# Fileset [LTC-calc.log](https://mdr.nims.go.jp/filesets/8135b975-4e95-4845-afab-620d91a77809/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for KNdPdO3 / C2/m (12) / materials id 558831](https://mdr.nims.go.jp/datasets/b7465ec7-6cf9-4449-973b-3b049c7115af) ## Fulltext ------------------------------------ calculate fc2 ------------------------------------ _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1-------------------------[time 2026-01-08 14:29:04]-------------------------Compiled with OpenMP support (max 128 threads).Running in phonopy.load mode.Python version 3.14.2Spglib version 2.6.1Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".Unit of length: angstromSettings: Supercell: [1 3 2] 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: 48------------------------------ primitive cell ------------------------------Lattice vectors: a 6.591017810002275 -1.960986390000000 0.000000000000000 b 6.591017810002275 1.960986390000000 0.000000000000000 c -1.918015979786121 0.000000000000000 7.198698166752732Atomic positions (fractional): *1 K 0.64264809296477 0.64264809296477 0.06393835728666 39.098 2 K 0.35735190703523 0.35735190703523 0.93606164271334 39.098 *3 Nd 0.35045640497996 0.35045640497996 0.42155573133720 144.242 4 Nd 0.64954359502004 0.64954359502004 0.57844426866280 144.242 *5 Pd 0.99303369774759 0.99303369774759 0.72260530330344 106.420 6 Pd 0.00696630225241 0.00696630225241 0.27739469669655 106.420 *7 O 0.84850169964049 0.84850169964049 0.22205908576650 15.999 *8 O 0.49341933308298 0.49341933308298 0.69057313002306 15.999 *9 O 0.16809615378411 0.16809615378411 0.36668828049520 15.999 10 O 0.15149830035951 0.15149830035951 0.77794091423350 15.999 11 O 0.83190384621588 0.83190384621588 0.63331171950480 15.999 12 O 0.50658066691702 0.50658066691702 0.30942686997694 15.999-------------------------------- unit cell ---------------------------------Lattice vectors: a 13.182035620004550 0.000000000000000 0.000000000000000 b 0.000000000000000 3.921972780000001 0.000000000000000 c -1.918015979786121 0.000000000000000 7.198698166752732Atomic positions (fractional): *1 K 0.14264809296477 0.50000000000000 0.06393835728666 39.098 > 1 2 K 0.35735190703523 0.00000000000000 0.93606164271334 39.098 > 2 3 K 0.64264809296477 0.00000000000000 0.06393835728666 39.098 > 1 4 K 0.85735190703523 0.50000000000000 0.93606164271334 39.098 > 2 *5 Nd 0.35045640497996 0.00000000000000 0.42155573133720 144.242 > 3 6 Nd 0.14954359502004 0.50000000000000 0.57844426866280 144.242 > 4 7 Nd 0.85045640497996 0.50000000000000 0.42155573133720 144.242 > 3 8 Nd 0.64954359502004 0.00000000000000 0.57844426866280 144.242 > 4 *9 Pd 0.49303369774759 0.50000000000000 0.72260530330344 106.420 > 5 10 Pd 0.00696630225241 0.00000000000000 0.27739469669655 106.420 > 6 11 Pd 0.99303369774759 0.00000000000000 0.72260530330344 106.420 > 5 12 Pd 0.50696630225241 0.50000000000000 0.27739469669655 106.420 > 6 *13 O 0.34850169964049 0.50000000000000 0.22205908576650 15.999 > 7 *14 O 0.49341933308298 0.00000000000000 0.69057313002306 15.999 > 8 *15 O 0.16809615378411 0.00000000000000 0.36668828049520 15.999 > 9 16 O 0.15149830035951 0.00000000000000 0.77794091423350 15.999 > 10 17 O 0.33190384621588 0.50000000000000 0.63331171950480 15.999 > 11 18 O 0.00658066691702 0.50000000000000 0.30942686997694 15.999 > 12 19 O 0.84850169964049 0.00000000000000 0.22205908576650 15.999 > 7 20 O 0.99341933308298 0.50000000000000 0.69057313002306 15.999 > 8 21 O 0.66809615378412 0.50000000000000 0.36668828049520 15.999 > 9 22 O 0.65149830035951 0.50000000000000 0.77794091423350 15.999 > 10 23 O 0.83190384621588 0.00000000000000 0.63331171950480 15.999 > 11 24 O 0.50658066691702 0.00000000000000 0.30942686997694 15.999 > 12-------------------------------- super cell --------------------------------Lattice vectors: a 13.182035620004550 0.000000000000000 0.000000000000000 b 0.000000000000000 11.765918340000002 0.000000000000000 c -3.836031959572242 0.000000000000000 14.397396333505464Atomic positions (fractional): *1 K 0.14264809296477 0.16666666666667 0.03196917864333 39.098 > 1 2 K 0.14264809296477 0.50000000000000 0.03196917864333 39.098 > 1 3 K 0.14264809296477 0.83333333333333 0.03196917864333 39.098 > 1 4 K 0.14264809296477 0.16666666666667 0.53196917864333 39.098 > 1 5 K 0.14264809296477 0.50000000000000 0.53196917864333 39.098 > 1 6 K 0.14264809296477 0.83333333333333 0.53196917864333 39.098 > 1 7 K 0.35735190703523 0.00000000000000 0.46803082135667 39.098 > 2 8 K 0.35735190703523 0.33333333333333 0.46803082135667 39.098 > 2 9 K 0.35735190703523 0.66666666666667 0.46803082135667 39.098 > 2 10 K 0.35735190703523 0.00000000000000 0.96803082135667 39.098 > 2 11 K 0.35735190703523 0.33333333333333 0.96803082135667 39.098 > 2 12 K 0.35735190703523 0.66666666666667 0.96803082135667 39.098 > 2 13 K 0.64264809296477 0.00000000000000 0.03196917864333 39.098 > 1 14 K 0.64264809296477 0.33333333333333 0.03196917864333 39.098 > 1 15 K 0.64264809296477 0.66666666666667 0.03196917864333 39.098 > 1 16 K 0.64264809296477 0.00000000000000 0.53196917864333 39.098 > 1 17 K 0.64264809296477 0.33333333333333 0.53196917864333 39.098 > 1 18 K 0.64264809296477 0.66666666666667 0.53196917864333 39.098 > 1 19 K 0.85735190703523 0.16666666666667 0.46803082135667 39.098 > 2 20 K 0.85735190703523 0.50000000000000 0.46803082135667 39.098 > 2 21 K 0.85735190703523 0.83333333333333 0.46803082135667 39.098 > 2 22 K 0.85735190703523 0.16666666666667 0.96803082135667 39.098 > 2 23 K 0.85735190703523 0.50000000000000 0.96803082135667 39.098 > 2 24 K 0.85735190703523 0.83333333333333 0.96803082135667 39.098 > 2 *25 Nd 0.35045640497996 0.00000000000000 0.21077786566860 144.242 > 3 26 Nd 0.35045640497996 0.33333333333333 0.21077786566860 144.242 > 3 27 Nd 0.35045640497996 0.66666666666667 0.21077786566860 144.242 > 3 28 Nd 0.35045640497996 0.00000000000000 0.71077786566860 144.242 > 3 29 Nd 0.35045640497996 0.33333333333333 0.71077786566860 144.242 > 3 30 Nd 0.35045640497996 0.66666666666667 0.71077786566860 144.242 > 3 31 Nd 0.14954359502004 0.16666666666667 0.28922213433140 144.242 > 4 32 Nd 0.14954359502004 0.50000000000000 0.28922213433140 144.242 > 4 33 Nd 0.14954359502004 0.83333333333333 0.28922213433140 144.242 > 4 34 Nd 0.14954359502004 0.16666666666667 0.78922213433140 144.242 > 4 35 Nd 0.14954359502004 0.50000000000000 0.78922213433140 144.242 > 4 36 Nd 0.14954359502004 0.83333333333333 0.78922213433140 144.242 > 4 37 Nd 0.85045640497996 0.16666666666667 0.21077786566860 144.242 > 3 38 Nd 0.85045640497996 0.50000000000000 0.21077786566860 144.242 > 3 39 Nd 0.85045640497996 0.83333333333333 0.21077786566860 144.242 > 3 40 Nd 0.85045640497996 0.16666666666667 0.71077786566860 144.242 > 3 41 Nd 0.85045640497996 0.50000000000000 0.71077786566860 144.242 > 3 42 Nd 0.85045640497996 0.83333333333333 0.71077786566860 144.242 > 3 43 Nd 0.64954359502004 0.00000000000000 0.28922213433140 144.242 > 4 44 Nd 0.64954359502004 0.33333333333333 0.28922213433140 144.242 > 4 45 Nd 0.64954359502004 0.66666666666667 0.28922213433140 144.242 > 4 46 Nd 0.64954359502004 0.00000000000000 0.78922213433140 144.242 > 4 47 Nd 0.64954359502004 0.33333333333333 0.78922213433140 144.242 > 4 48 Nd 0.64954359502004 0.66666666666667 0.78922213433140 144.242 > 4 *49 Pd 0.49303369774759 0.16666666666667 0.36130265165172 106.420 > 5 50 Pd 0.49303369774759 0.50000000000000 0.36130265165172 106.420 > 5 51 Pd 0.49303369774759 0.83333333333333 0.36130265165172 106.420 > 5 52 Pd 0.49303369774759 0.16666666666667 0.86130265165172 106.420 > 5 53 Pd 0.49303369774759 0.50000000000000 0.86130265165172 106.420 > 5 54 Pd 0.49303369774759 0.83333333333333 0.86130265165172 106.420 > 5 55 Pd 0.00696630225241 0.00000000000000 0.13869734834828 106.420 > 6 56 Pd 0.00696630225241 0.33333333333333 0.13869734834828 106.420 > 6 57 Pd 0.00696630225241 0.66666666666667 0.13869734834828 106.420 > 6 58 Pd 0.00696630225241 0.00000000000000 0.63869734834828 106.420 > 6 59 Pd 0.00696630225241 0.33333333333333 0.63869734834828 106.420 > 6 60 Pd 0.00696630225241 0.66666666666667 0.63869734834828 106.420 > 6 61 Pd 0.99303369774759 0.00000000000000 0.36130265165172 106.420 > 5 62 Pd 0.99303369774759 0.33333333333333 0.36130265165172 106.420 > 5 63 Pd 0.99303369774759 0.66666666666667 0.36130265165172 106.420 > 5 64 Pd 0.99303369774759 0.00000000000000 0.86130265165172 106.420 > 5 65 Pd 0.99303369774759 0.33333333333333 0.86130265165172 106.420 > 5 66 Pd 0.99303369774759 0.66666666666667 0.86130265165172 106.420 > 5 67 Pd 0.50696630225241 0.16666666666667 0.13869734834828 106.420 > 6 68 Pd 0.50696630225241 0.50000000000000 0.13869734834828 106.420 > 6 69 Pd 0.50696630225241 0.83333333333333 0.13869734834828 106.420 > 6 70 Pd 0.50696630225241 0.16666666666667 0.63869734834828 106.420 > 6 71 Pd 0.50696630225241 0.50000000000000 0.63869734834828 106.420 > 6 72 Pd 0.50696630225241 0.83333333333333 0.63869734834828 106.420 > 6 *73 O 0.34850169964049 0.16666666666667 0.11102954288325 15.999 > 7 74 O 0.34850169964049 0.50000000000000 0.11102954288325 15.999 > 7 75 O 0.34850169964049 0.83333333333333 0.11102954288325 15.999 > 7 76 O 0.34850169964049 0.16666666666667 0.61102954288325 15.999 > 7 77 O 0.34850169964049 0.50000000000000 0.61102954288325 15.999 > 7 78 O 0.34850169964049 0.83333333333333 0.61102954288325 15.999 > 7 *79 O 0.49341933308298 0.00000000000000 0.34528656501153 15.999 > 8 80 O 0.49341933308298 0.33333333333333 0.34528656501153 15.999 > 8 81 O 0.49341933308298 0.66666666666667 0.34528656501153 15.999 > 8 82 O 0.49341933308298 0.00000000000000 0.84528656501153 15.999 > 8 83 O 0.49341933308298 0.33333333333333 0.84528656501153 15.999 > 8 84 O 0.49341933308298 0.66666666666667 0.84528656501153 15.999 > 8 *85 O 0.16809615378411 0.00000000000000 0.18334414024760 15.999 > 9 86 O 0.16809615378411 0.33333333333333 0.18334414024760 15.999 > 9 87 O 0.16809615378411 0.66666666666667 0.18334414024760 15.999 > 9 88 O 0.16809615378411 0.00000000000000 0.68334414024760 15.999 > 9 89 O 0.16809615378411 0.33333333333333 0.68334414024760 15.999 > 9 90 O 0.16809615378411 0.66666666666667 0.68334414024760 15.999 > 9 91 O 0.15149830035951 0.00000000000000 0.38897045711675 15.999 > 10 92 O 0.15149830035951 0.33333333333333 0.38897045711675 15.999 > 10 93 O 0.15149830035951 0.66666666666667 0.38897045711675 15.999 > 10 94 O 0.15149830035951 0.00000000000000 0.88897045711675 15.999 > 10 95 O 0.15149830035951 0.33333333333333 0.88897045711675 15.999 > 10 96 O 0.15149830035951 0.66666666666667 0.88897045711675 15.999 > 10 97 O 0.33190384621588 0.16666666666667 0.31665585975240 15.999 > 11 98 O 0.33190384621588 0.50000000000000 0.31665585975240 15.999 > 11 99 O 0.33190384621588 0.83333333333333 0.31665585975240 15.999 > 11 100 O 0.33190384621588 0.16666666666667 0.81665585975240 15.999 > 11 101 O 0.33190384621588 0.50000000000000 0.81665585975240 15.999 > 11 102 O 0.33190384621588 0.83333333333333 0.81665585975240 15.999 > 11 103 O 0.00658066691702 0.16666666666667 0.15471343498847 15.999 > 12 104 O 0.00658066691702 0.50000000000000 0.15471343498847 15.999 > 12 105 O 0.00658066691702 0.83333333333333 0.15471343498847 15.999 > 12 106 O 0.00658066691702 0.16666666666667 0.65471343498847 15.999 > 12 107 O 0.00658066691702 0.50000000000000 0.65471343498847 15.999 > 12 108 O 0.00658066691702 0.83333333333333 0.65471343498847 15.999 > 12 109 O 0.84850169964049 0.00000000000000 0.11102954288325 15.999 > 7 110 O 0.84850169964049 0.33333333333333 0.11102954288325 15.999 > 7 111 O 0.84850169964049 0.66666666666667 0.11102954288325 15.999 > 7 112 O 0.84850169964049 0.00000000000000 0.61102954288325 15.999 > 7 113 O 0.84850169964049 0.33333333333333 0.61102954288325 15.999 > 7 114 O 0.84850169964049 0.66666666666667 0.61102954288325 15.999 > 7 115 O 0.99341933308298 0.16666666666667 0.34528656501153 15.999 > 8 116 O 0.99341933308298 0.50000000000000 0.34528656501153 15.999 > 8 117 O 0.99341933308298 0.83333333333333 0.34528656501153 15.999 > 8 118 O 0.99341933308298 0.16666666666667 0.84528656501153 15.999 > 8 119 O 0.99341933308298 0.50000000000000 0.84528656501153 15.999 > 8 120 O 0.99341933308298 0.83333333333333 0.84528656501153 15.999 > 8 121 O 0.66809615378412 0.16666666666667 0.18334414024760 15.999 > 9 122 O 0.66809615378412 0.50000000000000 0.18334414024760 15.999 > 9 123 O 0.66809615378412 0.83333333333333 0.18334414024760 15.999 > 9 124 O 0.66809615378412 0.16666666666667 0.68334414024760 15.999 > 9 125 O 0.66809615378412 0.50000000000000 0.68334414024760 15.999 > 9 126 O 0.66809615378412 0.83333333333333 0.68334414024760 15.999 > 9 127 O 0.65149830035951 0.16666666666667 0.38897045711675 15.999 > 10 128 O 0.65149830035951 0.50000000000000 0.38897045711675 15.999 > 10 129 O 0.65149830035951 0.83333333333333 0.38897045711675 15.999 > 10 130 O 0.65149830035951 0.16666666666667 0.88897045711675 15.999 > 10 131 O 0.65149830035951 0.50000000000000 0.88897045711675 15.999 > 10 132 O 0.65149830035951 0.83333333333333 0.88897045711675 15.999 > 10 133 O 0.83190384621588 0.00000000000000 0.31665585975240 15.999 > 11 134 O 0.83190384621588 0.33333333333333 0.31665585975240 15.999 > 11 135 O 0.83190384621588 0.66666666666667 0.31665585975240 15.999 > 11 136 O 0.83190384621588 0.00000000000000 0.81665585975240 15.999 > 11 137 O 0.83190384621588 0.33333333333333 0.81665585975240 15.999 > 11 138 O 0.83190384621588 0.66666666666667 0.81665585975240 15.999 > 11 139 O 0.50658066691702 0.00000000000000 0.15471343498847 15.999 > 12 140 O 0.50658066691702 0.33333333333333 0.15471343498847 15.999 > 12 141 O 0.50658066691702 0.66666666666667 0.15471343498847 15.999 > 12 142 O 0.50658066691702 0.00000000000000 0.65471343498847 15.999 > 12 143 O 0.50658066691702 0.33333333333333 0.65471343498847 15.999 > 12 144 O 0.50658066691702 0.66666666666667 0.65471343498847 15.999 > 12----------------------------------------------------------------------------NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".--------------------------- Dielectric constant ---------------------------- 5.6672099 0.0000000 0.1118806 0.0000000 8.4002518 0.0000000 0.1118824 0.0000000 4.3113202-------------------------- Born effective charges -------------------------- 1 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 2 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 3 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 4 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 5 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 6 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 7 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 8 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204 9 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 10 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 11 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 12 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204----------------------------------------------------------------------------Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz".-------------------------------- Symfc start -------------------------------Symfc version 1.5.4 (https://github.com/symfc/symfc)Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024)Computing [2] order force constants.Permutation basis: 432/432Permutation basis: 9324/9324Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2160Number of blocks in projector: 2160Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 565 eigenvectors found.(1) Complementary block size: 10(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 288Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 288Use standard eigh solver.Tree of FC basis block matrices:- (2160, 2131), data: False|-- (288, 288), data: True|-- (288, 288), data: True|-- (336, 330), data: True|-- (336, 330), data: True|-- (336, 330), data: True|-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: True-----Solver_atoms: 1 -- 144 / 144Time (Solver_compr_matrix_reshape): 0.005Solver_block: 100 / 400 - Time: 0.749Solver_block: 200 / 400 - Time: 0.705Solver_block: 300 / 400 - Time: 0.704Solver_block: 400 / 400 - Time: 0.711Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.948--------------------------------- Symfc end --------------------------------Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 432/432Permutation basis: 9324/9324Construct permutation basis matrix.Finding block diagonal structure in projector.Using scipy connected_components.Rank of projector: 2160Number of blocks in projector: 2160Finding block diagonal structure in projector.Using scipy connected_components.Number of blocks in projector (Sum rule): 6--- Eigsh_solver_block: 1 / 6 ---Block_size: 576Use submatrix version of eigh solver.(1) Block: 576 / 576 (2) Block: 250 / 576 (2) 239 eigenvectors found. (2) Block: 500 / 576 (2) 239 eigenvectors found. (2) Block: 576 / 576 (2) 69 eigenvectors found. (2) Complementary block size: 29 (2) Compute compressed projector. (2) Use standard solver. (2) 18 eigenvectors found.(1) 565 eigenvectors found.(1) Complementary block size: 10(1) Compute compressed projector.(1) Use standard solver.(1) 0 eigenvectors found.--- Eigsh_solver_block: 2 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 3 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 4 / 6 ---Block_size: 336Use standard eigh solver.--- Eigsh_solver_block: 5 / 6 ---Block_size: 288Use standard eigh solver.