ( 2.201 18.203 5.359) 19.103 3.008 ( 10.138 17.630 22.976) 30.683 3.182 ( -4.230 21.177 1.965) 21.685 3.562 ( -2.144 27.835 -13.339) 30.941 3.614 ( 0.207 30.280 2.352) 30.372 3.625 ( -0.461 33.971 0.240) 33.975 3.926 ( 1.102 17.695 1.151) 17.767 4.062 ( 3.945 31.356 9.565) 33.019 4.337 ( -6.149 -0.071 -4.451) 7.591 4.497 ( -10.500 19.810 -11.763) 25.319 4.643 ( 3.294 5.766 -2.810) 7.211 4.981 ( -1.603 -9.775 -3.859) 10.631 5.095 ( 5.512 24.216 -2.654) 24.977 5.309 ( -0.721 37.940 0.253) 37.947 5.429 ( -1.326 6.241 -2.692) 6.925 5.805 ( 2.166 -3.065 0.745) 3.827 6.062 ( 0.546 -1.039 -0.972) 1.524 6.183 ( 1.195 -7.822 5.197) 9.467 6.318 ( -0.991 1.002 0.721) 1.583 6.474 ( -3.996 -1.662 1.722) 4.658 6.537 ( 7.891 1.499 -3.775) 8.875 7.173 ( 1.955 0.354 1.280) 2.364 7.431 ( 0.353 -0.368 1.759) 1.831 7.472 ( 0.883 -2.297 7.607) 7.995 7.683 ( -1.035 4.970 -10.219) 11.410 8.121 ( -1.949 4.450 1.543) 5.097 8.250 ( 0.482 6.935 -1.665) 7.149 8.555 ( -1.632 -6.045 0.452) 6.277 8.907 ( -1.157 -1.707 3.462) 4.030 9.140 ( 0.707 -2.332 -3.699) 4.429 9.321 ( 5.396 2.028 4.284) 7.182 9.408 ( -4.929 4.041 -3.588) 7.314 9.865 ( 0.198 -1.931 0.409) 1.984 10.082 ( -0.518 11.995 -0.421) 12.013 10.242 ( 1.059 16.261 -1.105) 16.332 10.424 ( 3.501 12.041 3.337) 12.976 10.657 ( -2.635 6.562 -6.026) 9.291 10.898 ( -1.049 -5.131 -0.787) 5.296 11.429 ( 0.645 -6.604 0.453) 6.651 11.596 ( 0.081 -7.841 1.117) 7.920 12.662 ( 0.644 -0.840 0.124) 1.066 13.268 ( -5.950 -10.673 -0.068) 12.220 13.353 ( 3.332 4.194 -0.103) 5.357 13.907 ( 0.381 -1.229 -0.182) 1.299 14.588 ( -0.766 -1.070 1.992) 2.388 15.204 ( -0.878 -0.100 -1.769) 1.978 15.691 ( 2.601 -15.267 2.840) 15.746 15.779 ( -1.736 -10.253 -4.509) 11.335 16.019 ( 2.570 -3.181 0.616) 4.136 16.298 ( -1.656 -7.360 -0.855) 7.592 16.480 ( 4.595 -6.932 3.089) 8.872 16.591 ( -7.096 -0.684 -0.648) 7.159 17.551 ( -0.459 4.320 1.146) 4.493 17.711 ( 0.606 2.566 -1.545) 3.056 17.826 ( 0.814 -3.554 0.016) 3.646 18.119 ( 2.097 4.695 -2.269) 5.620 18.823 ( -2.016 2.259 4.541) 5.457 18.967 ( 4.536 2.770 -2.990) 6.098 19.486 ( -4.294 -13.101 2.169) 13.956 20.594 ( 1.157 -3.634 3.242) 5.005 27.572 ( 0.110 -2.376 -1.656) 2.899 28.671 ( 2.627 -10.889 4.387) 12.030 29.268 ( -0.603 0.426 -0.247) 0.779 29.350 ( 1.069 -0.741 -1.033) 1.661 29.596 ( 0.142 -4.055 2.098) 4.568 29.660 ( 0.105 -1.017 -2.548) 2.746 29.969 ( 0.067 -3.926 -0.036) 3.927 30.166 ( -0.341 -5.766 1.260) 5.912 30.623 ( -3.137 0.974 4.470) 5.547 30.705 ( 4.158 -3.965 -2.332) 6.200 31.125 ( 0.931 6.517 -0.350) 6.592 31.891 ( -2.064 -2.608 1.647) 3.711 32.362 ( -3.074 12.523 -1.112) 12.942 32.701 ( 4.049 39.195 -7.991) 40.206 34.370 ( 7.011 13.268 4.746) 15.738 35.079 ( -9.799 21.932 -8.201) 25.382 ======================= Grid point 265 (133/160) ======================= q-point: ( 0.22 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( 5.453 0.000 -16.516) 17.393 1.893 ( 18.766 0.000 -26.198) 32.226 2.103 ( 0.268 0.000 -1.003) 1.038 2.391 ( 6.388 0.000 -6.251) 8.937 2.680 ( -0.561 -0.000 6.618) 6.642 2.685 ( 11.271 0.000 -25.153) 27.563 3.033 ( 6.241 0.000 1.339) 6.383 3.136 ( 17.784 0.000 20.903) 27.444 3.215 ( -0.757 -0.000 1.920) 2.064 3.254 ( -9.300 -0.000 -9.522) 13.310 4.072 ( -15.960 -0.000 4.038) 16.463 4.254 ( -4.849 -0.000 -6.283) 7.937 4.450 ( -13.353 -0.000 18.815) 23.072 4.802 ( 1.451 0.000 -1.303) 1.950 4.869 ( 2.204 0.000 8.550) 8.829 5.469 ( 7.335 0.000 2.474) 7.741 5.633 ( -11.864 -0.000 -4.163) 12.574 5.729 ( -4.995 -0.000 4.886) 6.987 5.790 ( 12.692 0.000 7.148) 14.566 6.255 ( -2.546 -0.000 3.637) 4.439 6.287 ( 10.357 0.000 -13.956) 17.379 6.722 ( 7.743 0.000 2.873) 8.258 6.814 ( 1.402 0.000 -4.524) 4.736 6.982 ( -7.500 -0.000 -1.681) 7.686 7.299 ( -5.366 -0.000 3.562) 6.440 7.472 ( -5.038 -0.000 2.237) 5.512 7.702 ( 5.660 0.000 0.696) 5.702 8.164 ( 5.587 0.000 1.735) 5.850 8.252 ( 7.107 0.000 -0.057) 7.107 8.647 ( -10.750 -0.000 0.386) 10.757 8.695 ( -7.380 -0.000 0.166) 7.382 9.145 ( 5.345 0.000 -1.234) 5.486 9.555 ( -5.552 -0.000 3.825) 6.743 9.588 ( 8.341 0.000 -3.494) 9.044 9.628 ( -0.195 -0.000 1.164) 1.180 9.770 ( -1.540 -0.000 -0.969) 1.819 9.775 ( -2.749 -0.000 -5.241) 5.919 10.017 ( 3.444 0.000 1.297) 3.680 10.561 ( -2.527 -0.000 -0.266) 2.541 11.124 ( 4.680 0.000 4.270) 6.336 11.443 ( -4.823 -0.000 -4.249) 6.428 11.765 ( 2.589 0.000 -2.123) 3.348 12.560 ( -3.472 -0.000 1.745) 3.886 13.055 ( -10.263 -0.000 -7.127) 12.495 13.555 ( -1.555 -0.000 2.467) 2.916 13.856 ( -3.914 -0.000 2.530) 4.660 14.564 ( -2.149 -0.000 -1.987) 2.926 15.216 ( -4.734 -0.000 0.939) 4.826 15.863 ( 0.815 0.000 -8.374) 8.414 15.994 ( -0.376 -0.000 -0.860) 0.939 16.147 ( 1.247 0.000 3.770) 3.971 16.338 ( -7.515 -0.000 -3.175) 8.158 16.341 ( -6.437 -0.000 -1.296) 6.566 16.809 ( 5.414 0.000 -1.105) 5.526 17.524 ( 5.135 0.000 1.690) 5.406 17.892 ( 4.113 0.000 -0.268) 4.122 17.914 ( -0.839 -0.000 4.910) 4.981 18.142 ( 11.795 0.000 3.967) 12.444 18.721 ( -1.395 -0.000 4.372) 4.589 19.081 ( 11.298 0.000 0.760) 11.323 19.795 ( -8.791 -0.000 1.616) 8.939 20.521 ( -2.456 -0.000 -7.089) 7.502 27.678 ( 1.969 0.000 -0.086) 1.971 28.460 ( -11.497 -0.000 -13.620) 17.824 29.309 ( 1.083 0.000 1.881) 2.170 29.446 ( -3.288 -0.000 -0.947) 3.422 29.618 ( -1.689 -0.000 1.836) 2.494 29.659 ( -1.110 -0.000 0.153) 1.120 29.720 ( 0.571 0.000 -0.634) 0.853 30.364 ( 2.279 0.000 0.770) 2.405 30.421 ( 8.354 0.000 -0.373) 8.362 30.728 ( -0.100 -0.000 -10.355) 10.355 31.102 ( 6.714 0.000 -4.335) 7.992 31.990 ( -1.348 -0.000 0.147) 1.356 32.080 ( 1.183 0.000 -0.694) 1.371 32.409 ( 8.336 0.000 20.266) 21.914 33.057 ( -25.999 -0.000 -5.790) 26.636 35.550 ( 12.075 0.000 8.481) 14.756 ======================= Grid point 266 (134/160) ======================= q-point: ( 0.33 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 15.229 -17.614 -17.648) 29.217 1.958 ( 17.233 -13.496 -17.549) 28.055 2.529 ( 2.276 -42.219 -8.434) 43.113 2.683 ( 9.056 -19.264 -10.202) 23.604 2.863 ( -3.031 -18.100 -1.294) 18.398 2.950 ( 13.732 -47.357 -1.879) 49.344 3.114 ( -12.135 -1.507 -6.386) 13.795 3.338 ( 5.726 -16.849 10.964) 20.902 3.440 ( -0.596 -20.920 2.075) 21.031 3.533 ( 15.802 -21.390 7.719) 27.692 4.087 ( -14.203 -12.739 3.346) 19.370 4.364 ( -5.768 -24.361 -2.555) 25.164 4.502 ( -12.391 -3.752 16.504) 20.976 4.794 ( -3.832 -3.369 -3.448) 6.158 4.922 ( 0.433 1.044 5.170) 5.292 5.409 ( 2.815 7.131 -4.617) 8.950 5.562 ( -7.885 -2.927 -4.746) 9.657 5.660 ( -3.740 0.094 1.079) 3.894 6.018 ( 12.175 3.586 13.480) 18.514 6.259 ( 8.809 2.917 -0.049) 9.279 6.323 ( 3.213 -4.053 -1.118) 5.291 6.737 ( 8.053 4.640 -1.532) 9.419 6.757 ( 1.523 4.275 1.681) 4.840 6.888 ( -9.631 2.736 -0.310) 10.017 7.199 ( -6.760 7.227 -0.236) 9.899 7.449 ( -1.670 2.591 5.840) 6.604 7.779 ( 4.236 -1.316 -0.983) 4.543 8.179 ( -0.616 -0.974 -2.928) 3.146 8.383 ( 6.484 -6.629 1.499) 9.393 8.539 ( -7.079 2.372 0.771) 7.506 8.683 ( -3.432 -1.563 3.052) 4.851 9.093 ( 4.070 5.117 -1.260) 6.659 9.465 ( 1.261 5.559 1.251) 5.836 9.526 ( 0.352 2.547 -5.378) 5.961 9.755 ( -6.849 -7.951 -7.451) 12.870 9.897 ( 6.327 -18.251 -1.402) 19.367 9.993 ( -1.382 -17.704 8.969) 19.894 10.096 ( 2.780 -5.161 1.704) 6.105 10.586 ( -3.469 -5.217 1.984) 6.572 11.151 ( 2.749 3.298 2.142) 4.798 11.338 ( -4.152 4.060 -3.615) 6.840 11.730 ( 2.473 4.766 -2.214) 5.808 12.558 ( -2.404 -0.516 3.015) 3.891 12.904 ( -13.495 -2.105 -13.273) 19.045 13.565 ( -1.180 -0.709 2.093) 2.506 13.802 ( -1.604 4.988 1.520) 5.455 14.528 ( -2.150 0.139 -2.530) 3.323 15.132 ( -4.912 2.742 -5.364) 7.773 15.776 ( 2.245 3.966 -6.513) 7.949 15.961 ( -0.526 3.160 -1.511) 3.542 16.108 ( 0.933 7.787 3.901) 8.760 16.222 ( -5.474 5.439 -0.956) 7.775 16.314 ( -3.128 -2.238 -2.299) 4.481 16.798 ( 3.513 4.564 -1.857) 6.052 17.629 ( 6.354 -4.252 2.409) 8.016 17.843 ( 0.674 4.009 -1.143) 4.223 18.006 ( 1.933 -2.243 8.173) 8.693 18.216 ( 6.658 2.533 0.903) 7.181 18.790 ( 3.868 -2.777 4.630) 6.641 19.161 ( 9.161 4.218 5.876) 11.673 19.689 ( -10.510 2.432 0.120) 10.788 20.428 ( -0.646 4.201 -4.560) 6.234 27.677 ( 1.648 0.870 -1.965) 2.708 28.319 ( -2.398 0.879 -6.277) 6.777 29.277 ( -0.963 7.652 -0.574) 7.734 29.341 ( 1.351 -0.250 4.211) 4.430 29.586 ( -0.843 3.144 0.321) 3.270 29.694 ( -0.062 -0.356 1.024) 1.085 29.947 ( -3.043 -15.867 1.130) 16.196 30.368 ( 2.397 3.186 -2.488) 4.700 30.487 ( 1.990 -3.013 0.129) 3.613 30.626 ( 2.076 2.995 -7.780) 8.591 31.127 ( 5.739 -2.947 -3.616) 7.396 31.890 ( -8.545 5.317 1.058) 10.120 32.013 ( 0.303 5.943 0.725) 5.995 32.831 ( 7.630 -22.895 17.207) 29.639 33.124 ( -13.830 -26.446 -1.554) 29.885 35.657 ( 1.006 -3.096 -0.397) 3.279 ======================= Grid point 267 (135/160) ======================= q-point: ( 0.44 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( 21.048 -2.539 -13.571) 25.172 2.209 ( 19.566 -8.421 -6.375) 22.235 2.940 ( 0.820 -12.588 -0.597) 12.629 3.016 ( -12.335 -5.815 -4.040) 14.222 3.231 ( 3.407 -32.523 -6.105) 33.266 3.323 ( 4.173 -33.783 -3.559) 34.225 3.645 ( 4.713 -13.631 8.756) 16.873 3.731 ( -1.345 -13.273 5.620) 14.476 4.023 ( 8.226 -50.144 -1.018) 50.824 4.200 ( 1.532 -23.739 0.799) 23.802 4.257 ( -6.608 -25.885 3.933) 27.003 4.630 ( -13.388 -13.034 6.175) 19.679 4.714 ( -4.057 -6.711 2.309) 8.174 4.915 ( 0.620 -1.923 -1.309) 2.407 5.039 ( -5.254 -39.747 -2.370) 40.162 5.325 ( 8.289 3.188 -5.656) 10.530 5.531 ( -8.533 -7.286 -2.211) 11.437 5.716 ( -0.248 -8.040 2.620) 8.460 6.031 ( 4.795 5.671 0.520) 7.445 6.266 ( 8.372 4.165 1.608) 9.488 6.458 ( 2.824 -6.052 3.643) 7.608 6.700 ( -1.284 3.021 -2.453) 4.098 6.711 ( -9.421 8.546 4.289) 13.423 6.798 ( 9.329 -2.098 4.273) 10.473 7.063 ( -1.444 3.366 3.410) 5.004 7.395 ( -6.558 5.024 4.810) 9.560 7.777 ( 5.369 -0.178 -8.578) 10.121 8.183 ( -2.600 -2.200 0.022) 3.406 8.484 ( 0.442 0.763 0.942) 1.290 8.518 ( -0.395 -2.412 2.707) 3.647 8.775 ( 1.633 -8.475 1.511) 8.762 9.102 ( 3.821 -2.611 -0.027) 4.628 9.368 ( 1.819 7.667 -3.738) 8.721 9.495 ( -1.366 -5.045 -4.306) 6.772 9.774 ( -7.433 -5.716 -4.837) 10.550 10.153 ( 3.930 -4.856 -4.862) 7.916 10.223 ( 2.622 -8.388 5.056) 10.139 10.429 ( 4.325 -19.183 10.639) 22.358 10.693 ( -7.121 -8.245 5.904) 12.391 11.091 ( -2.360 3.139 -1.355) 4.154 11.225 ( -0.310 5.715 0.865) 5.788 11.618 ( 1.582 8.143 -2.027) 8.539 12.573 ( -4.312 -0.617 3.287) 5.456 12.726 ( -9.302 -1.495 -15.893) 18.475 13.584 ( -0.816 -0.272 2.127) 2.294 13.723 ( 2.984 4.946 0.933) 5.852 14.494 ( -1.677 -0.113 -2.315) 2.861 14.993 ( -2.173 4.811 -6.268) 8.195 15.708 ( 3.291 2.482 -3.372) 5.326 15.846 ( -1.685 7.792 -1.051) 8.041 15.979 ( -0.212 10.306 2.726) 10.662 16.090 ( -3.146 4.435 0.171) 5.440 16.305 ( -1.034 -0.455 -3.886) 4.047 16.704 ( 2.272 7.073 -1.263) 7.536 17.738 ( 7.009 2.241 2.007) 7.628 17.828 ( 2.942 -2.991 0.455) 4.220 18.111 ( -0.781 -1.939 7.900) 8.172 18.192 ( 1.493 2.470 -2.373) 3.737 18.918 ( 7.096 -3.657 1.598) 8.141 19.160 ( 4.731 7.743 7.384) 11.699 19.568 ( -13.151 -0.117 -2.258) 13.344 20.328 ( 1.584 4.808 -1.389) 5.250 27.650 ( 0.766 1.339 -2.943) 3.323 28.285 ( 1.696 0.311 -1.146) 2.071 29.197 ( -0.015 1.448 -0.678) 1.599 29.403 ( 1.681 -1.214 5.792) 6.152 29.528 ( -0.735 2.208 -1.498) 2.767 29.700 ( -0.458 0.861 2.637) 2.812 30.011 ( -1.004 5.567 -0.668) 5.696 30.233 ( 0.713 9.629 -6.018) 11.377 30.484 ( 0.554 0.876 -2.128) 2.367 30.645 ( 1.039 -2.865 0.650) 3.116 31.264 ( 6.741 -5.374 -1.714) 8.789 31.795 ( -13.440 -3.851 2.122) 14.141 31.963 ( -2.571 -4.249 0.426) 4.984 33.435 ( 10.614 -18.370 20.456) 29.471 33.553 ( -8.848 -36.679 -1.761) 37.772 35.689 ( -5.818 -7.867 -9.147) 13.394 ======================= Grid point 268 (136/160) ======================= q-point: ( 0.56 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.981 ( 14.300 1.675 -11.051) 18.150 2.515 ( 22.195 -3.910 13.914) 26.486 2.931 ( -10.552 -1.809 -0.252) 10.709 3.225 ( 3.230 -16.458 -2.956) 17.030 3.652 ( 0.374 -19.407 -1.858) 19.500 3.751 ( 1.165 -12.774 -1.783) 12.951 3.891 ( -3.859 -13.824 7.015) 15.975 4.033 ( -1.111 -21.291 -1.274) 21.358 4.174 ( -8.501 5.772 0.551) 10.290 4.542 ( 0.104 -4.688 -4.214) 6.304 4.617 ( -12.320 -5.780 -1.748) 13.720 4.672 ( 1.760 -4.963 -2.856) 5.991 4.922 ( 1.882 -12.925 1.989) 13.212 5.120 ( 2.851 -11.066 -1.362) 11.508 5.330 ( 7.552 -3.434 -2.863) 8.776 5.453 ( -4.526 -10.647 -3.265) 12.021 5.731 ( 3.471 -14.163 2.546) 14.803 5.928 ( -5.167 -7.658 3.295) 9.808 6.035 ( 8.070 -10.588 -5.116) 14.262 6.397 ( 2.743 -9.134 5.029) 10.782 6.501 ( -11.377 0.591 -1.460) 11.486 6.595 ( 0.847 -6.884 1.640) 7.128 6.725 ( 1.846 -7.682 1.160) 7.985 7.001 ( 3.577 -6.888 8.421) 11.452 7.112 ( 2.349 -2.592 6.655) 7.518 7.301 ( -7.131 -0.748 4.350) 8.387 7.800 ( 8.817 -3.331 -9.661) 13.497 8.201 ( -1.504 -1.891 0.025) 2.417 8.481 ( 0.053 1.162 1.465) 1.870 8.577 ( 1.636 -3.258 1.018) 3.785 8.933 ( 0.438 -7.978 -3.069) 8.559 9.164 ( -5.157 3.309 0.852) 6.186 9.251 ( 4.439 -3.015 -6.620) 8.522 9.617 ( 1.385 -11.192 -3.334) 11.760 9.752 ( -5.778 -2.367 -0.042) 6.244 10.067 ( -0.648 10.301 -4.738) 11.357 10.448 ( 3.509 -10.776 4.980) 12.379 10.722 ( 3.473 0.122 7.648) 8.400 10.800 ( -3.203 -5.834 0.005) 6.655 11.048 ( -6.918 -0.330 3.647) 7.827 11.147 ( 3.525 5.276 3.752) 7.372 11.489 ( 0.750 5.443 -1.360) 5.661 12.479 ( -7.646 0.951 -8.030) 11.128 12.685 ( 1.664 -2.872 -0.931) 3.447 13.581 ( -0.689 1.564 1.788) 2.473 13.713 ( 4.818 1.176 0.946) 5.049 14.478 ( -0.809 -0.849 -1.102) 1.609 14.866 ( -0.886 3.872 -4.278) 5.838 15.607 ( -1.116 7.671 -2.630) 8.186 15.787 ( 0.909 -2.104 1.992) 3.037 15.838 ( -0.151 7.872 2.200) 8.175 16.015 ( -2.204 2.438 -0.266) 3.298 16.231 ( -0.683 3.497 -8.189) 8.931 16.619 ( 1.783 4.349 1.789) 5.029 17.748 ( 6.520 3.024 0.667) 7.218 17.904 ( 2.452 0.487 1.871) 3.122 18.108 ( -1.083 2.374 -0.364) 2.635 18.202 ( -2.131 -2.978 1.366) 3.909 19.004 ( 4.628 0.993 -2.409) 5.311 19.130 ( 5.219 4.822 8.220) 10.865 19.435 ( -15.348 -0.102 -4.036) 15.870 20.293 ( 2.852 1.246 1.491) 3.451 27.603 ( -0.759 1.461 -3.178) 3.579 28.309 ( 3.064 -0.740 1.145) 3.353 29.204 ( 1.766 -1.782 -0.731) 2.614 29.477 ( -2.814 1.035 0.443) 3.031 29.489 ( 2.563 -1.846 3.686) 4.854 29.701 ( -0.470 0.737 2.197) 2.364 29.836 ( -1.701 10.398 -0.963) 10.580 30.020 ( 0.714 9.821 -6.165) 11.618 30.492 ( 1.681 -1.248 0.143) 2.098 30.671 ( -0.961 -0.207 -0.036) 0.984 31.282 ( 3.901 5.598 -0.999) 6.896 31.769 ( -4.836 -0.267 1.598) 5.100 32.197 ( -6.535 -23.066 0.667) 23.983 33.825 ( 3.714 -9.496 11.454) 15.335 34.131 ( 2.511 -27.625 7.426) 28.716 35.708 ( -7.699 -10.593 -14.182) 19.304 ======================= Grid point 269 (137/160) ======================= q-point: ( 0.67 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 8.799 5.517 -6.868) 12.451 2.789 ( -0.207 3.362 14.897) 15.273 2.934 ( 10.484 -0.875 11.652) 15.699 3.497 ( 4.613 -12.248 -1.031) 13.129 3.739 ( -2.317 6.270 -0.339) 6.693 3.907 ( -4.728 -4.462 -7.554) 9.966 3.986 ( -4.260 -3.870 2.509) 6.278 4.145 ( -4.679 -11.738 1.538) 12.729 4.352 ( -4.954 -12.015 -6.743) 14.641 4.417 ( -4.058 -5.186 -9.152) 11.274 4.577 ( -2.149 6.182 3.145) 7.262 4.720 ( 2.118 0.153 -1.479) 2.588 4.942 ( -1.764 5.790 -8.307) 10.279 5.149 ( 3.043 -0.258 -4.394) 5.351 5.405 ( 4.062 5.107 2.469) 6.977 5.513 ( -1.293 -5.007 -0.536) 5.198 5.750 ( 1.222 8.913 0.482) 9.009 6.061 ( 0.749 -2.421 7.281) 7.710 6.245 ( 2.902 -6.293 -2.130) 7.250 6.383 ( -4.588 -1.445 -0.607) 4.848 6.698 ( 0.297 -2.637 0.015) 2.654 6.758 ( 3.119 -16.549 2.653) 17.048 6.920 ( 3.287 -5.924 0.769) 6.818 7.104 ( -8.573 -4.756 -0.166) 9.805 7.236 ( 2.940 -3.224 8.232) 9.317 7.450 ( 1.031 -6.762 13.557) 15.184 7.855 ( 8.074 -1.968 -9.189) 12.389 8.226 ( -1.529 -2.028 0.215) 2.549 8.466 ( 0.469 1.333 0.408) 1.471 8.640 ( 3.943 1.267 0.035) 4.141 8.986 ( -7.099 -0.734 -4.141) 8.251 9.012 ( -3.709 -1.617 -8.295) 9.229 9.331 ( 3.021 -3.297 -3.123) 5.455 9.685 ( -1.057 -3.195 -0.712) 3.440 9.786 ( -1.181 12.128 -0.122) 12.186 9.987 ( 0.069 -17.357 1.071) 17.390 10.615 ( 0.244 6.303 2.214) 6.685 10.722 ( 2.745 -1.833 -0.291) 3.314 10.772 ( -1.935 1.778 1.249) 2.910 10.972 ( -3.119 3.150 -0.442) 4.455 11.186 ( 3.990 1.902 8.060) 9.193 11.426 ( 0.311 2.924 -2.886) 4.120 12.421 ( -2.422 -4.749 -3.229) 6.233 12.764 ( 1.497 -4.246 2.200) 5.011 13.553 ( -0.349 2.537 1.489) 2.962 13.757 ( 3.810 -1.431 0.614) 4.116 14.495 ( -0.211 -1.752 0.632) 1.874 14.803 ( -0.614 -0.531 -2.299) 2.438 15.514 ( -0.738 0.153 -0.701) 1.030 15.742 ( -0.033 6.933 4.771) 8.416 15.866 ( 0.065 -2.918 1.139) 3.133 15.983 ( -0.982 -3.264 -2.202) 4.058 16.093 ( -1.098 2.614 -9.057) 9.490 16.606 ( 0.854 1.287 3.107) 3.470 17.743 ( 3.008 3.626 1.572) 4.967 17.863 ( 0.223 4.210 -1.168) 4.374 18.055 ( -0.157 3.962 -1.712) 4.319 18.230 ( -0.840 -1.334 0.103) 1.580 18.960 ( -1.076 3.052 2.074) 3.844 19.171 ( 9.016 3.439 -1.952) 9.845 19.283 ( -14.388 0.008 -0.298) 14.391 20.348 ( 2.535 -2.863 2.945) 4.827 27.552 ( -1.472 0.887 -2.511) 3.043 28.371 ( 3.029 -2.238 2.102) 4.313 29.269 ( 3.851 -3.798 -0.823) 5.471 29.423 ( -3.798 1.271 -1.023) 4.134 29.542 ( 0.853 6.190 3.877) 7.354 29.642 ( 0.069 1.176 -0.121) 1.185 29.762 ( -3.427 -3.001 0.647) 4.601 29.872 ( 2.847 3.777 -3.524) 5.898 30.538 ( 1.852 -1.126 1.692) 2.750 30.652 ( -1.757 -0.113 -1.763) 2.492 31.194 ( 0.965 5.109 -0.620) 5.236 31.767 ( -2.582 -1.366 2.271) 3.700 32.499 ( -2.577 -15.059 -0.589) 15.289 33.975 ( 2.196 3.152 7.164) 8.129 34.556 ( 6.134 -11.494 7.827) 15.199 35.694 ( -6.824 -6.520 -15.369) 18.036 ======================= Grid point 270 (138/160) ======================= q-point: (-0.22 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( 5.470 8.271 -4.053) 10.712 2.683 ( -6.056 8.501 2.324) 10.693 3.153 ( 11.289 6.188 18.138) 22.243 3.531 ( 2.243 15.947 10.784) 19.381 3.608 ( 0.125 1.590 -0.684) 1.735 3.920 ( 0.913 -1.766 -9.846) 10.045 4.014 ( -1.968 2.524 -5.094) 6.016 4.076 ( -12.283 -2.736 -8.774) 15.341 4.370 ( -1.003 7.907 0.952) 8.027 4.466 ( -1.195 -7.221 1.761) 7.528 4.584 ( -0.928 -6.225 -1.250) 6.416 4.646 ( -1.889 9.099 -4.000) 10.118 4.765 ( 1.000 6.511 -2.877) 7.188 5.136 ( 3.457 3.083 -3.260) 5.664 5.318 ( 0.567 3.819 -0.688) 3.922 5.618 ( -1.779 -4.947 0.592) 5.290 5.674 ( 1.514 -2.635 0.379) 3.062 6.079 ( 4.919 7.470 2.369) 9.252 6.281 ( -1.735 4.491 1.219) 4.966 6.298 ( -0.163 7.455 -0.215) 7.460 6.667 ( -0.259 5.970 0.038) 5.976 6.885 ( 2.407 18.024 0.759) 18.200 6.927 ( 1.005 8.876 0.536) 8.948 7.038 ( -2.798 -5.627 0.109) 6.285 7.366 ( 0.756 -4.016 2.999) 5.069 7.583 ( -2.567 3.243 14.433) 15.014 7.834 ( 5.029 2.782 -11.011) 12.420 8.223 ( -2.477 1.498 2.117) 3.586 8.457 ( 1.225 0.703 -1.331) 1.941 8.549 ( 1.284 9.500 -0.588) 9.605 8.887 ( -2.442 1.625 1.041) 3.112 9.027 ( -2.388 -6.499 -8.794) 11.192 9.425 ( 1.714 -8.240 -1.226) 8.505 9.566 ( -3.567 9.699 3.677) 10.969 9.726 ( 4.627 2.705 -2.974) 6.130 10.291 ( -0.460 -11.756 3.069) 12.159 10.493 ( -0.653 4.179 -1.288) 4.422 10.606 ( -0.283 1.969 -3.372) 3.915 10.847 ( 0.419 9.894 3.495) 10.502 10.888 ( 0.135 0.254 0.043) 0.291 11.260 ( 2.721 -2.606 1.319) 3.992 11.352 ( -1.554 -1.176 -2.923) 3.513 12.522 ( -1.131 -8.045 0.149) 8.126 12.889 ( 0.092 -8.240 2.012) 8.482 13.510 ( 0.655 3.795 0.756) 3.925 13.822 ( 1.033 -3.216 0.047) 3.378 14.535 ( -0.397 -2.045 1.397) 2.509 14.871 ( 0.519 -9.500 -0.314) 9.520 15.544 ( -1.267 -3.349 -0.127) 3.583 15.639 ( -0.401 7.746 2.027) 8.016 15.920 ( 5.301 -1.753 0.935) 5.661 16.014 ( -6.548 -7.160 -5.781) 11.294 16.127 ( 2.102 -9.693 -0.304) 9.923 16.611 ( -0.919 0.970 2.658) 2.975 17.685 ( -4.736 3.895 3.073) 6.859 17.806 ( 5.673 2.843 -4.023) 7.513 17.934 ( -0.392 7.845 -1.294) 7.960 18.233 ( 1.164 1.133 -1.002) 1.909 18.939 ( -1.654 2.461 6.363) 7.020 19.071 ( -2.830 3.265 -7.109) 8.319 19.266 ( 0.928 -0.940 1.841) 2.266 20.449 ( 0.858 -4.623 2.289) 5.229 27.523 ( -0.669 -0.300 -1.148) 1.362 28.457 ( 1.509 -3.916 1.615) 4.496 29.360 ( -4.795 -0.016 -1.228) 4.950 29.365 ( 6.133 0.679 -1.279) 6.302 29.427 ( -1.143 2.028 1.534) 2.788 29.668 ( -0.021 0.895 1.640) 1.868 29.800 ( -0.521 -5.832 -1.917) 6.161 29.917 ( 1.106 -6.219 0.736) 6.360 30.566 ( 0.746 0.605 2.354) 2.543 30.639 ( -0.869 -1.597 -2.301) 2.932 31.146 ( 0.370 0.517 -0.383) 0.742 31.800 ( -2.476 -2.550 2.822) 4.538 32.621 ( -0.837 -1.481 -0.737) 1.853 33.831 ( 1.256 19.998 1.799) 20.118 34.715 ( 4.418 2.742 4.025) 6.576 35.578 ( -3.452 4.248 -10.497) 11.839 ======================= Grid point 271 (139/160) ======================= q-point: (-0.11 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( 7.057 5.715 -5.530) 10.632 2.516 ( 4.771 12.926 6.726) 15.332 3.039 ( -0.719 13.988 -2.288) 14.192 3.412 ( -2.089 15.191 -4.438) 15.964 3.500 ( -2.358 9.396 -1.862) 9.865 3.693 ( 3.355 9.364 5.585) 11.408 3.857 ( -1.787 10.278 -0.212) 10.435 4.139 ( -3.569 13.060 2.857) 13.837 4.196 ( -0.730 0.907 6.963) 7.060 4.256 ( 0.564 20.280 -6.752) 21.382 4.548 ( 1.006 16.267 1.587) 16.376 4.627 ( -7.464 -0.576 3.921) 8.451 4.753 ( 4.221 -9.585 -2.175) 10.696 4.990 ( 7.258 18.633 -1.535) 20.056 5.317 ( -5.010 -1.736 -3.410) 6.304 5.510 ( 5.011 14.695 0.214) 15.527 5.846 ( 0.150 14.000 -4.294) 14.644 5.916 ( 2.246 -10.726 3.894) 11.630 6.106 ( -1.592 9.781 0.945) 9.954 6.172 ( 3.805 19.256 -1.997) 19.730 6.417 ( -2.580 18.765 -0.322) 18.944 6.578 ( 0.427 7.751 1.464) 7.899 6.672 ( -0.998 16.144 -2.457) 16.360 7.134 ( -2.240 -4.259 0.019) 4.812 7.409 ( -1.134 -0.678 0.428) 1.388 7.566 ( -0.682 3.983 6.044) 7.270 7.701 ( -0.496 5.088 -7.170) 8.805 8.184 ( -0.939 3.029 2.035) 3.768 8.388 ( 2.016 8.006 0.442) 8.268 8.480 ( 1.326 -1.690 -1.401) 2.564 8.893 ( -0.706 -0.990 2.279) 2.583 9.063 ( -0.607 -3.345 -0.599) 3.452 9.411 ( -4.158 6.754 -3.031) 8.491 9.499 ( 4.315 4.663 2.592) 6.862 9.761 ( 2.978 -8.299 -1.451) 8.936 10.277 ( -0.004 9.597 0.391) 9.605 10.418 ( 0.505 6.241 -1.621) 6.468 10.651 ( -2.555 9.183 0.882) 9.573 10.738 ( -1.559 -4.884 -0.284) 5.135 10.783 ( 2.200 5.655 0.100) 6.069 11.325 ( -0.987 -5.135 -0.682) 5.274 11.453 ( 0.702 -9.173 0.112) 9.201 12.616 ( -2.540 -4.019 -0.018) 4.755 13.066 ( -0.554 -10.925 2.172) 11.153 13.448 ( 2.140 4.629 -0.739) 5.153 13.863 ( -2.992 -2.572 -0.779) 4.021 14.569 ( -0.942 -1.615 0.955) 2.099 15.088 ( -1.168 -13.000 -1.084) 13.097 15.543 ( -0.245 -0.864 2.538) 2.692 15.635 ( 2.189 -5.704 -1.055) 6.200 15.967 ( -0.140 -3.574 -3.543) 5.034 16.132 ( -1.909 -9.442 1.935) 9.826 16.330 ( 1.625 -11.293 -0.602) 11.425 16.600 ( -0.965 0.896 2.778) 3.074 17.610 ( -3.625 2.778 1.740) 4.887 17.772 ( 2.608 3.937 -1.680) 5.013 17.830 ( 4.188 3.201 -1.144) 5.393 18.187 ( 0.461 3.973 -1.649) 4.327 18.888 ( -4.379 4.901 3.793) 7.588 19.006 ( 2.879 0.466 -3.648) 4.671 19.341 ( 3.111 -5.108 2.868) 6.633 20.534 ( -1.517 -4.582 -0.159) 4.829 27.537 ( 1.110 -1.582 0.103) 1.936 28.544 ( -1.662 -6.123 -0.981) 6.420 29.292 ( -1.337 2.358 0.039) 2.711 29.330 ( -2.412 1.222 -0.697) 2.792 29.528 ( 3.548 -5.861 0.650) 6.882 29.649 ( -0.496 0.942 -0.517) 1.183 29.899 ( 0.910 -5.900 -0.287) 5.976 30.055 ( 1.107 -8.049 0.295) 8.130 30.591 ( -1.163 -2.502 1.647) 3.213 30.651 ( -0.115 -1.844 -1.568) 2.423 31.166 ( 1.539 -1.296 -0.519) 2.078 31.846 ( -2.436 -2.809 2.871) 4.698 32.527 ( -4.240 10.197 1.013) 11.090 33.359 ( 2.786 35.778 -3.087) 36.019 34.586 ( -6.108 12.502 -3.396) 14.323 35.383 ( 6.584 14.878 2.385) 16.444 ======================= Grid point 275 (140/160) ======================= q-point: ( 0.33 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 9.370 0.000 -9.498) 13.342 2.006 ( 31.453 0.000 -7.529) 32.341 2.022 ( 2.032 0.000 -10.810) 11.000 2.483 ( 6.087 0.000 0.215) 6.091 2.618 ( 21.559 0.000 -21.260) 30.279 2.711 ( 0.815 0.000 1.104) 1.372 2.976 ( -11.554 -0.000 -2.925) 11.919 3.056 ( -5.188 -0.000 0.579) 5.220 3.254 ( 1.350 0.000 0.357) 1.397 3.734 ( 16.454 0.000 15.699) 22.742 3.897 ( -8.708 -0.000 1.695) 8.871 4.083 ( -7.768 -0.000 -3.273) 8.429 4.491 ( -12.870 -0.000 13.888) 18.935 4.689 ( -8.779 -0.000 -3.199) 9.344 4.986 ( 0.983 0.000 4.389) 4.498 5.387 ( -1.572 -0.000 -11.349) 11.458 5.478 ( -4.806 -0.000 2.102) 5.246 5.691 ( 1.558 0.000 3.723) 4.035 6.212 ( -5.847 -0.000 -0.187) 5.850 6.253 ( 8.887 0.000 2.374) 9.198 6.425 ( 12.105 0.000 9.368) 15.307 6.769 ( 2.942 0.000 -5.691) 6.407 6.807 ( -9.734 -0.000 0.109) 9.735 6.859 ( 3.890 0.000 2.483) 4.615 7.269 ( -3.043 -0.000 6.133) 6.847 7.560 ( 2.964 0.000 10.217) 10.639 7.805 ( 4.910 0.000 1.051) 5.021 8.099 ( -5.945 -0.000 -8.466) 10.345 8.361 ( 6.393 0.000 -0.409) 6.406 8.502 ( -4.797 -0.000 0.213) 4.802 8.726 ( -0.711 -0.000 9.204) 9.232 9.192 ( 3.421 0.000 -2.411) 4.185 9.469 ( -7.455 -0.000 0.852) 7.503 9.502 ( -5.144 -0.000 -10.975) 12.120 9.685 ( 2.462 0.000 3.467) 4.252 9.764 ( -0.521 -0.000 1.544) 1.630 9.765 ( 8.574 0.000 -1.924) 8.787 10.105 ( 3.126 0.000 2.836) 4.221 10.532 ( -1.025 -0.000 1.007) 1.437 11.169 ( -3.787 -0.000 -4.370) 5.783 11.349 ( 0.992 0.000 0.815) 1.284 11.776 ( 2.441 0.000 -2.114) 3.229 12.555 ( -3.637 -0.000 2.710) 4.536 12.664 ( -10.070 -0.000 -18.280) 20.870 13.566 ( -0.138 -0.000 1.939) 1.944 13.839 ( -1.999 -0.000 1.305) 2.387 14.491 ( -1.971 -0.000 -3.105) 3.678 15.069 ( -3.554 -0.000 -7.463) 8.266 15.768 ( 1.801 0.000 -7.051) 7.278 15.987 ( 0.273 0.000 -0.030) 0.275 16.211 ( -1.734 -0.000 1.155) 2.084 16.242 ( -2.037 -0.000 1.383) 2.462 16.253 ( -0.665 -0.000 -0.215) 0.699 16.857 ( 3.303 0.000 -1.965) 3.844 17.653 ( 6.526 0.000 1.982) 6.821 17.887 ( 1.340 0.000 0.517) 1.437 18.056 ( 0.954 0.000 7.512) 7.573 18.275 ( 0.845 0.000 0.396) 0.933 18.840 ( 7.978 0.000 2.190) 8.273 19.328 ( 6.281 0.000 6.837) 9.284 19.601 ( -16.636 -0.000 3.729) 17.049 20.449 ( 1.016 0.000 -2.139) 2.368 27.681 ( 2.551 0.000 -3.068) 3.990 28.295 ( 1.418 0.000 -1.531) 2.087 29.342 ( -2.759 -0.000 0.473) 2.799 29.477 ( 4.833 0.000 9.628) 10.773 29.640 ( -0.580 -0.000 3.118) 3.171 29.648 ( -0.732 -0.000 0.371) 0.821 29.714 ( 0.236 0.000 -0.986) 1.014 30.350 ( -2.078 -0.000 -3.681) 4.227 30.518 ( 5.138 0.000 -1.335) 5.309 30.624 ( 3.954 0.000 -6.317) 7.452 31.133 ( 5.374 0.000 -4.534) 7.032 31.975 ( -0.892 -0.000 0.247) 0.926 32.083 ( 0.700 0.000 -0.979) 1.203 32.481 ( -14.747 -0.000 -6.834) 16.254 33.025 ( 6.230 0.000 26.952) 27.663 35.561 ( -7.684 -0.000 -11.855) 14.127 ======================= Grid point 276 (141/160) ======================= q-point: ( 0.44 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 11.491 -24.153 -11.256) 29.019 2.308 ( 32.581 -5.774 4.377) 33.377 2.444 ( 3.590 -44.500 -8.477) 45.442 2.728 ( 10.783 -20.016 -7.516) 23.946 2.764 ( -6.443 -17.710 -0.831) 18.864 2.890 ( -9.023 -1.463 2.310) 9.428 3.167 ( 13.906 -47.681 -0.555) 49.670 3.331 ( -3.713 -22.530 -3.411) 23.087 3.465 ( -1.716 -32.168 1.353) 32.242 3.877 ( -1.197 -2.733 6.046) 6.742 4.008 ( 3.752 -9.773 1.510) 10.577 4.207 ( -8.014 -25.018 -2.679) 26.406 4.488 ( -12.048 -5.935 6.099) 14.751 4.640 ( -7.113 -2.495 2.896) 8.075 4.985 ( 0.252 1.819 1.588) 2.428 5.298 ( -0.643 0.861 -10.641) 10.695 5.494 ( 1.088 -0.379 4.236) 4.389 5.685 ( -0.434 2.045 1.509) 2.578 6.131 ( -2.206 2.616 0.141) 3.424 6.302 ( -3.724 -1.372 -3.154) 5.069 6.536 ( 9.334 3.757 8.185) 12.971 6.727 ( -4.725 3.815 0.701) 6.113 6.779 ( 0.511 -2.484 -0.469) 2.579 6.854 ( 3.684 5.327 0.190) 6.479 7.257 ( 4.917 6.712 10.051) 13.048 7.522 ( -6.959 11.275 7.263) 15.110 7.797 ( 7.279 3.205 -5.872) 9.887 8.100 ( -2.543 -6.942 0.662) 7.423 8.456 ( 1.737 -3.874 -0.553) 4.281 8.480 ( -1.687 -2.066 -0.494) 2.713 8.763 ( 0.609 1.159 7.175) 7.294 9.128 ( 3.921 3.555 -2.825) 5.999 9.358 ( -4.089 -1.471 -9.446) 10.398 9.524 ( 0.918 6.169 0.387) 6.249 9.560 ( -4.500 -3.697 -4.033) 7.084 9.965 ( 1.291 -17.719 3.125) 18.039 10.147 ( 4.755 -17.903 2.568) 18.700 10.181 ( 2.396 -9.899 7.549) 12.677 10.576 ( -1.385 -3.885 3.597) 5.473 11.058 ( -6.524 2.126 -7.178) 9.930 11.345 ( 2.791 4.144 2.327) 5.512 11.734 ( 1.630 5.236 -1.953) 5.821 12.440 ( -10.639 -1.884 -15.025) 18.506 12.601 ( 1.418 -1.637 -0.838) 2.322 13.586 ( -0.025 -0.401 2.027) 2.066 13.811 ( 0.123 2.509 0.780) 2.631 14.458 ( -1.284 -0.348 -2.773) 3.076 14.981 ( -1.973 1.816 -6.423) 6.961 15.732 ( 2.249 0.836 -4.453) 5.059 15.948 ( 0.343 4.984 -0.114) 4.997 16.115 ( -3.464 7.065 -1.573) 8.024 16.188 ( -0.428 5.514 3.921) 6.779 16.285 ( 1.382 -0.431 -1.086) 1.810 16.815 ( 2.010 5.284 -1.998) 5.997 17.764 ( 4.964 -5.271 1.864) 7.477 17.877 ( 3.848 3.713 0.961) 5.433 18.118 ( 0.219 -1.204 4.944) 5.093 18.241 ( -2.984 3.055 0.336) 4.283 18.941 ( 9.211 -2.166 0.541) 9.477 19.334 ( -2.088 0.867 -4.045) 4.634 19.505 ( -10.714 6.802 14.686) 19.410 20.401 ( 0.865 3.765 -3.112) 4.960 27.668 ( 2.450 1.786 -2.661) 4.034 28.305 ( 2.201 0.300 0.214) 2.232 29.254 ( -0.758 5.691 -0.460) 5.760 29.473 ( 2.694 3.048 7.652) 8.666 29.585 ( -0.061 5.310 0.111) 5.312 29.718 ( 0.294 -0.991 1.854) 2.122 29.957 ( -0.669 -13.982 5.198) 14.932 30.287 ( -2.470 2.674 -4.939) 6.136 30.520 ( 2.742 2.412 -1.110) 3.816 30.616 ( 4.744 -0.750 -3.639) 6.026 31.170 ( 5.156 -5.388 -2.553) 7.883 31.753 ( -7.758 11.694 -1.403) 14.103 32.017 ( -0.072 5.920 -0.167) 5.923 32.794 ( -6.631 -40.565 -4.374) 41.335 33.424 ( 8.695 -13.123 29.670) 33.587 35.394 ( -12.064 -5.265 -21.015) 24.797 ======================= Grid point 277 (142/160) ======================= q-point: ( 0.56 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( 8.633 -4.558 -10.893) 14.627 2.712 ( 18.247 -9.159 5.828) 21.232 2.845 ( 2.680 -3.564 8.538) 9.633 2.946 ( 0.227 -15.311 0.770) 15.332 3.221 ( 5.958 -27.807 -3.134) 28.610 3.300 ( -1.488 -37.730 -1.703) 37.797 3.642 ( -1.385 -21.469 -1.278) 21.552 3.821 ( -6.866 -1.638 0.914) 7.118 4.108 ( 0.856 -22.796 -5.512) 23.468 4.154 ( -8.077 -33.878 -5.012) 35.186 4.163 ( -1.564 -27.525 2.689) 27.700 4.530 ( 2.005 -16.208 2.117) 16.468 4.691 ( -9.439 -9.058 6.295) 14.518 4.852 ( 0.443 -30.169 -3.865) 30.419 5.043 ( 1.873 -11.252 0.948) 11.447 5.281 ( 1.660 -13.886 -8.533) 16.382 5.452 ( -4.032 3.105 0.044) 5.089 5.786 ( 5.286 -9.352 5.498) 12.068 6.105 ( 3.294 2.687 0.653) 4.300 6.255 ( -7.069 -4.730 -2.968) 9.009 6.546 ( 1.550 9.952 1.240) 10.148 6.617 ( -0.453 3.964 3.860) 5.551 6.733 ( -0.529 5.279 2.781) 5.990 6.897 ( 3.077 -7.245 -1.236) 7.968 7.224 ( -3.568 9.849 3.226) 10.961 7.363 ( 0.177 2.223 10.577) 10.809 7.785 ( 8.805 0.930 -6.853) 11.196 8.182 ( -1.063 -1.704 3.397) 3.946 8.459 ( -3.218 -1.773 -1.351) 3.915 8.545 ( 1.868 -2.876 -0.323) 3.445 8.832 ( 0.077 -3.613 2.183) 4.222 9.144 ( 2.752 -3.160 -1.985) 4.637 9.269 ( -2.306 5.968 -6.566) 9.168 9.428 ( 1.273 -4.839 -3.691) 6.218 9.641 ( -4.785 -6.456 0.408) 8.046 10.142 ( 0.895 0.927 -1.844) 2.249 10.333 ( 0.912 -12.377 4.736) 13.283 10.660 ( 0.597 -7.286 1.839) 7.538 10.699 ( 4.961 -17.010 11.488) 21.116 10.945 ( -7.718 -2.511 -3.549) 8.859 11.289 ( 2.363 6.212 1.954) 6.927 11.608 ( 0.580 8.448 -1.889) 8.676 12.314 ( -6.307 -3.242 -12.240) 14.146 12.652 ( 1.604 -2.795 0.677) 3.292 13.599 ( -0.449 0.262 1.338) 1.435 13.787 ( 2.202 2.108 1.032) 3.219 14.447 ( -0.455 -1.079 -1.524) 1.922 14.884 ( -1.440 3.237 -4.547) 5.765 15.701 ( 1.055 3.526 -2.269) 4.323 15.838 ( 0.629 6.865 1.029) 6.970 15.942 ( -2.028 6.922 -2.850) 7.756 16.107 ( -1.495 7.063 5.036) 8.802 16.257 ( 2.464 3.430 -4.966) 6.518 16.715 ( 0.727 5.684 -0.694) 5.772 17.855 ( 4.416 3.223 0.667) 5.508 17.901 ( 2.309 -4.480 1.839) 5.365 18.144 ( -1.993 3.825 -2.299) 4.888 18.167 ( -1.808 -0.997 4.165) 4.649 19.042 ( 6.616 -0.858 -0.270) 6.677 19.260 ( -7.815 -1.104 -5.039) 9.364 19.395 ( -1.834 11.341 12.799) 17.199 20.330 ( 0.646 1.867 -2.699) 3.345 27.620 ( 0.912 3.059 -2.523) 4.069 28.324 ( 1.947 -0.496 0.390) 2.047 29.196 ( 0.603 0.781 -0.432) 1.077 29.499 ( -1.198 3.728 -0.282) 3.926 29.520 ( 1.983 -0.412 5.045) 5.436 29.728 ( -0.382 1.090 1.876) 2.203 30.004 ( -0.024 8.377 0.382) 8.386 30.139 ( -0.817 8.748 -4.542) 9.891 30.503 ( 2.151 0.361 0.369) 2.212 30.658 ( 0.509 -0.949 -0.970) 1.449 31.380 ( 9.445 -3.700 -0.218) 10.146 31.594 ( -12.532 -9.558 0.098) 15.761 31.944 ( -0.808 -0.189 0.160) 0.845 33.435 ( -3.286 -38.344 -0.709) 38.491 33.956 ( 10.900 -15.374 26.295) 32.351 35.289 ( -11.959 -13.334 -22.569) 28.812 ======================= Grid point 278 (143/160) ======================= q-point: (-0.33 -0.67 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( 1.085 -0.212 -6.325) 6.421 2.817 ( -3.386 -1.962 2.742) 4.778 3.173 ( 13.833 -4.828 16.322) 21.933 3.259 ( 8.219 -16.963 -1.067) 18.880 3.607 ( -3.502 -10.676 -5.510) 12.514 3.673 ( -4.615 -15.641 -0.338) 16.311 3.819 ( -8.098 -15.764 -2.311) 17.873 3.988 ( -0.108 -18.888 -0.047) 18.889 4.100 ( -0.939 1.006 0.531) 1.475 4.290 ( -3.765 2.106 -6.467) 7.774 4.569 ( -3.314 -9.350 3.378) 10.480 4.698 ( 2.141 -3.572 -2.553) 4.885 4.914 ( 0.449 -6.664 -2.684) 7.199 5.147 ( 2.104 -2.179 -1.960) 3.608 5.324 ( -2.890 -11.313 -0.253) 11.679 5.356 ( 2.405 -18.742 -1.835) 18.985 5.901 ( -3.304 -24.131 5.431) 24.954 5.976 ( 5.245 -4.880 3.327) 7.899 6.086 ( 3.250 -3.337 -3.871) 6.057 6.282 ( -5.451 -0.880 -0.488) 5.543 6.484 ( 2.879 -8.490 0.296) 8.970 6.618 ( 0.472 -5.273 0.742) 5.346 6.792 ( 1.016 -10.425 1.203) 10.543 6.982 ( -2.911 0.423 0.555) 2.993 7.165 ( -0.960 -7.932 1.107) 8.066 7.480 ( 0.471 -3.386 13.642) 14.064 7.793 ( 5.132 -1.961 -10.191) 11.577 8.206 ( -0.214 -0.276 2.269) 2.296 8.464 ( -1.757 -1.886 -0.065) 2.578 8.605 ( 2.095 -3.855 -3.209) 5.436 8.884 ( -1.562 -2.719 -0.249) 3.145 9.048 ( -3.463 10.005 -1.570) 10.703 9.247 ( 3.570 -6.171 -4.497) 8.429 9.629 ( 1.797 -16.157 0.607) 16.268 9.671 ( -4.346 -1.189 1.018) 4.619 10.018 ( -0.096 10.657 -1.783) 10.805 10.576 ( 1.780 -11.317 4.183) 12.196 10.717 ( -2.962 -3.556 -0.621) 4.670 10.827 ( -0.491 5.942 -0.059) 5.962 11.025 ( 1.690 2.292 2.327) 3.677 11.284 ( 3.242 -1.978 4.986) 6.268 11.473 ( 0.765 5.318 -2.514) 5.932 12.282 ( -3.083 -5.286 -4.945) 7.868 12.724 ( 1.277 -3.546 0.604) 3.817 13.590 ( 0.120 1.220 0.543) 1.341 13.781 ( 1.062 1.111 0.378) 1.583 14.465 ( -0.104 -1.937 -0.089) 1.941 