--- Eigsh_solver_block: 6 / 6 ---Block_size: 288Use standard eigh solver.Tree of FC basis block matrices:- (2160, 2131), data: False|-- (288, 288), data: True|-- (288, 288), data: True|-- (336, 330), data: True|-- (336, 330), data: True|-- (336, 330), data: True|-- (576, 565), data: False |-- (576, 565), data: False |-- (576, 18), data: (576, 29) @ (29, 18) |-- (76, 69), data: True |-- (250, 239), data: True |-- (250, 239), data: TrueMax drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) 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 14:29:28]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate fc3 ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 14:29:29]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: force constantsHDF5 data compression filter: gzipCrystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz".Supercell (dim): [1 3 2]Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.]Spacegroup: C2/m (12)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.591017810002275 -1.960986390000000 0.000000000000000 b 6.591017810002275 1.960986390000000 0.000000000000000 c -1.918015979786121 0.000000000000000 7.198698166752732Atomic positions (fractional): 1 K 0.64264809296477 0.64264809296477 0.06393835728666 39.098 2 K 0.35735190703523 0.35735190703523 0.93606164271334 39.098 3 Nd 0.35045640497996 0.35045640497996 0.42155573133720 144.242 4 Nd 0.64954359502004 0.64954359502004 0.57844426866280 144.242 5 Pd 0.99303369774759 0.99303369774759 0.72260530330344 106.420 6 Pd 0.00696630225241 0.00696630225241 0.27739469669655 106.420 7 O 0.84850169964049 0.84850169964049 0.22205908576650 15.999 8 O 0.49341933308298 0.49341933308298 0.69057313002306 15.999 9 O 0.16809615378411 0.16809615378411 0.36668828049520 15.999 10 O 0.15149830035951 0.15149830035951 0.77794091423350 15.999 11 O 0.83190384621588 0.83190384621588 0.63331171950480 15.999 12 O 0.50658066691702 0.50658066691702 0.30942686997694 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 13.182035620004550 0.000000000000000 0.000000000000000 b 0.000000000000000 11.765918340000002 0.000000000000000 c -3.836031959572242 0.000000000000000 14.397396333505464Atomic positions (fractional): 1 K 0.14264809296477 0.16666666666667 0.03196917864333 39.098 > 1 2 K 0.14264809296477 0.50000000000000 0.03196917864333 39.098 > 1 3 K 0.14264809296477 0.83333333333333 0.03196917864333 39.098 > 1 4 K 0.14264809296477 0.16666666666667 0.53196917864333 39.098 > 1 5 K 0.14264809296477 0.50000000000000 0.53196917864333 39.098 > 1 6 K 0.14264809296477 0.83333333333333 0.53196917864333 39.098 > 1 7 K 0.35735190703523 0.00000000000000 0.46803082135667 39.098 > 7 8 K 0.35735190703523 0.33333333333333 0.46803082135667 39.098 > 7 9 K 0.35735190703523 0.66666666666667 0.46803082135667 39.098 > 7 10 K 0.35735190703523 0.00000000000000 0.96803082135667 39.098 > 7 11 K 0.35735190703523 0.33333333333333 0.96803082135667 39.098 > 7 12 K 0.35735190703523 0.66666666666667 0.96803082135667 39.098 > 7 13 K 0.64264809296477 0.00000000000000 0.03196917864333 39.098 > 1 14 K 0.64264809296477 0.33333333333333 0.03196917864333 39.098 > 1 15 K 0.64264809296477 0.66666666666667 0.03196917864333 39.098 > 1 16 K 0.64264809296477 0.00000000000000 0.53196917864333 39.098 > 1 17 K 0.64264809296477 0.33333333333333 0.53196917864333 39.098 > 1 18 K 0.64264809296477 0.66666666666667 0.53196917864333 39.098 > 1 19 K 0.85735190703523 0.16666666666667 0.46803082135667 39.098 > 7 20 K 0.85735190703523 0.50000000000000 0.46803082135667 39.098 > 7 21 K 0.85735190703523 0.83333333333333 0.46803082135667 39.098 > 7 22 K 0.85735190703523 0.16666666666667 0.96803082135667 39.098 > 7 23 K 0.85735190703523 0.50000000000000 0.96803082135667 39.098 > 7 24 K 0.85735190703523 0.83333333333333 0.96803082135667 39.098 > 7 25 Nd 0.35045640497996 0.00000000000000 0.21077786566860 144.242 > 25 26 Nd 0.35045640497996 0.33333333333333 0.21077786566860 144.242 > 25 27 Nd 0.35045640497996 0.66666666666667 0.21077786566860 144.242 > 25 28 Nd 0.35045640497996 0.00000000000000 0.71077786566860 144.242 > 25 29 Nd 0.35045640497996 0.33333333333333 0.71077786566860 144.242 > 25 30 Nd 0.35045640497996 0.66666666666667 0.71077786566860 144.242 > 25 31 Nd 0.14954359502004 0.16666666666667 0.28922213433140 144.242 > 31 32 Nd 0.14954359502004 0.50000000000000 0.28922213433140 144.242 > 31 33 Nd 0.14954359502004 0.83333333333333 0.28922213433140 144.242 > 31 34 Nd 0.14954359502004 0.16666666666667 0.78922213433140 144.242 > 31 35 Nd 0.14954359502004 0.50000000000000 0.78922213433140 144.242 > 31 36 Nd 0.14954359502004 0.83333333333333 0.78922213433140 144.242 > 31 37 Nd 0.85045640497996 0.16666666666667 0.21077786566860 144.242 > 25 38 Nd 0.85045640497996 0.50000000000000 0.21077786566860 144.242 > 25 39 Nd 0.85045640497996 0.83333333333333 0.21077786566860 144.242 > 25 40 Nd 0.85045640497996 0.16666666666667 0.71077786566860 144.242 > 25 41 Nd 0.85045640497996 0.50000000000000 0.71077786566860 144.242 > 25 42 Nd 0.85045640497996 0.83333333333333 0.71077786566860 144.242 > 25 43 Nd 0.64954359502004 0.00000000000000 0.28922213433140 144.242 > 31 44 Nd 0.64954359502004 0.33333333333333 0.28922213433140 144.242 > 31 45 Nd 0.64954359502004 0.66666666666667 0.28922213433140 144.242 > 31 46 Nd 0.64954359502004 0.00000000000000 0.78922213433140 144.242 > 31 47 Nd 0.64954359502004 0.33333333333333 0.78922213433140 144.242 > 31 48 Nd 0.64954359502004 0.66666666666667 0.78922213433140 144.242 > 31 49 Pd 0.49303369774759 0.16666666666667 0.36130265165172 106.420 > 49 50 Pd 0.49303369774759 0.50000000000000 0.36130265165172 106.420 > 49 51 Pd 0.49303369774759 0.83333333333333 0.36130265165172 106.420 > 49 52 Pd 0.49303369774759 0.16666666666667 0.86130265165172 106.420 > 49 53 Pd 0.49303369774759 0.50000000000000 0.86130265165172 106.420 > 49 54 Pd 0.49303369774759 0.83333333333333 0.86130265165172 106.420 > 49 55 Pd 0.00696630225241 0.00000000000000 0.13869734834828 106.420 > 55 56 Pd 0.00696630225241 0.33333333333333 0.13869734834828 106.420 > 55 57 Pd 0.00696630225241 0.66666666666667 0.13869734834828 106.420 > 55 58 Pd 0.00696630225241 0.00000000000000 0.63869734834828 106.420 > 55 59 Pd 0.00696630225241 0.33333333333333 0.63869734834828 106.420 > 55 60 Pd 0.00696630225241 0.66666666666667 0.63869734834828 106.420 > 55 61 Pd 0.99303369774759 0.00000000000000 0.36130265165172 106.420 > 49 62 Pd 0.99303369774759 0.33333333333333 0.36130265165172 106.420 > 49 63 Pd 0.99303369774759 0.66666666666667 0.36130265165172 106.420 > 49 64 Pd 0.99303369774759 0.00000000000000 0.86130265165172 106.420 > 49 65 Pd 0.99303369774759 0.33333333333333 0.86130265165172 106.420 > 49 66 Pd 0.99303369774759 0.66666666666667 0.86130265165172 106.420 > 49 67 Pd 0.50696630225241 0.16666666666667 0.13869734834828 106.420 > 55 68 Pd 0.50696630225241 0.50000000000000 0.13869734834828 106.420 > 55 69 Pd 0.50696630225241 0.83333333333333 0.13869734834828 106.420 > 55 70 Pd 0.50696630225241 0.16666666666667 0.63869734834828 106.420 > 55 71 Pd 0.50696630225241 0.50000000000000 0.63869734834828 106.420 > 55 72 Pd 0.50696630225241 0.83333333333333 0.63869734834828 106.420 > 55 73 O 0.34850169964049 0.16666666666667 0.11102954288325 15.999 > 73 74 O 0.34850169964049 0.50000000000000 0.11102954288325 15.999 > 73 75 O 0.34850169964049 0.83333333333333 0.11102954288325 15.999 > 73 76 O 0.34850169964049 0.16666666666667 0.61102954288325 15.999 > 73 77 O 0.34850169964049 0.50000000000000 0.61102954288325 15.999 > 73 78 O 0.34850169964049 0.83333333333333 0.61102954288325 15.999 > 73 79 O 0.49341933308298 0.00000000000000 0.34528656501153 15.999 > 79 80 O 0.49341933308298 0.33333333333333 0.34528656501153 15.999 > 79 81 O 0.49341933308298 0.66666666666667 0.34528656501153 15.999 > 79 82 O 0.49341933308298 0.00000000000000 0.84528656501153 15.999 > 79 83 O 0.49341933308298 0.33333333333333 0.84528656501153 15.999 > 79 84 O 0.49341933308298 0.66666666666667 0.84528656501153 15.999 > 79 85 O 0.16809615378411 0.00000000000000 0.18334414024760 15.999 > 85 86 O 0.16809615378411 0.33333333333333 0.18334414024760 15.999 > 85 87 O 0.16809615378411 0.66666666666667 0.18334414024760 15.999 > 85 88 O 0.16809615378411 0.00000000000000 0.68334414024760 15.999 > 85 89 O 0.16809615378411 0.33333333333333 0.68334414024760 15.999 > 85 90 O 0.16809615378411 0.66666666666667 0.68334414024760 15.999 > 85 91 O 0.15149830035951 0.00000000000000 0.38897045711675 15.999 > 91 92 O 0.15149830035951 0.33333333333333 0.38897045711675 15.999 > 91 93 O 0.15149830035951 0.66666666666667 0.38897045711675 15.999 > 91 94 O 0.15149830035951 0.00000000000000 0.88897045711675 15.999 > 91 95 O 0.15149830035951 0.33333333333333 0.88897045711675 15.999 > 91 96 O 0.15149830035951 0.66666666666667 0.88897045711675 15.999 > 91 97 O 0.33190384621588 0.16666666666667 0.31665585975240 15.999 > 97 98 O 0.33190384621588 0.50000000000000 0.31665585975240 15.999 > 97 99 O 0.33190384621588 0.83333333333333 0.31665585975240 15.999 > 97 100 O 0.33190384621588 0.16666666666667 0.81665585975240 15.999 > 97 101 O 0.33190384621588 0.50000000000000 0.81665585975240 15.999 > 97 102 O 0.33190384621588 0.83333333333333 0.81665585975240 15.999 > 97 103 O 0.00658066691702 0.16666666666667 0.15471343498847 15.999 > 103 104 O 0.00658066691702 0.50000000000000 0.15471343498847 15.999 > 103 105 O 0.00658066691702 0.83333333333333 0.15471343498847 15.999 > 103 106 O 0.00658066691702 0.16666666666667 0.65471343498847 15.999 > 103 107 O 0.00658066691702 0.50000000000000 0.65471343498847 15.999 > 103 108 O 0.00658066691702 0.83333333333333 0.65471343498847 15.999 > 103 109 O 0.84850169964049 0.00000000000000 0.11102954288325 15.999 > 73 110 O 0.84850169964049 0.33333333333333 0.11102954288325 15.999 > 73 111 O 0.84850169964049 0.66666666666667 0.11102954288325 15.999 > 73 112 O 0.84850169964049 0.00000000000000 0.61102954288325 15.999 > 73 113 O 0.84850169964049 0.33333333333333 0.61102954288325 15.999 > 73 114 O 0.84850169964049 0.66666666666667 0.61102954288325 15.999 > 73 115 O 0.99341933308298 0.16666666666667 0.34528656501153 15.999 > 79 116 O 0.99341933308298 0.50000000000000 0.34528656501153 15.999 > 79 117 O 0.99341933308298 0.83333333333333 0.34528656501153 15.999 > 79 118 O 0.99341933308298 0.16666666666667 0.84528656501153 15.999 > 79 119 O 0.99341933308298 0.50000000000000 0.84528656501153 15.999 > 79 120 O 0.99341933308298 0.83333333333333 0.84528656501153 15.999 > 79 121 O 0.66809615378412 0.16666666666667 0.18334414024760 15.999 > 85 122 O 0.66809615378412 0.50000000000000 0.18334414024760 15.999 > 85 123 O 0.66809615378412 0.83333333333333 0.18334414024760 15.999 > 85 124 O 0.66809615378412 0.16666666666667 0.68334414024760 15.999 > 85 125 O 0.66809615378412 0.50000000000000 0.68334414024760 15.999 > 85 126 O 0.66809615378412 0.83333333333333 0.68334414024760 15.999 > 85 127 O 0.65149830035951 0.16666666666667 0.38897045711675 15.999 > 91 128 O 0.65149830035951 0.50000000000000 0.38897045711675 15.999 > 91 129 O 0.65149830035951 0.83333333333333 0.38897045711675 15.999 > 91 130 O 0.65149830035951 0.16666666666667 0.88897045711675 15.999 > 91 131 O 0.65149830035951 0.50000000000000 0.88897045711675 15.999 > 91 132 O 0.65149830035951 0.83333333333333 0.88897045711675 15.999 > 91 133 O 0.83190384621588 0.00000000000000 0.31665585975240 15.999 > 97 134 O 0.83190384621588 0.33333333333333 0.31665585975240 15.999 > 97 135 O 0.83190384621588 0.66666666666667 0.31665585975240 15.999 > 97 136 O 0.83190384621588 0.00000000000000 0.81665585975240 15.999 > 97 137 O 0.83190384621588 0.33333333333333 0.81665585975240 15.999 > 97 138 O 0.83190384621588 0.66666666666667 0.81665585975240 15.999 > 97 139 O 0.50658066691702 0.00000000000000 0.15471343498847 15.999 > 103 140 O 0.50658066691702 0.33333333333333 0.15471343498847 15.999 > 103 141 O 0.50658066691702 0.66666666666667 0.15471343498847 15.999 > 103 142 O 0.50658066691702 0.00000000000000 0.65471343498847 15.999 > 103 143 O 0.50658066691702 0.33333333333333 0.65471343498847 15.999 > 103 144 O 0.50658066691702 0.66666666666667 0.65471343498847 15.999 > 103----------------------------------------------------------------------------NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz".--------------------------- Dielectric constant ---------------------------- 5.6672099 0.0000000 0.1118806 0.0000000 8.4002518 0.0000000 0.1118824 0.0000000 4.3113202-------------------------- Born effective charges -------------------------- 1 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 2 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 3 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 4 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 5 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 6 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 7 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 8 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204 9 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 10 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 11 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 12 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204----------------------------------------------------------------------------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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Computing fc3[ 25, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Computing fc3[ 49, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Computing fc3[ 73, x, x ] using numpy.linalg.pinv.Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Computing fc3[ 79, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Computing fc3[ 85, 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] [-0.0026 0.0000 0.0097] [ 0.0026 0.0000 -0.0097]Expanding fc3.Symmetrizing fc3 by traditional approach (N=3).Symmetrizing fc2 by traditional approach (N=3).Max drift of fc3: 0.00000001 (xxx) 0.00000001 (xxx) 0.00000001 (xxx)fc3 was written into "fc3.hdf5".Max drift of fc2: -0.00000000 (zx) -0.00000000 (zx) fc2 was written into "fc2.hdf5".--------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperatures: 0.0 300.0 Cutoff frequency: 0.01Frequency 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 14:29:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|---------------------------------- calculate LTC ----------------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0-------------------------[time 2026-01-08 14:29:58]-------------------------Compiled with OpenMP support (max 128 threads).Running in phono3py.load mode.Python version 3.14.2Spglib version 2.6.1----------------------------- General settings -----------------------------Run mode: conductivity-RTAHDF5 data compression filter: gzipCrystal structure was read from "phono3py.yaml".Supercell (dim): [1 3 2]Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.]Spacegroup: C2/m (12)------------------------------ primitive cell ------------------------------Lattice vectors: a 6.591017810002275 -1.960986390000000 0.000000000000000 b 6.591017810002275 1.960986390000000 0.000000000000000 c -1.918015979786121 0.000000000000000 7.198698166752732Atomic positions (fractional): 1 K 0.64264809296477 0.64264809296477 0.06393835728666 39.098 2 K 0.35735190703523 0.35735190703523 0.93606164271334 39.098 3 Nd 0.35045640497996 0.35045640497996 0.42155573133720 144.242 4 Nd 0.64954359502004 0.64954359502004 0.57844426866280 144.242 5 Pd 0.99303369774759 0.99303369774759 0.72260530330344 106.420 6 Pd 0.00696630225241 0.00696630225241 0.27739469669655 106.420 7 O 0.84850169964049 0.84850169964049 0.22205908576650 15.999 8 O 0.49341933308298 0.49341933308298 0.69057313002306 15.999 9 O 0.16809615378411 0.16809615378411 0.36668828049520 15.999 10 O 0.15149830035951 0.15149830035951 0.77794091423350 15.999 11 O 0.83190384621588 0.83190384621588 0.63331171950480 15.999 12 O 0.50658066691702 0.50658066691702 0.30942686997694 15.999-------------------------------- supercell ---------------------------------Lattice vectors: a 13.182035620004550 0.000000000000000 0.000000000000000 b 0.000000000000000 11.765918340000002 0.000000000000000 c -3.836031959572242 0.000000000000000 14.397396333505464Atomic positions (fractional): 1 K 0.14264809296477 0.16666666666667 0.03196917864333 39.098 > 1 2 K 0.14264809296477 0.50000000000000 0.03196917864333 39.098 > 1 3 K 0.14264809296477 0.83333333333333 0.03196917864333 39.098 > 1 4 K 0.14264809296477 0.16666666666667 0.53196917864333 39.098 > 1 5 K 0.14264809296477 0.50000000000000 0.53196917864333 39.098 > 1 6 K 0.14264809296477 0.83333333333333 0.53196917864333 39.098 > 1 7 K 0.35735190703523 0.00000000000000 0.46803082135667 39.098 > 7 8 K 0.35735190703523 0.33333333333333 0.46803082135667 39.098 > 7 9 K 0.35735190703523 0.66666666666667 0.46803082135667 39.098 > 7 10 K 0.35735190703523 0.00000000000000 0.96803082135667 39.098 > 7 11 K 0.35735190703523 0.33333333333333 0.96803082135667 39.098 > 7 12 K 0.35735190703523 0.66666666666667 0.96803082135667 39.098 > 7 13 K 0.64264809296477 0.00000000000000 0.03196917864333 39.098 > 1 14 K 0.64264809296477 0.33333333333333 0.03196917864333 39.098 > 1 15 K 0.64264809296477 0.66666666666667 0.03196917864333 39.098 > 1 16 K 0.64264809296477 0.00000000000000 0.53196917864333 39.098 > 1 17 K 0.64264809296477 0.33333333333333 0.53196917864333 39.098 > 1 18 K 0.64264809296477 0.66666666666667 0.53196917864333 39.098 > 1 19 K 0.85735190703523 0.16666666666667 0.46803082135667 39.098 > 7 20 K 0.85735190703523 0.50000000000000 0.46803082135667 39.098 > 7 21 K 0.85735190703523 0.83333333333333 0.46803082135667 39.098 > 7 22 K 0.85735190703523 0.16666666666667 0.96803082135667 39.098 > 7 23 K 0.85735190703523 0.50000000000000 0.96803082135667 39.098 > 7 24 K 0.85735190703523 0.83333333333333 0.96803082135667 39.098 > 7 25 Nd 0.35045640497996 0.00000000000000 0.21077786566860 144.242 > 25 26 Nd 0.35045640497996 0.33333333333333 0.21077786566860 144.242 > 25 27 Nd 0.35045640497996 0.66666666666667 0.21077786566860 144.242 > 25 28 Nd 0.35045640497996 0.00000000000000 0.71077786566860 144.242 > 25 29 Nd 0.35045640497996 0.33333333333333 0.71077786566860 144.242 > 25 30 Nd 0.35045640497996 0.66666666666667 0.71077786566860 144.242 > 25 31 Nd 0.14954359502004 0.16666666666667 0.28922213433140 144.242 > 31 32 Nd 0.14954359502004 0.50000000000000 0.28922213433140 144.242 > 31 33 Nd 0.14954359502004 0.83333333333333 0.28922213433140 144.242 > 31 34 Nd 0.14954359502004 0.16666666666667 0.78922213433140 144.242 > 31 35 Nd 0.14954359502004 0.50000000000000 0.78922213433140 144.242 > 31 36 Nd 0.14954359502004 0.83333333333333 0.78922213433140 144.242 > 31 37 Nd 0.85045640497996 0.16666666666667 0.21077786566860 144.242 > 25 38 Nd 0.85045640497996 0.50000000000000 0.21077786566860 144.242 > 25 39 Nd 0.85045640497996 0.83333333333333 0.21077786566860 144.242 > 25 40 Nd 0.85045640497996 0.16666666666667 0.71077786566860 144.242 > 25 41 Nd 0.85045640497996 0.50000000000000 0.71077786566860 144.242 > 25 42 Nd 0.85045640497996 0.83333333333333 0.71077786566860 144.242 > 25 43 Nd 0.64954359502004 0.00000000000000 0.28922213433140 144.242 > 31 44 Nd 0.64954359502004 0.33333333333333 0.28922213433140 144.242 > 31 45 Nd 0.64954359502004 0.66666666666667 0.28922213433140 144.242 > 31 46 Nd 0.64954359502004 0.00000000000000 0.78922213433140 144.242 > 31 47 Nd 0.64954359502004 0.33333333333333 0.78922213433140 144.242 > 31 48 Nd 0.64954359502004 0.66666666666667 0.78922213433140 144.242 > 31 49 Pd 0.49303369774759 0.16666666666667 0.36130265165172 106.420 > 49 50 Pd 0.49303369774759 0.50000000000000 0.36130265165172 106.420 > 49 51 Pd 0.49303369774759 0.83333333333333 0.36130265165172 106.420 > 49 52 Pd 0.49303369774759 0.16666666666667 0.86130265165172 106.420 > 49 53 Pd 0.49303369774759 0.50000000000000 0.86130265165172 106.420 > 49 54 Pd 0.49303369774759 0.83333333333333 0.86130265165172 106.420 > 49 55 Pd 0.00696630225241 0.00000000000000 0.13869734834828 106.420 > 55 56 Pd 0.00696630225241 0.33333333333333 0.13869734834828 106.420 > 55 57 Pd 0.00696630225241 0.66666666666667 0.13869734834828 106.420 > 55 58 Pd 0.00696630225241 0.00000000000000 0.63869734834828 106.420 > 55 59 Pd 0.00696630225241 0.33333333333333 0.63869734834828 106.420 > 55 60 Pd 0.00696630225241 0.66666666666667 0.63869734834828 106.420 > 55 61 Pd 0.99303369774759 0.00000000000000 0.36130265165172 106.420 > 49 62 Pd 0.99303369774759 0.33333333333333 0.36130265165172 106.420 > 49 63 Pd 0.99303369774759 0.66666666666667 0.36130265165172 106.420 > 49 64 Pd 0.99303369774759 0.00000000000000 0.86130265165172 106.420 > 49 65 Pd 0.99303369774759 0.33333333333333 0.86130265165172 106.420 > 49 66 Pd 0.99303369774759 0.66666666666667 0.86130265165172 106.420 > 49 67 Pd 0.50696630225241 0.16666666666667 0.13869734834828 106.420 > 55 68 Pd 0.50696630225241 0.50000000000000 0.13869734834828 106.420 > 55 69 Pd 0.50696630225241 0.83333333333333 0.13869734834828 106.420 > 55 70 Pd 0.50696630225241 0.16666666666667 0.63869734834828 106.420 > 55 71 Pd 0.50696630225241 0.50000000000000 0.63869734834828 106.420 > 55 72 Pd 0.50696630225241 0.83333333333333 0.63869734834828 106.420 > 55 73 O 0.34850169964049 0.16666666666667 0.11102954288325 15.999 > 73 74 O 0.34850169964049 0.50000000000000 0.11102954288325 15.999 > 73 75 O 0.34850169964049 0.83333333333333 0.11102954288325 15.999 > 73 76 O 0.34850169964049 0.16666666666667 0.61102954288325 15.999 > 73 77 O 0.34850169964049 0.50000000000000 0.61102954288325 15.999 > 73 78 O 0.34850169964049 0.83333333333333 0.61102954288325 15.999 > 73 79 O 0.49341933308298 0.00000000000000 0.34528656501153 15.999 > 79 80 O 0.49341933308298 0.33333333333333 0.34528656501153 15.999 > 79 81 O 0.49341933308298 0.66666666666667 0.34528656501153 15.999 > 79 82 O 0.49341933308298 0.00000000000000 0.84528656501153 15.999 > 79 83 O 0.49341933308298 0.33333333333333 0.84528656501153 15.999 > 79 84 O 0.49341933308298 0.66666666666667 0.84528656501153 15.999 > 79 85 O 0.16809615378411 0.00000000000000 0.18334414024760 15.999 > 85 86 O 0.16809615378411 0.33333333333333 0.18334414024760 15.999 > 85 87 O 0.16809615378411 0.66666666666667 0.18334414024760 15.999 > 85 88 O 0.16809615378411 0.00000000000000 0.68334414024760 15.999 > 85 89 O 0.16809615378411 0.33333333333333 0.68334414024760 15.999 > 85 90 O 0.16809615378411 0.66666666666667 0.68334414024760 15.999 > 85 91 O 0.15149830035951 0.00000000000000 0.38897045711675 15.999 > 91 92 O 0.15149830035951 0.33333333333333 0.38897045711675 15.999 > 91 93 O 0.15149830035951 0.66666666666667 0.38897045711675 15.999 > 91 94 O 0.15149830035951 0.00000000000000 0.88897045711675 15.999 > 91 95 O 0.15149830035951 0.33333333333333 0.88897045711675 15.999 > 91 96 O 0.15149830035951 0.66666666666667 0.88897045711675 15.999 > 91 97 O 0.33190384621588 0.16666666666667 0.31665585975240 15.999 > 97 98 O 0.33190384621588 0.50000000000000 0.31665585975240 15.999 > 97 99 O 0.33190384621588 0.83333333333333 0.31665585975240 15.999 > 97 100 O 0.33190384621588 0.16666666666667 0.81665585975240 15.999 > 97 101 O 0.33190384621588 0.50000000000000 0.81665585975240 15.999 > 97 102 O 0.33190384621588 0.83333333333333 0.81665585975240 15.999 > 97 103 O 0.00658066691702 0.16666666666667 0.15471343498847 15.999 > 103 104 O 0.00658066691702 0.50000000000000 0.15471343498847 15.999 > 103 105 O 0.00658066691702 0.83333333333333 0.15471343498847 15.999 > 103 106 O 0.00658066691702 0.16666666666667 0.65471343498847 15.999 > 103 107 O 0.00658066691702 0.50000000000000 0.65471343498847 15.999 > 103 108 O 0.00658066691702 0.83333333333333 0.65471343498847 15.999 > 103 109 O 0.84850169964049 0.00000000000000 0.11102954288325 15.999 > 73 110 O 0.84850169964049 0.33333333333333 0.11102954288325 15.999 > 73 111 O 0.84850169964049 0.66666666666667 0.11102954288325 15.999 > 73 112 O 0.84850169964049 0.00000000000000 0.61102954288325 15.999 > 73 113 O 0.84850169964049 0.33333333333333 0.61102954288325 15.999 > 73 114 O 0.84850169964049 0.66666666666667 0.61102954288325 15.999 > 73 115 O 0.99341933308298 0.16666666666667 0.34528656501153 15.999 > 79 116 O 0.99341933308298 0.50000000000000 0.34528656501153 15.999 > 79 117 O 0.99341933308298 0.83333333333333 0.34528656501153 15.999 > 79 118 O 0.99341933308298 0.16666666666667 0.84528656501153 15.999 > 79 119 O 0.99341933308298 0.50000000000000 0.84528656501153 15.999 > 79 120 O 0.99341933308298 0.83333333333333 0.84528656501153 15.999 > 79 121 O 0.66809615378412 0.16666666666667 0.18334414024760 15.999 > 85 122 O 0.66809615378412 0.50000000000000 0.18334414024760 15.999 > 85 123 O 0.66809615378412 0.83333333333333 0.18334414024760 15.999 > 85 124 O 0.66809615378412 0.16666666666667 0.68334414024760 15.999 > 85 125 O 0.66809615378412 0.50000000000000 0.68334414024760 15.999 > 85 126 O 0.66809615378412 0.83333333333333 0.68334414024760 15.999 > 85 127 O 0.65149830035951 0.16666666666667 0.38897045711675 15.999 > 91 128 O 0.65149830035951 0.50000000000000 0.38897045711675 15.999 > 91 129 O 0.65149830035951 0.83333333333333 0.38897045711675 15.999 > 91 130 O 0.65149830035951 0.16666666666667 0.88897045711675 15.999 > 91 131 O 0.65149830035951 0.50000000000000 0.88897045711675 15.999 > 91 132 O 0.65149830035951 0.83333333333333 0.88897045711675 15.999 > 91 133 O 0.83190384621588 0.00000000000000 0.31665585975240 15.999 > 97 134 O 0.83190384621588 0.33333333333333 0.31665585975240 15.999 > 97 135 O 0.83190384621588 0.66666666666667 0.31665585975240 15.999 > 97 136 O 0.83190384621588 0.00000000000000 0.81665585975240 15.999 > 97 137 O 0.83190384621588 0.33333333333333 0.81665585975240 15.999 > 97 138 O 0.83190384621588 0.66666666666667 0.81665585975240 15.999 > 97 139 O 0.50658066691702 0.00000000000000 0.15471343498847 15.999 > 103 140 O 0.50658066691702 0.33333333333333 0.15471343498847 15.999 > 103 141 O 0.50658066691702 0.66666666666667 0.15471343498847 15.999 > 103 142 O 0.50658066691702 0.00000000000000 0.65471343498847 15.999 > 103 143 O 0.50658066691702 0.33333333333333 0.65471343498847 15.999 > 103 144 O 0.50658066691702 0.66666666666667 0.65471343498847 15.999 > 103----------------------------------------------------------------------------NAC parameters were read from "phono3py.yaml".--------------------------- Dielectric constant ---------------------------- 5.6672099 0.0000000 0.1118806 0.0000000 8.4002518 0.0000000 0.1118824 0.0000000 4.3113202-------------------------- Born effective charges -------------------------- 1 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 2 K 1.2181769 0.0000000 0.0936111 0.0000000 1.1417656 0.0000000 0.0171080 0.0000000 1.6283759 3 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 4 Nd 4.7760597 0.0000000 -0.2427456 0.0000000 4.2005744 0.0000000 0.0837630 0.0000000 2.7872127 5 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 6 Pd 1.8825792 0.0000000 0.6376857 0.0000000 2.9529460 0.0000000 0.5655401 0.0000000 -0.4924302 7 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 8 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204 9 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 10 O -2.5972723 0.0000000 -0.0964364 0.0000000 -1.9497604 0.0000000 -0.2317303 0.0000000 -1.6031437 11 O -3.7295255 0.0000000 -0.2716556 0.0000000 -1.7394531 0.0000000 -0.3180033 0.0000000 -1.3196943 12 O -1.5500180 0.0000000 -0.1204591 0.0000000 -4.6060725 0.0000000 -0.1166775 0.0000000 -1.0003204----------------------------------------------------------------------------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 (xx) 0.00000000 (xx) --------------------------- Calculation settings ---------------------------Non-analytical term correction (NAC): TrueNAC unit conversion factor: 14.39965BZ integration: Tetrahedron-methodTemperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0Cutoff frequency: 0.01Frequency conversion factor to THz: 15.63330Length for sampling mesh generation: 50.00Generating grid system ... [ 13 13 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: 0.73, Number of G-points: 297, Lambda: 0.19Running harmonic phonon calculations...-------------------- Lattice thermal conductivity (RTA) --------------------======================= Grid point 0 (1/322) =======================q-point: ( 0.00 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 2.542 ( 0.000 0.000 0.000) 0.000 2.826 ( 0.000 0.000 0.000) 0.000 2.849 ( 0.000 0.000 0.000) 0.000 3.048 ( 0.000 0.000 0.000) 0.000 3.049 ( 0.000 0.000 0.000) 0.000 3.384 ( 0.000 0.000 0.000) 0.000 3.773 ( 0.000 0.000 0.000) 0.000 3.781 ( 0.000 0.000 0.000) 0.000 3.891 ( 0.000 0.000 0.000) 0.000 4.081 ( 0.000 0.000 0.000) 0.000 4.351 ( 0.000 0.000 0.000) 0.000 5.115 ( 0.000 0.000 0.000) 0.000 5.292 ( 0.000 0.000 0.000) 0.000 5.299 ( 0.000 0.000 0.000) 0.000 5.667 ( 0.000 0.000 0.000) 0.000 6.582 ( 0.000 0.000 0.000) 0.000 7.689 ( 0.000 0.000 0.000) 0.000 7.788 ( 0.000 0.000 0.000) 0.000 8.380 ( 0.000 0.000 0.000) 0.000 8.557 ( 0.000 0.000 0.000) 0.000 8.964 ( 0.000 0.000 0.000) 0.000 9.673 ( 0.000 0.000 0.000) 0.000 9.689 ( 0.000 0.000 0.000) 0.000 10.509 ( 0.000 0.000 0.000) 0.000 10.678 ( 0.000 0.000 0.000) 0.000 10.714 ( 0.000 0.000 0.000) 0.000 11.329 ( 0.000 0.000 0.000) 0.000 14.446 ( 0.000 0.000 0.000) 0.000 14.966 ( 0.000 0.000 0.000) 0.000 16.178 ( 0.000 0.000 0.000) 0.000 16.600 ( 0.000 0.000 0.000) 0.000 19.875 ( 0.000 0.000 0.000) 0.000 20.112 ( 0.000 0.000 0.000) 0.000======================= Grid point 1 (2/322) =======================q-point: ( 0.08 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.500 ( 5.190 -22.913 2.716) 23.649 0.672 ( 18.160 -28.092 3.356) 33.618 1.214 ( 12.204 -55.534 1.401) 56.876 2.642 ( 0.161 -8.615 0.321) 8.622 2.786 ( -0.614 0.818 -0.775) 1.284 2.904 ( -1.584 -3.651 -0.530) 4.015 3.104 ( -0.237 -4.700 -0.089) 4.707 3.154 ( 2.167 -9.299 -0.531) 9.563 3.524 ( -0.784 -10.238 0.249) 10.271 3.777 ( -6.088 -3.084 -5.664) 8.868 3.908 ( 1.048 -1.200 4.792) 5.050 4.181 ( 1.376 -11.977 -0.536) 12.067 4.333 ( -0.173 1.034 0.467) 1.148 4.810 ( -32.257 -16.988 -11.017) 38.085 5.162 ( -0.396 -0.843 10.845) 10.885 5.301 ( 0.564 -0.651 1.001) 1.320 5.392 ( 19.693 3.479 -1.332) 20.042 5.760 ( -1.213 -10.681 -1.759) 10.892 6.548 ( -3.166 2.213 -0.226) 3.870 7.578 ( -2.024 8.574 -0.242) 8.813 7.785 ( 0.242 2.662 -2.718) 3.812 8.117 ( 1.327 20.690 0.426) 20.737 8.900 ( -5.899 -13.505 -3.032) 15.046 9.037 ( 9.278 2.395 6.158) 11.390 9.662 ( 5.407 3.718 -2.298) 6.953 10.292 ( -11.734 -5.462 -14.420) 19.377 10.449 ( 0.479 11.451 1.967) 11.629 10.541 ( 3.289 -4.091 -1.358) 5.422 10.933 ( 3.684 -8.182 9.011) 12.717 11.274 ( 1.544 5.575 1.816) 6.063 14.600 ( 39.122 10.762 9.807) 41.743 14.952 ( 1.475 1.637 -1.193) 2.505 16.174 ( 8.180 5.033 0.872) 9.644 16.573 ( 1.582 2.987 -0.065) 3.381 20.027 ( -0.037 -14.735 0.007) 14.735 22.086 ( -21.759 -3.907 -5.362) 22.748======================= Grid point 2 (3/322) =======================q-point: ( 0.15 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.947 ( 5.716 -18.326 2.257) 19.329 1.310 ( 15.806 -25.872 3.054) 30.472 2.259 ( 11.786 -40.854 0.631) 42.525 2.770 ( -4.212 -2.213 1.200) 4.907 2.853 ( 2.317 -9.746 -2.158) 10.247 2.995 ( -0.516 -7.841 -0.476) 7.873 3.212 ( -0.538 -6.611 -0.433) 6.647 3.395 ( 2.701 -13.183 -1.938) 13.595 3.628 ( -2.232 -2.491 -0.820) 3.443 3.795 ( -5.900 -2.482 -5.660) 8.545 3.965 ( 1.118 -3.187 5.357) 6.333 4.317 ( 0.152 -0.156 0.448) 0.498 4.532 ( 3.083 -13.801 1.176) 14.190 4.895 ( -11.873 -5.019 -2.475) 13.126 5.300 ( -4.513 -13.949 3.733) 15.129 5.350 ( 2.530 -6.066 1.495) 6.741 5.465 ( 6.810 -4.416 -2.261) 8.425 6.066 ( -2.958 -19.384 -3.140) 19.859 6.493 ( -9.420 -3.079 0.366) 9.917 7.356 ( -2.866 12.476 -0.416) 12.808 7.588 ( -5.615 19.017 -0.422) 19.833 7.794 ( 7.862 8.991 0.607) 11.959 8.969 ( 1.416 8.119 4.795) 9.535 9.107 ( 1.171 -7.310 -1.232) 7.505 9.589 ( 4.368 7.787 -3.374) 9.545 10.196 ( -2.854 9.099 -1.589) 9.668 10.244 ( 0.133 4.900 -0.593) 4.937 10.726 ( -3.572 -6.004 -7.127) 9.980 11.129 ( 2.963 -5.353 9.200) 11.049 11.245 ( -0.680 -11.489 -0.299) 11.513 14.654 ( 16.663 1.354 3.451) 17.071 14.925 ( 3.500 2.096 -1.256) 4.269 16.116 ( 4.462 4.322 0.285) 6.219 16.516 ( 2.961 3.817 0.053) 4.831 20.401 ( -0.074 -21.949 0.001) 21.949 21.999 ( -10.709 2.350 -2.451) 11.234======================= Grid point 3 (4/322) =======================q-point: ( 0.23 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.263 ( 6.412 -9.202 1.172) 11.277 1.861 ( 12.183 -20.996 2.178) 24.372 2.684 ( -1.286 0.078 -1.333) 1.854 2.873 ( 2.711 -8.549 -1.386) 9.075 3.069 ( 2.576 -9.775 0.880) 10.147 3.269 ( -2.100 -14.909 -1.187) 15.103 3.391 ( 2.747 -15.144 -0.397) 15.396 3.632 ( 1.031 -5.837 -8.056) 10.002 3.670 ( -1.679 -5.429 -1.757) 5.948 3.834 ( -1.372 -8.355 3.186) 9.047 4.058 ( 2.498 -4.093 4.467) 6.553 4.336 ( 0.091 -1.755 -0.925) 1.986 4.643 ( 3.336 1.297 3.245) 4.831 4.866 ( -4.889 1.754 0.506) 5.219 5.394 ( -5.792 -3.537 1.225) 6.896 5.527 ( 3.790 -4.443 0.182) 5.842 5.887 ( 0.005 -28.614 -1.280) 28.642 6.223 ( -9.167 -2.317 -2.548) 9.792 6.766 ( -10.533 -25.606 0.451) 27.692 7.047 ( -7.775 14.426 -0.567) 16.397 7.192 ( 3.589 15.401 0.623) 15.826 7.767 ( 8.675 0.241 0.057) 8.678 8.764 ( 0.287 12.879 5.546) 14.025 9.189 ( 4.887 0.761 -2.434) 5.512 9.375 ( -0.927 12.762 -3.287) 13.211 9.949 ( -3.235 12.070 -1.833) 12.629 10.259 ( 2.617 -2.275 1.049) 3.623 10.611 ( 0.533 12.086 -1.899) 12.246 11.301 ( -1.175 -13.557 2.950) 13.924 11.682 ( -3.679 -27.290 -0.526) 27.541 14.745 ( 7.526 -2.689 -0.313) 7.998 14.920 ( 6.750 1.003 0.835) 6.875 16.073 ( 3.561 2.099 -0.002) 4.133 16.473 ( 3.948 2.399 0.371) 4.634 20.833 ( -0.062 -21.068 -0.080) 21.068 21.868 ( -5.453 5.719 -0.988) 7.963======================= Grid point 4 (5/322) =======================q-point: ( 0.31 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.354 ( 6.475 4.332 -0.708) 7.822 2.264 ( 7.877 -13.414 0.710) 15.571 2.600 ( -2.468 5.105 -1.134) 5.782 3.001 ( 2.138 -4.539 -2.096) 5.438 3.247 ( 1.892 -6.753 0.793) 7.057 3.431 ( -3.646 -7.037 -0.741) 7.960 3.629 ( -3.651 -5.440 -5.494) 8.550 3.690 ( -3.830 -3.252 -1.836) 5.350 3.812 ( 3.625 -10.481 -1.259) 11.161 4.108 ( 7.314 -8.674 4.874) 12.349 4.153 ( 3.599 -4.500 0.412) 5.777 4.383 ( -0.856 -3.382 -1.614) 3.845 4.634 ( 6.147 2.591 7.416) 9.975 4.828 ( -3.356 -2.536 -0.189) 4.211 5.383 ( -7.177 0.509 -0.219) 7.198 5.632 ( 2.186 -4.422 0.359) 4.946 6.129 ( -15.428 -2.261 0.253) 15.595 6.310 ( -3.672 -3.555 -1.283) 5.269 6.704 ( 2.045 6.439 1.248) 6.871 6.982 ( 1.726 2.878 -1.299) 3.599 7.352 ( -8.069 -25.125 -0.398) 26.392 7.862 ( 11.800 -3.517 -0.134) 12.313 8.524 ( 0.102 11.753 4.755) 12.679 9.080 ( -1.737 10.383 -3.405) 11.065 9.188 ( 2.548 5.721 -2.202) 6.638 9.712 ( -2.906 9.554 -0.727) 10.012 10.320 ( 1.183 -3.050 0.557) 3.319 10.363 ( 1.175 11.948 0.011) 12.006 11.633 ( 1.571 -18.544 1.429) 18.666 12.155 ( -7.356 -22.981 -1.461) 24.173 14.816 ( 1.953 -1.706 -3.371) 4.253 14.982 ( 8.889 -1.957 3.475) 9.742 16.087 ( 3.805 -1.536 -0.096) 4.104 16.469 ( 4.056 0.655 0.647) 4.159 21.197 ( 0.002 -15.606 -0.198) 15.607 21.721 ( -1.740 6.753 -0.021) 6.974======================= Grid point 5 (6/322) =======================q-point: ( 0.38 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.179 ( 4.970 15.278 -2.222) 16.220 2.401 ( -1.584 3.019 -0.870) 3.518 2.570 ( 5.667 -3.915 -0.223) 6.892 3.086 ( 1.480 -3.238 -1.075) 3.719 3.347 ( -1.871 -3.202 0.164) 3.713 3.530 ( -0.244 -4.592 -0.853) 4.677 3.674 ( -4.156 -2.633 -0.663) 4.964 3.738 ( -2.792 -4.175 -4.403) 6.679 4.004 ( 0.477 -7.208 0.993) 7.291 4.141 ( 2.690 2.675 0.255) 3.802 4.303 ( 5.508 -3.981 1.521) 6.964 4.435 ( -0.461 -2.129 -2.079) 3.011 4.603 ( 4.357 4.764 6.759) 9.347 4.976 ( 1.846 -10.161 0.834) 10.361 5.331 ( -5.814 -0.129 -0.707) 5.858 5.723 ( 1.941 -3.318 0.707) 3.908 6.001 ( -15.942 4.748 1.381) 16.692 6.225 ( -1.505 4.166 -0.536) 4.462 6.707 ( 5.354 -0.145 0.041) 5.356 6.997 ( -0.234 -1.641 -0.949) 1.910 7.687 ( -4.046 -12.185 -0.118) 12.840 8.036 ( 13.057 -5.870 0.393) 14.322 8.349 ( -2.635 4.751 2.149) 5.843 8.859 ( -5.489 9.445 -3.222) 11.389 9.083 ( 2.485 6.015 -1.425) 6.662 9.541 ( -1.517 6.854 0.739) 7.059 10.199 ( 0.511 4.894 0.391) 4.936 10.416 ( 0.284 -6.043 -0.247) 6.055 11.999 ( 4.160 -15.608 1.247) 16.201 12.465 ( -8.528 -13.424 -1.731) 15.998 14.839 ( 1.115 -0.583 -2.568) 2.859 15.074 ( 5.676 -1.969 2.433) 6.482 16.173 ( 3.948 -4.400 0.078) 5.912 16.484 ( 2.806 0.377 0.610) 2.896 21.438 ( 0.038 -8.954 -0.188) 8.956 21.595 ( 0.237 5.308 0.330) 5.323======================= Grid point 6 (7/322) =======================q-point: ( 0.46 0.00 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.908 ( 2.045 10.426 -1.435) 10.721 2.317 ( -0.822 2.546 -0.320) 2.694 2.663 ( 2.852 -1.762 -0.298) 3.366 3.138 ( 0.608 -1.338 -0.161) 1.479 3.364 ( -1.956 -0.442 -0.079) 2.007 3.599 ( 0.743 -1.872 -0.438) 2.061 3.690 ( -2.111 -0.999 0.283) 2.352 3.787 ( -1.034 -1.913 -2.092) 3.018 4.098 ( -0.174 -1.076 1.116) 1.560 4.106 ( 0.740 0.102 -0.394) 0.844 4.393 ( 3.322 -2.596 0.845) 4.300 4.447 ( -0.461 0.487 -2.007) 2.116 4.547 ( 0.712 2.504 3.289) 4.195 5.130 ( 1.039 -3.452 0.283) 3.616 5.333 ( -1.220 -1.646 -0.138) 2.053 5.770 ( -0.417 -0.265 0.590) 0.769 5.866 ( -4.112 1.454 0.532) 4.394 6.157 ( -1.219 1.754 -0.365) 2.167 6.737 ( 1.476 -0.530 0.035) 1.569 7.003 ( -0.057 0.268 -0.333) 0.431 7.815 ( -0.447 -2.942 0.237) 2.985 8.146 ( 5.234 0.850 1.306) 5.461 8.389 ( 1.476 -8.904 -0.969) 9.078 8.628 ( -5.859 10.130 -1.181) 11.762 9.002 ( 0.938 2.572 -0.447) 2.774 9.432 ( -0.479 3.184 0.530) 3.263 10.160 ( 0.053 0.257 0.067) 0.271 10.521 ( 0.044 -3.440 -0.126) 3.442 12.251 ( 3.127 -6.514 0.749) 7.265 12.586 ( -4.760 -3.759 -0.976) 6.143 14.848 ( 0.450 -0.163 -0.903) 1.022 15.123 ( 1.823 -0.604 0.785) 2.075 16.273 ( 2.004 -2.943 0.100) 3.561 16.482 ( 0.756 0.748 0.242) 1.090 21.523 ( 0.300 1.887 0.338) 1.941 21.553 ( 0.077 -2.726 -0.238) 2.738======================= Grid point 14 (8/322) =======================q-point: ( 0.08 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.254 ( 19.467 0.000 9.075) 21.478 0.374 ( 30.728 0.000 4.518) 31.058 0.732 ( 59.790 0.000 9.374) 60.520 2.547 ( 0.668 0.000 0.307) 0.735 2.811 ( -6.213 -0.000 -0.136) 6.214 2.823 ( -0.046 -0.000 -1.733) 1.734 3.035 ( -2.436 -0.000 0.259) 2.449 3.083 ( 6.063 0.000 -0.433) 6.078 3.371 ( -2.099 -0.000 0.078) 2.100 3.696 ( -8.340 -0.000 -6.885) 10.815 3.790 ( 1.306 0.000 0.364) 1.356 3.931 ( 2.869 0.000 1.942) 3.465 4.095 ( 2.933 0.000 -6.613) 7.234 4.370 ( 2.555 0.000 1.486) 2.955 5.148 ( -6.825 -0.000 9.391) 11.609 5.304 ( 0.497 0.000 -1.865) 1.930 5.575 ( -10.911 -0.000 3.599) 11.489 5.793 ( 5.537 0.000 -3.390) 6.492 6.557 ( -3.744 -0.000 -1.468) 4.022 7.647 ( -6.611 -0.000 -0.322) 6.619 7.843 ( 3.537 0.000 -17.476) 17.831 8.387 ( 1.141 0.000 -0.133) 1.149 8.589 ( 5.010 0.000 0.105) 5.012 9.357 ( -2.673 -0.000 9.813) 10.171 9.677 ( 0.572 0.000 0.391) 0.693 9.946 ( 12.836 0.000 -52.683) 54.224 10.523 ( 2.164 0.000 0.074) 2.165 10.675 ( -0.426 -0.000 -0.219) 0.479 10.927 ( -11.317 -0.000 15.263) 19.001 11.364 ( 3.712 0.000 5.572) 6.695 14.961 ( 0.309 0.000 -3.394) 3.408 15.788 ( -0.292 -0.000 4.952) 4.961 16.619 ( 3.223 0.000 -0.199) 3.229 18.387 ( -0.483 -0.000 -14.949) 14.957 19.874 ( -0.062 -0.000 -0.003) 0.062 20.112 ( -0.024 -0.000 0.010) 0.026======================= Grid point 15 (9/322) =======================q-point: ( 0.15 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.620 ( 12.407 -18.814 5.404) 23.175 0.962 ( 24.098 -23.946 4.790) 34.309 1.516 ( 36.839 -40.229 4.422) 54.726 2.643 ( -0.747 -7.376 0.911) 7.469 2.758 ( -3.652 -0.820 -1.782) 4.146 2.875 ( -1.986 -4.393 -1.557) 5.066 3.091 ( -2.227 -5.160 -0.287) 5.628 3.202 ( 6.578 -7.882 -0.861) 10.302 3.505 ( -2.667 -10.005 0.180) 10.356 3.657 ( -9.125 -4.221 -7.406) 12.487 3.926 ( -0.509 -1.911 4.607) 5.013 4.203 ( 2.372 -11.648 -1.184) 11.946 4.294 ( -8.614 -9.380 -1.491) 12.822 4.514 ( -9.017 -20.648 -3.073) 22.739 5.140 ( -5.054 -2.307 6.475) 8.532 5.297 ( -2.474 -0.972 -2.575) 3.701 5.510 ( -1.796 1.732 3.447) 4.255 5.765 ( 4.257 -3.822 -4.465) 7.257 6.485 ( -6.635 3.684 -1.432) 7.723 7.525 ( -6.862 7.232 -0.415) 9.978 7.770 ( -0.481 5.609 -4.397) 7.143 8.149 ( 3.411 18.465 0.847) 18.796 8.869 ( 1.198 -15.771 -1.022) 15.849 9.143 ( 4.798 9.019 7.119) 12.451 9.746 ( 9.415 3.706 -3.905) 10.846 10.098 ( -10.753 -12.332 -15.930) 22.836 10.452 ( -0.919 11.432 1.191) 11.530 10.567 ( 2.344 0.132 -2.603) 3.505 10.973 ( -2.406 -8.102 6.355) 10.575 11.322 ( 3.761 6.717 6.181) 9.873 14.924 ( 2.826 4.695 -3.758) 6.644 15.247 ( 41.307 37.598 11.001) 56.929 16.396 ( 29.142 29.778 3.413) 41.805 16.610 ( 4.729 3.153 -0.000) 5.684 20.026 ( -0.102 -14.729 0.018) 14.729 21.674 ( -38.120 -32.570 -9.474) 51.027======================= Grid point 16 (10/322) =======================q-point: ( 0.23 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.050 ( 10.330 -16.573 3.441) 19.830 1.542 ( 20.267 -21.271 3.970) 29.648 2.460 ( 21.152 -31.701 0.064) 38.110 2.707 ( -6.689 -3.585 0.851) 7.637 2.875 ( 2.684 -9.993 -1.834) 10.509 2.988 ( -0.223 -9.198 -0.683) 9.226 3.197 ( -1.958 -7.221 -0.772) 7.522 3.434 ( 5.102 -11.759 -2.283) 13.020 3.587 ( -3.086 -3.365 -2.833) 5.373 3.714 ( -5.119 -3.933 -3.363) 7.279 3.990 ( 0.734 -3.944 4.694) 6.174 4.316 ( -0.740 -0.765 0.235) 1.090 4.561 ( 0.346 -14.099 0.519) 14.113 4.786 ( -4.909 -10.072 0.443) 11.214 5.241 ( -6.188 -9.592 3.377) 11.904 5.370 ( -0.098 -12.235 -1.576) 12.336 5.505 ( -0.580 -1.879 -0.514) 2.033 6.010 ( -4.455 -19.702 -4.129) 20.617 6.353 ( -13.599 1.238 -0.113) 13.656 7.289 ( -8.103 12.635 -1.275) 15.064 7.554 ( 0.175 16.072 0.270) 16.076 7.883 ( 6.875 8.679 0.887) 11.107 8.998 ( -0.443 9.356 8.210) 12.455 9.137 ( 5.200 -8.692 -2.918) 10.540 9.628 ( 4.296 11.869 -5.756) 13.873 10.144 ( -4.701 6.652 -2.470) 8.512 