14.799 ( -0.497 2.446 -2.324) 3.411 15.567 ( -0.880 7.473 -0.424) 7.536 15.803 ( -0.906 0.455 1.153) 1.536 15.868 ( 1.800 -0.566 -0.815) 2.056 15.998 ( -2.525 7.842 3.784) 9.066 16.137 ( 2.493 7.035 -7.339) 10.468 16.651 ( -0.145 2.332 0.841) 2.483 17.821 ( -2.814 3.803 1.731) 5.038 17.933 ( 1.888 2.640 -0.508) 3.286 18.085 ( -0.616 0.729 -0.371) 1.024 18.206 ( 2.415 -1.508 0.047) 2.848 19.036 ( -0.191 4.339 1.274) 4.526 19.168 ( -10.446 1.231 -0.136) 10.519 19.329 ( 7.524 5.232 2.328) 9.455 20.326 ( 0.316 -2.011 -0.346) 2.065 27.558 ( -0.115 2.479 -1.618) 2.963 28.359 ( 1.008 -1.900 0.193) 2.160 29.218 ( 0.350 -2.760 -0.506) 2.827 29.438 ( -0.331 2.367 -0.579) 2.459 29.590 ( 0.629 -2.690 3.958) 4.827 29.717 ( -0.181 0.841 1.084) 1.384 29.799 ( -0.723 13.459 -0.630) 13.493 29.958 ( 0.781 7.806 -3.797) 8.716 30.538 ( 1.332 -1.609 1.377) 2.502 30.637 ( -0.860 1.175 -1.552) 2.128 31.308 ( -0.047 7.776 -0.407) 7.787 31.735 ( -1.743 -3.221 1.777) 4.071 32.150 ( 0.194 -22.419 0.095) 22.420 33.911 ( -1.622 -17.823 3.509) 18.237 34.439 ( 8.333 -14.706 11.072) 20.207 35.338 ( -5.993 -16.407 -13.509) 22.081 ======================= Grid point 279 (144/160) ======================= q-point: (-0.22 -0.67 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.916 ( -3.037 2.677 -4.144) 5.794 2.829 ( 4.915 4.178 4.399) 7.808 3.261 ( -14.190 -1.257 -9.723) 17.247 3.506 ( 0.183 -11.432 -1.766) 11.569 3.729 ( 2.328 -8.776 3.074) 9.586 3.788 ( -2.624 3.029 0.998) 4.130 3.994 ( 3.862 4.880 4.663) 7.776 4.112 ( 4.591 -5.925 8.158) 11.079 4.179 ( 3.492 -7.996 -3.441) 9.379 4.364 ( -0.530 -15.081 -0.269) 15.092 4.603 ( -0.542 5.837 2.590) 6.408 4.705 ( -0.328 0.505 -1.871) 1.965 4.856 ( 0.503 5.598 -1.435) 5.800 5.135 ( 0.346 0.611 -2.342) 2.445 5.454 ( 0.446 7.119 -1.700) 7.332 5.494 ( -0.239 -8.183 1.122) 8.263 5.753 ( -2.770 10.018 1.085) 10.450 6.161 ( 1.572 -6.595 -3.908) 7.825 6.244 ( -2.025 0.090 -0.357) 2.059 6.355 ( 3.836 -4.976 1.967) 6.584 6.695 ( -0.860 -2.277 0.429) 2.472 6.796 ( -0.731 -19.630 -1.061) 19.672 6.946 ( -4.780 -3.718 -1.871) 6.338 7.051 ( 7.946 -3.891 4.024) 9.719 7.295 ( -0.606 -5.618 -0.095) 5.651 7.637 ( -6.198 -4.135 12.682) 14.709 7.773 ( 0.040 -3.163 -14.693) 15.030 8.225 ( -1.236 -0.950 1.228) 1.984 8.480 ( 1.707 0.749 -0.140) 1.869 8.647 ( -0.413 -0.474 -3.075) 3.139 8.876 ( -3.000 -1.463 2.261) 4.031 8.946 ( 5.840 2.948 1.693) 6.758 9.329 ( 2.485 -3.778 -3.026) 5.441 9.645 ( -6.698 0.720 3.546) 7.613 9.816 ( 5.782 7.476 -2.693) 9.828 9.986 ( -1.267 -19.867 0.926) 19.929 10.635 ( -0.764 11.581 0.647) 11.624 10.708 ( 0.021 4.879 -0.484) 4.903 10.796 ( -0.524 -8.878 -0.165) 8.895 10.957 ( 1.725 3.704 1.278) 4.281 11.324 ( 2.115 4.291 -0.230) 4.789 11.370 ( 0.206 5.262 -2.125) 5.678 12.369 ( -2.051 -8.201 1.335) 8.558 12.797 ( 0.600 -4.569 -0.571) 4.644 13.569 ( 1.138 2.175 -0.207) 2.463 13.773 ( -2.286 -1.216 -0.889) 2.738 14.501 ( -0.540 -2.261 0.285) 2.342 14.780 ( 0.798 -1.654 -0.146) 1.842 15.503 ( -0.402 -0.136 0.451) 0.619 15.806 ( -1.303 4.693 1.337) 5.051 15.866 ( -1.648 2.595 2.046) 3.693 15.931 ( 2.447 -3.774 -0.637) 4.543 16.032 ( 2.464 0.099 -3.452) 4.242 16.629 ( -1.335 0.788 0.730) 1.713 17.713 ( -9.008 3.921 2.897) 10.242 17.895 ( 5.747 4.026 -2.919) 7.600 18.044 ( 1.013 4.531 -0.307) 4.653 18.244 ( 2.964 -0.339 -1.151) 3.198 18.981 ( -2.864 0.764 0.840) 3.080 19.062 ( -7.244 4.260 5.250) 9.909 19.336 ( 9.397 2.520 -2.592) 10.068 20.378 ( -1.203 -4.130 -0.270) 4.310 27.524 ( 0.439 0.894 0.141) 1.005 28.401 ( -0.894 -3.026 -0.883) 3.277 29.265 ( -3.254 -3.568 -0.445) 4.850 29.415 ( 4.040 0.948 -0.197) 4.154 29.574 ( -0.034 11.569 -0.108) 11.569 29.676 ( -1.230 -5.372 0.877) 5.580 29.713 ( 0.512 1.584 1.490) 2.234 29.868 ( 1.182 0.247 -2.386) 2.674 30.579 ( -1.790 -2.262 -1.908) 3.458 30.610 ( 1.725 1.246 1.825) 2.804 31.190 ( -0.638 4.878 -0.240) 4.926 31.765 ( -1.889 -1.539 2.446) 3.453 32.491 ( 1.993 -14.139 0.229) 14.280 34.038 ( -1.803 3.178 1.480) 3.942 34.686 ( -1.283 -8.113 -4.207) 9.229 35.514 ( 5.417 -8.104 1.029) 9.802 ======================= Grid point 280 (145/160) ======================= q-point: (-0.11 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( 1.071 4.029 -5.358) 6.789 2.832 ( 10.910 6.898 5.365) 13.978 3.016 ( -15.201 1.281 -20.125) 25.253 3.538 ( -2.972 12.364 -7.624) 14.827 3.596 ( -0.016 4.422 1.878) 4.804 3.828 ( -4.407 3.201 3.567) 6.511 4.042 ( 3.204 0.462 6.930) 7.649 4.201 ( 7.750 0.039 12.514) 14.719 4.379 ( 0.174 12.344 0.082) 12.346 4.503 ( 3.895 -6.867 3.083) 8.475 4.579 ( -0.438 -4.095 -0.192) 4.123 4.658 ( 1.816 8.053 8.106) 11.569 4.719 ( -1.297 3.407 -0.265) 3.655 5.140 ( 2.643 -1.603 -2.991) 4.301 5.316 ( 0.594 6.125 -1.926) 6.448 5.637 ( -2.529 -8.498 -1.770) 9.041 5.659 ( 2.882 0.326 1.340) 3.195 6.105 ( 2.395 9.132 -6.540) 11.485 6.231 ( -5.025 1.155 0.475) 5.178 6.366 ( 7.177 7.540 1.190) 10.478 6.663 ( -0.669 7.155 0.440) 7.200 6.805 ( -7.454 11.056 -3.320) 13.741 6.898 ( -3.189 9.591 -1.215) 10.180 7.111 ( 5.308 3.831 2.900) 7.160 7.354 ( -2.064 -4.011 -2.700) 5.258 7.626 ( -4.128 4.719 -11.896) 13.447 7.712 ( -4.812 -0.883 6.834) 8.405 8.234 ( -0.164 0.866 2.508) 2.658 8.452 ( 0.369 1.885 -1.655) 2.535 8.565 ( 2.190 6.173 -1.765) 6.784 8.937 ( 4.659 4.497 2.523) 6.950 9.018 ( 1.404 -6.387 8.228) 10.510 9.406 ( -1.725 -3.152 -1.442) 3.872 9.577 ( -0.355 1.469 2.304) 2.756 9.752 ( 5.845 5.062 -4.671) 9.033 10.282 ( -2.796 -12.015 -0.805) 12.362 10.500 ( 0.936 4.789 1.696) 5.166 10.593 ( -0.441 3.193 2.030) 3.809 10.849 ( -0.730 8.107 -2.484) 8.510 10.888 ( 0.081 2.745 -0.406) 2.776 11.229 ( -2.677 -2.703 -3.249) 5.003 11.368 ( 2.062 -1.343 2.327) 3.387 12.500 ( -2.976 -7.137 1.990) 7.984 12.904 ( 0.570 -9.049 -1.456) 9.183 13.527 ( 1.949 3.615 -1.380) 4.333 13.771 ( -5.266 -2.794 -1.503) 6.148 14.533 ( -0.992 -2.086 0.051) 2.311 14.871 ( 0.507 -8.469 -0.740) 8.516 15.544 ( -0.400 -3.724 1.982) 4.237 15.667 ( 1.891 7.222 -0.588) 7.488 15.848 ( -4.638 -2.256 -2.267) 5.633 16.051 ( 2.101 -3.555 4.009) 5.755 16.155 ( 4.599 -11.733 -0.327) 12.606 16.604 ( -2.729 0.353 -0.034) 2.752 17.619 ( -6.539 1.904 2.807) 7.366 17.844 ( 2.889 3.638 -2.635) 5.341 17.965 ( 5.727 6.793 -0.355) 8.892 18.239 ( 1.659 2.257 -0.883) 2.937 18.927 ( -6.631 1.945 0.589) 6.935 19.026 ( 0.708 1.813 3.930) 4.385 19.376 ( 9.602 0.130 0.950) 9.649 20.422 ( -3.821 -4.517 -2.652) 6.484 27.539 ( 1.910 -0.599 1.664) 2.603 28.426 ( -3.336 -3.584 -3.134) 5.813 29.262 ( -4.708 -0.894 -0.119) 4.794 29.415 ( 1.541 7.427 0.022) 7.586 29.485 ( 4.708 -3.481 0.141) 5.857 29.671 ( -0.445 2.325 -0.800) 2.499 29.779 ( -1.593 -6.836 1.309) 7.140 29.933 ( 1.953 -7.056 -1.737) 7.524 30.563 ( -1.005 -0.402 -2.421) 2.652 30.636 ( 0.204 -0.092 2.629) 2.639 31.150 ( 0.854 -0.386 -0.429) 1.031 31.800 ( -2.475 -2.483 2.712) 4.433 32.619 ( -0.503 1.009 1.689) 2.031 33.814 ( -1.975 19.725 -3.141) 20.071 34.643 ( -7.555 4.297 -6.134) 10.638 35.654 ( 11.179 3.833 7.830) 14.177 ======================= Grid point 285 (146/160) ======================= q-point: ( 0.44 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 7.700 0.000 -4.504) 8.921 1.902 ( -0.649 -0.000 -6.732) 6.763 2.490 ( -2.366 -0.000 -0.378) 2.396 2.544 ( 21.931 0.000 1.743) 22.001 2.673 ( 5.260 0.000 -8.703) 10.169 2.833 ( 13.079 0.000 -2.751) 13.366 2.927 ( 13.462 0.000 12.427) 18.320 2.946 ( -9.912 -0.000 3.177) 10.409 3.203 ( -4.337 -0.000 -1.982) 4.768 3.883 ( 4.720 0.000 -0.423) 4.739 3.913 ( -10.563 -0.000 -8.785) 13.739 3.914 ( -9.111 -0.000 -0.588) 9.130 4.429 ( -3.330 -0.000 8.491) 9.120 4.607 ( -5.601 -0.000 5.406) 7.784 4.984 ( -2.142 -0.000 -0.362) 2.172 5.258 ( 0.909 0.000 -10.327) 10.366 5.521 ( 1.824 0.000 5.165) 5.477 5.718 ( -0.328 -0.000 -0.254) 0.415 6.087 ( -5.327 -0.000 -2.993) 6.110 6.272 ( -3.414 -0.000 3.900) 5.184 6.679 ( 3.380 0.000 6.027) 6.910 6.736 ( -0.027 -0.000 -2.249) 2.249 6.765 ( 3.140 0.000 -1.069) 3.317 6.930 ( 2.887 0.000 -0.104) 2.889 7.400 ( 2.150 0.000 7.531) 7.832 7.718 ( -4.098 -0.000 11.040) 11.776 7.874 ( 1.634 0.000 0.852) 1.843 7.945 ( 2.186 0.000 -4.664) 5.151 8.424 ( -3.062 -0.000 -3.703) 4.805 8.431 ( 2.782 0.000 -0.508) 2.828 8.837 ( -1.235 -0.000 6.478) 6.594 9.199 ( 1.065 0.000 -2.843) 3.036 9.266 ( -2.687 -0.000 -7.525) 7.991 9.384 ( -3.783 -0.000 0.632) 3.835 9.752 ( 0.743 0.000 0.730) 1.042 9.812 ( 1.722 0.000 4.210) 4.549 9.913 ( 7.498 0.000 2.291) 7.840 10.159 ( 0.103 0.000 0.340) 0.355 10.593 ( 3.401 0.000 5.648) 6.593 10.963 ( -7.111 -0.000 -8.594) 11.155 11.416 ( 2.285 0.000 1.553) 2.763 11.779 ( 0.990 0.000 -1.378) 1.697 12.244 ( -5.860 -0.000 -14.464) 15.606 12.600 ( 1.257 0.000 0.425) 1.327 13.598 ( 0.082 0.000 1.920) 1.922 13.829 ( -0.351 -0.000 0.046) 0.354 14.427 ( -0.734 -0.000 -2.319) 2.432 14.943 ( -1.187 -0.000 -4.729) 4.876 15.721 ( 1.446 0.000 -3.494) 3.781 15.999 ( 0.739 0.000 0.319) 0.805 16.144 ( -2.622 -0.000 -0.839) 2.753 16.255 ( 1.040 0.000 -0.726) 1.268 16.294 ( 0.769 0.000 2.624) 2.734 16.863 ( 0.992 0.000 -1.733) 1.997 17.756 ( 2.569 0.000 1.659) 3.058 17.944 ( 2.713 0.000 0.728) 2.809 18.151 ( 3.476 0.000 2.216) 4.122 18.236 ( -6.063 -0.000 1.163) 6.174 19.000 ( 8.924 0.000 0.354) 8.931 19.216 ( -11.377 -0.000 -4.583) 12.266 19.680 ( -0.870 -0.000 18.589) 18.609 20.399 ( -0.747 -0.000 -6.604) 6.646 27.696 ( 3.079 0.000 -1.726) 3.530 28.323 ( 1.244 0.000 0.076) 1.247 29.304 ( -1.414 -0.000 -0.132) 1.420 29.646 ( -0.266 -0.000 0.507) 0.573 29.673 ( -0.134 -0.000 2.497) 2.501 29.701 ( 0.055 0.000 -0.956) 0.958 29.772 ( 4.541 0.000 14.115) 14.827 30.269 ( -1.653 -0.000 0.378) 1.696 30.543 ( 0.175 0.000 -0.694) 0.715 30.639 ( 7.411 0.000 -7.267) 10.379 31.149 ( 3.533 0.000 -3.464) 4.948 31.969 ( -0.328 -0.000 0.254) 0.416 32.077 ( 0.244 0.000 -0.818) 0.854 32.173 ( -7.695 -0.000 -7.693) 10.881 33.613 ( 8.359 0.000 36.588) 37.530 35.046 ( -14.824 -0.000 -30.266) 33.701 ======================= Grid point 286 (147/160) ======================= q-point: (-0.44 -0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( 1.212 -21.081 -5.953) 21.939 2.370 ( -2.498 -46.636 -1.922) 46.742 2.625 ( -10.575 -10.869 3.395) 15.540 2.701 ( -1.322 -19.392 -0.242) 19.438 2.752 ( 12.947 -11.724 -5.067) 18.186 3.204 ( 12.149 -14.205 11.881) 22.149 3.259 ( 6.293 -20.111 3.261) 21.323 3.330 ( 0.017 -35.835 2.423) 35.916 3.416 ( 6.691 -36.792 -3.782) 37.586 3.664 ( -19.725 0.440 -14.321) 24.379 3.960 ( -4.773 -9.163 1.830) 10.492 4.100 ( 2.831 -24.208 -2.444) 24.496 4.531 ( -3.296 -6.499 8.675) 11.329 4.621 ( -0.285 -2.300 3.244) 3.987 4.980 ( -2.991 -1.736 1.282) 3.688 5.151 ( 3.633 3.244 -10.189) 11.294 5.549 ( 0.905 4.951 0.634) 5.073 5.732 ( 2.570 -4.194 2.012) 5.315 6.059 ( -2.529 -2.778 -1.848) 4.187 6.252 ( -1.032 3.855 3.019) 5.004 6.692 ( -1.748 3.870 2.291) 4.825 6.729 ( 5.097 5.392 -0.960) 7.482 6.760 ( -3.320 -3.693 1.768) 5.271 6.901 ( 4.734 4.879 -3.176) 7.504 7.425 ( -4.254 6.692 3.427) 8.638 7.499 ( 1.998 13.675 5.514) 14.879 7.859 ( 3.596 4.388 -2.498) 6.199 8.118 ( -1.340 -10.011 4.653) 11.121 8.386 ( -2.143 -1.442 -3.672) 4.489 8.485 ( 0.301 -4.267 -0.665) 4.329 8.844 ( -0.422 1.607 3.633) 3.995 9.138 ( 2.344 3.348 -2.898) 5.010 9.195 ( -1.438 -2.633 -4.446) 5.364 9.489 ( -1.803 -8.634 1.527) 8.952 9.534 ( 0.541 13.935 -1.546) 14.031 10.036 ( -0.785 -17.747 4.964) 18.445 