10.249 ( 1.142 1.749 -0.643) 2.185 10.667 ( -2.522 -6.215 -5.954) 8.969 11.184 ( 0.638 -4.538 9.428) 10.482 11.232 ( -1.157 -8.023 -0.013) 8.106 14.829 ( 8.496 5.619 -1.676) 10.323 15.050 ( 19.198 8.230 3.548) 21.187 16.195 ( 8.909 8.294 0.572) 12.186 16.566 ( 5.442 3.999 0.210) 6.757 20.400 ( -0.131 -21.952 0.003) 21.952 21.824 ( -16.612 -6.050 -3.792) 18.082======================= Grid point 17 (11/322) =======================q-point: ( 0.31 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.363 ( 9.834 -7.884 1.383) 12.680 2.029 ( 14.733 -16.995 2.406) 22.620 2.641 ( -5.264 1.192 -1.348) 5.563 2.901 ( 2.267 -6.721 -3.449) 7.887 3.113 ( 4.237 -9.279 1.262) 10.279 3.240 ( -2.008 -10.772 -1.279) 11.032 3.411 ( 1.177 -14.702 -2.552) 14.968 3.626 ( -3.377 -1.459 -1.348) 3.918 3.657 ( 5.935 -7.785 -6.348) 11.667 3.861 ( 4.934 -15.905 3.973) 17.120 4.100 ( 2.197 -5.213 4.562) 7.268 4.325 ( -1.346 -1.158 -1.708) 2.464 4.673 ( -0.495 -1.144 2.446) 2.746 4.839 ( -0.740 2.014 3.031) 3.714 5.324 ( -6.249 -3.244 1.589) 7.218 5.543 ( -1.630 -4.371 -0.628) 4.707 5.881 ( -0.319 -28.184 -1.566) 28.229 6.089 ( -11.669 1.851 -2.689) 12.117 6.622 ( -13.549 -31.025 -0.068) 33.855 6.946 ( -8.518 14.573 -0.717) 16.895 7.258 ( 7.065 14.098 0.654) 15.782 7.869 ( 8.289 -1.228 0.510) 8.395 8.782 ( -0.729 12.849 6.796) 14.554 9.251 ( 6.603 0.409 -3.100) 7.306 9.348 ( -1.275 15.014 -4.505) 15.728 9.898 ( -4.164 11.656 -2.244) 12.579 10.297 ( 2.920 -1.365 1.537) 3.571 10.611 ( 0.616 10.070 -2.234) 10.333 11.292 ( -2.127 -14.029 3.668) 14.656 11.629 ( -4.793 -24.757 -0.766) 25.229 14.812 ( 5.134 0.500 -2.977) 5.955 15.053 ( 13.844 2.457 3.229) 14.427 16.125 ( 5.305 3.153 0.065) 6.172 16.530 ( 5.418 2.735 0.562) 6.095 20.832 ( -0.087 -21.095 -0.110) 21.095 21.788 ( -7.275 1.425 -1.304) 7.527======================= Grid point 18 (12/322) =======================q-point: ( 0.38 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.441 ( 8.812 6.044 -1.041) 10.736 2.362 ( 7.803 -8.377 0.229) 11.451 2.570 ( -1.601 1.775 -0.648) 2.477 3.004 ( -0.893 -4.841 -1.860) 5.262 3.271 ( 2.298 -4.737 -1.034) 5.366 3.399 ( -1.575 -8.121 0.507) 8.288 3.586 ( -1.828 -4.570 -3.508) 6.044 3.634 ( -3.413 -3.650 -3.944) 6.366 3.851 ( 3.226 -8.710 0.425) 9.298 4.186 ( 3.692 -2.375 2.365) 4.986 4.226 ( 8.737 -8.031 1.667) 11.983 4.357 ( -2.646 -4.211 -1.861) 5.310 4.724 ( 4.127 0.891 7.974) 9.023 4.786 ( -3.966 -4.237 -0.360) 5.815 5.317 ( -3.150 0.660 0.769) 3.309 5.629 ( -3.040 -5.637 -0.769) 6.451 5.928 ( -17.910 1.024 0.291) 17.942 6.279 ( -1.263 -3.904 -1.040) 4.233 6.726 ( 0.889 -0.802 0.890) 1.492 6.999 ( 1.215 0.350 -0.509) 1.363 7.272 ( -4.096 -21.467 -1.213) 21.888 7.992 ( 10.027 -5.173 0.360) 11.289 8.529 ( -2.233 12.487 4.254) 13.379 9.045 ( -1.569 12.953 -3.163) 13.426 9.219 ( 3.778 5.616 -2.817) 7.331 9.675 ( -2.933 8.365 -0.508) 8.879 10.331 ( 0.516 -2.042 -0.134) 2.111 10.377 ( 0.893 11.988 0.890) 12.054 11.657 ( 1.697 -20.545 1.299) 20.656 12.056 ( -8.406 -21.720 -1.553) 23.341 14.836 ( 3.348 -0.472 -3.375) 4.778 15.106 ( 10.135 0.314 3.293) 10.661 16.138 ( 4.868 -1.409 0.035) 5.068 16.521 ( 4.268 1.417 0.737) 4.557 21.196 ( 0.006 -15.641 -0.237) 15.643 21.698 ( -2.019 4.540 -0.010) 4.969======================= Grid point 19 (13/322) =======================q-point: ( 0.46 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.241 ( 6.680 17.187 -2.109) 18.560 2.378 ( -1.789 3.871 -0.913) 4.361 2.641 ( 6.050 -3.597 0.086) 7.039 3.082 ( -1.749 -3.899 0.030) 4.273 3.337 ( 1.182 -1.871 -2.044) 3.013 3.535 ( 0.734 -5.281 0.460) 5.352 3.624 ( -4.063 -3.192 -0.384) 5.181 3.717 ( 1.482 -4.538 -3.842) 6.128 4.010 ( 0.013 -6.187 1.790) 6.441 4.164 ( 1.189 3.471 -0.059) 3.669 4.364 ( 4.069 -3.016 1.567) 5.302 4.420 ( -0.893 -2.672 -2.097) 3.512 4.623 ( -4.448 5.665 2.958) 7.787 5.010 ( 2.937 -10.573 2.491) 11.253 5.306 ( 2.044 -0.562 0.724) 2.240 5.710 ( -4.815 -4.285 -0.308) 6.453 5.817 ( -14.763 -0.512 0.844) 14.796 6.218 ( 0.450 4.511 0.036) 4.533 6.787 ( 7.314 0.929 0.657) 7.402 6.996 ( 1.080 -0.639 -1.021) 1.618 7.640 ( -3.456 -15.107 -0.545) 15.507 8.179 ( 10.243 -6.139 0.664) 11.960 8.304 ( -5.976 6.245 0.255) 8.647 8.804 ( -1.801 10.761 -1.147) 10.971 9.102 ( 1.545 6.577 -1.954) 7.033 9.526 ( -1.471 6.065 0.881) 6.303 10.205 ( 0.407 5.295 0.226) 5.315 10.414 ( -0.498 -6.012 -0.099) 6.034 12.049 ( 3.626 -16.004 0.681) 16.424 12.359 ( -8.338 -14.558 -1.382) 16.834 14.854 ( 2.618 0.012 -2.294) 3.480 15.149 ( 5.714 0.742 2.099) 6.132 16.223 ( 4.631 -3.728 0.207) 5.949 16.514 ( 1.829 1.579 0.571) 2.483 21.438 ( 0.054 -8.973 -0.204) 8.975 21.599 ( 0.253 4.717 0.358) 4.737======================= Grid point 20 (14/322) =======================q-point: ( 0.54 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.942 ( 4.064 12.759 -0.648) 13.406 2.307 ( -0.786 1.559 -0.275) 1.767 2.687 ( 1.054 1.025 0.210) 1.485 3.127 ( -2.136 -1.565 0.426) 2.682 3.375 ( 4.084 -1.064 -1.757) 4.571 3.602 ( -0.186 -1.346 0.707) 1.532 3.675 ( -0.576 -2.952 0.209) 3.015 3.797 ( 3.372 -2.316 -0.647) 4.142 4.089 ( -2.226 -0.985 1.088) 2.667 4.116 ( 1.025 0.587 0.164) 1.192 4.418 ( 0.001 0.018 -0.167) 0.168 4.440 ( 0.865 -0.002 -1.564) 1.787 4.505 ( -7.714 1.429 0.103) 7.846 5.145 ( 0.324 -2.011 1.414) 2.479 5.357 ( 4.817 -1.127 0.731) 5.000 5.728 ( -5.910 -2.683 0.565) 6.515 5.812 ( -5.317 -3.309 -0.871) 6.322 6.164 ( 2.007 1.412 0.580) 2.522 6.792 ( 7.224 2.594 0.282) 7.681 7.000 ( -0.035 0.229 -0.444) 0.501 7.812 ( 0.152 -3.726 0.077) 3.730 8.115 ( -8.836 2.807 -2.398) 9.576 8.456 ( 7.948 -10.870 0.959) 13.499 8.586 ( -0.655 10.697 1.030) 10.766 9.003 ( -0.367 3.094 -0.839) 3.227 9.428 ( -0.438 2.742 0.501) 2.822 10.161 ( 0.048 0.371 -0.033) 0.376 10.518 ( -0.522 -3.609 -0.047) 3.647 12.261 ( -1.541 -3.928 -0.748) 4.285 12.553 ( -0.363 -8.387 0.331) 8.401 14.859 ( 1.703 0.502 -0.673) 1.899 15.148 ( 1.925 1.812 0.651) 2.722 16.300 ( 2.479 -0.665 0.091) 2.569 16.483 ( -0.805 1.456 0.185) 1.673 21.528 ( 0.297 2.251 0.336) 2.295 21.553 ( 0.062 -2.701 -0.240) 2.712======================= Grid point 21 (15/322) =======================q-point: (-0.38 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.903 ( 0.068 -7.717 1.726) 7.908 2.328 ( 0.794 -3.718 0.319) 3.815 2.629 ( -2.959 4.090 0.561) 5.079 3.116 ( -2.879 1.097 0.623) 3.143 3.410 ( 5.297 0.914 -1.259) 5.520 3.592 ( -0.549 1.856 1.604) 2.514 3.721 ( 3.311 -0.646 -0.139) 3.376 3.834 ( 5.503 1.799 2.860) 6.457 4.072 ( -4.014 -0.604 -1.386) 4.290 4.109 ( 0.171 2.065 1.210) 2.399 4.334 ( -6.301 3.475 -2.108) 7.498 4.456 ( -0.112 -0.167 1.989) 1.999 4.494 ( -3.819 -2.604 -4.642) 6.551 5.112 ( -2.424 4.754 0.154) 5.339 5.387 ( 6.973 1.064 0.998) 7.123 5.733 ( -5.430 0.161 -1.228) 5.569 5.902 ( 2.134 -8.540 -0.598) 8.823 6.188 ( 3.062 -1.808 0.883) 3.663 6.762 ( 5.632 4.646 -0.001) 7.301 7.001 ( -0.480 -0.686 0.191) 0.858 7.805 ( -3.113 2.393 -0.891) 4.026 8.042 ( -8.096 1.018 -1.577) 8.311 8.402 ( 1.648 7.364 0.757) 7.584 8.714 ( 7.213 -10.166 2.473) 12.708 8.986 ( -1.883 -2.093 0.015) 2.816 9.436 ( 0.449 -3.553 -0.432) 3.607 10.160 ( -0.024 -0.118 -0.129) 0.177 10.518 ( -0.518 3.324 0.161) 3.368 12.199 ( -4.583 7.303 -1.356) 8.728 12.654 ( 5.621 0.946 1.372) 5.863 14.853 ( 0.699 0.744 0.926) 1.378 15.103 ( -1.271 3.078 -0.742) 3.412 16.252 ( -1.534 5.023 -0.114) 5.253 16.466 ( -1.594 -0.106 -0.221) 1.613 21.519 ( -0.239 -1.580 -0.271) 1.621 21.553 ( -0.071 2.784 0.189) 2.791======================= Grid point 22 (16/322) =======================q-point: (-0.31 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.140 ( -2.847 -13.334 1.673) 13.737 2.420 ( 1.299 0.795 0.615) 1.642 2.516 ( -3.596 0.892 0.322) 3.719 3.061 ( -2.842 2.813 1.201) 4.175 3.363 ( 0.780 5.545 -1.024) 5.692 3.553 ( 2.811 3.173 1.729) 4.578 3.731 ( 5.261 2.154 2.027) 6.036 3.799 ( 5.178 4.785 3.238) 7.758 3.985 ( -2.467 7.576 -1.388) 8.088 4.091 ( -6.409 -0.880 -1.021) 6.549 4.235 ( -4.144 3.225 -1.373) 5.427 4.443 ( -0.116 1.807 1.772) 2.534 4.522 ( -4.634 -3.322 -5.949) 8.240 4.960 ( -0.579 8.111 -0.115) 8.133 5.420 ( 7.881 0.076 0.896) 7.932 5.674 ( -5.296 2.044 -1.193) 5.801 6.151 ( 9.514 -12.271 -1.099) 15.566 6.253 ( 2.893 -2.716 0.583) 4.011 6.675 ( 0.162 5.279 0.236) 5.286 7.001 ( 0.033 1.493 0.624) 1.618 7.712 ( -1.300 5.977 -0.687) 6.155 7.905 ( -7.327 8.605 0.431) 11.311 8.363 ( 1.097 -2.996 -2.041) 3.787 8.933 ( 5.000 -7.959 2.931) 9.846 9.056 ( -2.606 -5.884 0.827) 6.488 9.555 ( 1.232 -7.722 -0.459) 7.833 10.192 ( -0.390 -4.438 -0.370) 4.470 10.410 ( -0.670 6.184 0.264) 6.226 11.950 ( -3.251 14.719 -1.149) 15.117 12.559 ( 6.294 12.857 1.382) 14.382 14.842 ( 0.188 0.898 2.357) 2.529 15.007 ( -4.261 4.710 -2.271) 6.745 16.132 ( -2.837 4.884 -0.024) 5.648 16.450 ( -2.470 0.498 -0.461) 2.561 21.438 ( -0.018 8.946 0.131) 8.947 21.592 ( -0.168 -5.819 -0.230) 5.826======================= Grid point 23 (17/322) =======================q-point: (-0.23 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.297 ( -3.421 -3.110 0.334) 4.636 2.187 ( -4.603 16.674 -0.521) 17.305 2.627 ( 1.424 -6.138 0.748) 6.345 2.978 ( -2.197 4.380 1.255) 5.058 3.225 ( -1.290 7.751 -0.769) 7.895 3.478 ( 3.291 6.827 0.828) 7.624 3.701 ( 4.550 9.435 3.586) 11.072 3.723 ( 1.475 5.969 -0.132) 6.150 3.790 ( -0.431 6.207 6.304) 8.857 3.995 ( -8.510 6.218 -8.457) 13.513 4.126 ( -1.265 6.130 0.576) 6.285 4.391 ( 0.033 3.289 0.836) 3.394 4.555 ( -3.704 -3.683 -4.187) 6.694 4.868 ( 2.975 1.057 0.401) 3.182 5.463 ( 5.814 0.476 0.074) 5.834 5.589 ( -4.366 3.709 -0.553) 5.755 6.252 ( 5.378 6.665 0.088) 8.564 6.382 ( 7.213 3.311 0.790) 7.976 6.679 ( -1.376 -13.362 -0.909) 13.464 6.969 ( -0.973 -1.344 0.866) 1.871 7.445 ( 7.191 24.374 -0.239) 25.414 7.731 ( -10.038 1.776 0.524) 10.207 8.507 ( -0.379 -11.111 -2.936) 11.499 9.096 ( -0.224 -6.140 1.674) 6.368 9.178 ( -0.278 -8.135 1.545) 8.285 9.743 ( 1.856 -10.449 0.538) 10.626 10.305 ( -0.928 3.799 -0.578) 3.953 10.351 ( -0.857 -11.819 0.284) 11.854 11.614 ( -0.979 17.167 -0.953) 17.222 12.228 ( 4.329 23.774 0.896) 24.181 14.808 ( -1.000 4.525 2.685) 5.356 14.889 ( -4.912 1.964 -2.801) 5.986 16.052 ( -2.174 1.577 0.084) 2.687 16.428 ( -2.462 -0.222 -0.378) 2.500 21.197 ( -0.000 15.582 0.113) 15.583 21.737 ( 1.011 -8.377 0.017) 8.437======================= Grid point 24 (18/322) =======================q-point: (-0.15 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.209 ( -2.250 9.961 -0.470) 10.222 1.751 ( -4.924 24.273 -0.908) 24.784 2.686 ( -0.689 4.092 0.551) 4.186 2.860 ( -0.255 6.811 0.223) 6.819 3.047 ( -0.950 9.677 -0.235) 9.726 3.293 ( 1.354 21.191 0.592) 21.242 3.361 ( -1.842 9.670 -0.160) 9.845 3.655 ( 0.129 11.432 6.144) 12.979 3.682 ( 0.556 4.070 -1.706) 4.448 3.854 ( 2.026 1.161 -0.881) 2.496 4.019 ( -1.756 3.946 -2.356) 4.920 4.334 ( -0.230 2.122 0.267) 2.151 4.601 ( -1.834 -1.928 -1.423) 3.018 4.924 ( 3.432 -3.485 0.353) 4.904 5.442 ( 3.186 4.377 -1.540) 5.629 5.476 ( -4.025 5.200 0.679) 6.611 5.890 ( -0.052 29.003 0.495) 29.007 6.305 ( 3.499 5.223 1.084) 6.380 6.851 ( 3.955 20.627 -0.332) 21.006 7.106 ( 1.401 -12.460 0.495) 12.549 7.180 ( 1.483 -16.776 -0.566) 16.851 7.684 ( -4.391 -1.081 0.110) 4.524 8.748 ( -0.241 -12.873 -2.135) 13.051 9.156 ( -1.699 -0.691 0.941) 2.061 9.388 ( 0.155 -11.510 1.169) 11.570 9.980 ( 1.254 -12.270 0.725) 12.355 10.234 ( -1.060 2.604 -0.379) 2.837 10.611 ( -0.210 -13.446 0.759) 13.469 11.303 ( 0.357 13.374 -1.142) 13.427 11.714 ( 1.386 28.944 0.187) 28.978 14.668 ( -4.030 6.534 -0.521) 7.694 14.879 ( -1.272 -1.437 0.261) 1.936 16.044 ( -1.281 -1.599 0.004) 2.049 16.440 ( -1.444 -2.298 -0.129) 2.717 20.834 ( 0.023 21.053 0.029) 21.053 21.915 ( 2.033 -8.341 0.370) 8.593======================= Grid point 25 (19/322) =======================q-point: (-0.08 0.08 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.909 ( -0.000 19.102 0.000) 19.102 1.204 ( -0.000 29.042 0.000) 29.042 2.189 ( -0.000 43.238 0.000) 43.238 2.794 ( -0.000 1.277 0.000) 1.277 2.840 ( -0.000 10.806 0.000) 10.806 3.000 ( -0.000 7.127 0.000) 7.127 3.215 ( -0.000 6.514 0.000) 6.514 3.382 ( -0.000 13.687 0.000) 13.687 3.642 ( -0.000 2.521 0.000) 2.521 3.853 ( -0.000 1.306 0.000) 1.306 3.940 ( -0.000 3.080 0.000) 3.080 4.315 ( 0.000 -0.148 -0.000) 0.148 4.508 ( -0.000 13.860 0.000) 13.860 5.000 ( 0.000 -1.545 -0.000) 1.545 5.279 ( -0.000 14.285 0.000) 14.285 5.364 ( -0.000 4.844 0.000) 4.844 5.409 ( -0.000 10.389 0.000) 10.389 6.090 ( -0.000 18.950 0.000) 18.950 6.551 ( -0.000 4.375 0.000) 4.375 7.371 ( 0.000 -12.758 -0.000) 12.758 7.649 ( 0.000 -25.098 -0.000) 25.098 7.721 ( 0.000 -3.731 -0.000) 3.731 8.951 ( 0.000 -6.688 -0.000) 6.688 9.105 ( -0.000 5.666 0.000) 5.666 9.565 ( 0.000 -5.681 -0.000) 5.681 10.216 ( 0.000 -10.581 -0.000) 10.581 10.245 ( 0.000 -5.758 -0.000) 5.758 10.767 ( -0.000 3.816 0.000) 3.816 11.088 ( -0.000 9.153 0.000) 9.153 11.249 ( -0.000 11.530 0.000) 11.530 14.537 ( -0.000 4.800 0.000) 4.800 14.912 ( 0.000 -2.070 -0.000) 2.070 16.089 ( 0.000 -3.150 -0.000) 3.150 16.498 ( 0.000 -3.792 -0.000) 3.792 20.402 ( -0.000 21.948 0.000) 21.948 22.069 ( 0.000 -6.096 -0.000) 6.096======================= Grid point 28 (20/322) =======================q-point: ( 0.15 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.512 ( 20.233 0.000 8.336) 21.883 0.743 ( 30.049 0.000 4.394) 30.369 1.448 ( 57.912 0.000 7.988) 58.461 2.558 ( 0.943 0.000 0.661) 1.152 2.708 ( -11.190 -0.000 -0.067) 11.190 2.814 ( -0.118 -0.000 -3.208) 3.210 2.994 ( -4.701 -0.000 0.197) 4.705 3.184 ( 10.921 0.000 0.291) 10.925 3.338 ( -3.627 -0.000 0.361) 3.644 3.570 ( -8.519 -0.000 -8.144) 11.785 3.812 ( 2.116 0.000 0.602) 2.200 3.942 ( -0.907 -0.000 -0.818) 1.221 4.119 ( 2.675 0.000 -0.599) 2.742 4.411 ( 3.034 0.000 2.222) 3.761 5.100 ( -4.787 -0.000 5.409) 7.223 5.246 ( -9.305 -0.000 -5.111) 10.616 5.486 ( -6.418 -0.000 6.380) 9.050 5.816 ( 0.371 0.000 -5.498) 5.511 6.493 ( -5.457 -0.000 -3.071) 6.262 7.545 ( -10.125 -0.000 -0.528) 10.139 7.825 ( 0.245 0.000 -7.279) 7.283 8.405 ( 1.929 0.000 -0.249) 1.945 8.664 ( 7.262 0.000 0.158) 7.264 9.353 ( -2.097 -0.000 4.757) 5.198 9.688 ( 1.036 0.000 0.680) 1.239 9.938 ( 6.080 0.000 -21.733) 22.567 10.554 ( 2.591 0.000 0.795) 2.711 10.667 ( -0.764 -0.000 -0.391) 0.859 10.824 ( -10.909 -0.000 3.711) 11.523 11.428 ( 3.145 0.000 7.123) 7.787 14.959 ( 2.043 0.000 -5.632) 5.991 15.800 ( 0.254 0.000 2.224) 2.239 16.674 ( 6.315 0.000 -0.142) 6.317 18.311 ( -5.925 -0.000 -9.879) 11.519 19.873 ( -0.109 -0.000 -0.004) 0.109 20.112 ( -0.043 -0.000 0.018) 0.047======================= Grid point 29 (21/322) =======================q-point: ( 0.23 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.810 ( 16.631 -14.556 6.027) 22.908 1.244 ( 22.588 -23.258 4.050) 32.673 2.032 ( 46.122 -24.308 4.414) 52.322 2.603 ( -7.974 -2.568 0.525) 8.394 2.711 ( -2.156 -7.342 -0.464) 7.666 2.854 ( -0.704 -4.483 -2.832) 5.349 3.046 ( -5.141 -6.290 -0.712) 8.154 3.297 ( 8.863 -5.278 1.190) 10.384 3.466 ( -3.211 -8.736 -1.244) 9.391 3.547 ( -5.253 -6.759 -6.197) 10.569 3.931 ( -0.312 -3.066 2.774) 4.147 4.175 ( -7.266 -19.264 -2.266) 20.713 4.226 ( 0.963 -9.912 0.075) 9.959 4.495 ( 1.314 -9.839 0.925) 9.970 5.108 ( -2.887 -2.598 3.828) 5.453 5.203 ( -11.422 -3.864 -4.926) 13.026 5.462 ( -6.445 -0.377 4.820) 8.057 5.777 ( -1.392 -0.728 -4.375) 4.648 6.398 ( -6.504 5.569 -3.025) 9.082 7.421 ( -10.111 6.297 -0.963) 11.950 7.756 ( 0.140 5.868 -2.761) 6.487 8.194 ( 3.715 16.612 0.860) 17.044 8.902 ( 4.097 -13.985 -0.018) 14.573 9.201 ( 1.953 8.730 5.930) 10.733 9.842 ( 8.927 4.642 -4.359) 10.965 9.954 ( -6.957 -12.887 -9.765) 17.602 10.434 ( -2.495 12.344 0.409) 12.600 10.586 ( 1.923 0.344 -1.173) 2.279 10.935 ( -5.209 -10.930 1.862) 12.251 11.378 ( 1.739 7.221 7.087) 10.267 14.940 ( 3.541 2.679 -5.591) 7.140 15.577 ( 13.864 22.929 4.563) 27.180 16.675 ( 7.775 4.993 -0.204) 9.243 16.803 ( 32.084 55.955 3.590) 64.600 20.025 ( -0.144 -14.719 0.026) 14.720 21.235 ( -30.869 -45.329 -7.736) 55.385======================= Grid point 30 (22/322) =======================q-point: ( 0.31 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.204 ( 13.872 -14.365 3.657) 20.302 1.784 ( 18.887 -18.704 3.505) 26.811 2.579 ( -7.762 -2.983 -1.393) 8.431 2.729 ( 12.823 -15.495 -2.607) 20.281 2.924 ( 7.523 -13.370 1.576) 15.422 2.991 ( 2.605 -11.654 -1.824) 12.080 3.162 ( -3.147 -9.127 -1.139) 9.721 3.485 ( 2.635 -9.947 0.400) 10.298 3.578 ( 4.710 -5.154 -2.782) 7.516 3.663 ( -0.815 -6.264 -1.592) 6.514 4.013 ( 0.800 -4.515 3.712) 5.899 4.298 ( -2.300 -1.507 -0.153) 2.754 4.550 ( -1.390 -13.977 0.858) 14.072 4.763 ( -1.725 -11.826 1.163) 12.008 5.192 ( -3.477 -6.501 3.202) 8.038 5.332 ( -5.055 -19.149 -4.287) 20.263 5.449 ( -7.660 -2.489 0.244) 8.058 5.930 ( -8.309 -20.123 -2.481) 21.912 6.202 ( -10.761 8.002 -1.502) 13.494 7.172 ( -10.428 12.576 -1.976) 16.457 7.587 ( 4.821 12.810 0.924) 13.718 7.956 ( 4.837 7.699 1.085) 9.157 9.011 ( -1.506 8.828 8.207) 12.147 9.195 ( 5.556 -7.743 -3.318) 10.091 9.652 ( 3.343 14.467 -6.416) 16.175 10.078 ( -5.180 6.036 -2.238) 8.263 10.271 ( 2.978 -2.279 -0.162) 3.754 10.630 ( -1.619 -4.295 -3.237) 5.617 11.185 ( -2.850 -16.021 2.099) 16.408 11.230 ( -1.090 5.575 5.210) 7.708 14.888 ( 5.288 3.820 -4.304) 7.816 15.299 ( 17.994 13.636 4.149) 22.955 16.324 ( 12.376 15.044 0.776) 19.496 16.641 ( 7.045 4.635 0.504) 8.448 20.398 ( -0.157 -21.956 0.006) 21.956 21.611 ( -17.037 -14.381 -3.871) 22.629======================= Grid point 31 (23/322) =======================q-point: ( 0.38 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.497 ( 12.295 -6.126 1.158) 13.785 2.205 ( 13.790 -13.669 1.887) 19.508 2.560 ( -7.687 -0.658 -0.848) 7.762 2.893 ( -1.250 -5.095 -3.980) 6.585 3.165 ( 3.645 -9.045 0.556) 9.768 3.217 ( -1.146 -8.063 -1.168) 8.228 3.413 ( 1.474 -12.262 -3.988) 12.979 3.569 ( -4.654 -0.568 -2.807) 5.464 3.729 ( 6.917 -6.954 -1.183) 9.879 3.993 ( 15.348 -18.732 4.306) 24.596 4.137 ( 1.847 -7.164 4.128) 8.472 4.293 ( -2.962 -0.039 -2.003) 3.576 4.658 ( -2.616 -2.269 1.800) 3.903 4.833 ( -3.347 2.123 2.828) 4.869 5.278 ( -2.265 -3.686 2.487) 4.991 5.480 ( -8.465 -5.574 -2.002) 10.331 5.870 ( -1.147 -24.761 -1.030) 24.808 5.951 ( -9.790 2.495 -2.056) 10.310 6.463 ( -13.081 -34.779 -0.760) 37.165 6.850 ( -7.385 12.324 -1.052) 14.405 7.358 ( 9.440 13.358 1.028) 16.389 7.955 ( 5.851 -2.876 0.788) 6.568 8.781 ( -3.025 13.458 5.483) 14.843 9.284 ( -0.265 3.673 -3.807) 5.297 9.360 ( 6.822 13.136 -3.242) 15.153 9.842 ( -4.150 10.861 -2.028) 11.803 10.332 ( 2.019 0.347 1.740) 2.687 10.612 ( 0.497 8.199 -1.869) 8.424 11.274 ( -2.881 -14.982 3.306) 15.611 11.571 ( -4.598 -22.260 -0.859) 22.746 14.861 ( 5.272 1.381 -3.508) 6.481 15.227 ( 13.097 5.001 3.148) 14.368 16.195 ( 6.538 4.747 0.247) 8.083 16.598 ( 5.522 3.469 0.656) 6.554 20.831 ( -0.092 -21.128 -0.114) 21.129 21.698 ( -7.254 -3.241 -1.283) 8.048======================= Grid point 32 (24/322) =======================q-point: ( 0.46 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.549 ( 9.913 8.040 -1.156) 12.816 2.414 ( 0.411 -0.461 -1.102) 1.263 2.582 ( 3.840 -5.550 0.939) 6.814 2.976 ( -2.333 -5.127 -1.145) 5.748 3.295 ( 3.069 -3.563 -2.692) 5.418 3.395 ( -0.027 -9.224 1.641) 9.369 3.543 ( -4.036 -2.068 -2.243) 5.059 3.611 ( 1.725 -7.000 -4.308) 8.398 3.889 ( 2.575 -6.418 1.796) 7.145 4.224 ( 1.969 0.494 0.082) 2.032 4.289 ( -3.147 -5.166 0.054) 6.049 4.367 ( 8.806 -4.635 1.448) 10.056 4.705 ( -7.691 4.039 -0.278) 8.692 4.792 ( 2.465 -10.425 5.694) 12.132 5.327 ( 3.367 -0.753 2.108) 4.043 5.553 ( -9.132 -7.001 -1.947) 11.671 5.735 ( -14.311 3.164 0.121) 14.658 6.271 ( 0.215 -4.302 -0.523) 4.339 6.728 ( -0.692 -5.665 0.224) 5.712 6.992 ( -2.473 -14.503 0.267) 14.715 7.270 ( 4.437 -7.067 -1.050) 8.410 8.092 ( 6.732 -6.530 0.643) 9.401 8.486 ( -6.547 13.703 1.336) 15.245 9.040 ( 1.985 13.308 -0.311) 13.459 9.250 ( 2.873 7.177 -3.610) 8.533 