10.148 ( -1.254 -3.627 -2.083) 4.367 10.379 ( 7.166 -28.586 3.450) 29.671 10.674 ( 3.750 0.296 6.311) 7.347 10.841 ( -5.569 0.220 -7.136) 9.054 11.403 ( 1.286 4.034 0.368) 4.250 11.724 ( -0.078 5.776 -1.079) 5.877 12.147 ( -3.201 -2.496 -8.078) 9.040 12.626 ( 1.201 -1.761 -0.105) 2.134 13.610 ( 0.169 0.138 1.100) 1.122 13.820 ( -0.218 0.709 0.156) 0.758 14.416 ( -0.467 -0.794 -1.142) 1.467 14.893 ( -0.672 1.946 -2.541) 3.270 15.712 ( 0.634 -0.156 -1.970) 2.076 15.961 ( 0.548 4.956 0.164) 4.989 16.054 ( -1.005 8.158 -0.678) 8.247 16.225 ( 0.017 3.905 1.683) 4.252 16.297 ( 1.788 1.975 -1.532) 3.073 16.807 ( -0.141 5.181 -0.982) 5.275 17.825 ( -0.272 -5.100 1.353) 5.283 17.936 ( 0.540 2.618 -0.055) 2.674 18.163 ( -4.235 2.369 -0.807) 4.920 18.200 ( 4.176 0.859 2.329) 4.858 19.072 ( 2.496 -0.817 0.110) 2.629 19.130 ( -7.226 -2.241 -0.113) 7.566 19.706 ( 3.767 11.454 10.948) 16.287 20.325 ( -0.689 1.241 -5.823) 5.994 27.675 ( 1.887 3.332 -1.965) 4.304 28.329 ( 0.526 -0.111 -0.222) 0.582 29.243 ( -0.038 4.457 -0.174) 4.460 29.567 ( -2.412 4.541 3.306) 6.113 29.595 ( 2.607 5.297 -0.513) 5.926 29.743 ( 0.366 -1.051 0.769) 1.353 30.031 ( 0.220 -7.634 2.444) 8.019 30.249 ( -0.519 5.179 3.595) 6.326 30.528 ( -0.560 1.186 -0.377) 1.365 30.625 ( 4.197 -1.570 -5.949) 7.447 31.206 ( 1.986 -9.451 -1.932) 9.849 31.641 ( -1.641 15.103 -0.943) 15.221 32.011 ( -0.394 5.846 0.036) 5.860 32.691 ( -0.076 -44.099 -2.212) 44.154 34.047 ( 9.179 -9.182 34.811) 37.153 34.782 ( -13.573 -10.720 -30.138) 34.749 ======================= Grid point 287 (148/160) ======================= q-point: (-0.33 -0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( -8.619 -4.885 -1.666) 10.046 2.725 ( -2.880 -10.171 3.232) 11.054 2.917 ( -5.432 -18.160 -3.293) 19.239 3.084 ( 1.416 -18.660 -4.231) 19.186 3.246 ( -8.296 -27.367 -1.499) 28.637 3.360 ( -11.026 -20.034 -13.203) 26.405 3.626 ( 1.368 -20.944 1.051) 21.015 3.647 ( 18.480 -4.599 14.461) 23.912 4.013 ( -6.854 -31.642 4.789) 32.728 4.110 ( 0.667 -15.613 0.240) 15.630 4.213 ( 6.245 -32.805 -2.698) 33.503 4.568 ( -0.451 -14.460 -1.899) 14.592 4.653 ( -3.743 -17.471 9.064) 20.035 4.880 ( 6.904 -22.073 -4.150) 23.497 5.036 ( -2.793 -5.931 0.524) 6.577 5.218 ( 1.977 -20.517 -3.020) 20.832 5.450 ( 3.432 2.021 0.737) 4.050 5.870 ( -4.361 -8.863 -2.285) 10.139 6.114 ( -0.733 0.522 -0.077) 0.903 6.199 ( 3.818 -2.756 2.415) 5.292 6.550 ( -1.851 9.540 0.759) 9.748 6.681 ( 2.980 3.963 -2.695) 5.643 6.739 ( -2.668 4.569 2.299) 5.769 6.919 ( 3.986 -6.864 -3.340) 8.611 7.202 ( 1.518 11.418 4.640) 12.418 7.485 ( -2.484 -1.291 0.691) 2.884 7.763 ( -2.243 3.700 -5.594) 7.072 8.221 ( -1.238 -0.700 1.508) 2.073 8.407 ( 0.951 -3.292 1.633) 3.796 8.546 ( -0.409 -3.322 -0.857) 3.455 8.848 ( -0.581 -0.783 0.685) 1.192 9.132 ( -0.305 -2.245 -1.471) 2.701 9.203 ( 1.120 3.423 -0.093) 3.603 9.405 ( -1.156 -4.926 -1.118) 5.182 9.630 ( 1.440 -6.040 1.875) 6.486 10.126 ( -1.393 3.072 -0.085) 3.374 10.355 ( -4.357 -16.036 2.468) 16.799 10.688 ( -0.582 -0.225 -0.471) 0.782 10.805 ( -2.170 -4.728 -0.416) 5.219 10.959 ( 15.488 -19.938 -1.903) 25.319 11.320 ( 0.099 5.076 -1.011) 5.177 11.588 ( -0.670 8.537 -0.387) 8.572 12.160 ( -1.595 -4.395 1.184) 4.823 12.673 ( 0.828 -3.114 -0.911) 3.348 13.611 ( 0.739 0.632 0.161) 0.985 13.799 ( -1.568 1.255 -0.408) 2.050 14.430 ( -0.432 -1.671 0.050) 1.727 14.838 ( 0.414 3.011 -0.046) 3.040 15.684 ( -0.830 4.065 -0.346) 4.163 15.866 ( -0.675 5.186 -1.203) 5.366 15.896 ( 1.694 7.748 1.047) 7.999 16.154 ( -0.727 6.625 4.262) 7.911 16.222 ( 2.191 5.881 -5.615) 8.421 16.707 ( -1.078 4.817 0.096) 4.937 17.857 ( -5.809 4.271 0.093) 7.211 17.913 ( -2.709 -4.816 0.788) 5.582 18.101 ( -0.542 1.688 1.178) 2.128 18.236 ( 7.530 0.914 -1.761) 7.787 19.038 ( -8.832 -0.609 0.240) 8.856 19.166 ( 0.425 0.802 4.786) 4.872 19.548 ( 6.727 13.265 -1.628) 14.962 20.295 ( -0.429 -0.672 -0.516) 0.949 27.605 ( 0.298 3.854 -1.177) 4.041 28.335 ( -0.454 -0.849 -0.659) 1.167 29.196 ( -0.054 0.782 -0.348) 0.858 29.482 ( -1.259 3.633 0.656) 3.900 29.579 ( 0.420 -0.203 0.078) 0.473 29.745 ( 0.731 1.244 0.218) 1.459 30.006 ( 0.533 8.987 -0.114) 9.003 30.102 ( -0.244 11.021 -0.282) 11.027 30.520 ( -1.088 -0.978 -0.743) 1.641 30.647 ( 0.807 -0.048 -0.816) 1.148 31.388 ( -9.234 -0.865 -1.002) 9.328 31.583 ( 12.218 -12.933 1.080) 17.825 31.940 ( -0.062 -0.579 0.452) 0.737 33.425 ( 2.401 -39.381 0.289) 39.455 34.341 ( -3.331 -6.552 -3.604) 8.186 34.928 ( 3.906 -23.047 5.007) 23.906 ======================= Grid point 288 (149/160) ======================= q-point: (-0.22 -0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( -11.220 -1.947 1.598) 11.500 2.829 ( -26.409 -11.030 -15.275) 32.441 2.931 ( 3.138 -0.933 0.328) 3.290 3.238 ( 0.626 -14.796 -5.366) 15.751 3.587 ( -0.463 -19.946 3.284) 20.220 3.713 ( -2.055 -13.177 1.812) 13.459 3.944 ( 9.108 -11.359 4.717) 15.305 4.012 ( 1.319 -20.779 0.785) 20.835 4.130 ( 4.869 4.111 3.032) 7.056 4.401 ( 9.801 0.730 7.130) 12.142 4.587 ( 0.568 -11.359 4.802) 12.345 4.651 ( -1.435 -3.179 -1.698) 3.879 4.948 ( 5.229 -2.933 0.936) 6.068 5.056 ( -7.111 -6.561 -0.359) 9.682 5.358 ( 2.186 -21.245 -3.654) 21.668 5.396 ( 4.128 -4.380 1.893) 6.309 5.796 ( -13.146 -9.958 -3.643) 16.890 5.940 ( -3.356 -12.474 5.139) 13.902 6.013 ( -0.651 -8.822 -5.488) 10.410 6.453 ( 11.387 -1.595 3.376) 11.983 6.486 ( 0.642 -9.328 -4.269) 10.278 6.631 ( 1.466 -2.614 -1.629) 3.411 6.740 ( -4.313 -8.123 -0.135) 9.198 7.069 ( 4.728 -7.430 -0.668) 8.833 7.179 ( 1.363 -2.853 2.115) 3.804 7.495 ( -3.069 -5.606 -8.601) 10.715 7.648 ( -8.865 0.044 0.417) 8.875 8.207 ( -0.649 -0.162 -0.463) 0.814 8.496 ( 2.497 -1.406 1.372) 3.177 8.580 ( -0.676 -2.917 -0.435) 3.025 8.863 ( -2.699 -1.333 3.200) 4.393 9.105 ( 5.168 5.154 4.465) 8.556 9.233 ( 2.172 -6.125 -3.566) 7.413 9.571 ( -4.500 -10.938 0.921) 11.863 9.735 ( 3.124 -4.849 2.516) 6.293 10.010 ( -0.118 9.402 1.197) 9.479 10.531 ( -4.673 -11.303 -3.197) 12.641 10.740 ( -3.502 -2.833 2.709) 5.257 10.803 ( 2.873 2.862 0.335) 4.069 11.115 ( 6.456 8.642 -1.268) 10.862 11.326 ( 6.376 -4.209 -11.678) 13.955 11.459 ( -0.076 5.616 0.731) 5.663 12.279 ( 0.332 -4.767 9.101) 10.279 12.722 ( 0.009 -3.454 -2.309) 4.155 13.603 ( 1.171 1.265 -0.549) 1.809 13.739 ( -4.296 1.507 -1.811) 4.900 14.461 ( -0.354 -1.969 0.539) 2.072 14.806 ( 1.352 2.288 1.707) 3.159 15.567 ( -0.288 6.929 1.634) 7.124 15.822 ( 1.195 -0.156 0.196) 1.221 15.846 ( -0.907 0.507 -1.314) 1.675 16.057 ( 2.651 8.487 2.272) 9.177 16.091 ( 0.447 5.627 -0.635) 5.680 16.638 ( -2.032 2.248 -0.194) 3.036 17.723 ( -9.510 4.232 2.069) 10.613 17.937 ( -2.597 -0.505 -0.805) 2.765 18.101 ( 3.992 1.501 -0.110) 4.266 18.262 ( 5.626 0.067 -3.511) 6.632 18.967 ( -7.934 1.517 1.475) 8.211 19.139 ( -3.583 4.461 6.448) 8.621 19.447 ( 10.655 4.058 -4.382) 12.215 20.308 ( -1.993 -1.714 -0.369) 2.655 27.557 ( 0.401 1.829 1.109) 2.176 28.338 ( -1.996 -1.637 -1.693) 3.087 29.199 ( -1.191 -1.620 -0.305) 2.034 29.452 ( 1.110 0.601 0.786) 1.487 29.587 ( -1.128 -1.988 -2.851) 3.654 29.720 ( 0.108 3.406 -0.161) 3.412 29.834 ( 3.271 9.788 0.673) 10.342 29.932 ( -0.933 8.564 1.072) 8.681 30.515 ( -2.281 -1.518 -2.010) 3.398 30.653 ( 1.731 0.468 1.409) 2.280 31.270 ( -3.716 5.505 0.182) 6.645 31.762 ( 0.743 -0.077 2.251) 2.372 32.208 ( 7.175 -22.201 -0.378) 23.334 33.932 ( -0.246 -15.537 0.452) 15.545 34.368 ( -7.971 -15.580 -15.704) 23.514 35.434 ( 13.999 -15.889 12.901) 24.796 ======================= Grid point 289 (150/160) ======================= q-point: (-0.11 -0.56 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -5.579 -0.277 0.245) 5.591 2.613 ( -23.212 -6.559 -18.478) 30.385 3.038 ( 11.042 0.214 0.637) 11.063 3.413 ( -5.476 -10.091 -2.534) 11.758 3.776 ( 2.177 2.365 2.879) 4.316 3.871 ( -2.656 -6.578 9.201) 11.618 4.111 ( 9.155 7.298 -1.414) 11.793 4.238 ( 5.613 -12.923 1.129) 14.134 4.355 ( -0.590 -18.091 0.290) 18.103 4.429 ( 0.402 2.328 7.066) 7.451 4.654 ( 4.448 7.728 1.126) 8.988 4.694 ( 1.781 -1.922 1.545) 3.042 4.937 ( 1.630 8.689 6.588) 11.026 5.108 ( -0.401 -2.562 0.120) 2.596 5.363 ( -2.515 3.092 -6.456) 7.587 5.513 ( -0.984 -2.304 0.745) 2.613 5.730 ( -0.097 2.626 3.206) 4.145 6.031 ( -6.911 -9.900 -2.678) 12.367 6.258 ( 4.629 -1.625 0.833) 4.976 6.479 ( 7.583 1.073 -1.354) 7.777 6.682 ( -2.810 -4.036 -2.463) 5.500 6.704 ( -4.224 -9.834 -0.569) 10.718 6.876 ( -2.752 -6.971 -0.794) 7.537 7.191 ( -1.905 -2.032 -7.478) 7.980 7.248 ( 1.508 -5.644 -1.761) 6.101 7.465 ( -3.038 -4.712 -11.205) 12.530 7.699 ( -4.154 -4.422 9.838) 11.558 8.237 ( 1.459 -2.250 1.653) 3.150 8.479 ( 0.434 2.392 -3.459) 4.228 8.603 ( -1.733 0.353 -0.381) 1.809 8.970 ( 0.248 -7.772 9.526) 12.296 9.123 ( 8.278 5.083 2.587) 10.052 9.334 ( 3.277 -5.119 -2.498) 6.571 9.585 ( -6.521 1.945 4.135) 7.963 9.888 ( 5.816 7.345 0.510) 9.383 9.967 ( -2.548 -17.822 -0.247) 18.004 10.618 ( -0.293 4.760 -1.132) 4.902 10.677 ( -2.768 -5.764 -1.757) 6.631 10.803 ( 1.436 5.895 1.528) 6.257 11.034 ( 4.345 4.682 1.283) 6.515 11.191 ( -0.579 8.349 -13.371) 15.774 11.419 ( 0.785 1.725 1.931) 2.706 12.409 ( -0.782 -3.407 7.772) 8.522 12.765 ( -0.341 -5.015 -3.665) 6.221 13.573 ( 0.210 1.838 -1.658) 2.485 13.689 ( -3.828 -0.918 -1.285) 4.141 14.494 ( -0.315 -1.732 0.497) 1.829 14.811 ( 1.274 -0.623 0.993) 1.731 15.514 ( -0.151 0.617 1.609) 1.729 15.750 ( -1.221 5.108 -3.008) 6.052 15.858 ( -0.738 1.219 -0.621) 1.555 16.018 ( 2.952 -1.534 -2.659) 4.259 16.102 ( 4.973 -1.982 10.333) 11.638 16.580 ( -3.993 1.290 -1.911) 4.611 17.618 ( -7.241 2.028 3.382) 8.245 17.889 ( -0.541 2.421 -2.639) 3.622 18.091 ( 4.781 3.256 -1.476) 5.970 18.274 ( 3.027 0.430 -1.845) 3.571 18.904 ( -6.567 0.763 3.532) 7.495 19.085 ( -1.466 2.618 0.344) 3.020 19.488 ( 10.674 1.283 2.945) 11.147 20.303 ( -4.747 -2.355 -3.230) 6.206 27.566 ( 1.612 0.026 2.763) 3.199 28.331 ( -3.182 -1.889 -3.017) 4.774 29.213 ( -1.785 -1.370 -0.046) 2.250 29.480 ( 2.244 -1.314 0.415) 2.633 29.550 ( 0.362 5.050 -3.151) 5.963 29.644 ( 0.203 0.339 -0.843) 0.931 29.794 ( -0.190 5.119 5.628) 7.610 29.841 ( 1.119 -2.090 -3.302) 4.065 30.515 ( -1.820 -1.863 -1.434) 2.973 30.671 ( 1.604 0.627 1.620) 2.365 31.172 ( -1.271 3.199 0.067) 3.443 31.774 ( -1.653 -0.540 2.748) 3.252 32.562 ( 5.166 -11.244 0.979) 12.412 33.943 ( -5.333 3.884 -7.127) 9.712 34.504 ( -4.826 -10.369 -4.941) 12.459 35.799 ( 13.389 -4.879 7.869) 16.279 ======================= Grid point 295 (151/160) ======================= q-point: (-0.44 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -4.832 -0.000 -2.826) 5.598 1.823 ( -4.628 -0.000 1.960) 5.026 2.437 ( -23.848 -0.000 7.853) 25.108 2.485 ( 2.215 0.000 0.079) 2.216 2.738 ( 6.152 0.000 -10.766) 12.400 2.783 ( -10.358 -0.000 1.232) 10.431 3.015 ( 9.182 0.000 -2.809) 9.602 3.178 ( 4.973 0.000 0.339) 4.984 3.237 ( -22.040 -0.000 -16.920) 27.785 3.661 ( 20.111 0.000 14.661) 24.887 3.790 ( -8.838 -0.000 5.100) 10.204 3.992 ( 12.038 0.000 -4.759) 12.945 4.497 ( -6.623 -0.000 4.070) 7.774 4.637 ( 3.642 0.000 3.369) 4.961 4.945 ( -4.505 -0.000 2.514) 5.159 5.194 ( 9.306 0.000 -5.958) 11.050 5.590 ( 0.556 0.000 -1.269) 1.386 5.726 ( 2.435 0.000 -0.713) 2.537 6.037 ( 2.754 0.000 1.637) 3.203 6.305 ( 0.139 0.000 1.828) 1.833 6.699 ( -3.743 -0.000 1.332) 3.973 6.731 ( -1.808 -0.000 0.430) 1.858 6.786 ( 2.937 0.000 -4.121) 5.061 6.950 ( 1.632 0.000 -2.087) 2.650 7.457 ( -0.603 -0.000 1.205) 1.348 7.839 ( -0.089 -0.000 7.120) 7.121 7.877 ( -2.440 -0.000 0.502) 2.491 7.904 ( -0.635 -0.000 -5.828) 5.863 8.356 ( 0.739 0.000 0.822) 1.105 8.430 ( -2.147 -0.000 -0.334) 2.173 8.880 ( 0.731 0.000 1.356) 1.541 9.149 ( 0.852 0.000 0.094) 0.857 9.236 ( 0.632 0.000 -1.246) 1.397 9.377 ( 1.378 0.000 1.241) 1.854 9.762 ( 0.634 0.000 -0.489) 0.801 9.865 ( -0.223 -0.000 -0.470) 0.520 9.990 ( 1.322 0.000 -4.172) 4.377 10.150 ( -0.679 -0.000 0.723) 0.992 10.719 ( -4.294 -0.000 -5.841) 7.250 10.803 ( 5.492 0.000 6.600) 8.586 11.441 ( 0.146 0.000 -1.025) 1.036 11.767 ( -1.105 -0.000 -0.177) 1.119 12.078 ( -1.220 -0.000 0.490) 1.315 12.616 ( 1.069 0.000 -0.944) 1.426 13.619 ( 0.653 0.000 0.045) 0.655 13.821 ( -1.192 -0.000 0.502) 1.294 14.401 ( -0.526 -0.000 0.185) 0.558 14.898 ( 0.007 0.000 -0.147) 0.147 15.699 ( -0.500 -0.000 -1.058) 1.170 16.005 ( -0.268 -0.000 -0.306) 0.406 16.130 ( 1.409 0.000 0.623) 1.541 16.261 ( 1.704 0.000 -1.497) 2.268 16.321 ( 0.086 0.000 -0.066) 0.108 16.847 ( -1.179 -0.000 -0.157) 1.189 17.770 ( -2.986 -0.000 0.413) 3.015 17.952 ( -1.943 -0.000 -0.376) 1.979 18.145 ( -4.165 -0.000 0.356) 4.180 18.270 ( 7.525 0.000 0.232) 7.529 19.004 ( -10.333 -0.000 0.178) 10.334 19.141 ( 4.882 0.000 3.192) 5.833 19.914 ( 7.836 0.000 0.369) 7.844 20.296 ( -0.218 -0.000 -1.226) 1.245 27.705 ( 1.398 0.000 -2.810) 3.139 28.328 ( -0.201 -0.000 -0.312) 0.372 29.298 ( 0.351 0.000 0.472) 0.588 29.651 ( 0.169 0.000 0.156) 0.230 29.693 ( 0.017 0.000 -0.209) 0.210 29.695 ( 0.538 0.000 0.047) 0.540 29.910 ( 0.081 0.000 0.458) 0.466 30.319 ( -0.441 -0.000 3.493) 3.521 30.514 ( -3.724 -0.000 1.226) 3.921 30.604 ( 3.808 0.000 -10.117) 10.811 31.132 ( -0.919 -0.000 -1.845) 2.061 31.971 ( 0.242 0.000 0.082) 0.256 32.070 ( -0.109 -0.000 -0.184) 0.214 32.080 ( 3.638 0.000 1.202) 3.832 34.247 ( -5.680 -0.000 -4.740) 7.398 34.408 ( 2.026 0.000 11.380) 11.559 ======================= Grid point 296 (152/160) ======================= q-point: (-0.33 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( -12.837 -17.984 2.225) 22.208 2.313 ( -6.453 -44.348 5.228) 45.119 2.414 ( -24.329 -15.285 -0.945) 28.747 2.702 ( -15.646 -23.533 -8.580) 29.533 2.750 ( 4.947 -15.798 -0.178) 16.556 3.009 ( -3.793 -4.635 -8.431) 10.342 3.112 ( -13.566 -42.030 1.828) 44.203 3.294 ( 2.567 -18.674 1.062) 18.880 3.535 ( 9.237 -38.496 -5.005) 39.904 3.860 ( 8.108 -4.235 7.471) 11.810 3.955 ( 0.592 -10.443 6.156) 12.137 4.199 ( 10.553 -20.013 -1.685) 22.688 4.506 ( -0.005 -3.228 2.735) 4.230 4.721 ( 4.707 -4.913 -0.484) 6.821 4.964 ( -2.422 -2.334 5.510) 6.456 5.175 ( 7.383 5.462 -3.007) 9.663 5.563 ( 1.285 2.622 -2.604) 3.913 5.729 ( 0.852 -0.653 -3.083) 3.264 6.116 ( 5.347 -1.622 2.605) 6.165 6.271 ( 0.045 4.062 0.656) 4.115 6.638 ( -5.653 4.053 -2.975) 7.566 6.712 ( -4.874 1.509 2.729) 5.786 6.762 ( 2.420 -0.363 -1.458) 2.848 6.918 ( 4.587 3.038 -4.799) 7.301 7.432 ( -4.730 2.218 -6.300) 8.184 7.534 ( 4.440 17.450 5.796) 18.916 7.782 ( -5.933 6.213 -5.036) 9.958 8.126 ( -1.632 -10.133 -0.393) 10.271 8.411 ( 3.596 -1.856 5.250) 6.629 8.457 ( -2.990 -5.154 -0.098) 5.959 8.860 ( -0.053 2.982 -2.071) 3.631 9.117 ( -0.183 4.567 -2.395) 5.160 9.205 ( 2.720 -2.798 5.106) 6.427 9.493 ( -2.311 9.961 1.210) 10.297 9.538 ( 2.439 -4.638 0.951) 5.325 10.005 ( -5.704 -15.436 -1.092) 16.493 10.139 ( -0.448 -4.930 1.866) 5.290 10.421 ( 6.113 -28.044 -13.848) 31.869 10.663 ( 0.197 -5.506 -5.020) 7.454 10.910 ( 7.046 0.306 8.183) 10.803 11.390 ( -0.918 4.040 -2.341) 4.759 11.706 ( -1.863 5.626 0.785) 5.978 12.143 ( 1.413 -2.726 11.344) 11.752 12.629 ( 0.970 -1.648 -1.767) 2.604 13.620 ( 0.681 -0.037 -1.259) 1.432 13.806 ( -1.555 1.386 0.866) 2.256 14.412 ( -0.034 -0.782 1.666) 1.841 14.892 ( 0.387 1.667 2.349) 2.907 15.689 ( -1.696 -0.120 0.058) 1.701 15.952 ( -0.638 5.216 -0.543) 5.283 16.084 ( 3.206 8.063 1.593) 8.822 16.245 ( 1.554 2.324 -0.529) 2.846 16.283 ( -0.007 3.642 -2.493) 4.414 16.787 ( -2.154 5.049 0.764) 5.542 17.786 ( -4.985 -5.206 -0.278) 7.213 17.885 ( -5.395 4.195 -0.446) 6.848 18.125 ( -0.626 0.240 1.670) 1.799 18.308 ( 7.436 1.697 -3.189) 8.267 18.942 ( -9.321 -1.637 0.567) 9.481 19.217 ( 2.552 -0.770 6.103) 6.659 19.802 ( 7.786 13.276 -12.043) 19.543 20.311 ( 0.438 1.341 4.948) 5.145 27.657 ( -0.549 3.174 -2.187) 3.893 28.318 ( -1.009 0.193 -0.772) 1.285 29.249 ( 0.796 5.152 0.110) 5.215 29.542 ( -3.625 5.676 0.213) 6.738 29.611 ( 1.589 4.114 -1.988) 4.837 29.752 ( 0.873 -1.130 -1.250) 1.897 30.046 ( 0.798 -7.051 -1.497) 7.252 30.266 ( -0.145 6.820 -1.904) 7.082 30.491 ( -3.963 0.821 1.162) 4.211 30.585 ( -0.307 -5.127 -3.089) 5.994 31.159 ( -3.299 -7.588 -1.425) 8.396 31.715 ( 7.980 10.727 2.404) 13.585 32.008 ( -0.655 5.746 0.639) 5.818 32.732 ( 6.059 -44.208 1.486) 44.647 34.007 ( -13.440 -7.541 -30.124) 33.837 34.856 ( 13.692 -12.122 34.697) 39.221 ======================= Grid point 297 (153/160) ======================= q-point: (-0.22 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -18.296 -5.919 8.178) 20.896 2.269 ( -34.801 -11.569 -11.731) 38.504 2.893 ( 3.095 -16.815 7.149) 18.532 3.026 ( 5.757 -5.045 -6.566) 10.085 3.136 ( -2.262 -32.011 1.823) 32.142 3.293 ( -2.056 -34.857 0.706) 34.925 3.656 ( -0.108 -23.279 1.526) 23.330 3.824 ( -8.335 -25.082 2.295) 26.530 4.007 ( -1.876 -28.328 -1.419) 28.426 4.169 ( 0.781 -13.734 3.992) 14.323 4.322 ( 6.134 -33.561 -2.920) 34.241 4.582 ( 10.206 -6.002 4.825) 12.785 4.835 ( 3.059 -17.377 5.807) 18.575 4.903 ( 8.920 -13.330 -6.235) 17.208 5.030 ( 2.779 -13.404 0.382) 13.694 5.198 ( -5.445 -9.427 1.061) 10.938 5.533 ( 4.698 -1.953 -0.135) 5.089 5.755 ( -0.782 -6.911 -2.143) 7.278 6.032 ( -5.908 9.411 -1.286) 11.186 6.311 ( 0.837 -4.140 -1.091) 4.362 6.512 ( -0.812 1.195 -1.788) 2.299 6.642 ( -3.156 1.898 0.999) 3.815 6.772 ( 2.615 5.797 0.387) 6.372 6.897 ( 1.676 -4.699 -6.618) 8.287 7.210 ( -4.946 5.236 -8.161) 10.885 7.481 ( 8.760 6.063 -1.541) 10.764 7.606 ( -9.552 2.279 4.200) 10.680 8.193 ( -0.456 -1.465 -0.422) 1.591 8.496 ( 1.008 -1.701 0.442) 2.026 8.532 ( 1.094 -3.456 1.218) 3.824 8.807 ( -3.847 -2.469 -1.270) 4.744 9.104 ( -1.199 -3.960 -1.192) 4.305 9.283 ( 2.081 5.704 4.525) 7.572 9.396 ( -0.118 -6.166 4.129) 7.422 9.715 ( 4.578 -6.347 2.406) 8.187 10.090 ( -4.533 -1.152 1.693) 4.974 10.289 ( -4.243 -10.678 -1.329) 11.566 10.584 ( -4.074 -9.901 -4.800) 11.733 10.859 ( 9.370 -3.094 -6.185) 11.645 11.112 ( 13.258 -13.957 -9.369) 21.409 11.269 ( -1.147 6.348 -3.122) 7.166 11.580 ( -1.901 7.917 1.842) 8.348 12.354 ( 7.907 -3.417 19.737) 21.535 12.655 ( 0.595 -2.369 -2.857) 3.758 13.619 ( 1.215 -0.136 -1.567) 1.988 13.740 ( -3.892 4.361 -0.695) 5.886 14.447 ( 0.663 -1.049 2.331) 2.641 14.884 ( 0.895 2.958 4.382) 5.362 15.664 ( -2.504 2.147 1.204) 3.511 15.839 ( 0.249 5.991 -0.408) 6.010 15.974 ( 3.275 8.971 2.355) 9.837 16.160 ( 1.442 6.269 -6.214) 8.944 16.219 ( 0.906 3.852 4.651) 6.107 16.683 ( -2.780 5.143 0.843) 5.907 17.740 ( -8.700 5.011 0.992) 10.089 17.842 ( -4.209 -5.103 -0.579) 6.640 18.149 ( 1.795 -0.357 1.665) 2.474 18.279 ( 4.265 2.162 -7.817) 9.163 18.912 ( -7.049 -1.698 1.222) 7.353 19.230 ( -4.221 5.121 3.350) 7.434 19.582 ( 8.616 7.236 -5.987) 12.745 20.300 ( -1.869 2.191 1.951) 3.479 27.598 ( -0.930 1.927 1.354) 2.532 28.295 ( -2.075 -0.096 -1.510) 2.568 29.192 ( 0.443 1.550 -0.190) 1.623 29.464 ( -2.726 0.857 0.240) 2.868 29.555 ( 1.403 1.492 -3.943) 4.443 29.746 ( 0.585 0.724 -1.988) 2.195 30.012 ( 0.499 8.413 -0.675) 8.454 30.124 ( -0.232 10.144 4.379) 11.051 30.467 ( -2.417 -0.679 -0.616) 2.585 30.652 ( 0.002 -2.939 -0.275) 2.952 31.253 ( -6.009 -4.670 -0.376) 7.620 31.801 ( 10.345 -2.615 1.508) 10.777 31.968 ( 4.716 -7.362 -0.274) 8.747 33.519 ( 7.381 -37.382 1.729) 38.143 33.877 ( -13.077 -13.449 -24.898) 31.174 35.416 ( 16.678 -14.319 19.731) 29.538 ======================= Grid point 298 (154/160) ======================= q-point: (-0.11 -0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.704 ( -13.966 -4.850 5.562) 15.796 2.181 ( -23.078 -11.938 -2.885) 26.142 3.086 ( 4.605 -1.945 -4.658) 6.833 3.197 ( 3.413 -12.267 4.677) 13.565 3.623 ( -3.645 -20.575 2.592) 21.055 3.683 ( -2.860 -16.308 -0.561) 16.567 3.966 ( -0.039 -19.380 -4.832) 19.973 4.046 ( 2.225 -16.838 -0.022) 16.984 4.333 ( 9.590 2.250 6.087) 11.579 4.487 ( -3.732 -9.554 2.498) 10.557 4.669 ( 4.540 -2.867 -0.260) 5.375 4.760 ( -0.196 -5.545 3.491) 6.555 4.932 ( 5.065 -8.657 -4.938) 11.179 5.082 ( -4.849 0.873 5.034) 7.044 5.217 ( -0.501 -13.432 -9.216) 16.298 5.508 ( 3.759 -6.284 5.373) 9.083 5.722 ( 0.964 -13.674 2.575) 13.948 5.810 ( -9.916 3.320 1.928) 10.634 6.086 ( 7.509 -24.625 1.099) 25.768 6.361 ( -6.620 -12.157 -7.178) 15.593 6.593 ( 0.709 -6.916 -2.068) 7.254 6.618 ( 3.066 7.662 -0.720) 8.284 6.708 ( -1.200 -7.537 2.149) 7.928 6.943 ( -7.911 -8.306 -13.817) 17.957 7.121 ( -1.007 -3.871 -1.932) 4.442 7.421 ( 4.173 1.778 -2.823) 5.342 7.668 ( 0.385 -4.128 10.130) 10.945 8.224 ( 1.933 -2.067 1.120) 3.044 8.481 ( -0.858 1.443 -3.212) 3.624 8.585 ( 0.918 -1.335 -1.031) 1.921 8.880 ( -3.643 -7.985 4.150) 9.708 9.185 ( -0.963 -6.283 0.547) 6.380 9.263 ( 5.711 0.223 -0.916) 5.788 9.571 ( -1.589 -7.592 4.753) 9.097 9.788 ( -0.251 1.222 1.299) 1.801 10.066 ( 1.790 4.310 5.403) 7.140 10.416 ( -2.471 -12.291 -3.552) 13.030 10.660 ( -4.360 -2.911 -2.395) 5.764 10.886 ( 4.330 1.115 -0.120) 4.473 11.120 ( -2.261 4.338 -7.026) 8.561 11.241 ( 11.260 2.591 -13.465) 17.743 11.470 ( -0.875 4.296 1.278) 4.566 12.556 ( 8.445 6.266 15.581) 18.798 12.678 ( 0.405 -2.913 -1.580) 3.339 13.577 ( -4.542 3.106 -1.477) 5.697 13.660 ( 0.553 -0.206 -1.220) 1.355 14.484 ( 0.786 -0.698 1.987) 2.248 14.863 ( 0.828 3.690 3.452) 5.120 15.593 ( -1.153 5.272 2.925) 6.138 15.793 ( 0.628 0.182 -2.507) 2.590 15.851 ( 0.335 7.082 -1.718) 7.295 16.062 ( 2.833 3.301 -1.902) 4.747 16.234 ( 4.668 2.179 9.590) 10.886 16.577 ( -4.409 4.401 -1.124) 6.330 17.621 ( -7.063 2.498 2.864) 8.020 17.867 ( -2.413 -1.708 -2.011) 3.576 18.138 ( 0.846 2.247 -3.392) 4.156 18.254 ( 1.697 -2.554 -4.763) 5.664 18.895 ( -5.247 -0.002 4.136) 6.681 19.094 ( -3.835 3.062 -4.665) 6.771 19.604 ( 6.157 0.505 4.340) 7.550 20.247 ( -2.994 1.797 -0.774) 3.577 27.598 ( 0.278 0.221 3.180) 3.199 28.274 ( -1.782 -0.522 -1.307) 2.271 29.194 ( 1.229 -0.571 -0.016) 1.355 29.455 ( -2.266 -1.852 -1.054) 3.111 29.531 ( 2.009 -0.296 -3.483) 4.031 29.711 ( -0.188 2.609 -1.409) 2.971 29.866 ( 1.862 7.309 -0.542) 7.562 29.979 ( -1.070 10.485 5.742) 12.002 30.467 ( -1.302 -1.369 0.394) 1.930 30.686 ( 0.946 -1.017 -0.063) 1.390 31.215 ( -3.291 2.881 0.423) 4.394 31.805 ( -0.341 2.762 3.040) 4.122 32.356 ( 11.776 -20.119 -1.113) 23.338 33.773 ( -8.714 -8.076 -13.637) 18.087 34.158 ( 2.011 -25.822 -1.218) 25.929 35.831 ( 13.761 -9.259 4.432) 17.168 ======================= Grid point 305 (155/160) ======================= q-point: (-0.33 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( -14.181 -0.000 3.644) 14.641 1.826 ( -3.937 -0.000 8.945) 9.773 2.044 ( -38.068 -0.000 -7.874) 38.874 2.265 ( -32.941 -0.000 11.197) 34.792 2.472 ( -7.645 -0.000 0.562) 7.665 2.704 ( 0.534 0.000 1.224) 1.335 3.008 ( 7.837 0.000 -5.723) 9.704 3.105 ( 7.890 0.000 -2.974) 8.432 3.266 ( 3.280 0.000 -1.663) 3.678 3.821 ( 1.798 0.000 8.036) 8.235 3.925 ( -5.641 -0.000 -3.578) 6.680 4.115 ( 11.804 0.000 -5.145) 12.877 4.556 ( 10.282 0.000 3.375) 10.821 4.716 ( 5.296 0.000 -1.494) 5.502 4.994 ( 1.676 0.000 7.871) 8.048 5.249 ( 1.237 0.000 -3.033) 3.276 5.542 ( 1.722 0.000 -4.292) 4.624 5.757 ( 3.341 0.000 -2.937) 4.448 6.183 ( 8.037 0.000 2.988) 8.575 6.283 ( -4.311 -0.000 -2.281) 4.877 6.611 ( -6.742 -0.000 -7.749) 10.271 6.658 ( -6.923 -0.000 5.232) 8.678 6.816 ( 6.549 0.000 -0.756) 6.592 6.924 ( 0.518 0.000 -4.015) 4.049 7.389 ( -2.085 -0.000 -5.912) 6.269 7.752 ( -5.735 -0.000 -8.547) 10.293 7.813 ( -5.948 -0.000 0.225) 5.952 7.956 ( 6.192 0.000 6.191) 8.756 8.361 ( -5.529 -0.000 -0.289) 5.536 8.466 ( 4.507 0.000 4.450) 6.334 8.876 ( 0.991 0.000 -5.058) 5.155 9.198 ( 0.801 0.000 -3.461) 3.552 9.288 ( 4.555 0.000 10.419) 11.371 9.457 ( 5.334 0.000 1.890) 5.659 9.747 ( -1.212 -0.000 -2.590) 2.860 9.812 ( -0.129 -0.000 -3.335) 3.337 9.825 ( -6.299 -0.000 -9.975) 11.798 10.146 ( -1.700 -0.000 -0.638) 1.816 10.574 ( -1.776 -0.000 -3.820) 4.213 11.041 ( 7.160 0.000 8.358) 11.005 11.395 ( -1.597 -0.000 -3.214) 3.589 11.741 ( -2.907 -0.000 1.301) 3.185 12.264 ( 6.345 0.000 20.880) 21.823 12.611 ( 1.497 0.000 -2.309) 2.752 13.606 ( -0.187 -0.000 -2.290) 2.298 13.832 ( 0.742 0.000 2.259) 2.378 14.428 ( 0.931 0.000 3.177) 3.310 14.933 ( 0.150 0.000 5.263) 5.265 15.679 ( -2.285 -0.000 2.059) 3.076 15.991 ( -0.402 -0.000 -0.439) 0.595 16.196 ( 4.391 0.000 1.444) 4.623 16.267 ( 2.072 0.000 -1.832) 2.766 16.295 ( -0.647 -0.000 -2.702) 2.779 16.822 ( -3.175 -0.000 1.470) 3.498 17.686 ( -5.992 -0.000 -1.335) 6.139 17.886 ( -4.296 -0.000 0.196) 4.301 18.128 ( 0.045 0.000 0.017) 0.048 18.342 ( 3.885 0.000 -5.318) 6.586 18.861 ( -6.827 -0.000 -0.210) 6.830 19.276 ( 0.775 0.000 7.741) 7.779 19.875 ( 10.177 0.000 -19.889) 22.341 20.391 ( 1.402 0.000 5.520) 5.695 27.655 ( -2.375 -0.000 -2.214) 3.247 28.306 ( -1.290 -0.000 -1.345) 1.863 29.330 ( 2.330 0.000 1.097) 2.575 29.655 ( 0.573 0.000 -0.335) 0.664 29.690 ( 0.358 0.000 -2.313) 2.341 29.697 ( -0.082 -0.000 0.700) 0.704 29.761 ( -5.307 -0.000 -16.639) 17.465 30.294 ( 1.054 0.000 -0.777) 1.309 30.497 ( -6.065 -0.000 6.909) 9.193 30.516 ( -3.394 -0.000 -2.162) 4.024 31.089 ( -2.747 -0.000 0.575) 2.807 31.979 ( 0.764 0.000 -0.103) 0.771 32.068 ( -0.467 -0.000 0.472) 0.664 32.313 ( 13.954 0.000 9.422) 16.838 33.592 ( -12.614 -0.000 -31.781) 34.193 35.136 ( 14.275 0.000 34.517) 37.352 ======================= Grid point 306 (156/160) ======================= q-point: (-0.22 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -19.389 -15.095 12.364) 27.508 1.763 ( -34.681 -9.833 0.278) 36.049 2.353 ( -2.262 -45.620 9.318) 46.617 2.466 ( -16.111 -40.091 10.654) 44.501 2.846 ( 3.671 -13.416 1.281) 13.968 2.882 ( -17.020 -46.792 4.141) 49.963 3.058 ( 9.127 -1.198 -0.939) 9.253 3.382 ( 4.034 -17.312 1.788) 17.866 3.528 ( 2.990 -37.502 -8.587) 38.588 3.797 ( -11.729 -1.989 -11.873) 16.807 4.065 ( 8.463 -15.682 5.652) 18.695 4.351 ( 9.965 -23.444 -1.571) 25.523 4.663 ( 5.695 -2.668 1.782) 6.536 4.789 ( 9.074 -3.962 -3.893) 10.639 5.045 ( 8.454 3.279 -4.463) 10.106 5.204 ( -7.469 2.584 10.073) 12.803 5.546 ( 4.907 -0.264 -2.296) 5.424 5.720 ( 1.689 2.312 -3.506) 4.527 6.131 ( -4.468 6.842 -1.701) 8.347 6.291 ( -2.067 0.408 -1.319) 2.485 6.434 ( -7.560 0.005 -9.951) 12.498 6.647 ( -8.549 0.200 4.765) 9.789 6.812 ( 3.309 2.817 -1.322) 4.542 6.923 ( 5.020 1.932 -3.913) 6.652 7.252 ( 0.048 9.164 -5.457) 10.666 7.580 ( -4.227 5.605 -7.376) 10.182 7.698 ( -0.196 5.044 6.702) 8.390 8.132 ( 1.264 -5.681 2.005) 6.156 8.396 ( -4.359 -8.123 -0.070) 9.219 8.533 ( 4.559 -0.237 1.825) 4.917 8.779 ( -0.856 4.888 -5.935) 7.736 9.081 ( -1.323 4.505 -0.652) 4.740 9.385 ( 3.969 -0.656 8.688) 9.574 9.454 ( -4.903 10.333 2.216) 11.650 9.639 ( 5.407 -8.665 4.098) 11.005 9.884 ( -7.110 -14.300 -0.601) 15.981 10.126 ( -1.619 -7.026 -1.318) 7.329 10.257 ( 5.084 -21.926 -17.864) 28.735 10.641 ( 4.614 -12.859 -4.887) 14.509 11.123 ( 4.745 2.079 5.257) 7.380 11.326 ( -0.528 3.844 -2.566) 4.652 11.686 ( -3.105 4.826 2.167) 6.134 12.545 ( 12.800 -3.640 23.307) 26.839 12.619 ( 3.656 -0.901 -1.666) 4.117 13.599 ( 0.846 -1.024 -1.853) 2.280 13.815 ( 0.827 5.180 0.824) 5.310 14.467 ( 1.532 -0.326 3.627) 3.951 14.980 ( 2.246 1.713 8.755) 9.200 15.674 ( -2.650 1.021 3.537) 4.536 15.945 ( 0.067 4.690 0.369) 4.705 16.170 ( 3.445 7.835 -0.307) 8.565 16.225 ( 1.794 4.479 -3.270) 5.828 16.281 ( 1.739 0.152 0.964) 1.994 16.759 ( -3.740 4.801 1.953) 6.391 17.671 ( -6.372 -4.311 -1.947) 7.936 17.816 ( -3.702 4.291 1.597) 5.888 18.135 ( 0.678 -1.693 -2.271) 2.912 18.281 ( -1.860 2.850 -7.703) 8.421 18.837 ( -2.847 -2.141 -0.714) 3.633 19.275 ( -7.166 3.889 -0.479) 8.167 19.730 ( 7.290 8.474 -8.996) 14.348 20.367 ( -1.997 4.594 2.750) 5.715 27.619 ( -2.322 0.788 2.210) 3.301 28.278 ( -1.455 0.558 -0.947) 1.823 29.271 ( 1.450 7.428 0.139) 7.570 29.438 ( -4.491 1.955 -4.896) 6.925 29.604 ( 1.270 4.706 -1.803) 5.197 29.727 ( 0.085 -1.396 -2.555) 2.913 29.998 ( 1.626 -13.433 -4.707) 14.327 30.284 ( -0.703 4.869 4.661) 6.777 30.467 ( -1.948 1.796 3.557) 4.436 30.530 ( -4.309 -7.011 0.434) 8.241 31.097 ( -3.118 -4.537 0.093) 5.506 31.895 ( 10.187 3.400 0.689) 10.761 32.007 ( -0.977 5.648 0.940) 5.809 32.928 ( 11.884 -38.954 3.949) 40.918 33.384 ( -11.026 -10.981 -25.747) 30.085 35.505 ( 13.104 -6.343 17.881) 23.059 ======================= Grid point 307 (157/160) ======================= q-point: (-0.11 -0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( -21.025 -7.168 11.881) 25.191 1.853 ( -17.079 -13.585 18.500) 28.609 2.922 ( -2.718 -12.814 -3.029) 13.444 3.132 ( -3.997 -31.757 6.704) 32.702 3.192 ( 9.948 -8.193 2.854) 13.199 3.250 ( -3.442 -29.337 0.120) 29.538 3.569 ( -6.771 -29.108 -2.705) 30.007 3.750 ( -2.431 -20.857 -2.760) 21.179 3.871 ( -8.362 -40.099 2.949) 41.068 4.187 ( 2.039 -40.263 -6.196) 40.788 4.431 ( 8.661 -10.748 1.742) 13.913 4.740 ( 0.333 -2.987 -1.891) 3.551 4.871 ( 9.450 -9.584 -13.483) 19.051 4.973 ( 0.896 -2.380 -3.418) 4.260 5.073 ( 3.169 -22.908 5.647) 23.806 5.230 ( 3.506 -12.627 7.729) 15.214 5.625 ( 3.936 -1.539 3.964) 5.794 5.704 ( -2.667 -6.448 -3.356) 7.743 5.978 ( -2.821 6.657 3.759) 8.149 6.120 ( -9.612 -1.629 -10.775) 14.530 6.442 ( -3.178 -5.746 -4.141) 7.763 6.610 ( -7.001 -0.754 -0.109) 7.042 6.756 ( -1.963 0.805 -5.861) 6.233 6.826 ( 5.001 9.382 0.255) 10.635 7.128 ( 3.065 3.974 1.399) 5.210 7.469 ( 1.511 2.805 -2.461) 4.026 7.723 ( 3.188 -0.187 6.605) 7.336 8.204 ( -0.284 -2.578 0.795) 2.713 8.479 ( -1.481 -3.182 -1.868) 3.976 8.537 ( 0.475 0.907 -3.441) 3.590 8.752 ( -0.655 -4.644 2.784) 5.454 9.067 ( -0.500 -4.234 -1.284) 4.452 9.329 ( -1.221 3.908 1.503) 4.361 9.497 ( 1.193 -3.704 4.425) 5.892 9.837 ( 2.939 -2.647 4.730) 6.166 10.048 ( -4.551 -10.509 4.697) 12.378 10.198 ( -2.328 -7.766 -3.413) 8.796 10.456 ( 1.005 -12.452 -8.864) 15.318 10.864 ( 7.905 -8.941 -12.275) 17.120 11.093 ( -2.115 3.563 -4.803) 6.343 11.280 ( 5.645 2.049 -0.277) 6.012 11.576 ( -2.412 7.117 2.551) 7.936 12.624 ( 1.433 -1.087 -3.119) 3.600 12.884 ( 17.795 0.817 17.069) 24.671 13.600 ( -2.172 3.251 -3.000) 4.929 13.695 ( 1.768 5.525 1.304) 5.946 14.507 ( 1.266 0.001 3.046) 3.298 15.005 ( 3.620 6.418 8.098) 10.948 15.640 ( -3.402 2.478 2.399) 4.845 15.869 ( 1.864 5.626 1.832) 6.203 15.997 ( -0.144 10.847 -4.766) 11.849 16.151 ( 4.468 5.530 0.666) 7.140 16.332 ( 4.536 -0.907 4.388) 6.376 16.651 ( -3.161 6.713 2.418) 7.804 17.628 ( -6.518 2.326 1.020) 6.995 17.785 ( -2.150 -3.092 -0.492) 3.798 18.122 ( -5.984 2.489 -10.662) 12.477 18.169 ( 0.037 -3.321 -1.979) 3.866 18.867 ( -0.042 -2.652 0.498) 2.699 19.057 ( -11.486 4.164 -6.234) 13.716 19.668 ( -0.687 2.542 2.891) 3.910 20.305 ( 0.591 4.154 3.978) 5.782 27.623 ( -0.763 0.485 3.204) 3.329 28.271 ( 1.058 0.422 2.329) 2.593 29.215 ( 2.762 1.298 0.133) 3.054 29.386 ( -2.502 -1.206 -3.873) 4.766 29.548 ( 1.640 2.051 -0.672) 2.711 29.718 ( 0.281 0.485 -2.228) 2.297 30.019 ( 0.074 6.772 0.660) 6.805 30.173 ( -3.451 9.174 4.812) 10.919 30.473 ( 0.655 1.012 4.233) 4.402 30.640 ( 0.337 -5.342 -1.172) 5.480 31.178 ( -3.451 -5.200 0.098) 6.242 31.897 ( -0.435 5.644 2.489) 6.184 32.126 ( 15.708 -16.255 -3.086) 22.814 33.339 ( -12.122 -18.363 -20.671) 30.189 33.714 ( 11.902 -32.509 3.980) 34.847 35.775 ( 7.558 -8.880 -2.244) 11.874 ======================= Grid point 315 (158/160) ======================= q-point: (-0.22 -0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -13.560 -0.000 15.025) 20.240 1.453 ( -29.735 -0.000 16.779) 34.142 1.958 ( 1.039 0.000 11.700) 11.746 2.106 ( -26.898 -0.000 30.880) 40.952 2.319 ( -11.479 -0.000 2.342) 11.716 2.753 ( 2.864 0.000 -1.113) 3.073 3.125 ( 0.995 0.000 -7.501) 7.567 3.136 ( 9.530 0.000 3.100) 10.022 3.253 ( 1.782 0.000 -2.274) 2.889 3.567 ( -12.484 -0.000 -19.927) 23.515 4.035 ( 7.551 0.000 8.538) 11.398 4.227 ( 10.657 0.000 -4.082) 11.412 4.679 ( 4.598 0.000 -2.573) 5.269 4.801 ( 5.972 0.000 -3.359) 6.852 5.054 ( 1.616 0.000 -12.834) 12.935 5.309 ( 0.118 0.000 18.549) 18.549 5.586 ( 7.772 0.000 0.517) 7.789 5.732 ( 2.279 0.000 -4.736) 5.255 6.113 ( -8.831 -0.000 -2.805) 9.266 6.203 ( -20.036 -0.000 -16.921) 26.225 6.302 ( 3.738 0.000 -1.305) 3.960 6.646 ( -6.192 -0.000 7.736) 9.909 6.855 ( 0.095 0.000 -5.657) 5.657 6.960 ( 7.977 0.000 1.153) 8.060 7.361 ( 4.986 0.000 -2.084) 5.404 7.549 ( -1.635 -0.000 -6.473) 6.676 7.706 ( -7.341 -0.000 0.389) 7.352 8.125 ( 0.149 0.000 5.234) 5.236 8.257 ( -6.147 -0.000 -0.566) 6.173 8.604 ( 8.191 0.000 2.888) 8.685 8.789 ( 2.257 0.000 -7.603) 7.931 9.151 ( -1.613 -0.000 -2.509) 2.982 9.483 ( -3.188 -0.000 7.534) 8.181 9.586 ( 6.681 0.000 1.194) 6.787 9.659 ( -2.305 -0.000 -2.758) 3.595 9.673 ( -0.805 -0.000 3.287) 3.384 9.791 ( 1.642 0.000 -2.640) 3.109 10.064 ( -3.476 -0.000 -3.553) 4.971 10.555 ( 1.519 0.000 0.295) 1.548 11.183 ( -1.060 -0.000 -0.802) 1.329 11.369 ( 3.736 0.000 2.347) 4.412 11.717 ( -3.428 -0.000 2.658) 4.338 12.597 ( 2.074 0.000 -1.554) 2.591 12.822 ( 17.807 0.000 18.870) 25.945 13.589 ( 2.076 0.000 -1.203) 2.399 13.895 ( 4.714 0.000 -0.583) 4.750 14.506 ( 1.616 0.000 3.912) 4.233 15.117 ( 8.946 0.000 11.543) 14.603 15.712 ( -0.857 -0.000 7.405) 7.454 15.986 ( 0.149 0.000 0.049) 0.157 16.224 ( -0.797 -0.000 -4.209) 4.284 16.289 ( 3.881 0.000 0.309) 3.893 16.311 ( 5.792 0.000 1.924) 6.103 16.781 ( -5.007 -0.000 1.746) 5.303 17.563 ( -5.166 -0.000 -2.460) 5.722 17.848 ( -3.098 -0.000 2.393) 3.914 18.086 ( 0.616 0.000 -8.712) 8.734 18.219 ( -8.156 -0.000 -5.395) 9.778 18.799 ( 1.470 0.000 -2.735) 3.105 19.196 ( -15.342 -0.000 -8.715) 17.644 19.819 ( 7.194 0.000 -5.002) 8.762 20.417 ( -1.723 -0.000 3.115) 3.560 27.637 ( -0.087 -0.000 4.731) 4.732 28.283 ( 1.561 0.000 3.364) 3.708 29.371 ( -2.045 -0.000 -3.813) 4.327 29.443 ( -1.414 -0.000 -3.409) 3.691 29.663 ( 0.924 0.000 -0.237) 0.954 29.675 ( 1.777 0.000 -3.513) 3.937 29.705 ( -0.378 -0.000 0.832) 0.913 30.339 ( -2.505 -0.000 3.437) 4.253 30.418 ( -6.976 -0.000 -0.183) 6.978 30.533 ( -1.550 -0.000 9.124) 9.255 31.060 ( -2.370 -0.000 0.879) 2.527 31.993 ( 1.195 0.000 -0.104) 1.199 32.066 ( -0.903 -0.000 0.690) 1.136 32.689 ( 9.938 0.000 -0.250) 9.941 33.054 ( 1.101 0.000 -14.586) 14.628 35.611 ( 2.452 0.000 4.525) 5.147 ======================= Grid point 316 (159/160) ======================= q-point: (-0.11 -0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 284 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.356 ( -19.856 -5.562 21.529) 29.811 1.665 ( -7.331 -22.585 27.472) 36.312 2.451 ( -6.772 -37.341 16.375) 41.332 2.503 ( -1.383 -38.250 11.426) 39.944 2.676 ( -15.350 -43.325 6.448) 46.414 2.893 ( 0.527 -14.231 0.841) 14.266 3.217 ( -2.357 -4.716 -3.173) 6.154 3.340 ( -4.740 -27.695 -10.497) 29.994 3.392 ( 3.706 -7.948 -13.715) 16.279 3.501 ( 3.250 -27.772 -0.939) 27.977 4.294 ( 8.664 -14.704 4.942) 17.768 4.458 ( 7.301 -22.008 -3.402) 23.436 4.719 ( 4.750 -4.009 -2.830) 6.829 4.816 ( 3.437 -2.975 -6.796) 8.176 4.925 ( -6.857 2.849 -8.288) 11.128 5.369 ( 3.285 6.327 3.042) 7.750 5.660 ( 4.478 1.531 -0.772) 4.795 5.717 ( 3.749 1.808 5.853) 7.182 5.914 ( -12.161 -1.610 -14.064) 18.662 6.057 ( -4.081 1.992 4.783) 6.595 6.328 ( -1.990 -2.381 -2.228) 3.820 6.614 ( -4.219 2.886 2.687) 5.775 6.753 ( -1.203 6.638 -5.927) 8.980 6.998 ( 5.124 3.568 1.550) 6.434 7.281 ( 3.262 7.745 1.940) 8.625 7.506 ( 3.056 1.841 -2.524) 4.370 7.727 ( -1.504 -4.646 0.866) 4.959 8.143 ( -3.789 -2.423 0.446) 4.520 8.284 ( -6.558 -7.625 -3.129) 10.532 8.663 ( 7.104 6.131 1.712) 9.538 8.756 ( 4.370 -0.044 1.244) 4.543 9.049 ( -0.937 3.331 -0.815) 3.556 9.405 ( -4.845 7.142 2.233) 8.914 9.508 ( -0.318 1.617 2.644) 3.116 9.780 ( -4.184 -12.096 1.197) 12.855 9.814 ( 3.842 -10.777 7.259) 13.549 10.051 ( -2.849 -4.634 -4.301) 6.935 10.136 ( 6.769 -21.683 -11.114) 25.288 10.646 ( 2.431 -9.043 -2.712) 9.749 11.107 ( -4.161 3.313 -4.139) 6.739 11.400 ( 5.217 3.788 3.740) 7.454 11.675 ( -2.796 4.312 3.072) 5.988 12.610 ( 2.721 -0.494 -1.766) 3.281 13.077 ( 13.023 -2.673 8.881) 15.988 13.597 ( 0.480 0.579 -3.119) 3.209 13.860 ( 5.196 6.869 -0.710) 8.642 14.542 ( 0.959 0.236 3.403) 3.543 15.223 ( 9.541 4.984 4.725) 11.755 15.729 ( 0.802 5.486 6.528) 8.565 15.965 ( 0.850 2.711 1.450) 3.190 16.111 ( -1.167 7.810 -4.857) 9.271 16.317 ( 6.755 5.693 1.649) 8.987 16.375 ( 5.783 -0.923 3.788) 6.974 16.733 ( -2.719 2.193 2.560) 4.331 17.552 ( -4.916 -4.226 -2.098) 6.814 17.794 ( -4.211 4.594 2.990) 6.912 17.993 ( -6.905 0.162 -11.485) 13.402 18.111 ( -4.159 -0.198 -3.839) 5.664 18.817 ( 2.586 -2.888 -4.858) 6.215 18.963 ( -16.338 2.837 -1.771) 16.677 19.764 ( -1.036 7.821 2.264) 8.208 20.423 ( 2.234 2.883 7.444) 8.289 27.657 ( 0.692 1.612 1.262) 2.161 28.367 ( 8.586 2.438 11.020) 14.181 29.281 ( -0.520 3.505 0.158) 3.547 29.346 ( 0.908 2.515 -2.194) 3.459 29.608 ( 1.493 3.775 -0.562) 4.098 29.705 ( 0.597 -0.893 -1.383) 1.751 29.998 ( 2.509 -13.476 -1.015) 13.745 30.280 ( -6.063 4.519 2.736) 8.041 30.456 ( -4.121 -12.222 -0.552) 12.910 30.575 ( 2.576 2.786 8.373) 9.193 31.056 ( -2.384 -2.964 0.150) 3.807 31.999 ( -1.357 5.322 0.328) 5.502 32.042 ( 9.123 -5.083 -1.999) 10.633 32.751 ( -12.202 -18.167 -21.030) 30.351 33.396 ( 21.762 -23.486 8.217) 33.056 35.597 ( -10.337 -6.095 -10.496) 15.943 ======================= Grid point 325 (160/160) ======================= q-point: (-0.11 -0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.43e-04 3.43e-04 3.43e-04 3.43e-04 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -7.470 -0.000 22.770) 23.964 1.474 ( -17.269 -0.000 27.848) 32.768 2.134 ( 3.964 0.000 1.927) 4.408 2.243 ( -6.056 -0.000 11.772) 13.239 2.426 ( -0.232 -0.000 45.190) 45.190 2.713 ( -0.825 -0.000 -8.495) 8.535 2.944 ( -14.271 -0.000 -23.311) 27.332 2.972 ( -3.020 -0.000 -7.199) 7.807 3.250 ( 1.648 0.000 -3.107) 3.517 3.418 ( 10.043 0.000 2.158) 10.272 4.245 ( 1.127 0.000 8.991) 9.061 4.347 ( 11.869 0.000 -4.529) 12.704 4.692 ( -0.429 -0.000 -3.821) 3.845 4.744 ( -0.694 -0.000 -11.120) 11.141 4.827 ( -6.039 -0.000 -10.501) 12.114 5.410 ( -3.431 -0.000 -10.392) 10.943 5.627 ( -7.712 -0.000 -13.386) 15.448 5.795 ( 10.622 0.000 6.620) 12.516 5.910 ( 12.864 0.000 11.839) 17.483 6.087 ( -2.908 -0.000 8.130) 8.634 6.282 ( -1.264 -0.000 -2.121) 2.469 6.592 ( -8.948 -0.000 -1.270) 9.037 6.822 ( 3.384 0.000 -1.698) 3.787 7.069 ( 4.577 0.000 1.208) 4.734 7.369 ( 1.646 0.000 -3.013) 3.433 7.569 ( 5.483 0.000 -1.498) 5.684 7.612 ( -5.031 -0.000 1.202) 5.172 8.077 ( -5.992 -0.000 -1.237) 6.118 8.161 ( -4.112 -0.000 -0.859) 4.201 8.778 ( 3.367 0.000 -2.950) 4.476 8.820 ( 8.033 0.000 4.538) 9.226 9.076 ( -1.853 -0.000 -0.117) 1.857 9.438 ( -7.658 -0.000 2.077) 7.935 9.576 ( -2.044 -0.000 -0.986) 2.269 9.705 ( 5.243 0.000 -4.506) 6.913 9.791 ( 1.465 0.000 6.908) 7.062 9.795 ( 2.335 0.000 1.692) 2.884 9.970 ( -3.001 -0.000 -1.620) 3.410 10.599 ( 2.461 0.000 0.711) 2.562 11.066 ( -4.975 -0.000 -4.552) 6.743 11.500 ( 4.206 0.000 3.178) 5.272 11.714 ( -2.117 -0.000 3.237) 3.867 12.623 ( 3.427 0.000 -0.561) 3.473 13.174 ( 7.241 0.000 3.532) 8.057 13.581 ( -0.995 -0.000 -4.000) 4.122 13.935 ( 2.984 0.000 -2.792) 4.086 14.574 ( 0.277 0.000 3.216) 3.228 15.310 ( 3.190 0.000 -6.930) 7.629 15.856 ( 4.597 0.000 4.684) 6.563 15.998 ( 0.575 0.000 0.833) 1.012 16.146 ( -1.139 -0.000 -4.084) 4.240 16.443 ( 6.937 0.000 1.834) 7.175 16.458 ( 7.015 0.000 2.384) 7.409 16.708 ( -6.346 -0.000 0.900) 6.410 17.459 ( -4.175 -0.000 -0.431) 4.197 17.786 ( -8.627 -0.000 -3.058) 9.153 17.922 ( -0.185 -0.000 -0.123) 0.222 18.053 ( -0.457 -0.000 -6.159) 6.176 18.758 ( -3.670 -0.000 0.003) 3.670 18.909 ( -3.417 -0.000 1.769) 3.848 19.877 ( 1.346 0.000 1.550) 2.053 20.527 ( 2.925 0.000 8.564) 9.049 27.677 ( 1.470 0.000 -3.950) 4.214 28.668 ( 23.758 0.000 18.722) 30.248 29.285 ( -1.274 -0.000 0.771) 1.489 29.500 ( 3.735 0.000 0.852) 3.831 29.660 ( 1.987 0.000 -2.544) 3.228 29.678 ( 1.126 0.000 -0.015) 1.126 29.706 ( -0.784 -0.000 0.559) 0.963 30.242 ( -12.491 -0.000 0.613) 12.506 30.324 ( -3.482 -0.000 -0.258) 3.491 30.688 ( 2.247 0.000 8.958) 9.235 31.035 ( -1.427 -0.000 -0.047) 1.428 32.014 ( 1.441 0.000 -0.002) 1.441 32.057 ( -1.276 -0.000 0.504) 1.372 32.337 ( -11.280 -0.000 -19.850) 22.831 33.484 ( 30.645 0.000 11.682) 32.796 35.278 ( -29.970 -0.000 -13.492) 32.867 =================== 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 3/44226 10.0 862.708 354.758 634.842 -0.000 11.499 0.000 3/44226 20.0 159.528 148.401 146.686 0.000 30.130 0.000 3/44226 30.0 65.720 99.029 64.122 0.000 16.774 0.000 3/44226 40.0 37.292 68.840 37.401 0.000 10.483 0.000 3/44226 50.0 24.677 50.802 25.041 0.000 7.087 0.000 3/44226 60.0 17.966 39.538 18.309 0.000 5.130 0.000 3/44226 70.0 13.952 32.067 14.235 0.000 3.926 0.000 3/44226 80.0 11.342 26.841 11.570 0.000 3.139 0.000 3/44226 90.0 9.533 23.022 9.719 0.000 2.597 0.000 3/44226 100.0 8.216 20.130 8.372 0.000 2.207 0.000 3/44226 110.0 7.220 17.874 7.354 0.000 1.914 0.000 3/44226 120.0 6.442 16.071 6.560 0.000 1.689 0.000 3/44226 130.0 5.819 14.600 5.925 0.000 1.510 0.000 3/44226 140.0 5.310 13.379 5.406 0.000 1.366 0.000 3/44226 150.0 4.886 12.350 4.974 0.000 1.247 0.000 3/44226 160.0 4.528 11.471 4.609 0.000 1.147 0.000 3/44226 170.0 4.221 10.713 4.297 0.000 1.062 0.000 3/44226 180.0 3.956 10.052 4.027 0.000 0.989 0.000 3/44226 190.0 3.724 9.472 3.791 0.000 0.925 0.000 3/44226 200.0 3.520 8.958 3.583 0.000 0.870 0.000 3/44226 210.0 3.339 8.500 3.398 0.000 0.821 0.000 3/44226 220.0 3.177 8.089 3.233 0.000 0.778 0.000 3/44226 230.0 3.032 7.719 3.085 0.000 0.739 0.000 3/44226 240.0 2.900 7.384 2.951 0.000 0.704 0.000 3/44226 250.0 2.781 7.079 2.829 0.000 0.673 0.000 3/44226 260.0 2.672 6.800 2.718 0.000 0.644 0.000 3/44226 270.0 2.572 6.544 2.616 0.000 0.618 0.000 3/44226 280.0 2.480 6.309 2.522 0.000 0.594 0.000 3/44226 290.0 2.396 6.092 2.436 0.000 0.572 0.000 3/44226 300.0 2.317 5.890 2.355 0.000 0.552 0.000 3/44226 310.0 2.244 5.703 2.281 0.000 0.534 0.000 3/44226 320.0 2.176 5.528 2.212 0.000 0.516 0.000 3/44226 330.0 2.113 5.365 2.147 0.000 0.500 0.000 3/44226 340.0 2.053 5.212 2.086 0.000 0.486 0.000 3/44226 350.0 1.997 5.069 2.029 0.000 0.472 0.000 3/44226 360.0 1.944 4.933 1.976 0.000 0.459 0.000 3/44226 370.0 1.895 4.806 1.925 0.000 0.446 0.000 3/44226 380.0 1.848 4.685 1.877 0.000 0.435 0.000 3/44226 390.0 1.803 4.571 1.832 0.000 0.424 0.000 3/44226 400.0 1.761 4.463 1.789 0.000 0.414 0.000 3/44226 410.0 1.721 4.360 1.748 0.000 0.404 0.000 3/44226 420.0 1.683 4.263 1.710 0.000 0.395 0.000 3/44226 430.0 1.647 4.169 1.673 0.000 0.386 0.000 3/44226 440.0 1.612 4.081 1.637 0.000 0.378 0.000 3/44226 450.0 1.579 3.996 1.604 0.000 0.370 0.000 3/44226 460.0 1.547 3.914 1.571 0.000 0.362 0.000 3/44226 470.0 1.517 3.836 1.540 0.000 0.355 0.000 3/44226 480.0 1.488 3.762 1.511 0.000 0.348 0.000 3/44226 490.0 1.460 3.690 1.482 0.000 0.341 0.000 3/44226 500.0 1.433 3.621 1.455 0.000 0.335 0.000 3/44226 510.0 1.407 3.555 1.429 0.000 0.329 0.000 3/44226 520.0 1.382 3.491 1.403 0.000 0.323 0.000 3/44226 530.0 1.358 3.430 1.379 0.000 0.317 0.000 3/44226 540.0 1.335 3.371 1.355 0.000 0.312 0.000 3/44226 550.0 1.312 3.314 1.332 0.000 0.306 0.000 3/44226 560.0 1.291 3.258 1.310 0.000 0.301 0.000 3/44226 570.0 1.270 3.205 1.289 0.000 0.297 0.000 3/44226 580.0 1.249 3.153 1.269 0.000 0.292 0.000 3/44226 590.0 1.230 3.104 1.249 0.000 0.287 0.000 3/44226 600.0 1.211 3.055 1.230 0.000 0.283 0.000 3/44226 610.0 1.192 3.008 1.211 0.000 0.278 0.000 3/44226 620.0 1.175 2.963 1.193 0.000 0.274 0.000 3/44226 630.0 1.157 2.919 1.175 0.000 0.270 0.000 3/44226 640.0 1.141 2.876 1.158 0.000 0.266 0.000 3/44226 650.0 1.124 2.835 1.142 0.000 0.263 0.000 3/44226 660.0 1.108 2.795 1.126 0.000 0.259 0.000 3/44226 670.0 1.093 2.755 1.110 0.000 0.255 0.000 3/44226 680.0 1.078 2.717 1.095 0.000 0.252 0.000 3/44226 690.0 1.064 2.680 1.080 0.000 0.248 0.000 3/44226 700.0 1.049 2.644 1.066 0.000 0.245 0.000 3/44226 710.0 1.036 2.609 1.052 0.000 0.242 0.000 3/44226 720.0 1.022 2.575 1.038 0.000 0.239 0.000 3/44226 730.0 1.009 2.542 1.025 0.000 0.236 0.000 3/44226 740.0 0.996 2.509 1.012 0.000 0.233 0.000 3/44226 750.0 0.984 2.478 0.999 0.000 0.230 0.000 3/44226 760.0 0.972 2.447 0.987 0.000 0.227 0.000 3/44226 770.0 0.960 2.417 0.975 0.000 0.224 0.000 3/44226 780.0 0.948 2.388 0.963 0.000 0.222 0.000 3/44226 790.0 0.937 2.359 0.952 0.000 0.219 0.000 3/44226 800.0 0.926 2.331 0.940 0.000 0.217 0.000 3/44226 810.0 0.915 2.304 0.929 0.000 0.214 0.000 3/44226 820.0 0.905 2.277 0.919 0.000 0.212 0.000 3/44226 830.0 0.894 2.251 0.908 0.000 0.209 0.000 3/44226 840.0 0.884 2.226 0.898 0.000 0.207 0.000 3/44226 850.0 0.874 2.201 0.888 0.000 0.205 0.000 3/44226 860.0 0.865 2.176 0.878 0.000 0.202 0.000 3/44226 870.0 0.855 2.152 0.869 0.000 0.200 0.000 3/44226 880.0 0.846 2.129 0.859 0.000 0.198 0.000 3/44226 890.0 0.837 2.106 0.850 0.000 0.196 0.000 3/44226 900.0 0.828 2.084 0.841 0.000 0.194 0.000 3/44226 910.0 0.820 2.062 0.833 0.000 0.192 0.000 3/44226 920.0 0.811 2.041 0.824 0.000 0.190 0.000 3/44226 930.0 0.803 2.020 0.816 0.000 0.188 0.000 3/44226 940.0 0.795 1.999 0.807 0.000 0.186 0.000 3/44226 950.0 0.787 1.979 0.799 0.000 0.184 0.000 3/44226 960.0 0.779 1.959 0.791 0.000 0.182 0.000 3/44226 970.0 0.771 1.940 0.784 0.000 0.181 0.000 3/44226 980.0 0.764 1.921 0.776 0.000 0.179 0.000 3/44226 990.0 0.756 1.902 0.768 0.000 0.177 0.000 3/44226 1000.0 0.749 1.884 0.761 0.000 0.176 0.000 3/44226 Thermal conductivity related properties were written into "kappa-m997.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 15:56:21]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|