9.644 ( -2.084 7.245 -0.062) 7.539 10.331 ( -0.471 -1.113 -0.463) 1.294 10.387 ( 0.246 11.903 1.241) 11.970 11.679 ( 1.567 -22.815 0.799) 22.883 11.957 ( -7.592 -20.124 -1.242) 21.544 14.872 ( 4.404 0.272 -2.870) 5.263 15.226 ( 8.326 2.617 2.518) 9.084 16.200 ( 5.503 -1.181 0.291) 5.636 16.568 ( 3.144 2.495 0.628) 4.063 21.196 ( 0.009 -15.682 -0.222) 15.683 21.675 ( -1.826 2.280 0.004) 2.921======================= Grid point 33 (25/322) =======================q-point: ( 0.54 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.316 ( 6.893 18.705 -1.473) 19.989 2.355 ( -1.758 3.454 -0.789) 3.955 2.698 ( 3.102 -1.878 0.415) 3.649 3.058 ( -1.739 -4.116 0.177) 4.472 3.366 ( 4.835 -2.154 -2.428) 5.823 3.545 ( 0.532 -5.053 0.987) 5.176 3.582 ( -2.703 -4.710 -0.515) 5.455 3.742 ( 3.978 -5.076 -2.585) 6.948 4.008 ( -2.493 -4.914 2.612) 6.098 4.170 ( 0.724 3.272 -0.880) 3.465 4.387 ( -1.169 -4.238 0.916) 4.491 4.419 ( 1.386 -0.113 -1.124) 1.788 4.547 ( -6.842 5.996 0.423) 9.108 5.046 ( 1.485 -8.973 2.824) 9.523 5.369 ( 6.884 -0.836 1.330) 7.061 5.609 ( -10.669 -4.476 0.690) 11.590 5.683 ( -8.959 -4.732 -1.481) 10.240 6.233 ( 1.768 3.990 0.567) 4.400 6.857 ( 3.415 -2.615 0.747) 4.366 7.033 ( 6.253 2.860 -0.362) 6.886 7.609 ( -1.422 -17.115 -0.559) 17.183 8.187 ( -9.826 10.128 -2.162) 14.275 8.292 ( 5.425 -8.945 0.668) 10.483 8.820 ( 4.010 11.636 1.680) 12.422 9.103 ( -0.375 7.070 -2.451) 7.493 9.513 ( -1.124 5.627 0.820) 5.796 10.209 ( 0.193 5.509 0.030) 5.512 10.404 ( -1.040 -6.137 0.046) 6.225 12.081 ( 1.555 -14.390 -0.370) 14.478 12.273 ( -5.499 -17.391 -0.349) 18.243 14.883 ( 3.351 0.626 -1.699) 3.809 15.214 ( 4.206 2.787 1.459) 5.252 16.281 ( 5.038 -3.036 0.368) 5.893 16.526 ( -0.014 2.964 0.359) 2.986 21.438 ( 0.055 -8.997 -0.173) 8.999 21.603 ( 0.212 4.182 0.302) 4.198======================= Grid point 34 (26/322) =======================q-point: ( 0.62 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.991 ( 4.147 14.357 -0.019) 14.944 2.298 ( -0.633 0.782 -0.201) 1.026 2.690 ( -0.467 2.810 0.441) 2.883 3.100 ( -2.340 -1.179 0.058) 2.621 3.436 ( 6.525 -1.515 -1.604) 6.888 3.602 ( -0.272 -0.946 1.518) 1.810 3.679 ( 1.431 -4.864 -0.024) 5.070 3.850 ( 4.990 -3.446 0.046) 6.064 4.041 ( -6.417 -0.741 0.182) 6.462 4.134 ( 1.892 1.380 1.095) 2.585 4.366 ( -7.539 3.733 -3.037) 8.944 4.438 ( -0.321 -1.665 -1.526) 2.281 4.458 ( -0.057 0.664 1.984) 2.093 5.135 ( -2.160 -0.893 0.963) 2.528 5.437 ( 7.390 -0.708 0.848) 7.472 5.657 ( -6.167 -4.480 0.486) 7.638 5.741 ( -5.586 -6.223 -1.304) 8.464 6.195 ( 2.483 0.978 0.830) 2.795 6.884 ( 6.903 1.920 0.737) 7.203 7.009 ( 2.517 2.330 -0.549) 3.473 7.814 ( -0.533 -1.812 0.024) 1.889 7.982 ( -10.432 0.706 -3.088) 10.902 8.515 ( 1.538 -7.550 0.809) 7.747 8.633 ( 6.699 7.719 2.179) 10.450 8.989 ( -1.530 3.295 -1.052) 3.782 9.425 ( -0.319 2.308 0.358) 2.358 10.161 ( 0.030 0.419 -0.081) 0.428 10.510 ( -0.710 -3.780 0.009) 3.846 12.224 ( -3.391 -2.037 -1.220) 4.140 12.568 ( 1.833 -11.872 0.805) 12.040 14.880 ( 2.047 1.103 -0.377) 2.356 15.169 ( 1.340 3.547 0.404) 3.813 16.332 ( 3.072 1.871 0.107) 3.598 16.464 ( -2.368 1.558 0.073) 2.836 21.532 ( 0.222 2.616 0.256) 2.638 21.553 ( 0.035 -2.742 -0.187) 2.749======================= Grid point 35 (27/322) =======================q-point: (-0.31 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.914 ( 0.734 -5.486 1.171) 5.658 2.337 ( 0.548 -4.852 0.212) 4.887 2.603 ( -1.683 5.456 0.401) 5.723 3.085 ( -2.300 1.092 0.369) 2.573 3.458 ( 2.902 2.813 -1.044) 4.175 3.603 ( 1.328 0.716 1.805) 2.353 3.771 ( 5.439 -1.942 0.735) 5.822 3.923 ( 7.676 1.203 2.103) 8.049 3.992 ( -8.263 0.159 -2.104) 8.528 4.098 ( -3.587 2.725 0.920) 4.598 4.256 ( -4.037 2.692 -2.328) 5.382 4.452 ( -1.061 -0.693 -0.957) 1.588 4.462 ( -0.455 -0.498 -0.158) 0.693 5.084 ( -1.868 4.628 0.103) 4.992 5.476 ( 6.987 0.723 0.623) 7.052 5.655 ( -6.525 -0.018 -0.955) 6.595 5.914 ( 0.430 -12.554 -0.301) 12.565 6.221 ( 1.858 -1.867 0.662) 2.716 6.851 ( 8.267 7.333 0.138) 11.052 6.992 ( -1.189 -1.080 -0.038) 1.607 7.725 ( -8.209 2.826 -1.218) 8.767 7.992 ( -0.811 0.234 -0.337) 0.909 8.419 ( 0.962 7.066 0.253) 7.136 8.796 ( 5.101 -9.902 1.996) 11.316 8.961 ( -2.085 -1.656 -0.342) 2.684 9.439 ( 0.298 -3.824 -0.234) 3.843 10.159 ( 0.009 -0.015 -0.099) 0.100 10.512 ( -0.500 3.275 0.112) 3.315 12.148 ( -2.991 7.216 -0.941) 7.868 12.713 ( 3.445 -0.456 0.878) 3.584 14.866 ( 0.878 1.120 0.619) 1.552 15.089 ( -0.647 4.904 -0.477) 4.970 16.238 ( -0.848 6.685 -0.084) 6.739 16.448 ( -1.280 0.163 -0.131) 1.297 21.516 ( -0.132 -1.373 -0.150) 1.388 21.553 ( -0.042 2.835 0.104) 2.837======================= Grid point 36 (28/322) =======================q-point: (-0.23 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.122 ( -0.898 -12.063 0.618) 12.113 2.434 ( 0.748 8.387 0.210) 8.422 2.487 ( -1.405 -6.243 0.156) 6.401 3.038 ( -1.310 2.683 0.471) 3.023 3.363 ( -0.077 6.743 -0.431) 6.757 3.589 ( 1.766 2.716 0.859) 3.352 3.811 ( 6.518 2.404 2.491) 7.380 3.872 ( 5.161 5.070 3.494) 8.035 3.936 ( -3.986 4.142 -3.707) 6.840 3.986 ( -8.794 3.961 -2.031) 9.856 4.210 ( -0.480 1.698 0.089) 1.767 4.446 ( -0.078 1.772 1.122) 2.099 4.472 ( -1.526 -2.251 -2.615) 3.773 4.959 ( 0.158 6.397 0.081) 6.399 5.501 ( 4.952 0.422 0.339) 4.981 5.609 ( -4.439 1.200 -0.610) 4.639 6.214 ( 2.423 -16.715 -0.375) 16.894 6.282 ( 1.202 -2.988 0.235) 3.229 6.699 ( 2.296 10.189 0.102) 10.445 7.001 ( -0.137 1.156 0.198) 1.181 7.661 ( -4.048 -0.041 -0.431) 4.071 7.876 ( -0.014 12.359 0.335) 12.363 8.366 ( 0.331 -2.061 -0.790) 2.232 8.988 ( 3.172 -6.087 1.421) 7.010 9.028 ( -2.386 -6.822 -0.024) 7.228 9.565 ( 0.496 -8.295 -0.147) 8.311 10.188 ( -0.135 -4.141 -0.150) 4.146 10.404 ( -0.346 6.313 0.113) 6.323 11.921 ( -1.227 14.118 -0.463) 14.179 12.613 ( 2.312 12.558 0.524) 12.780 14.853 ( 0.433 0.615 1.159) 1.382 14.966 ( -1.734 6.836 -1.128) 7.142 16.109 ( -1.059 5.136 -0.006) 5.244 16.428 ( -0.978 0.951 -0.171) 1.374 21.438 ( -0.005 8.946 0.047) 8.946 21.590 ( -0.061 -6.117 -0.082) 6.118======================= Grid point 37 (29/322) =======================q-point: (-0.15 0.15 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.278 ( 0.000 -2.658 -0.000) 2.658 2.159 ( -0.000 17.965 0.000) 17.965 2.636 ( 0.000 -6.334 -0.000) 6.334 2.966 ( -0.000 4.286 0.000) 4.286 3.215 ( -0.000 8.004 0.000) 8.004 3.500 ( -0.000 6.673 0.000) 6.673 3.711 ( -0.000 16.452 0.000) 16.452 3.746 ( -0.000 4.198 0.000) 4.198 3.864 ( -0.000 1.083 0.000) 1.083 3.869 ( -0.000 5.655 0.000) 5.655 4.120 ( -0.000 6.908 0.000) 6.908 4.392 ( -0.000 3.324 0.000) 3.324 4.527 ( 0.000 -3.814 -0.000) 3.814 4.888 ( -0.000 0.263 0.000) 0.263 5.507 ( -0.000 0.980 0.000) 0.980 5.550 ( -0.000 3.560 0.000) 3.560 6.279 ( -0.000 7.879 0.000) 7.879 6.433 ( -0.000 4.644 0.000) 4.644 6.669 ( 0.000 -16.619 -0.000) 16.619 6.965 ( 0.000 -0.664 -0.000) 0.664 7.496 ( -0.000 25.153 0.000) 25.153 7.662 ( 0.000 -0.387 -0.000) 0.387 8.500 ( 0.000 -10.833 -0.000) 10.833 9.095 ( 0.000 -4.490 -0.000) 4.490 9.181 ( 0.000 -9.135 -0.000) 9.135 9.755 ( 0.000 -10.780 -0.000) 10.780 10.298 ( -0.000 4.144 0.000) 4.144 10.346 ( 0.000 -11.822 -0.000) 11.822 11.606 ( -0.000 16.679 0.000) 16.679 12.256 ( -0.000 24.040 0.000) 24.040 14.807 ( -0.000 8.076 0.000) 8.076 14.855 ( 0.000 -0.501 -0.000) 0.501 16.039 ( -0.000 1.584 0.000) 1.584 16.413 ( 0.000 -0.086 -0.000) 0.086 21.198 ( -0.000 15.574 0.000) 15.574 21.743 ( 0.000 -8.974 -0.000) 8.974======================= Grid point 42 (30/322) =======================q-point: ( 0.23 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.778 ( 21.262 0.000 7.127) 22.424 1.101 ( 28.877 0.000 4.182) 29.178 2.123 ( 53.531 0.000 4.651) 53.732 2.556 ( -14.626 -0.000 0.531) 14.636 2.569 ( 0.161 0.000 0.956) 0.970 2.799 ( -0.662 -0.000 -3.887) 3.943 2.930 ( -5.926 -0.000 -0.524) 5.949 3.292 ( -4.339 -0.000 0.848) 4.421 3.324 ( 9.582 0.000 3.819) 10.315 3.469 ( -1.673 -0.000 -8.223) 8.391 3.840 ( 2.320 0.000 0.676) 2.416 3.918 ( -2.235 -0.000 -1.112) 2.496 4.143 ( 1.327 0.000 0.136) 1.334 4.442 ( 0.650 0.000 1.872) 1.981 5.062 ( -7.606 -0.000 -5.759) 9.540 5.096 ( -8.388 -0.000 3.687) 9.163 5.438 ( -6.258 -0.000 5.316) 8.211 5.759 ( -7.458 -0.000 -5.192) 9.088 6.424 ( -3.814 -0.000 -4.315) 5.759 7.420 ( -10.619 -0.000 -0.596) 10.635 7.806 ( -0.603 -0.000 -3.480) 3.532 8.428 ( 2.184 0.000 -0.339) 2.210 8.750 ( 7.118 0.000 0.175) 7.120 9.335 ( -2.908 -0.000 2.532) 3.856 9.704 ( 1.291 0.000 0.796) 1.517 9.962 ( 6.670 0.000 -10.059) 12.069 10.580 ( 0.391 0.000 2.427) 2.458 10.656 ( -0.940 -0.000 -0.478) 1.054 10.708 ( -8.863 -0.000 -0.715) 8.892 11.471 ( 0.256 0.000 6.528) 6.533 14.980 ( 4.930 0.000 -6.151) 7.883 15.803 ( -0.793 -0.000 0.950) 1.238 16.764 ( 9.022 0.000 0.319) 9.027 18.191 ( -9.542 -0.000 -8.655) 12.882 19.872 ( -0.132 -0.000 -0.005) 0.132 20.111 ( -0.052 -0.000 0.021) 0.056======================= Grid point 43 (31/322) =======================q-point: ( 0.31 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.038 ( 19.151 -11.350 5.422) 22.913 1.521 ( 22.688 -19.742 3.662) 30.297 2.461 ( -11.136 -2.419 -1.452) 11.488 2.547 ( 28.596 -10.976 0.513) 30.635 2.722 ( 8.014 -11.752 2.271) 14.404 2.838 ( 0.078 -5.196 -3.249) 6.129 2.977 ( -5.300 -7.025 -1.571) 8.939 3.359 ( -0.786 -3.420 2.604) 4.369 3.446 ( -2.145 -11.953 1.486) 12.234 3.543 ( 11.459 -5.476 -4.307) 13.411 3.937 ( 0.005 -4.138 1.374) 4.361 4.112 ( -3.226 -17.900 0.544) 18.196 4.232 ( 0.123 -9.577 -0.386) 9.585 4.506 ( -0.411 -8.551 0.664) 8.586 5.017 ( -14.677 -5.314 -7.222) 17.199 5.108 ( -0.661 -2.377 4.284) 4.943 5.392 ( -8.043 0.847 3.164) 8.684 5.694 ( -10.622 -1.300 -3.512) 11.262 6.327 ( -3.412 7.037 -3.593) 8.606 7.295 ( -10.424 6.459 -1.347) 12.337 7.759 ( 1.334 3.912 -1.150) 4.290 8.237 ( 3.041 15.553 0.721) 15.864 8.954 ( 4.253 -11.904 0.596) 12.655 9.226 ( -0.220 6.757 3.746) 7.729 9.857 ( -2.442 -2.308 -9.134) 9.733 9.945 ( 7.262 -3.276 0.749) 8.002 10.399 ( -3.243 11.287 -0.282) 11.747 10.602 ( 0.842 0.986 0.367) 1.347 10.878 ( -4.592 -12.634 -0.064) 13.442 11.400 ( -1.363 7.412 5.788) 9.503 14.979 ( 6.018 2.532 -5.408) 8.478 15.677 ( 3.529 12.109 1.701) 12.727 16.774 ( 9.103 4.707 0.473) 10.259 17.112 ( 18.940 56.734 0.436) 59.814 20.023 ( -0.152 -14.707 0.027) 14.708 20.915 ( -20.636 -44.784 -5.178) 49.581======================= Grid point 44 (32/322) =======================q-point: ( 0.38 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.392 ( 16.238 -12.009 3.143) 20.440 2.003 ( 16.944 -16.285 2.850) 23.673 2.448 ( -12.900 -4.075 -0.576) 13.540 2.769 ( -1.437 -6.559 -4.716) 8.205 2.966 ( -0.282 -10.422 1.609) 10.550 3.083 ( 3.382 -7.144 -3.108) 8.493 3.157 ( 8.325 -14.498 -3.488) 17.078 3.495 ( -0.848 -6.284 -1.176) 6.449 3.615 ( 3.137 -7.801 1.933) 8.628 3.789 ( 21.302 -11.996 3.317) 24.672 4.027 ( -0.202 -4.472 2.263) 5.016 4.267 ( -2.658 -1.842 0.468) 3.268 4.548 ( 0.211 -13.543 1.981) 13.689 4.722 ( -5.635 -10.053 -0.491) 11.535 5.180 ( -0.509 -5.429 1.301) 5.606 5.221 ( -11.157 -22.840 -3.762) 25.697 5.361 ( -6.644 -6.067 -0.127) 8.999 5.786 ( -15.135 -19.796 -1.321) 24.954 6.111 ( -3.982 11.698 -1.769) 12.483 7.046 ( -9.590 11.827 -2.174) 15.381 7.664 ( 7.558 9.558 1.260) 12.250 8.000 ( 1.994 7.202 0.953) 7.534 9.013 ( -2.123 9.727 6.811) 12.063 9.233 ( 2.620 -6.847 -4.149) 8.424 9.680 ( 4.899 13.736 -4.574) 15.284 10.011 ( -5.270 7.061 -1.696) 8.972 10.317 ( 4.740 -4.547 0.335) 6.577 10.604 ( -1.995 -2.779 -1.228) 3.635 11.153 ( -2.875 -17.352 0.168) 17.589 11.222 ( -2.947 7.774 4.553) 9.479 14.942 ( 6.169 3.645 -3.988) 8.200 15.468 ( 9.285 11.320 2.359) 14.830 16.473 ( 12.040 20.996 0.586) 24.210 16.729 ( 7.388 6.068 0.790) 9.593 20.397 ( -0.148 -21.960 0.007) 21.960 21.417 ( -13.839 -20.343 -3.124) 24.802======================= Grid point 45 (33/322) =======================q-point: ( 0.46 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.651 ( 13.306 -3.923 0.720) 13.891 2.344 ( 7.338 -8.664 0.350) 11.359 2.468 ( -6.177 -5.620 0.593) 8.372 2.860 ( -2.023 -5.285 -3.133) 6.468 3.189 ( -0.295 -11.491 1.469) 11.588 3.213 ( 1.520 -6.047 -2.077) 6.572 3.429 ( 3.672 -10.801 -4.214) 12.162 3.508 ( -4.322 -0.194 -2.324) 4.911 3.800 ( 5.360 -5.991 0.526) 8.056 4.128 ( -1.642 -6.744 1.859) 7.186 4.221 ( 8.480 -7.709 0.662) 11.480 4.293 ( 12.109 -7.604 3.880) 14.816 4.621 ( -4.644 -1.121 0.666) 4.824 4.782 ( -5.422 1.042 2.521) 6.070 5.278 ( 0.100 -4.883 1.332) 5.062 5.339 ( -13.798 -7.197 -2.798) 15.812 5.822 ( -6.196 5.923 0.509) 8.587 5.889 ( 0.006 -25.968 -1.541) 26.013 6.319 ( -10.815 -37.300 -1.255) 38.857 6.770 ( -5.554 9.588 -1.139) 11.139 7.479 ( 10.377 12.995 1.418) 16.690 8.007 ( 2.447 -4.608 0.628) 5.255 8.745 ( -5.063 15.243 2.676) 16.283 9.266 ( -0.315 5.238 -2.263) 5.715 9.441 ( 7.429 12.184 -2.377) 14.467 9.792 ( -3.333 9.410 -1.390) 10.079 10.353 ( 0.698 2.539 1.564) 3.063 10.611 ( 0.303 7.054 -1.184) 7.159 11.248 ( -2.884 -16.460 2.285) 16.867 11.521 ( -3.446 -20.364 -0.756) 20.667 14.914 ( 5.382 1.860 -2.845) 6.365 15.361 ( 8.180 5.897 2.042) 10.289 16.275 ( 6.595 6.414 0.411) 9.209 16.658 ( 4.342 4.627 0.602) 6.374 20.829 ( -0.075 -21.160 -0.092) 21.160 21.617 ( -5.689 -7.207 -0.995) 9.235======================= Grid point 46 (34/322) =======================q-point: ( 0.54 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.657 ( 8.747 10.237 -0.918) 13.497 2.386 ( -3.418 0.605 -1.005) 3.614 2.632 ( 2.952 -6.802 1.055) 7.490 2.957 ( -0.186 -5.405 -0.814) 5.469 3.331 ( 3.880 -4.426 -0.954) 5.962 3.398 ( -0.278 -9.457 0.260) 9.465 3.497 ( -2.243 -2.121 -1.568) 3.462 3.634 ( 4.058 -8.042 -3.513) 9.669 3.906 ( -2.003 -3.836 2.714) 5.108 4.208 ( -2.682 -0.776 -2.173) 3.538 4.278 ( 1.685 -5.031 1.616) 5.547 4.457 ( 2.704 2.438 0.860) 3.741 4.622 ( -4.184 3.991 -0.523) 5.806 4.849 ( 5.374 -12.066 5.327) 14.242 5.370 ( 0.483 -3.988 -0.891) 4.115 5.417 ( -10.955 -8.067 -0.488) 13.614 5.611 ( -6.535 5.143 0.205) 8.319 6.278 ( 0.984 -4.680 -0.100) 4.784 6.717 ( -1.066 -8.087 -0.086) 8.157 6.954 ( -3.455 -26.587 -0.034) 26.810 7.349 ( 8.112 2.873 0.165) 8.608 8.150 ( 2.668 -7.405 0.398) 7.881 8.399 ( -7.504 15.444 -0.788) 17.188 9.086 ( 4.657 11.771 2.471) 12.897 9.257 ( 0.216 9.424 -4.248) 10.339 9.628 ( -0.732 6.597 0.272) 6.643 10.320 ( -0.963 -0.720 -0.261) 1.231 10.391 ( -0.214 11.949 0.854) 11.982 11.698 ( 1.370 -25.142 0.293) 25.181 11.876 ( -5.454 -18.262 -0.720) 19.073 14.915 ( 4.038 0.791 -1.926) 4.544 15.309 ( 4.739 4.029 1.468) 6.391 16.264 ( 5.038 -0.994 0.446) 5.154 16.596 ( 1.391 3.758 0.374) 4.024 21.195 ( 0.009 -15.717 -0.156) 15.718 21.657 ( -1.253 0.472 0.011) 1.339======================= Grid point 47 (35/322) =======================q-point: ( 0.62 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.383 ( 4.594 19.774 -0.686) 20.312 2.335 ( -1.222 2.713 -0.487) 3.015 2.715 ( 0.152 -0.785 0.418) 0.902 3.046 ( -0.579 -3.398 -0.258) 3.457 3.428 ( 5.872 -2.809 -0.956) 6.579 3.552 ( 0.453 -5.159 -0.042) 5.179 3.561 ( -0.769 -6.041 0.420) 6.104 3.786 ( 4.774 -5.332 -2.189) 7.485 3.947 ( -8.793 -3.524 1.920) 9.665 4.200 ( 5.008 1.855 0.101) 5.341 4.362 ( -4.440 -0.662 -0.737) 4.550 4.400 ( -2.436 -0.247 -0.184) 2.455 4.515 ( 0.261 4.293 0.502) 4.330 5.066 ( 0.953 -5.649 2.068) 6.090 5.442 ( 4.026 -2.952 -0.846) 5.063 5.510 ( -5.802 -6.380 1.879) 8.826 5.585 ( -6.268 -4.987 -1.480) 8.145 6.255 ( 1.419 3.400 0.500) 3.718 6.876 ( 0.369 -4.935 0.254) 4.955 7.120 ( 6.998 3.741 0.433) 7.947 7.603 ( 0.463 -18.158 -0.199) 18.165 8.057 ( -9.470 12.097 -2.443) 15.556 8.342 ( 2.576 -9.150 0.555) 9.522 8.890 ( 5.890 12.202 2.636) 13.803 9.077 ( -2.505 6.828 -2.580) 7.717 9.505 ( -0.559 5.578 0.508) 5.629 10.210 ( 0.047 5.565 -0.048) 5.566 10.393 ( -0.852 -6.337 0.078) 6.395 12.083 ( -0.556 -10.916 -0.839) 10.963 12.233 ( -1.678 -21.595 0.381) 21.664 14.915 ( 2.458 1.091 -0.900) 2.836 15.253 ( 1.973 3.882 0.716) 4.413 16.339 ( 4.268 -2.855 0.375) 5.148 16.517 ( -1.470 4.498 0.086) 4.733 21.438 ( 0.035 -9.016 -0.099) 9.017 21.606 ( 0.120 3.813 0.173) 3.819======================= Grid point 48 (36/322) =======================q-point: (-0.31 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.028 ( 1.761 15.183 0.087) 15.285 2.292 ( -0.255 0.313 -0.077) 0.411 2.685 ( -0.389 3.325 0.209) 3.354 3.079 ( -1.008 -0.750 -0.086) 1.260 3.494 ( 3.087 -0.769 -0.664) 3.250 3.606 ( 0.151 -1.164 0.969) 1.522 3.707 ( 2.720 -6.901 0.215) 7.421 3.886 ( 0.129 -3.011 -0.755) 3.106 3.968 ( -3.584 -2.867 0.280) 4.598 4.164 ( 2.097 5.096 1.163) 5.632 4.283 ( -4.236 2.072 -1.740) 5.026 4.438 ( 0.369 -1.666 -0.438) 1.761 4.460 ( -0.216 1.697 0.619) 1.819 5.116 ( -1.010 -0.239 0.387) 1.107 5.515 ( 5.324 -0.901 -0.099) 5.401 5.590 ( -5.154 -3.420 0.346) 6.196 5.691 ( -2.040 -9.333 -0.406) 9.562 6.218 ( 0.982 0.839 0.355) 1.339 6.930 ( 1.156 -1.495 0.319) 1.917 7.056 ( 3.877 6.011 -0.084) 7.153 7.786 ( -3.184 7.028 -0.412) 7.727 7.899 ( -2.273 -8.295 -0.980) 8.657 8.524 ( 0.165 -4.438 0.366) 4.456 8.706 ( 3.534 5.438 1.066) 6.572 8.968 ( -1.169 2.999 -0.607) 3.275 9.423 ( -0.119 2.033 0.131) 2.041 10.161 ( 0.011 0.422 -0.041) 0.424 10.504 ( -0.329 -3.885 0.012) 3.899 12.190 ( -1.493 -1.475 -0.519) 2.162 12.588 ( 0.889 -13.291 0.346) 13.325 14.898 ( 0.940 1.473 -0.114) 1.751 15.181 ( 0.437 4.370 0.131) 4.394 16.369 ( 2.723 5.355 0.088) 6.008 16.433 ( -2.556 -0.334 -0.024) 2.578 21.534 ( 0.083 2.877 0.098) 2.880 21.553 ( 0.010 -2.820 -0.073) 2.821======================= Grid point 49 (37/322) =======================q-point: (-0.23 0.23 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.921 ( 0.000 -4.620 -0.000) 4.620 2.340 ( 0.000 -5.360 -0.000) 5.360 2.593 ( -0.000 5.921 0.000) 5.921 3.071 ( -0.000 1.111 0.000) 1.111 3.472 ( -0.000 3.851 0.000) 3.851 3.618 ( -0.000 0.099 0.000) 0.099 3.840 ( 0.000 -4.749 -0.000) 4.749 3.893 ( -0.000 0.931 0.000) 0.931 4.016 ( 0.000 -0.813 -0.000) 0.813 4.037 ( -0.000 7.083 0.000) 7.083 4.234 ( -0.000 1.887 0.000) 1.887 4.443 ( 0.000 -0.155 -0.000) 0.155 4.460 ( 0.000 -0.359 -0.000) 0.359 5.073 ( -0.000 4.352 0.000) 4.352 5.532 ( -0.000 0.719 0.000) 0.719 5.600 ( 0.000 -0.214 -0.000) 0.214 5.915 ( 0.000 -13.703 -0.000) 13.703 6.233 ( 0.000 -1.824 -0.000) 1.824 6.914 ( -0.000 9.493 0.000) 9.493 6.978 ( 0.000 -2.546 -0.000) 2.546 7.665 ( -0.000 2.888 0.000) 2.888 7.991 ( 0.000 -0.186 -0.000) 0.186 8.425 ( -0.000 7.033 0.000) 7.033 8.833 ( 0.000 -10.157 -0.000) 10.157 8.945 ( 0.000 -1.089 -0.000) 1.089 9.440 ( 0.000 -3.933 -0.000) 3.933 10.159 ( -0.000 0.020 0.000) 0.020 10.509 ( -0.000 3.266 0.000) 3.266 12.129 ( -0.000 7.124 0.000) 7.124 12.735 ( 0.000 -0.911 -0.000) 0.911 14.873 ( -0.000 1.241 0.000) 1.241 15.085 ( -0.000 5.577 0.000) 5.577 16.233 ( -0.000 7.364 0.000) 7.364 16.440 ( -0.000 0.189 0.000) 0.189 21.515 ( 0.000 -1.300 -0.000) 1.300 21.552 ( -0.000 2.855 0.000) 2.855======================= Grid point 56 (38/322) =======================q-point: ( 0.31 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.052 ( 22.203 0.000 5.558) 22.888 1.441 ( 27.141 0.000 3.872) 27.416 2.356 ( -17.121 -0.000 -0.671) 17.134 2.557 ( -3.501 -0.000 0.592) 3.550 2.719 ( 43.316 0.000 -0.404) 43.318 2.769 ( -2.893 -0.000 -2.249) 3.665 2.867 ( -3.205 -0.000 -2.545) 4.092 3.245 ( -4.189 -0.000 1.277) 4.380 3.343 ( -2.404 -0.000 2.703) 3.617 3.578 ( 17.287 0.000 1.388) 17.343 3.868 ( 2.022 0.000 0.602) 2.110 3.892 ( -1.238 -0.000 -0.744) 1.444 4.151 ( 0.304 0.000 -0.371) 0.479 4.435 ( -2.536 -0.000 1.066) 2.751 4.887 ( -13.773 -0.000 -5.984) 15.016 5.092 ( 0.516 0.000 2.867) 2.914 5.361 ( -9.334 -0.000 2.830) 9.754 5.613 ( -14.416 -0.000 -4.287) 15.040 6.383 ( -1.027 -0.000 -4.060) 4.188 7.302 ( -9.005 -0.000 -0.537) 9.021 7.792 ( -0.425 -0.000 -1.582) 1.638 8.452 ( 1.922 0.000 -0.375) 1.958 8.826 ( 5.661 0.000 0.169) 5.664 9.303 ( -3.423 -0.000 1.184) 3.622 9.722 ( 1.258 0.000 0.724) 1.451 10.030 ( 8.444 0.000 -4.060) 9.369 10.545 ( -8.010 -0.000 2.539) 8.403 10.643 ( -0.905 -0.000 -0.456) 1.013 10.649 ( -0.275 -0.000 -1.743) 1.764 11.474 ( -2.616 -0.000 4.759) 5.431 15.035 ( 7.269 0.000 -5.115) 8.889 15.786 ( -2.313 -0.000 0.149) 2.317 16.884 ( 10.855 0.000 1.117) 10.913 18.040 ( -11.672 -0.000 -7.751) 14.011 19.870 ( -0.124 -0.000 -0.005) 0.124 20.111 ( -0.049 -0.000 0.020) 0.053======================= Grid point 57 (39/322) =======================q-point: ( 0.38 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.285 ( 20.530 -8.931 4.172) 22.774 1.793 ( 21.998 -15.783 3.313) 27.276 2.279 ( -17.262 -3.268 -0.385) 17.573 2.603 ( -6.464 -6.764 -1.795) 9.527 2.801 ( -1.298 -5.654 -0.125) 5.803 2.926 ( -1.962 -7.019 -2.642) 7.752 3.027 ( 22.785 -7.474 -6.253) 24.781 3.358 ( -0.264 -7.198 1.482) 7.354 3.443 ( 4.443 -11.726 3.349) 12.979 3.737 ( 17.673 -6.340 5.210) 19.485 3.946 ( 3.035 -4.986 0.246) 5.842 4.098 ( -0.084 -15.641 2.090) 15.780 4.228 ( -0.569 -9.486 -0.407) 9.512 4.491 ( -1.870 -9.653 0.156) 9.834 4.824 ( -14.033 -4.235 -5.487) 15.652 5.119 ( -0.169 -2.174 0.375) 2.212 5.290 ( -10.618 0.986 2.194) 10.887 5.525 ( -15.130 -1.660 -3.236) 15.561 6.295 ( -0.717 7.756 -2.568) 8.201 7.179 ( -8.393 7.163 -1.280) 11.108 7.777 ( 2.045 1.096 -0.272) 2.336 8.268 ( 1.976 15.237 0.477) 15.372 9.001 ( 3.342 -10.505 0.993) 11.069 9.220 ( -1.970 5.467 1.325) 5.960 9.818 ( -0.687 -3.913 -4.233) 5.805 10.032 ( 6.803 2.345 0.343) 7.204 10.364 ( -2.087 7.710 -0.603) 8.010 10.604 ( -1.040 1.908 1.265) 2.515 10.834 ( -2.660 -13.053 -0.769) 13.343 11.386 ( -3.299 7.415 3.716) 8.925 15.043 ( 7.091 2.856 -4.022) 8.638 15.695 ( -0.425 7.414 0.532) 7.445 16.887 ( 9.600 6.087 1.203) 11.431 17.256 ( 6.913 47.193 -1.720) 47.727 20.022 ( -0.126 -14.697 0.023) 14.698 20.713 ( -12.247 -40.423 -3.053) 42.348======================= Grid point 58 (40/322) =======================q-point: ( 0.46 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.596 ( 16.981 -9.540 2.224) 19.604 2.192 ( 12.737 -12.188 1.872) 17.728 2.286 ( -13.174 -6.904 0.000) 14.873 2.709 ( -5.923 -7.967 -3.327) 10.470 2.964 ( -0.497 -10.663 0.943) 10.717 3.069 ( -1.178 -8.251 -1.838) 8.535 3.246 ( 6.598 -9.074 -4.547) 12.106 3.462 ( -3.149 -2.663 -1.434) 4.366 3.696 ( 9.089 -8.597 0.389) 12.517 3.996 ( -3.070 -6.534 2.071) 7.510 4.127 ( 27.446 -10.021 5.771) 29.783 4.250 ( -0.177 -2.686 2.615) 3.753 4.562 ( 0.861 -13.612 2.034) 13.790 4.642 ( -6.587 -5.930 -1.486) 8.987 5.056 ( -14.188 -18.696 -3.530) 23.734 5.173 ( -1.983 -6.577 -2.981) 7.488 5.308 ( -2.460 -15.162 2.654) 15.588 5.592 ( -15.882 -19.239 -2.028) 25.030 6.083 ( -0.750 12.162 -0.612) 12.200 6.943 ( -6.739 10.989 -1.754) 13.010 7.765 ( 8.570 5.785 1.291) 10.420 8.005 ( -1.437 8.057 0.440) 8.196 9.003 ( -2.473 11.822 4.311) 12.824 9.237 ( 0.671 -6.350 -3.654) 7.357 9.737 ( 6.379 11.066 -2.083) 12.942 9.944 ( -5.358 8.203 -1.167) 9.868 10.381 ( 5.860 -4.141 0.454) 7.190 10.571 ( -3.328 -2.753 -0.145) 4.322 11.125 ( -1.827 -17.436 -0.188) 17.532 11.195 ( -3.375 8.198 2.586) 9.235 15.002 ( 5.544 4.004 -2.681) 7.345 15.543 ( 3.240 8.044 1.042) 8.735 16.593 ( 7.920 23.151 0.213) 24.469 16.810 ( 5.812 7.943 0.736) 9.869 20.395 ( -0.104 -21.963 0.007) 21.964 21.276 ( -8.809 -23.814 -1.976) 25.467======================= Grid point 59 (41/322) =======================q-point: ( 0.54 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.800 ( 11.092 -1.080 0.317) 11.149 2.313 ( -7.770 -4.831 -0.664) 9.174 2.485 ( 4.342 -9.638 1.239) 10.644 2.835 ( -0.811 -7.148 -1.721) 7.397 3.183 ( -1.026 -11.115 1.127) 11.219 3.226 ( 1.293 -8.074 -1.207) 8.265 3.459 ( -2.130 -2.264 -1.142) 3.311 3.470 ( 4.044 -8.703 -3.227) 10.125 3.852 ( 2.845 -2.517 0.958) 3.917 4.074 ( -5.680 -6.878 0.152) 8.922 4.262 ( 2.953 -0.925 0.123) 3.096 4.523 ( 5.954 0.656 1.527) 6.182 4.586 ( 10.315 -8.293 2.529) 13.475 4.748 ( -1.310 -1.593 3.940) 4.447 5.133 ( -17.948 -9.013 -5.575) 20.843 5.287 ( -0.307 -5.288 1.109) 5.411 5.770 ( -2.871 9.034 0.749) 9.509 5.900 ( 1.726 -29.623 -0.397) 29.676 6.209 ( -6.887 -38.804 -1.093) 39.426 6.716 ( -3.067 7.551 -0.764) 8.185 7.595 ( 8.019 13.231 1.262) 15.523 8.017 ( -0.525 -6.432 0.142) 6.455 8.693 ( -3.996 17.164 0.665) 17.635 9.264 ( 0.392 3.546 -0.703) 3.636 9.506 ( 4.357 14.876 -1.461) 15.570 9.759 ( -1.726 7.178 -0.592) 7.406 10.360 ( -0.065 4.402 0.962) 4.506 10.611 ( 0.116 6.734 -0.532) 6.756 11.225 ( -1.825 -17.985 1.101) 18.111 11.488 ( -1.807 -19.246 -0.446) 19.336 14.962 ( 3.627 2.223 -1.569) 4.534 15.431 ( 3.315 5.722 0.917) 6.677 16.342 ( 4.314 7.387 0.323) 8.560 16.699 ( 2.323 5.863 0.369) 6.317 20.829 ( -0.042 -21.183 -0.051) 21.183 21.563 ( -3.095 -9.804 -0.537) 10.295======================= Grid point 60 (42/322) =======================q-point: ( 0.62 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.732 ( 3.793 12.154 -0.352) 12.737 2.348 ( -1.966 -1.160 -0.348) 2.309 2.652 ( 0.402 -5.758 0.387) 5.785 2.960 ( 0.544 -5.368 -0.358) 5.408 3.364 ( 0.841 -7.054 1.231) 7.210 3.398 ( 0.985 -8.484 -1.446) 8.663 3.481 ( -0.355 -2.876 -0.352) 2.919 3.681 ( 4.884 -8.628 -2.282) 10.174 3.854 ( -6.220 -0.309 1.864) 6.501 4.194 ( 0.498 -5.491 -0.416) 5.530 4.314 ( 3.336 -2.430 0.517) 4.160 4.424 ( -5.111 4.645 -0.390) 6.917 4.613 ( 0.598 5.161 0.096) 5.197 4.951 ( 7.609 -8.402 3.731) 11.934 5.250 ( -9.730 -12.109 -3.224) 15.865 5.391 ( -0.742 -5.434 0.598) 5.517 5.579 ( -0.472 6.183 0.435) 6.216 6.288 ( 0.553 -4.710 0.022) 4.743 6.707 ( -0.431 -9.180 -0.060) 9.190 6.923 ( -1.481 -31.294 -0.101) 31.329 7.429 ( 4.186 5.574 0.377) 6.981 8.159 ( -0.521 -6.129 -0.122) 6.153 8.334 ( -2.593 15.093 -0.445) 15.321 9.150 ( 3.959 8.472 3.090) 9.849 9.230 ( -2.077 12.731 -3.593) 13.391 9.625 ( -0.006 6.523 0.170) 6.525 10.310 ( -0.501 -0.654 -0.051) 0.826 10.390 ( -0.156 11.991 0.275) 11.995 11.712 ( 0.726 -27.377 0.037) 27.387 11.829 ( -2.159 -16.250 -0.213) 16.394 14.947 ( 1.689 1.076 -0.680) 2.115 15.347 ( 1.385 4.581 0.465) 4.808 16.310 ( 2.208 -1.032 0.229) 2.448 16.605 ( 0.214 4.778 0.109) 4.784 21.195 ( 0.004 -15.738 -0.056) 15.738 21.647 ( -0.444 -0.525 0.005) 0.687======================= Grid point 61 (43/322) =======================q-point: ( 0.69 0.31 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.410 ( -0.000 20.200 0.000) 20.200 2.326 ( -0.000 2.337 0.000) 2.337 2.715 ( 0.000 -0.586 -0.000) 0.586 3.042 ( 0.000 -2.874 -0.000) 2.874 3.466 ( 0.000 -2.995 -0.000) 2.995 3.556 ( 0.000 -3.957 -0.000) 3.957 3.560 ( 0.000 -8.199 -0.000) 8.199 3.844 ( 0.000 -1.724 -0.000) 1.724 3.853 ( 0.000 -6.636 -0.000) 6.636 4.267 ( 0.000 -1.404 -0.000) 1.404 4.294 ( -0.000 5.903 0.000) 5.903 4.389 ( 0.000 -3.203 -0.000) 3.203 4.520 ( -0.000 4.111 0.000) 4.111 5.077 ( 0.000 -3.384 -0.000) 3.384 5.447 ( 0.000 -9.241 -0.000) 9.241 5.492 ( 0.000 -4.413 -0.000) 4.413 5.546 ( 0.000 -2.994 -0.000) 2.994 6.265 ( -0.000 3.184 0.000) 3.184 6.877 ( 0.000 -5.302 -0.000) 5.302 7.167 ( -0.000 2.884 0.000) 2.884 7.609 ( 0.000 -18.413 -0.000) 18.413 7.990 ( -0.000 13.159 0.000) 13.159 8.357 ( 0.000 -8.967 -0.000) 8.967 8.941 ( -0.000 13.560 0.000) 13.560 9.048 ( -0.000 5.430 0.000) 5.430 9.503 ( -0.000 5.636 0.000) 5.636 10.210 ( -0.000 5.568 0.000) 5.568 10.387 ( 0.000 -6.438 -0.000) 6.438 12.076 ( 0.000 -9.574 -0.000) 9.574 12.225 ( 0.000 -23.173 -0.000) 23.173 14.929 ( -0.000 1.268 0.000) 1.268 15.266 ( -0.000 4.193 0.000) 4.193 16.369 ( 0.000 -3.335 -0.000) 3.335 16.505 ( -0.000 5.656 0.000) 5.656 21.438 ( 0.000 -9.024 -0.000) 9.024 21.607 ( -0.000 3.682 0.000) 3.682======================= Grid point 71 (44/322) =======================q-point: ( 0.38 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.329 ( 22.586 0.000 3.827) 22.908 1.756 ( 24.670 0.000 3.436) 24.908 2.135 ( -19.972 -0.000 -0.401) 19.976 2.472 ( -11.234 -0.000 -0.904) 11.270 2.732 ( -2.232 -0.000 0.148) 2.236 2.843 ( 0.147 0.000 -3.439) 3.443 3.069 ( 15.722 0.000 -8.166) 17.717 3.206 ( -3.140 -0.000 1.251) 3.380 3.408 ( 13.800 0.000 4.665) 14.567 3.759 ( 4.896 0.000 6.425) 8.078 3.890 ( 1.362 0.000 0.412) 1.423 3.940 ( 14.695 0.000 1.959) 14.825 4.154 ( 1.081 0.000 -0.610) 1.241 4.397 ( -3.953 -0.000 0.771) 4.027 4.730 ( -9.761 -0.000 -3.825) 10.483 5.084 ( -4.972 -0.000 -3.728) 6.215 5.243 ( -10.529 -0.000 4.293) 11.371 5.433 ( -12.132 -0.000 -3.542) 12.639 6.370 ( 0.140 0.000 -2.555) 2.559 7.212 ( -5.973 -0.000 -0.372) 5.984 7.786 ( -0.021 -0.000 -0.629) 0.629 8.470 ( 1.289 0.000 -0.308) 1.326 8.881 ( 3.574 0.000 0.128) 3.576 9.268 ( -2.783 -0.000 0.475) 2.824 9.737 ( 0.917 0.000 0.497) 1.043 10.125 ( 8.814 0.000 -1.168) 8.891 10.450 ( -8.198 -0.000 0.686) 8.227 10.633 ( -0.654 -0.000 -0.327) 0.731 10.653 ( 0.670 0.000 -0.261) 0.719 11.447 ( -3.476 -0.000 2.625) 4.356 15.109 ( 7.094 0.000 -3.197) 7.781 15.753 ( -3.042 -0.000 -0.208) 3.049 17.017 ( 10.647 0.000 1.804) 10.799 17.880 ( -11.326 -0.000 -6.136) 12.881 19.869 ( -0.088 -0.000 -0.004) 0.088 20.110 ( -0.035 -0.000 0.014) 0.038======================= Grid point 72 (45/322) =======================q-point: ( 0.46 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.537 ( 20.301 -6.829 2.680) 21.585 2.039 ( 7.260 -9.517 1.500) 12.063 2.077 ( -5.655 -7.516 0.864) 9.445 2.476 ( -13.479 -8.013 -2.206) 15.835 2.790 ( -0.669 -6.534 0.436) 6.583 2.908 ( -0.108 -6.372 -2.055) 6.696 3.146 ( 4.286 -3.705 -4.633) 7.319 3.342 ( -1.827 -9.331 0.221) 9.510 3.589 ( 15.233 -8.370 -0.452) 17.387 3.826 ( -4.464 -7.562 4.031) 9.663 4.107 ( 4.608 -12.708 0.939) 13.551 4.143 ( 20.274 -9.065 6.025) 23.012 4.222 ( 0.781 -8.256 0.839) 8.335 4.473 ( -1.120 -13.292 0.163) 13.340 4.674 ( -8.476 -0.896 -3.157) 9.089 5.028 ( -15.717 -1.527 -7.202) 17.356 5.211 ( -2.679 -0.728 5.863) 6.487 5.367 ( -8.802 -0.677 -3.121) 9.364 6.288 ( 0.126 7.877 -1.137) 7.960 7.098 ( -4.681 7.882 -0.784) 9.201 7.799 ( 1.574 -1.389 0.025) 2.100 8.286 ( 0.902 15.428 0.216) 15.456 9.036 ( 1.974 -10.227 0.924) 10.457 9.197 ( -1.960 5.677 -0.070) 6.006 9.808 ( 0.200 -4.224 -1.563) 4.508 10.095 ( 3.497 7.835 0.249) 8.583 10.354 ( 0.493 1.527 -0.469) 1.672 10.587 ( -2.223 2.957 1.095) 3.857 10.812 ( -0.811 -12.618 -0.594) 12.658 11.356 ( -2.754 7.319 1.679) 7.999 15.108 ( 5.116 3.373 -2.078) 6.470 15.682 ( -1.429 5.125 0.090) 5.321 16.995 ( 7.568 7.719 1.503) 10.915 17.284 ( -0.038 38.754 -2.133) 38.813 20.020 ( -0.071 -14.690 0.013) 14.690 20.603 ( -5.643 -36.693 -1.394) 37.150======================= Grid point 73 (46/322) =======================q-point: ( 0.54 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.783 ( 12.235 -6.478 1.048) 13.884 2.112 ( -11.284 -8.983 -0.469) 14.431 2.343 ( 7.585 -8.135 1.342) 11.203 2.629 ( -5.021 -12.436 -1.563) 13.502 2.962 ( -0.206 -10.572 0.291) 10.578 3.056 ( -0.283 -8.683 -0.682) 8.715 3.286 ( 2.178 -9.136 -1.611) 9.529 3.429 ( -1.577 -1.648 -0.543) 2.345 3.811 ( 10.141 -6.470 -0.728) 12.051 3.926 ( -8.421 -4.136 0.860) 9.421 4.242 ( 0.386 -2.428 0.652) 2.543 4.489 ( 23.980 -12.020 7.127) 27.754 4.573 ( -0.399 -19.019 0.385) 19.027 4.581 ( -1.413 2.640 -0.353) 3.015 4.857 ( -17.472 -8.285 -4.653) 19.889 5.130 ( -2.181 -19.300 -2.605) 19.597 5.317 ( 1.377 -18.820 3.593) 19.210 5.436 ( -8.116 -16.643 -2.474) 18.681 6.080 ( 0.021 12.243 -0.038) 12.243 6.885 ( -2.447 10.481 -0.687) 10.785 7.860 ( 6.315 -0.786 0.824) 6.417 7.972 ( -3.649 12.982 -0.165) 13.486 8.989 ( -1.184 13.422 1.386) 13.545 9.233 ( 0.159 -6.351 -1.361) 6.497 9.808 ( 6.095 8.200 -0.466) 10.228 9.878 ( -5.513 9.802 -0.507) 11.257 10.452 ( 5.683 -0.504 0.194) 5.709 10.524 ( -4.660 -5.799 0.089) 7.440 11.111 ( -0.504 -17.683 -0.121) 17.690 11.169 ( -1.587 8.610 0.807) 8.792 15.044 ( 2.311 4.388 -0.935) 5.046 15.564 ( 0.582 6.238 0.284) 6.271 16.656 ( 2.671 23.380 0.038) 23.532 16.860 ( 2.201 9.017 0.286) 9.286 20.394 ( -0.038 -21.965 0.003) 21.965 21.203 ( -3.005 -25.343 -0.671) 25.529======================= Grid point 74 (47/322) =======================q-point: ( 0.62 0.38 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.877 ( -0.000 1.254 0.000) 1.254 2.254 ( 0.000 -7.343 -0.000) 7.343 2.515 ( 0.000 -7.871 -0.000) 7.871 2.829 ( 0.000 -8.521 -0.000) 8.521 3.178 ( 0.000 -10.913 -0.000) 10.913 3.233 ( 0.000 -8.981 -0.000) 8.981 3.441 ( 0.000 -1.067 -0.000) 1.067 3.496 ( 0.000 -10.837 -0.000) 10.837 3.869 ( -0.000 2.117 0.000) 2.117 4.035 ( 0.000 -9.350 -0.000) 9.350 4.284 ( 0.000 -1.908 -0.000) 1.908 4.501 ( -0.000 4.336 0.000) 4.336 4.699 ( -0.000 1.814 0.000) 1.814 4.859 ( 0.000 -5.271 -0.000) 5.271 4.912 ( 0.000 -16.419 -0.000) 16.419 5.286 ( 0.000 -5.103 -0.000) 5.103 5.756 ( -0.000 8.265 0.000) 8.265 5.913 ( 0.000 -29.804 -0.000) 29.804 6.164 ( 0.000 -39.277 -0.000) 39.277 6.697 ( -0.000 6.806 0.000) 6.806 7.650 ( -0.000 13.773 0.000) 13.773 8.010 ( 0.000 -7.564 -0.000) 7.564 8.669 ( -0.000 17.922 0.000) 17.922 9.266 ( -0.000 2.693 0.000) 2.693 9.529 ( -0.000 16.590 0.000) 16.590 9.748 ( -0.000 5.794 0.000) 5.794 10.360 ( -0.000 5.136 0.000) 5.136 10.611 ( -0.000 6.745 0.000) 6.745 11.215 ( 0.000 -18.656 -0.000) 18.656 11.476 ( 0.000 -18.884 -0.000) 18.884 14.982 ( -0.000 2.369 0.000) 2.369 15.451 ( -0.000 5.544 0.000) 5.544 16.369 ( -0.000 7.615 0.000) 7.615 16.713 ( -0.000 6.431 0.000) 6.431 20.828 ( 0.000 -21.192 -0.000) 21.192 21.544 ( 0.000 -10.703 -0.000) 10.703======================= Grid point 86 (48/322) =======================q-point: ( 0.46 0.46 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.595 ( 20.285 0.000 2.073) 20.390 1.897 ( -19.427 -0.000 -0.865) 19.447 2.031 ( 19.735 0.000 2.639) 19.910 2.302 ( -15.638 -0.000 -1.876) 15.751 2.718 ( -0.518 -0.000 0.328) 0.613 2.840 ( 0.389 0.000 -1.479) 1.530 3.125 ( 1.510 0.000 -2.801) 3.182 3.182 ( -1.193 -0.000 0.539) 1.309 3.596 ( 12.706 0.000 -1.098) 12.753 3.748 ( -5.331 -0.000 3.217) 6.226 3.901 ( 0.479 0.000 0.146) 0.501 4.112 ( 3.907 0.000 0.266) 3.916 4.239 ( 13.703 0.000 4.214) 14.336 4.360 ( -2.156 -0.000 0.618) 2.243 4.653 ( -1.619 -0.000 -0.776) 1.795 4.911 ( -15.450 -0.000 -6.039) 16.588 5.204 ( -0.726 -0.000 3.738) 3.808 5.331 ( -3.967 -0.000 -2.153) 4.514 6.367 ( 0.136 0.000 -0.831) 0.842 7.163 ( -2.087 -0.000 -0.133) 2.091 7.786 ( 0.069 0.000 -0.160) 0.174 8.479 ( 0.452 0.000 -0.121) 0.468 8.909 ( 1.216 0.000 0.049) 1.217 9.245 ( -1.071 -0.000 0.124) 1.078 9.745 ( 0.336 0.000 0.176) 0.380 10.214 ( 5.811 0.000 -0.150) 5.813 10.368 ( -5.273 -0.000 0.112) 5.275 10.627 ( -0.239 -0.000 -0.119) 0.267 10.657 ( 0.189 0.000 0.022) 0.190 11.420 ( -1.601 -0.000 0.788) 1.785 15.166 ( 3.124 0.000 -1.060) 3.299 15.723 ( -1.564 -0.000 -0.134) 1.570 17.122 ( 5.315 0.000 1.153) 5.438 17.760 ( -5.573 -0.000 -2.662) 6.176 19.868 ( -0.032 -0.000 -0.001) 0.032 20.110 ( -0.013 -0.000 0.005) 0.014======================= Grid point 87 (49/322) =======================q-point: ( 0.54 0.46 0.00)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.721 ( 0.000 -4.320 -0.000) 4.320 1.892 ( 0.000 -7.309 -0.000) 7.309 2.268 ( 0.000 -3.394 -0.000) 3.394 2.301 ( 0.000 -16.019 -0.000) 16.019 2.787 ( 0.000 -6.716 -0.000) 6.716 2.905 ( 0.000 -6.131 -0.000) 6.131 3.159 ( 0.000 -3.863 -0.000) 3.863 3.331 ( 0.000 -9.378 -0.000) 9.378 3.740 ( 0.000 -10.466 -0.000) 10.466 3.741 ( 0.000 -3.298 -0.000) 3.298 4.121 ( 0.000 -13.096 -0.000) 13.096 4.210 ( 0.000 -10.698 -0.000) 10.698 4.363 ( 0.000 -7.835 -0.000) 7.835 4.465 ( 0.000 -16.064 -0.000) 16.064 4.630 ( -0.000 1.985 0.000) 1.985 4.854 ( 0.000 -1.088 -0.000) 1.088 5.215 ( 0.000 -1.271 -0.000) 1.271 5.309 ( -0.000 0.058 0.000) 0.058 6.287 ( -0.000 7.837 0.000) 7.837 7.069 ( -0.000 8.187 0.000) 8.187 7.809 ( 0.000 -2.404 -0.000) 2.404 8.291 ( -0.000 15.605 0.000) 15.605 9.049 ( 0.000 -10.571 -0.000) 10.571 9.183 ( -0.000 6.305 0.000) 6.305 9.807 ( 0.000 -4.427 -0.000) 4.427 10.115 ( -0.000 10.732 0.000) 10.732 10.360 ( 0.000 -2.215 -0.000) 2.215 10.572 ( -0.000 3.795 0.000) 3.795 10.807 ( 0.000 -12.306 -0.000) 12.306 11.342 ( -0.000 7.270 0.000) 7.270 15.136 ( -0.000 3.651 0.000) 3.651 15.672 ( -0.000 4.357 0.000) 4.357 17.049 ( -0.000 8.262 0.000) 8.262 17.273 ( -0.000 35.727 0.000) 35.727 20.020 ( 0.000 -14.688 -0.000) 14.688 20.568 ( 0.000 -35.303 -0.000) 35.303======================= Grid point 175 (50/322) =======================q-point: ( 0.00 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.397 ( 1.680 0.000 19.308) 19.381 0.447 ( 10.492 0.000 21.665) 24.072 0.730 ( 1.476 0.000 35.372) 35.402 2.468 ( 1.600 0.000 -6.804) 6.990 2.845 ( -2.129 -0.000 1.761) 2.763 2.882 ( 1.914 0.000 -0.130) 1.918 2.989 ( -1.098 -0.000 -2.134) 2.400 3.054 ( -0.002 -0.000 0.126) 0.126 3.409 ( -0.613 -0.000 2.466) 2.541 3.722 ( -9.282 -0.000 -4.286) 10.224 3.770 ( 0.901 0.000 -1.083) 1.409 3.963 ( 3.350 0.000 5.121) 6.119 4.342 ( 2.734 0.000 -0.877) 2.871 4.503 ( -24.244 -0.000 -2.992) 24.428 5.191 ( 5.042 0.000 -3.869) 6.355 5.362 ( 10.649 0.000 2.104) 10.855 5.599 ( 5.323 0.000 -2.499) 5.880 5.720 ( -6.045 -0.000 1.749) 6.292 6.661 ( -2.899 -0.000 8.007) 8.515 7.691 ( -0.587 -0.000 0.260) 0.643 8.255 ( -39.545 -0.000 2.033) 39.597 8.395 ( -1.424 -0.000 1.560) 2.112 8.557 ( 0.182 0.000 -0.010) 0.182 8.963 ( 19.064 0.000 -2.592) 19.239 9.681 ( 0.422 0.000 0.721) 0.835 9.987 ( -42.562 -0.000 -2.838) 42.657 10.494 ( -0.361 -0.000 -1.501) 1.544 10.670 ( -0.139 -0.000 -0.770) 0.782 11.340 ( -1.105 -0.000 1.028) 1.509 11.534 ( -29.193 -0.000 0.735) 29.202 14.777 ( 106.824 0.000 0.446) 106.825 14.961 ( -0.354 -0.000 -0.436) 0.562 16.203 ( 13.438 0.000 0.771) 13.460 16.597 ( -0.362 -0.000 -0.295) 0.467 19.876 ( -0.025 -0.000 0.078) 0.082 20.112 ( 0.027 0.000 -0.045) 0.053======================= Grid point 176 (51/322) =======================q-point: ( 0.08 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.808 ( 2.704 -16.174 20.561) 26.300 0.855 ( 17.015 -21.535 13.580) 30.621 1.339 ( 13.264 -45.855 10.951) 48.975 2.575 ( 2.081 -9.272 -5.985) 11.230 2.804 ( -2.120 0.465 1.626) 2.712 2.939 ( -3.186 -3.015 3.954) 5.906 3.056 ( 2.393 -8.437 -7.993) 11.866 3.101 ( -1.168 -4.626 -0.321) 4.782 3.552 ( -1.182 -9.850 2.268) 10.176 3.674 ( -8.651 -2.615 -4.507) 10.100 4.008 ( 1.914 -3.794 4.868) 6.462 4.162 ( 0.161 -19.442 -1.287) 19.485 4.358 ( 0.438 1.708 1.666) 2.426 4.565 ( -16.446 -20.240 -9.718) 27.831 5.218 ( 1.927 -0.990 -3.968) 4.522 5.384 ( -5.945 -0.429 4.195) 7.289 5.466 ( 12.687 11.956 6.416) 18.576 5.704 ( -3.626 -10.481 -3.079) 11.509 6.618 ( -5.888 2.537 7.187) 9.631 7.594 ( -3.666 8.563 0.628) 9.336 7.878 ( -10.709 8.275 8.838) 16.164 8.138 ( 2.163 19.454 1.965) 19.673 8.819 ( 0.713 -11.381 -4.037) 12.097 9.085 ( 11.724 -2.167 -1.522) 12.019 9.660 ( -2.653 3.568 1.935) 4.849 10.042 ( -13.079 -14.554 -8.416) 21.300 10.457 ( 0.369 8.537 -0.729) 8.576 10.526 ( -0.012 4.532 -0.892) 4.619 11.155 ( -7.963 0.889 7.692) 11.107 11.370 ( 8.296 5.268 7.981) 12.660 14.768 ( 35.701 17.160 4.890) 39.912 14.934 ( 7.022 4.232 -0.066) 8.199 16.193 ( 9.126 5.943 0.880) 10.926 16.570 ( 1.483 2.861 -0.289) 3.236 20.040 ( -0.382 -15.313 1.313) 15.374 21.421 ( -5.841 -44.802 -42.310) 61.899======================= Grid point 177 (52/322) =======================q-point: ( 0.15 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.146 ( 3.252 -13.520 15.712) 20.982 1.423 ( 16.101 -23.019 7.613) 29.105 2.263 ( 11.064 -34.879 -0.766) 36.600 2.780 ( 1.876 -8.074 -1.714) 8.464 2.822 ( -4.127 -6.956 1.208) 8.178 3.020 ( -1.412 -7.069 2.276) 7.560 3.208 ( -1.748 -7.094 -0.086) 7.307 3.254 ( 3.658 -10.273 -9.506) 14.466 3.631 ( -4.500 -2.877 0.676) 5.384 3.743 ( -3.733 -5.976 -0.809) 7.093 4.079 ( -0.803 -3.571 5.545) 6.644 4.329 ( 0.427 1.416 0.943) 1.754 4.567 ( 1.794 -14.376 1.330) 14.548 4.856 ( -6.643 -13.596 -0.542) 15.142 5.305 ( 1.422 -12.727 -4.563) 13.595 5.370 ( -5.499 -4.254 2.495) 7.387 5.450 ( 6.772 -0.677 -0.080) 6.806 6.004 ( -5.077 -21.027 -2.884) 21.823 6.549 ( -10.272 -1.434 5.376) 11.682 7.351 ( -4.719 13.332 -0.298) 14.145 7.596 ( -4.455 19.207 0.878) 19.736 7.856 ( 6.079 9.375 5.326) 12.378 8.937 ( 8.867 3.040 -5.045) 10.645 9.154 ( -0.863 -2.341 2.341) 3.422 9.552 ( -1.719 7.271 0.414) 7.483 10.120 ( -2.671 5.478 -5.404) 8.145 10.234 ( -0.090 3.408 -0.449) 3.439 10.592 ( -1.097 -3.939 -5.275) 6.674 11.254 ( -2.201 -12.163 1.122) 12.412 11.342 ( 2.467 0.003 10.391) 10.680 14.712 ( 11.976 4.162 1.768) 12.801 14.913 ( 7.852 2.068 0.323) 8.127 16.126 ( 4.567 4.708 0.661) 6.592 16.515 ( 3.071 3.601 -0.090) 4.734 20.423 ( -0.696 -22.104 2.187) 22.223 21.768 ( -6.411 -8.438 -18.416) 21.248======================= Grid point 178 (53/322) =======================q-point: ( 0.23 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.385 ( 4.054 -5.567 10.055) 12.187 1.931 ( 11.930 -18.753 4.492) 22.675 2.640 ( 0.071 -3.227 -3.150) 4.510 2.870 ( -0.678 -5.928 1.301) 6.107 3.083 ( 1.933 -10.867 0.060) 11.038 3.240 ( -2.468 -14.814 -2.082) 15.162 3.345 ( -0.794 -7.375 -4.468) 8.659 3.494 ( 7.590 -13.867 -2.532) 16.010 3.644 ( -3.615 -0.898 -1.590) 4.050 3.903 ( -0.347 -12.217 2.837) 12.547 4.156 ( 1.737 -2.383 5.014) 5.817 4.316 ( -0.705 -0.658 -0.789) 1.246 4.709 ( 1.478 -2.581 2.652) 3.985 4.906 ( -1.081 3.065 3.332) 4.654 5.397 ( -4.807 -2.407 -0.858) 5.444 5.516 ( 2.871 -4.227 -1.309) 5.275 5.851 ( -0.595 -30.385 -2.194) 30.470 6.230 ( -11.006 -4.596 2.829) 12.258 6.758 ( -10.767 -25.456 -0.745) 27.649 7.026 ( -7.867 14.519 -1.382) 16.571 7.207 ( 4.128 17.059 0.740) 17.567 7.807 ( 8.326 1.554 3.570) 9.191 8.800 ( 5.479 12.519 -2.176) 13.837 9.177 ( 1.200 1.758 0.384) 2.163 9.346 ( -3.773 10.564 1.450) 11.310 9.885 ( -2.872 11.161 -3.982) 12.194 10.281 ( 3.387 -1.457 0.999) 3.820 10.539 ( 1.311 7.143 -4.747) 8.677 11.399 ( -1.344 -8.962 6.084) 10.915 11.665 ( -4.083 -24.841 -1.224) 25.204 14.726 ( 3.616 -0.489 -1.359) 3.893 14.953 ( 10.192 -0.518 2.125) 10.424 16.078 ( 3.481 2.322 0.448) 4.209 16.477 ( 4.175 2.268 0.018) 4.751 20.851 ( -0.706 -20.616 1.855) 20.711 21.775 ( -3.493 1.124 -7.738) 8.564======================= Grid point 179 (54/322) =======================q-point: ( 0.31 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.411 ( 4.094 6.884 5.865) 9.927 2.293 ( 7.337 -11.617 2.148) 13.907 2.603 ( -2.515 3.468 1.369) 4.497 2.989 ( 1.300 -5.400 1.056) 5.654 3.255 ( 0.083 -6.995 0.101) 6.996 3.420 ( -1.797 -5.810 -0.503) 6.102 3.491 ( -0.408 -9.148 -6.826) 11.422 3.642 ( -5.653 -2.658 -2.658) 6.789 3.816 ( 5.382 -12.139 0.453) 13.286 4.149 ( 5.726 -4.566 -0.525) 7.342 4.194 ( 2.962 -3.437 3.372) 5.653 4.355 ( -1.266 -3.372 -0.830) 3.696 4.791 ( 6.332 -2.218 6.941) 9.654 4.824 ( -2.972 1.673 0.148) 3.414 5.374 ( -6.316 0.891 -0.592) 6.406 5.621 ( 0.827 -5.352 -1.433) 5.602 6.153 ( -14.706 -2.802 1.918) 15.093 6.289 ( -4.848 -4.063 -0.588) 6.353 6.735 ( 1.019 5.279 1.623) 5.616 6.961 ( 3.107 4.487 -0.491) 5.480 7.323 ( -8.240 -25.759 -2.317) 27.144 7.884 ( 12.232 -2.660 2.145) 12.701 8.561 ( 0.922 12.541 -1.519) 12.666 9.042 ( -2.505 9.620 -0.166) 9.942 9.195 ( 0.067 5.164 3.254) 6.104 9.680 ( -1.969 7.669 -2.207) 8.219 10.268 ( 1.932 4.572 -3.457) 6.049 10.407 ( 1.496 4.082 1.942) 4.762 11.668 ( 0.944 -16.658 1.963) 16.800 12.103 ( -6.773 -21.946 -3.460) 23.227 14.760 ( 1.735 -1.625 -2.127) 3.190 15.041 ( 8.846 -1.797 2.418) 9.345 16.090 ( 3.809 -1.490 0.342) 4.104 16.474 ( 4.258 0.778 -0.198) 4.334 21.203 ( -0.399 -15.032 0.784) 15.058 21.693 ( -0.825 4.540 -2.547) 5.271======================= Grid point 180 (55/322) =======================q-point: ( 0.38 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.207 ( 3.386 15.318 4.730) 16.385 2.428 ( -1.773 1.352 3.239) 3.933 2.580 ( 5.082 -2.534 1.344) 5.836 3.091 ( 1.793 -3.664 1.656) 4.403 3.356 ( -4.567 -4.281 0.822) 6.313 3.515 ( 2.562 -4.221 -0.633) 4.978 3.642 ( -1.758 -6.356 -4.619) 8.052 3.667 ( -4.165 -3.798 -0.369) 5.649 4.020 ( 2.069 -6.605 0.529) 6.942 4.138 ( 2.639 2.666 -0.787) 3.833 4.323 ( 4.580 -2.924 0.701) 5.479 4.399 ( -0.412 -1.581 -1.569) 2.265 4.709 ( -0.840 5.671 3.100) 6.517 4.988 ( 4.773 -8.583 0.543) 9.835 5.324 ( -4.233 0.158 0.147) 4.238 5.720 ( 0.148 -4.342 -1.008) 4.460 6.023 ( -15.868 5.279 0.691) 16.738 6.217 ( -0.807 4.219 -0.112) 4.297 6.736 ( 5.158 0.365 2.784) 5.873 6.974 ( -0.138 -2.316 -1.222) 2.622 7.674 ( -4.468 -13.324 -1.136) 14.099 8.058 ( 13.822 -5.884 1.574) 15.104 8.350 ( -4.484 6.053 -2.085) 7.816 8.848 ( -3.874 8.460 2.175) 9.556 9.097 ( 0.349 5.157 2.890) 5.922 9.537 ( -0.693 6.491 -0.942) 6.596 10.167 ( 1.177 3.935 -3.089) 5.139 10.434 ( 0.082 -4.650 1.587) 4.914 12.006 ( 3.530 -14.798 -0.597) 15.225 12.405 ( -7.112 -13.403 -3.885) 15.663 14.801 ( 1.368 -1.851 -1.175) 2.584 15.113 ( 5.350 -0.691 1.391) 5.571 16.175 ( 4.033 -4.274 0.148) 5.878 16.483 ( 2.956 0.739 -0.697) 3.126 21.434 ( -0.029 -8.663 -0.153) 8.664 21.597 ( 0.441 4.549 -0.128) 4.572======================= Grid point 181 (56/322) =======================q-point: ( 0.46 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.968 ( 1.181 7.922 6.865) 10.549 2.371 ( -2.099 1.696 5.311) 5.958 2.664 ( 3.429 -1.811 0.374) 3.896 3.150 ( 1.055 -1.076 1.235) 1.948 3.384 ( -5.300 -1.848 2.090) 5.990 3.600 ( 2.606 -2.234 0.540) 3.475 3.669 ( -1.008 -0.797 -2.265) 2.604 3.769 ( 0.303 -4.726 0.283) 4.744 4.095 ( 1.101 1.083 -0.896) 1.785 4.115 ( 0.953 -0.849 0.735) 1.473 4.383 ( 2.163 -1.708 -1.715) 3.246 4.408 ( 0.169 0.248 -1.432) 1.463 4.598 ( -4.903 3.969 1.223) 6.426 5.126 ( 3.630 -2.281 -1.061) 4.417 5.326 ( 0.329 -0.851 -0.254) 0.947 5.772 ( -1.223 -0.651 -0.497) 1.472 5.865 ( -5.230 2.789 -0.472) 5.946 6.155 ( 0.249 1.640 0.177) 1.668 6.761 ( 1.035 -0.261 2.297) 2.533 6.995 ( -0.088 -0.491 -0.427) 0.657 7.810 ( -0.510 -2.750 -0.632) 2.867 8.126 ( -0.664 1.922 -3.461) 4.014 8.413 ( 5.483 -10.889 3.601) 12.712 8.658 ( -4.336 9.240 3.869) 10.915 9.029 ( -0.687 1.690 3.031) 3.538 9.418 ( 0.119 4.340 -1.773) 4.689 10.135 ( 0.554 0.147 -2.451) 2.517 10.529 ( -0.068 -3.372 0.780) 3.462 12.231 ( 1.489 -5.590 -2.635) 6.357 12.546 ( -2.024 -4.870 -2.774) 5.959 14.842 ( 0.595 -1.748 0.324) 1.875 15.133 ( 1.733 0.767 0.187) 1.904 16.271 ( 2.044 -2.660 -0.285) 3.367 16.472 ( 0.991 1.186 -1.207) 1.961 21.528 ( 0.341 1.646 0.080) 1.683 21.550 ( 0.034 -2.410 -0.037) 2.410======================= Grid point 182 (57/322) =======================q-point: (-0.46 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.015 ( -3.300 -11.321 8.340) 14.444 2.382 ( -0.827 -2.812 5.682) 6.393 2.673 ( -2.411 1.514 0.658) 2.922 3.154 ( 0.968 1.158 1.233) 1.949 3.386 ( -2.624 -0.235 2.064) 3.347 3.614 ( 0.894 2.174 0.755) 2.469 3.676 ( 3.420 0.370 -0.553) 3.484 3.829 ( 1.828 -0.099 1.601) 2.432 4.069 ( -0.953 1.526 -1.629) 2.427 4.121 ( 1.887 0.488 1.433) 2.419 4.361 ( -3.065 2.582 -2.124) 4.536 4.439 ( -1.415 -3.190 -2.934) 4.559 4.511 ( -3.734 2.277 -0.245) 4.380 5.109 ( 0.146 4.902 -2.226) 5.385 5.335 ( 3.803 1.020 0.457) 3.964 5.753 ( -0.823 1.204 -1.032) 1.787 5.846 ( 4.108 -1.148 -1.250) 4.444 6.167 ( 2.171 -1.787 0.541) 2.863 6.760 ( -1.782 0.420 2.268) 2.915 7.007 ( -0.134 -0.824 0.133) 0.845 7.801 ( -0.009 2.795 -1.032) 2.980 8.091 ( -5.821 -0.843 -3.935) 7.077 8.436 ( -2.794 10.439 3.577) 11.383 8.703 ( 7.373 -11.814 5.969) 15.152 9.043 ( -2.501 -3.637 3.466) 5.612 9.397 ( 1.178 -2.379 -2.916) 3.944 10.134 ( 0.477 0.008 -2.423) 2.469 10.534 ( -0.217 3.032 0.909) 3.173 12.206 ( -3.567 6.552 -3.454) 8.221 12.578 ( 6.199 2.970 -1.695) 7.079 14.875 ( -0.704 -1.426 1.663) 2.302 15.105 ( -1.634 2.161 -1.001) 2.888 16.268 ( -1.942 2.890 -0.399) 3.504 16.463 ( -0.301 -0.357 -1.532) 1.601 21.517 ( -0.224 -0.501 -0.279) 0.615 21.558 ( -0.118 1.577 0.196) 1.594======================= Grid point 183 (58/322) =======================q-point: (-0.38 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.283 ( -7.151 -14.547 7.429) 17.831 2.456 ( -0.785 -1.078 4.004) 4.220 2.588 ( -5.137 2.523 1.719) 5.976 3.125 ( -0.105 2.408 2.524) 3.489 3.349 ( -2.054 3.429 0.346) 4.012 3.545 ( 2.062 5.125 0.536) 5.550 3.689 ( 5.438 1.201 0.820) 5.629 3.794 ( 2.155 4.639 0.343) 5.126 3.991 ( -1.648 4.902 0.160) 5.174 4.141 ( -2.414 -0.158 0.484) 2.467 4.271 ( -5.350 3.315 -1.416) 6.451 4.442 ( -2.472 1.675 -4.228) 5.176 4.496 ( -1.410 -2.520 -0.855) 3.011 4.951 ( -0.132 9.207 -1.543) 9.336 5.350 ( 6.950 0.606 1.198) 7.079 5.696 ( -2.629 2.997 -1.821) 4.383 5.975 ( 15.810 -5.218 -0.987) 16.678 6.236 ( 1.778 -3.995 0.528) 4.405 6.735 ( -4.888 0.622 2.723) 5.630 7.009 ( -0.331 0.945 0.283) 1.040 7.679 ( 3.198 11.811 -0.869) 12.267 8.033 ( -12.488 2.630 -0.548) 12.773 8.295 ( 2.760 0.996 -2.282) 3.717 8.961 ( 4.483 -9.706 6.634) 12.583 9.141 ( -4.111 -7.001 3.926) 9.018 9.505 ( 2.461 -7.575 -2.822) 8.450 10.157 ( 0.297 -3.455 -3.251) 4.753 10.441 ( -0.767 4.984 1.759) 5.341 11.961 ( -3.581 14.850 -2.338) 15.454 12.466 ( 8.621 13.118 -1.623) 15.781 14.895 ( -1.968 -1.083 2.627) 3.457 15.024 ( -5.063 3.863 -2.238) 6.750 16.173 ( -3.845 4.023 0.100) 5.566 16.461 ( -2.179 -0.273 -1.526) 2.674 21.441 ( -0.077 8.304 0.108) 8.305 21.586 ( -0.051 -4.394 -0.571) 4.432======================= Grid point 184 (59/322) =======================q-point: (-0.31 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.436 ( -8.613 -3.586 6.903) 11.606 2.267 ( -8.229 14.478 0.992) 16.683 2.645 ( 0.964 -4.595 3.023) 5.584 3.061 ( -3.467 3.919 3.667) 6.390 3.225 ( -2.269 7.225 -1.362) 7.695 3.450 ( 4.122 6.771 1.054) 7.997 3.660 ( 1.917 9.584 -3.223) 10.291 3.688 ( 3.367 3.008 -0.426) 4.535 3.911 ( -0.251 2.063 6.868) 7.176 4.006 ( -12.522 10.049 -4.922) 16.793 4.136 ( -1.123 8.256 -1.348) 8.440 4.399 ( -0.269 2.114 0.158) 2.137 4.543 ( -1.541 -4.019 -1.176) 4.462 4.835 ( 3.929 2.358 0.655) 4.629 5.381 ( 7.508 1.416 -0.375) 7.649 5.609 ( -2.295 4.021 -1.849) 4.985 6.146 ( 14.385 -0.402 1.758) 14.498 6.333 ( 4.388 0.882 0.904) 4.567 6.695 ( -1.747 -2.757 0.560) 3.311 7.007 ( -2.558 -3.551 1.169) 4.530 7.337 ( 6.871 25.181 -1.790) 26.163 7.888 ( -12.109 3.076 2.168) 12.680 8.407 ( 2.924 -9.322 -6.180) 11.560 9.171 ( -0.974 -9.793 5.583) 11.314 9.254 ( -3.835 -6.470 3.791) 8.422 9.700 ( 3.280 -10.704 -1.966) 11.367 10.252 ( 0.013 -3.876 -4.042) 5.600 10.404 ( -1.819 -4.457 1.974) 5.203 11.615 ( -0.903 17.699 -0.237) 17.723 12.156 ( 7.071 22.678 -1.352) 23.793 14.882 ( -4.944 4.813 1.515) 7.064 14.916 ( -6.063 -0.995 -1.356) 6.291 16.094 ( -3.902 1.403 0.521) 4.179 16.451 ( -3.343 -0.879 -1.072) 3.619 21.210 ( -0.311 15.139 1.109) 15.182 21.693 ( 2.235 -5.739 -2.627) 6.696======================= Grid point 185 (60/322) =======================q-point: (-0.23 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.344 ( -7.573 8.725 8.441) 14.308 1.854 ( -11.245 21.538 1.557) 24.346 2.694 ( -1.028 2.127 -0.569) 2.430 2.907 ( -4.770 10.381 1.868) 11.576 3.059 ( -0.724 8.799 -0.149) 8.830 3.291 ( 1.900 14.621 1.062) 14.782 3.395 ( -2.336 11.925 0.163) 12.152 3.623 ( -5.165 11.709 -6.006) 14.137 3.689 ( -0.734 4.967 -1.295) 5.185 3.925 ( 3.379 0.047 10.314) 10.853 3.988 ( -0.611 5.716 -2.578) 6.300 4.341 ( -1.193 2.692 -0.320) 2.962 4.617 ( -1.376 -2.746 1.027) 3.239 4.875 ( 6.665 -1.745 1.113) 6.979 5.353 ( 5.834 5.302 -2.651) 8.317 5.508 ( -2.719 4.798 -1.688) 5.768 5.898 ( -0.542 28.319 -0.266) 28.326 6.327 ( 5.791 -0.396 7.282) 9.312 6.735 ( 10.857 25.156 -2.376) 27.502 7.043 ( 8.687 -14.873 -0.985) 17.252 7.190 ( -4.863 -14.543 0.501) 15.343 7.805 ( -9.180 -0.981 3.580) 9.902 8.623 ( 3.938 -10.833 -7.533) 13.770 9.253 ( -5.530 -0.294 3.018) 6.307 9.455 ( -2.596 -13.627 4.665) 14.636 9.942 ( 2.518 -12.036 -2.595) 12.567 10.248 ( -1.825 1.405 0.011) 2.303 10.595 ( -1.474 -12.426 -3.478) 12.988 11.304 ( 2.857 13.832 3.115) 14.463 11.686 ( 3.471 26.781 -0.133) 27.005 14.733 ( -9.481 4.605 -1.327) 10.623 14.927 ( -4.554 -2.295 1.434) 5.298 16.078 ( -3.682 -1.891 0.489) 4.168 16.464 ( -3.378 -2.702 -0.475) 4.352 20.854 ( -0.431 20.827 1.946) 20.922 21.808 ( 5.944 -3.574 -6.680) 9.630======================= Grid point 186 (61/322) =======================q-point: (-0.15 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.071 ( -5.766 15.728 13.041) 21.229 1.319 ( -12.896 25.519 3.987) 28.869 2.248 ( -10.374 38.885 -0.541) 40.249 2.744 ( 2.270 7.039 -1.323) 7.514 2.876 ( -0.961 6.879 0.393) 6.957 3.044 ( -1.382 7.254 3.723) 8.270 3.228 ( -0.074 7.077 1.240) 7.185 3.323 ( -3.570 12.499 -7.350) 14.933 3.655 ( 0.712 2.477 1.413) 2.939 3.864 ( -3.912 3.604 -3.223) 6.219 3.976 ( 6.361 1.802 9.575) 11.636 4.302 ( 0.502 0.504 -0.978) 1.209 4.541 ( -2.749 12.361 1.705) 12.777 4.927 ( 10.787 5.040 0.476) 11.916 5.231 ( 5.600 13.539 -3.214) 15.000 5.287 ( -3.093 7.767 -3.349) 9.006 5.507 ( -3.450 4.514 1.063) 5.781 6.097 ( 0.424 22.359 -0.830) 22.379 6.552 ( 5.717 -1.392 6.793) 8.987 7.369 ( 2.595 -12.819 0.659) 13.096 7.605 ( 4.899 -24.532 0.764) 25.028 7.841 ( -8.128 -7.072 5.362) 12.035 8.816 ( 4.342 -6.514 -8.457) 11.525 9.155 ( -1.718 8.373 1.782) 8.731 9.666 ( -8.054 -8.530 4.154) 12.445 10.174 ( 1.553 -10.510 -3.631) 11.227 10.254 ( -1.025 -4.899 0.251) 5.011 10.728 ( -5.004 0.791 -7.372) 8.945 11.133 ( 7.805 8.004 9.652) 14.770 11.266 ( 0.253 11.629 1.897) 11.786 14.599 ( -12.129 2.405 -1.657) 12.476 14.952 ( -4.925 -2.647 1.260) 5.731 16.116 ( -4.019 -3.882 0.339) 5.598 16.514 ( -2.738 -3.954 -0.153) 4.812 20.422 ( -0.417 22.173 2.124) 22.278 21.843 ( 10.353 4.753 -16.555) 20.096======================= Grid point 187 (62/322) =======================q-point: (-0.08 0.00 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.732 ( -5.397 20.920 14.641) 26.099 0.770 ( -8.334 19.827 16.438) 27.070 1.287 ( -9.320 49.453 8.728) 51.075 2.574 ( 1.099 8.880 -5.454) 10.479 2.815 ( -0.540 0.011 1.223) 1.337 2.948 ( -0.397 3.850 3.416) 5.163 3.081 ( -2.452 8.383 -6.242) 10.735 3.109 ( -0.268 5.013 0.259) 5.027 3.546 ( 0.713 9.974 2.235) 10.247 3.780 ( -6.276 1.346 -4.849) 8.044 3.938 ( 6.372 6.440 6.826) 11.343 4.176 ( -1.757 16.856 -0.888) 16.971 4.335 ( 1.330 -0.872 0.215) 1.605 4.728 ( 3.352 13.900 -11.042) 18.066 5.191 ( 8.807 2.166 2.015) 9.290 5.230 ( 7.218 -2.851 0.245) 7.765 5.484 ( -6.420 -4.523 4.357) 8.981 5.763 ( -5.044 8.606 -1.057) 10.031 6.630 ( -0.793 -2.769 8.029) 8.530 7.600 ( 2.235 -8.563 0.916) 8.897 7.976 ( -9.270 -13.434 12.381) 20.486 8.117 ( 0.437 -22.379 0.648) 22.393 8.845 ( -0.929 6.852 -7.339) 10.083 8.966 ( 6.370 7.932 -0.632) 10.192 9.715 ( -6.831 -1.496 2.334) 7.372 10.260 ( -14.274 0.455 -10.730) 17.863 10.459 ( 0.110 -10.848 -0.029) 10.849 10.555 ( -6.806 0.233 -1.426) 6.957 11.121 ( 10.166 -3.716 21.185) 23.789 11.269 ( 2.932 -4.357 0.901) 5.329 14.491 ( -7.643 1.850 -0.074) 7.864 14.970 ( -5.338 -1.866 0.538) 5.680 16.167 ( -4.481 -3.217 0.248) 5.522 16.572 ( -1.723 -2.990 -0.171) 3.456 20.040 ( -0.259 15.293 1.291) 15.349 21.517 ( 14.025 41.891 -43.929) 62.301======================= Grid point 189 (63/322) =======================q-point: ( 0.08 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.598 ( 20.018 0.000 14.799) 24.894 0.709 ( 11.705 0.000 24.082) 26.776 1.066 ( 39.409 0.000 22.448) 45.354 2.471 ( 2.720 0.000 -7.307) 7.797 2.824 ( -2.463 -0.000 1.835) 3.071 2.873 ( -5.133 -0.000 3.253) 6.077 2.998 ( 5.584 0.000 -5.435) 7.792 3.037 ( -2.782 -0.000 -0.380) 2.807 3.400 ( -2.173 -0.000 2.691) 3.458 3.595 ( -9.795 -0.000 -3.872) 10.532 3.785 ( 1.993 0.000 -0.887) 2.182 3.998 ( -0.385 -0.000 3.593) 3.614 4.216 ( -15.506 -0.000 4.282) 16.087 4.397 ( 4.475 0.000 1.385) 4.685 5.205 ( -2.998 -0.000 -4.235) 5.188 5.351 ( -7.849 -0.000 6.211) 10.009 5.591 ( -0.882 -0.000 -1.124) 1.429 5.730 ( 0.512 0.000 -2.535) 2.586 6.618 ( -8.269 -0.000 7.537) 11.189 7.645 ( -7.054 -0.000 0.101) 7.055 7.923 ( -15.731 -0.000 12.316) 19.979 8.397 ( 0.574 0.000 1.304) 1.425 8.591 ( 5.139 0.000 0.055) 5.139 9.189 ( 16.370 0.000 -11.157) 19.810 9.691 ( 0.840 0.000 0.903) 1.233 9.743 ( -4.681 -0.000 4.200) 6.289 10.507 ( 2.927 0.000 -1.589) 3.330 10.664 ( -0.491 -0.000 -0.879) 1.007 11.103 ( -23.452 -0.000 4.592) 23.897 11.491 ( 5.189 0.000 6.022) 7.949 14.884 ( -3.722 -0.000 -4.314) 5.698 15.673 ( 25.782 0.000 -13.384) 29.049 16.611 ( 3.401 0.000 -0.737) 3.480 16.860 ( 87.800 0.000 -47.930) 100.031 19.875 ( -0.086 -0.000 0.077) 0.115 20.112 ( -0.000 -0.000 -0.040) 0.040======================= Grid point 190 (64/322) =======================q-point: ( 0.15 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.932 ( 7.059 -12.360 21.210) 25.543 1.115 ( 19.239 -22.928 9.690) 31.460 1.657 ( 33.715 -31.209 8.694) 46.758 2.584 ( 2.680 -9.343 -6.236) 11.548 2.770 ( -5.297 1.033 2.754) 6.059 2.904 ( -4.554 -4.552 4.068) 7.616 3.074 ( -2.450 -5.275 -1.789) 6.085 3.099 ( 9.114 -6.379 -7.634) 13.492 3.520 ( -5.916 -5.751 0.723) 8.283 3.575 ( -5.371 -8.141 -1.026) 9.807 4.014 ( -2.453 -2.455 3.928) 5.241 4.165 ( 0.072 -22.808 -2.204) 22.915 4.289 ( -8.727 -9.389 0.263) 12.821 4.479 ( 2.321 -10.564 -0.390) 10.823 5.179 ( -6.961 -1.906 -4.575) 8.545 5.312 ( -7.116 0.030 5.867) 9.223 5.564 ( 0.004 6.277 0.899) 6.341 5.684 ( 2.277 -6.246 -3.032) 7.306 6.542 ( -10.240 3.307 6.947) 12.808 7.523 ( -8.393 7.527 -0.093) 11.274 7.809 ( -5.062 6.660 6.373) 10.516 8.178 ( 3.282 16.450 2.269) 16.927 8.840 ( 4.080 -13.417 -1.621) 14.117 9.187 ( 6.428 3.560 -2.973) 7.926 9.675 ( 4.136 4.460 -1.095) 6.181 9.925 ( -4.364 -14.672 -3.437) 15.688 10.455 ( -0.913 12.852 -0.453) 12.892 10.536 ( 2.411 1.011 -1.328) 2.933 11.062 ( -9.740 -6.016 3.088) 11.857 11.467 ( 4.115 5.578 7.346) 10.100 14.838 ( -0.751 2.458 -4.511) 5.192 15.354 ( 34.010 31.163 0.448) 46.130 16.402 ( 26.394 25.004 -2.256) 36.427 16.607 ( 5.302 3.296 -0.315) 6.251 20.039 ( -0.485 -15.320 1.274) 15.380 21.175 ( -14.835 -47.961 -30.117) 58.544======================= Grid point 191 (65/322) =======================q-point: ( 0.23 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.252 ( 6.540 -12.024 15.012) 20.315 1.653 ( 18.183 -19.422 6.559) 27.402 2.423 ( 15.775 -23.615 -4.010) 28.681 2.754 ( -6.675 -3.643 3.416) 8.336 2.814 ( 4.004 -13.523 -3.648) 14.567 3.017 ( -0.783 -8.031 2.757) 8.528 3.181 ( -2.739 -7.655 -0.849) 8.175 3.310 ( 10.891 -9.683 -6.582) 15.990 3.576 ( -4.233 -4.908 0.781) 6.528 3.705 ( -2.858 -6.521 0.902) 7.177 4.082 ( -0.948 -4.729 4.254) 6.431 4.325 ( -1.530 0.539 0.740) 1.783 4.575 ( -0.254 -14.115 0.619) 14.131 4.817 ( -1.822 -16.106 2.663) 16.426 5.274 ( -4.502 -17.157 -4.536) 18.308 5.311 ( -4.146 -3.464 0.868) 5.472 5.489 ( -0.804 0.760 -1.517) 1.877 5.943 ( -3.980 -19.738 -2.361) 20.273 6.412 ( -15.212 1.477 5.816) 16.353 7.262 ( -9.592 13.321 -1.345) 16.470 7.580 ( 1.052 15.919 1.939) 16.071 7.943 ( 5.665 8.564 4.801) 11.335 9.021 ( 7.342 3.671 -5.040) 9.633 9.150 ( -0.674 -2.633 2.429) 3.645 9.548 ( 1.049 10.116 -1.111) 10.230 10.072 ( -2.870 5.315 -4.009) 7.250 10.242 ( 1.745 -0.907 -0.067) 1.968 10.579 ( 0.826 -1.638 -3.208) 3.696 11.223 ( -3.340 -14.480 0.230) 14.862 11.378 ( -1.361 3.643 8.275) 9.143 14.778 ( 3.144 3.114 -2.862) 5.270 15.120 ( 21.575 10.907 2.871) 24.345 16.206 ( 8.823 8.603 0.453) 12.331 16.567 ( 5.687 3.800 -0.121) 6.841 20.421 ( -0.785 -22.079 2.104) 22.193 21.611 ( -10.635 -14.452 -15.677) 23.826======================= Grid point 192 (66/322) =======================q-point: ( 0.31 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.479 ( 6.833 -4.173 9.372) 12.326 2.095 ( 13.460 -14.986 3.917) 20.521 2.618 ( -2.695 -0.560 -1.332) 3.058 2.865 ( -0.810 -7.557 0.568) 7.621 3.101 ( 1.907 -9.837 -3.138) 10.500 3.221 ( -0.233 -11.864 -0.280) 11.870 3.331 ( 0.477 -8.139 -3.760) 8.978 3.554 ( -0.898 -5.420 -3.007) 6.263 3.637 ( 7.202 -7.340 0.572) 10.299 3.939 ( 5.841 -15.716 3.645) 17.158 4.186 ( 1.161 -4.275 3.894) 5.898 4.297 ( -2.104 0.410 -0.858) 2.309 4.710 ( -1.871 -3.503 1.321) 4.186 4.915 ( -0.755 1.909 3.807) 4.325 5.338 ( -4.332 -1.944 -0.196) 4.752 5.509 ( -3.287 -4.325 -2.631) 6.036 5.840 ( -0.051 -31.237 -2.297) 31.322 6.104 ( -11.940 1.197 3.752) 12.572 6.605 ( -14.218 -30.399 -1.359) 33.587 6.922 ( -8.564 13.532 -1.510) 16.085 7.281 ( 7.706 15.617 1.502) 17.480 7.916 ( 7.855 -0.198 3.815) 8.734 8.827 ( -0.052 13.614 -3.261) 14.000 9.215 ( 5.243 2.174 -0.834) 5.737 9.316 ( -2.064 10.990 2.628) 11.487 9.838 ( -3.135 10.714 -3.269) 11.632 10.326 ( 3.464 0.043 1.298) 3.699 10.545 ( 2.009 5.258 -4.102) 6.965 11.388 ( -3.614 -9.339 5.304) 11.332 11.607 ( -4.861 -22.913 -1.461) 23.469 14.760 ( 3.907 0.528 -2.070) 4.453 15.110 ( 14.138 2.502 2.300) 14.540 16.131 ( 5.336 3.344 0.485) 6.316 16.535 ( 5.523 2.649 -0.141) 6.127 20.848 ( -0.701 -20.626 1.737) 20.711 21.702 ( -4.918 -2.755 -6.842) 8.866======================= Grid point 193 (67/322) =======================q-point: ( 0.38 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.493 ( 6.747 8.277 5.738) 12.123 2.386 ( 6.583 -6.974 2.172) 9.833 2.587 ( -0.578 0.639 2.140) 2.307 3.002 ( -0.278 -6.390 2.006) 6.703 3.241 ( -1.295 -5.402 -1.870) 5.862 3.414 ( 0.535 -7.682 0.915) 7.755 3.492 ( 3.274 -7.980 -4.957) 9.948 3.565 ( -5.763 -2.701 -2.850) 6.974 3.878 ( 4.854 -9.413 1.452) 10.689 4.206 ( 1.932 2.790 -0.404) 3.418 4.257 ( 8.123 -8.751 1.504) 12.034 4.336 ( -1.286 -4.209 -0.116) 4.403 4.765 ( -5.875 -1.239 -1.843) 6.281 4.870 ( 2.143 -1.757 6.103) 6.703 5.328 ( -0.742 0.861 0.381) 1.199 5.592 ( -4.743 -6.536 -2.735) 8.526 5.956 ( -18.392 1.527 2.314) 18.599 6.261 ( -0.635 -5.398 -0.659) 5.475 6.740 ( -0.572 -2.451 0.454) 2.557 7.004 ( 2.764 1.311 1.156) 3.270 7.239 ( -3.326 -20.879 -1.886) 21.226 8.025 ( 10.127 -4.596 2.678) 11.439 8.531 ( -4.802 13.699 -4.200) 15.111 9.039 ( 1.769 11.874 2.274) 12.219 9.210 ( 0.704 4.852 2.374) 5.447 9.651 ( -1.786 6.579 -1.624) 7.008 10.277 ( 1.520 5.214 -3.387) 6.400 10.427 ( 0.688 4.864 2.129) 5.354 11.681 ( 0.508 -18.696 1.019) 18.731 12.010 ( -7.235 -20.899 -2.813) 22.294 14.786 ( 3.793 -0.882 -1.530) 4.184 15.157 ( 9.330 0.754 1.709) 9.516 16.143 ( 5.024 -1.350 0.438) 5.221 16.524 ( 4.242 1.573 -0.504) 4.552 21.201 ( -0.306 -15.086 0.706) 15.105 21.674 ( -1.142 2.502 -2.264) 3.562======================= Grid point 194 (68/322) =======================q-point: ( 0.46 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.277 ( 5.777 16.711 5.458) 18.505 2.415 ( -2.378 2.691 4.219) 5.540 2.652 ( 6.044 -2.690 1.063) 6.701 3.108 ( -0.516 -3.955 2.593) 4.758 3.308 ( -2.263 -3.235 -0.836) 4.035 3.545 ( 2.225 -4.808 0.655) 5.338 3.604 ( -2.826 -4.114 -1.938) 5.355 3.657 ( 2.615 -7.077 -1.659) 7.725 4.049 ( 2.346 -5.681 1.880) 6.427 4.148 ( -0.279 3.025 -1.325) 3.314 4.375 ( 2.941 -0.485 -0.365) 3.003 4.392 ( 0.869 -2.621 -0.719) 2.854 4.646 ( -9.041 5.141 -0.640) 10.420 5.044 ( 3.414 -8.115 0.505) 8.818 5.326 ( 3.677 -0.013 1.306) 3.902 5.683 ( -5.257 -5.663 -2.156) 8.022 5.832 ( -16.121 0.332 0.491) 16.132 6.221 ( 1.232 4.255 0.336) 4.442 6.821 ( 6.650 0.674 2.567) 7.160 6.979 ( 2.363 -0.063 -0.386) 2.395 7.623 ( -3.253 -16.130 -1.022) 16.487 8.192 ( 4.610 0.673 -1.400) 4.865 8.279 ( -2.915 0.021 -0.513) 2.960 8.839 ( 0.866 10.199 4.108) 11.029 9.106 ( -0.470 5.464 2.371) 5.975 9.525 ( -0.999 6.023 -0.867) 6.166 10.170 ( 1.049 4.224 -3.213) 5.409 10.435 ( -0.790 -4.471 1.691) 4.845 12.038 ( 2.430 -14.745 -1.771) 15.048 12.316 ( -6.105 -14.985 -2.658) 16.398 14.826 ( 3.232 -1.051 -0.463) 3.430 15.178 ( 5.041 1.651 0.792) 5.363 16.227 ( 4.742 -3.479 0.142) 5.883 16.509 ( 1.813 1.872 -1.024) 2.800 21.434 ( 0.063 -8.703 -0.159) 8.705 21.602 ( 0.333 4.029 -0.139) 4.045======================= Grid point 195 (69/322) =======================q-point: ( 0.54 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.016 ( 2.895 10.472 7.449) 13.173 2.363 ( -2.124 0.986 5.471) 5.952 2.695 ( 1.344 0.894 0.547) 1.704 3.155 ( -1.440 -1.195 2.198) 2.886 3.357 ( 1.130 -2.284 0.008) 2.548 3.625 ( 1.150 -1.674 1.517) 2.535 3.666 ( 0.765 -2.862 -0.731) 3.051 3.794 ( 3.831 -4.954 0.035) 6.263 4.087 ( -2.166 2.190 -1.194) 3.304 4.136 ( 1.868 -1.640 1.974) 3.174 4.388 ( -2.149 -0.296 -2.492) 3.303 4.394 ( -1.058 2.121 -2.129) 3.186 4.520 ( -5.679 1.838 0.319) 5.978 5.144 ( -0.256 -1.011 -1.958) 2.219 5.369 ( 6.053 -0.638 0.879) 6.149 5.726 ( -5.446 -2.135 -0.907) 5.919 5.792 ( -6.504 -3.269 -0.857) 7.329 6.175 ( 2.529 1.228 0.524) 2.860 6.820 ( 7.218 3.169 2.529) 8.279 6.992 ( 0.095 -0.336 -0.231) 0.419 7.806 ( 0.256 -3.149 -0.638) 3.223 8.040 ( -9.559 1.966 -4.677) 10.822 8.517 ( 7.188 -12.246 4.782) 14.983 8.643 ( 0.127 10.959 4.306) 11.775 9.023 ( -1.827 2.214 2.678) 3.925 9.413 ( -0.071 3.785 -1.926) 4.248 10.134 ( 0.623 0.213 -2.493) 2.578 10.527 ( -0.705 -3.496 0.797) 3.654 12.217 ( -1.909 -3.261 -3.440) 5.110 12.537 ( 1.366 -9.069 -1.937) 9.373 14.859 ( 1.910 -0.711 0.702) 2.156 15.154 ( 1.717 2.813 -0.053) 3.296 16.296 ( 2.469 -0.317 -0.393) 2.520 16.471 ( -0.547 1.686 -1.314) 2.206 21.532 ( 0.229 1.694 -0.037) 1.710 21.551 ( 0.100 -2.106 0.045) 2.109======================= Grid point 196 (70/322) =======================q-point: (-0.38 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.008 ( -2.425 -8.024 7.954) 11.555 2.389 ( -0.882 -3.717 5.388) 6.604 2.641 ( -3.192 3.976 0.539) 5.127 3.152 ( -2.587 0.686 2.735) 3.827 3.394 ( 3.383 0.638 -0.355) 3.461 3.621 ( -0.014 2.053 0.982) 2.275 3.725 ( 4.850 -1.237 0.808) 5.070 3.872 ( 4.733 0.439 0.485) 4.778 4.031 ( -4.639 1.570 -2.098) 5.328 4.149 ( 0.173 1.162 2.619) 2.870 4.283 ( -7.289 2.848 -2.473) 8.207 4.404 ( -0.738 -1.197 -3.667) 3.927 4.492 ( -0.734 0.413 0.741) 1.122 5.088 ( -1.953 5.129 -2.507) 6.034 5.408 ( 6.938 0.612 1.078) 7.048 5.706 ( -5.258 0.752 -1.353) 5.481 5.889 ( 2.874 -8.136 -0.614) 8.650 6.201 ( 2.865 -1.707 0.375) 3.356 6.789 ( 5.334 4.494 2.587) 7.439 7.003 ( -0.690 -1.010 -0.003) 1.223 7.779 ( -4.135 2.106 -1.551) 4.893 8.004 ( -5.099 -0.273 -2.321) 5.609 8.430 ( -0.280 9.846 2.232) 10.100 8.803 ( 6.009 -11.121 6.185) 14.072 9.018 ( -3.492 -2.941 2.915) 5.417 9.402 ( 1.315 -2.978 -2.850) 4.327 10.132 ( 0.626 0.115 -2.400) 2.483 10.530 ( -0.825 2.967 0.820) 3.186 12.153 ( -3.377 6.951 -3.007) 8.292 12.644 ( 5.651 0.736 -2.282) 6.138 14.876 ( 0.024 -0.328 1.271) 1.313 15.088 ( -0.765 4.241 -0.649) 4.358 16.246 ( -1.498 4.829 -0.440) 5.075 16.450 ( -1.023 0.152 -1.324) 1.680 21.514 ( -0.087 -0.387 -0.197) 0.443 21.556 ( -0.168 1.775 0.155) 1.789======================= Grid point 197 (71/322) =======================q-point: (-0.31 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.229 ( -5.773 -12.697 6.604) 15.432 2.453 ( -1.159 4.959 2.121) 5.517 2.546 ( -3.326 -2.664 2.807) 5.103 3.107 ( -3.911 2.429 3.239) 5.630 3.344 ( 0.856 5.575 -0.930) 5.717 3.572 ( 1.967 3.570 0.073) 4.076 3.763 ( 6.475 1.610 1.086) 6.760 3.828 ( 3.563 6.104 -2.074) 7.365 3.955 ( -4.009 2.214 0.056) 4.580 4.063 ( -9.591 5.259 -1.661) 11.063 4.233 ( -0.734 1.660 0.618) 1.917 4.413 ( -0.127 -0.447 -2.455) 2.498 4.489 ( -0.309 -0.699 0.980) 1.242 4.949 ( 0.465 6.862 -0.813) 6.926 5.439 ( 6.929 0.483 0.881) 7.001 5.647 ( -4.353 2.034 -1.377) 4.998 6.132 ( 10.389 -11.899 -0.769) 15.815 6.262 ( 2.349 -2.859 0.280) 3.710 6.713 ( -0.210 4.872 3.408) 5.949 7.004 ( -0.548 1.230 -0.321) 1.384 7.694 ( -1.183 6.116 -0.996) 6.309 7.906 ( -7.372 6.656 -0.608) 9.951 8.322 ( 2.913 0.536 -1.558) 3.347 9.020 ( 2.158 -7.546 5.680) 9.689 9.101 ( -4.668 -6.889 3.135) 8.892 9.525 ( 2.323 -8.303 -2.501) 8.978 10.152 ( 0.654 -3.102 -3.102) 4.436 10.433 ( -1.326 5.117 1.534) 5.504 11.922 ( -1.898 13.941 -1.537) 14.153 12.545 ( 5.801 12.589 -2.622) 14.107 14.877 ( -2.131 -0.224 0.415) 2.183 14.976 ( -2.116 6.065 -0.135) 6.425 16.133 ( -2.860 4.502 0.115) 5.335 16.433 ( -1.705 0.501 -1.114) 2.097 21.440 ( -0.109 8.323 0.071) 8.324 21.584 ( 0.102 -4.860 -0.490) 4.885======================= Grid point 198 (72/322) =======================q-point: (-0.23 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.374 ( -5.576 -3.326 6.712) 9.338 2.196 ( -4.304 16.834 1.386) 17.431 2.656 ( -0.384 -4.991 1.947) 5.371 3.018 ( -4.637 4.721 2.623) 7.118 3.211 ( 0.081 7.368 -0.560) 7.390 3.492 ( 2.117 6.028 0.469) 6.407 3.659 ( 1.174 12.133 -5.199) 13.252 3.725 ( 2.223 4.179 -0.728) 4.789 3.835 ( -12.320 10.438 -6.620) 17.452 3.958 ( 4.099 -0.976 7.525) 8.624 4.125 ( -0.756 8.300 -0.275) 8.339 4.390 ( -0.943 2.501 0.004) 2.673 4.544 ( 1.394 -3.944 2.506) 4.876 4.879 ( 2.580 0.619 0.714) 2.748 5.456 ( 5.495 2.121 -0.669) 5.928 5.570 ( -3.026 3.394 -1.190) 4.701 6.257 ( 4.154 6.258 0.385) 7.521 6.414 ( 7.458 -1.258 2.117) 7.854 6.681 ( -0.908 -9.110 1.399) 9.261 6.976 ( -2.546 -2.235 -0.150) 3.391 7.415 ( 7.065 24.442 -2.444) 25.560 7.757 ( -10.601 1.267 1.706) 10.812 8.433 ( 4.275 -8.967 -3.901) 10.672 9.158 ( -3.391 -5.781 4.006) 7.808 9.228 ( -2.725 -8.716 3.441) 9.759 9.724 ( 1.802 -10.699 -2.382) 11.108 10.243 ( 0.668 -3.382 -3.693) 5.052 10.388 ( -1.705 -4.036 1.551) 4.648 11.613 ( 0.254 15.993 0.869) 16.019 12.214 ( 3.644 23.163 -2.258) 23.556 14.811 ( -4.593 6.058 -2.575) 8.026 14.888 ( -1.235 0.459 2.812) 3.105 16.057 ( -2.417 1.474 0.431) 2.864 16.418 ( -1.700 -0.426 -0.599) 1.852 21.209 ( -0.400 15.072 1.073) 15.115 21.708 ( 1.629 -6.904 -2.810) 7.630======================= Grid point 199 (73/322) =======================q-point: (-0.15 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.308 ( -3.252 8.180 9.459) 12.922 1.774 ( -3.039 23.689 3.119) 24.086 2.666 ( -2.007 6.695 -2.486) 7.419 2.882 ( -1.270 6.651 1.825) 7.013 3.054 ( -0.213 9.472 0.753) 9.504 3.309 ( -0.051 20.463 0.991) 20.487 3.371 ( -1.625 7.640 1.011) 7.876 3.522 ( -5.707 10.922 -11.165) 16.629 3.691 ( 0.333 1.855 -0.586) 1.973 3.942 ( -2.751 7.027 2.421) 7.926 4.034 ( 5.657 -0.338 6.144) 8.359 4.328 ( -0.665 2.470 -0.609) 2.629 4.621 ( 1.215 -1.282 3.075) 3.547 4.937 ( 2.195 -3.884 0.926) 4.556 5.400 ( 4.313 5.992 -2.302) 7.734 5.477 ( -1.693 4.798 -0.703) 5.136 5.885 ( -1.183 29.012 -0.909) 29.051 6.373 ( -1.369 5.217 5.023) 7.370 6.827 ( 5.538 20.204 -1.528) 21.004 7.112 ( 1.201 -11.865 -0.049) 11.926 7.165 ( 1.857 -18.360 -0.713) 18.467 7.724 ( -5.538 -2.225 3.419) 6.878 8.663 ( 6.182 -10.820 -5.351) 13.562 9.207 ( -3.943 -0.808 2.852) 4.933 9.428 ( -3.899 -11.819 3.115) 12.830 9.948 ( 0.245 -11.785 -3.650) 12.340 10.236 ( -0.231 1.757 0.422) 1.822 10.566 ( -1.037 -11.075 -4.715) 12.081 11.347 ( 2.250 11.169 4.938) 12.417 11.712 ( 0.950 27.458 -0.377) 27.477 14.660 ( -2.161 6.322 -0.208) 6.684 14.891 ( -2.476 -1.231 0.850) 2.893 16.049 ( -1.430 -1.575 0.459) 2.176 16.437 ( -0.980 -2.433 -0.159) 2.628 20.854 ( -0.554 20.731 1.973) 20.832 21.838 ( 2.828 -4.929 -7.669) 9.545======================= Grid point 200 (74/322) =======================q-point: (-0.08 0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.081 ( -0.441 14.761 15.192) 21.186 1.275 ( 3.378 26.895 6.722) 27.928 2.193 ( 0.828 39.332 0.018) 39.341 2.762 ( 1.986 8.484 -2.104) 8.964 2.858 ( -2.597 5.971 1.166) 6.615 3.034 ( -2.020 6.832 2.872) 7.682 3.224 ( -1.128 6.931 0.813) 7.069 3.269 ( -0.831 11.335 -9.451) 14.781 3.660 ( -0.965 2.077 1.296) 2.632 3.801 ( -5.029 4.929 -2.635) 7.519 4.055 ( 2.101 2.296 7.543) 8.159 4.314 ( 1.467 -1.010 0.186) 1.791 4.537 ( 1.189 13.841 2.148) 14.057 4.953 ( -5.814 7.805 -3.406) 10.312 5.281 ( 4.405 11.410 -3.368) 12.687 5.315 ( 9.007 4.435 0.823) 10.073 5.456 ( -5.596 5.740 1.854) 8.228 6.069 ( -4.009 21.539 -2.275) 22.026 6.601 ( -1.252 1.573 5.478) 5.835 7.380 ( -0.815 -13.479 0.568) 13.515 7.644 ( -0.973 -24.606 -0.414) 24.629 7.794 ( -0.736 -6.486 6.436) 9.166 8.859 ( 7.122 -4.520 -6.419) 10.600 9.152 ( -0.162 5.158 1.954) 5.518 9.592 ( -5.958 -6.517 2.757) 9.250 10.161 ( -1.242 -8.670 -5.173) 10.172 10.242 ( -0.933 -5.094 -0.328) 5.190 10.644 ( -4.286 4.159 -7.719) 9.760 11.252 ( 5.549 1.049 9.406) 10.971 11.270 ( -0.144 14.116 4.058) 14.689 14.566 ( 6.350 3.335 2.648) 7.646 14.906 ( -2.877 -1.767 -0.578) 3.426 16.096 ( 0.255 -3.260 0.602) 3.325 16.497 ( 0.072 -3.727 -0.090) 3.729 20.423 ( -0.564 22.138 2.193) 22.253 21.858 ( 1.557 4.338 -18.903) 19.457======================= Grid point 203 (75/322) =======================q-point: ( 0.15 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.901 ( 9.571 0.000 24.467) 26.272 0.905 ( 24.832 0.000 10.648) 27.019 1.641 ( 46.892 0.000 10.017) 47.950 2.485 ( 3.572 0.000 -7.492) 8.300 2.780 ( -12.540 -0.000 5.987) 13.896 2.800 ( -2.624 -0.000 1.839) 3.204 2.986 ( -5.534 -0.000 -1.066) 5.636 3.103 ( 15.482 0.000 -6.542) 16.808 3.377 ( -3.265 -0.000 3.289) 4.634 3.484 ( -7.412 -0.000 -1.388) 7.541 3.809 ( 2.560 0.000 -0.904) 2.715 3.974 ( -4.251 -0.000 2.923) 5.159 4.148 ( -1.010 -0.000 1.471) 1.785 4.451 ( 3.235 0.000 1.799) 3.702 5.094 ( -11.762 -0.000 -5.000) 12.781 5.284 ( -6.986 -0.000 7.033) 9.913 5.577 ( -4.082 -0.000 2.285) 4.679 5.702 ( -1.681 -0.000 -5.370) 5.627 6.534 ( -9.352 -0.000 7.101) 11.742 7.540 ( -10.363 -0.000 0.084) 10.363 7.857 ( -4.107 -0.000 7.977) 8.972 8.413 ( 1.303 0.000 1.101) 1.706 8.666 ( 7.319 0.000 0.084) 7.320 9.271 ( 4.774 0.000 -9.059) 10.240 9.705 ( 1.074 0.000 0.892) 1.396 9.783 ( 7.399 0.000 0.953) 7.461 10.545 ( 4.212 0.000 -1.346) 4.422 10.654 ( -0.713 -0.000 -0.886) 1.137 10.886 ( -16.773 -0.000 2.729) 16.993 11.560 ( 2.629 0.000 5.819) 6.385 14.849 ( 0.837 0.000 -5.284) 5.350 15.779 ( 4.058 0.000 -4.085) 5.759 16.667 ( 6.732 0.000 -0.537) 6.753 17.464 ( 42.870 0.000 -48.640) 64.836 19.874 ( -0.132 -0.000 0.076) 0.152 20.112 ( -0.024 -0.000 -0.041) 0.047======================= Grid point 204 (76/322) =======================q-point: ( 0.23 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.095 ( 9.749 -9.792 19.480) 23.883 1.366 ( 19.609 -22.160 7.634) 30.559 2.103 ( 36.890 -18.219 1.556) 41.173 2.592 ( 0.791 -8.179 -4.757) 9.495 2.697 ( -7.444 -0.837 2.727) 7.972 2.867 ( -3.663 -6.367 3.342) 8.069 3.019 ( -5.789 -6.035 -1.813) 8.557 3.240 ( 18.239 -4.663 -4.647) 19.391 3.451 ( -4.591 -3.868 1.203) 6.123 3.530 ( -3.608 -10.921 1.744) 11.633 3.994 ( -2.409 -3.922 3.174) 5.591 4.135 ( -2.592 -22.563 -1.962) 22.796 4.246 ( -0.697 -10.500 1.613) 10.646 4.511 ( 1.637 -7.026 0.728) 7.251 5.045 ( -12.256 -3.858 -6.192) 14.263 5.255 ( -5.679 -0.257 6.077) 8.321 5.513 ( -7.465 2.965 -0.211) 8.035 5.694 ( -0.762 -3.520 -3.310) 4.891 6.442 ( -9.754 4.907 7.157) 13.055 7.406 ( -10.924 7.298 -0.509) 13.147 7.793 ( -1.269 5.906 5.415) 8.113 8.222 ( 3.045 14.671 2.062) 15.125 8.894 ( 5.389 -13.086 -0.720) 14.170 9.222 ( 1.814 4.901 -3.974) 6.565 9.721 ( 4.093 4.641 -2.717) 6.758 9.911 ( 2.470 -10.920 0.491) 11.207 10.430 ( -2.939 14.083 -0.459) 14.394 10.570 ( 3.649 -0.140 -0.843) 3.748 10.960 ( -8.503 -10.266 0.985) 13.366 11.509 ( -0.501 6.340 5.642) 8.502 14.839 ( 3.658 1.627 -4.421) 5.965 15.604 ( 11.931 18.573 -1.450) 22.123 16.661 ( 10.937 9.779 -1.667) 14.765 16.755 ( 26.125 36.951 -6.371) 45.700 20.037 ( -0.545 -15.311 1.177) 15.366 20.924 ( -14.318 -46.067 -18.682) 51.732======================= Grid point 205 (77/322) =======================q-point: ( 0.31 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.388 ( 9.198 -10.407 13.371) 19.279 1.875 ( 16.760 -17.466 5.261) 24.772 2.540 ( 3.320 -6.980 -3.996) 8.701 2.693 ( -3.326 -8.313 0.835) 8.993 2.874 ( 9.006 -13.872 -5.421) 17.405 3.014 ( -1.304 -9.380 2.622) 9.826 3.139 ( -3.734 -9.426 -1.067) 10.195 3.449 ( 10.010 -6.310 -2.117) 12.021 3.572 ( 6.130 -5.965 1.779) 8.736 3.695 ( 2.322 -10.774 3.239) 11.488 4.083 ( -1.138 -5.367 3.077) 6.291 4.304 ( -2.013 -0.522 0.800) 2.228 4.580 ( 0.580 -12.920 2.003) 13.087 4.791 ( -4.783 -15.065 1.556) 15.882 5.193 ( -6.163 -21.088 -5.532) 22.655 5.272 ( -3.633 -6.105 0.931) 7.165 5.430 ( -6.962 0.078 -1.988) 7.240 5.880 ( -6.936 -19.596 -2.351) 20.920 6.259 ( -13.018 7.173 6.789) 16.341 7.135 ( -10.825 12.935 -1.602) 16.943 7.625 ( 5.193 12.998 2.537) 14.225 8.012 ( 3.425 7.116 4.315) 9.000 9.053 ( 0.590 8.807 -6.082) 10.720 9.166 ( 2.434 -7.125 1.850) 7.753 9.574 ( 4.030 11.828 -0.514) 12.506 10.027 ( -3.342 7.571 -2.411) 8.620 10.275 ( 3.752 -5.361 0.496) 6.562 10.584 ( 0.994 0.560 -1.812) 2.141 11.181 ( -3.584 -16.317 -0.459) 16.712 11.363 ( -4.821 5.885 5.770) 9.548 14.817 ( 5.518 2.459 -2.616) 6.583 15.352 ( 15.789 13.007 1.131) 20.488 16.330 ( 11.849 14.436 -0.188) 18.677 16.643 ( 7.325 4.613 -0.259) 8.660 20.418 ( -0.809 -22.071 1.959) 22.173 21.438 ( -10.934 -19.734 -12.080) 25.591======================= Grid point 206 (78/322) =======================q-point: ( 0.38 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.601 ( 9.119 -2.885 8.411) 12.737 2.258 ( 12.035 -11.866 3.224) 17.206 2.571 ( -5.218 -1.262 1.371) 5.540 2.850 ( -2.087 -8.145 0.282) 8.413 3.118 ( 3.663 -7.496 -4.538) 9.498 3.224 ( -0.055 -11.312 0.951) 11.352 3.330 ( 1.198 -10.176 -3.019) 10.681 3.506 ( -3.789 -0.219 -3.007) 4.842 3.744 ( 8.380 -7.843 1.320) 11.553 4.075 ( 14.286 -15.740 3.648) 21.567 4.207 ( 0.146 -7.564 2.693) 8.030 4.269 ( -0.865 2.390 0.001) 2.541 4.678 ( -4.278 -2.103 0.067) 4.767 4.891 ( -4.704 0.078 2.755) 5.453 5.301 ( -2.652 -3.314 -0.651) 4.294 5.425 ( -8.769 -5.177 -2.859) 10.576 5.837 ( 0.862 -31.855 -1.883) 31.922 5.984 ( -10.531 7.898 4.882) 14.039 6.434 ( -13.593 -34.926 -1.905) 37.527 6.825 ( -7.074 10.993 -1.149) 13.123 7.391 ( 9.989 14.279 2.135) 17.557 8.004 ( 4.931 -2.199 3.817) 6.612 8.780 ( -5.021 14.856 -5.791) 16.716 9.271 ( 2.658 -0.358 1.014) 2.868 9.334 ( 5.044 14.609 2.485) 15.654 9.794 ( -2.876 9.919 -2.436) 10.611 10.364 ( 2.108 2.439 1.394) 3.512 10.558 ( 2.183 3.883 -3.298) 5.543 11.349 ( -5.226 -10.825 3.849) 12.622 11.548 ( -4.264 -21.241 -1.358) 21.707 14.812 ( 5.925 1.013 -1.330) 6.156 15.271 ( 11.778 4.892 1.247) 12.814 16.203 ( 6.567 4.762 0.465) 8.125 16.600 ( 5.484 3.514 -0.467) 6.530 20.846 ( -0.641 -20.684 1.610) 20.756 21.624 ( -4.808 -6.579 -5.664) 9.924======================= Grid point 207 (79/322) =======================q-point: ( 0.46 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.600 ( 8.368 9.512 5.947) 13.996 2.435 ( 0.072 -1.001 3.055) 3.215 2.617 ( 4.056 -4.554 2.347) 6.534 2.990 ( -2.865 -7.173 2.764) 8.204 3.242 ( 3.426 -3.890 -2.672) 5.832 3.426 ( 0.079 -8.876 1.399) 8.986 3.495 ( -3.857 -3.486 -2.390) 5.722 3.527 ( 4.007 -7.771 -3.612) 9.460 3.940 ( 4.674 -7.292 2.630) 9.052 4.199 ( -2.397 2.792 -1.409) 3.940 4.300 ( -0.971 -6.108 0.392) 6.198 4.393 ( 9.349 -2.217 0.991) 9.659 4.671 ( -8.185 1.345 -2.901) 8.788 4.894 ( 0.405 -6.169 3.991) 7.358 5.344 ( 1.368 -1.588 -0.739) 2.223 5.503 ( -8.052 -7.627 -2.503) 11.370 5.765 ( -14.844 4.515 2.558) 15.725 6.262 ( 0.839 -5.735 -0.345) 5.806 6.728 ( -1.314 -6.495 -0.112) 6.628 6.999 ( -3.747 -18.939 0.223) 19.307 7.266 ( 7.554 -2.129 0.892) 7.898 8.130 ( 6.122 -6.184 2.849) 9.156 8.434 ( -8.192 14.628 -5.981) 17.800 9.094 ( 5.321 13.210 4.312) 14.880 9.221 ( -0.123 5.548 1.480) 5.744 9.630 ( -1.112 5.900 -1.187) 6.120 10.282 ( 1.001 5.372 -3.098) 6.282 10.433 ( -0.811 5.865 1.923) 6.226 11.688 ( 0.491 -21.061 -0.003) 21.066 11.923 ( -6.205 -19.699 -1.922) 20.743 14.838 ( 5.432 -0.153 -0.520) 5.459 15.259 ( 7.122 2.895 0.765) 7.725 16.207 ( 5.588 -1.100 0.440) 5.712 16.565 ( 2.973 2.688 -0.939) 4.117 21.200 ( -0.198 -15.163 0.673) 15.179 21.654 ( -1.061 0.580 -1.995) 2.333======================= Grid point 208 (80/322) =======================q-point: ( 0.54 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.368 ( 6.164 18.022 6.224) 20.039 2.400 ( -2.476 2.678 4.941) 6.141 2.712 ( 3.084 -1.187 0.957) 3.440 3.093 ( -3.095 -4.326 3.285) 6.252 3.322 ( 5.401 -2.727 -2.011) 6.376 3.569 ( -0.192 -5.298 1.170) 5.429 3.570 ( -0.800 -5.724 -0.314) 5.788 3.698 ( 4.740 -7.018 -1.727) 8.643 4.067 ( -3.331 -3.181 3.217) 5.619 4.139 ( 2.212 1.369 -1.927) 3.238 4.371 ( -1.248 -1.456 -1.568) 2.477 4.413 ( -0.319 1.057 -0.722) 1.319 4.545 ( -5.499 4.335 -0.578) 7.026 5.065 ( 0.856 -6.554 -1.034) 6.690 5.384 ( 4.191 -1.346 -0.042) 4.402 5.601 ( -6.770 -6.491 -1.162) 9.450 5.669 ( -11.458 -2.545 0.135) 11.738 6.241 ( 1.703 3.648 0.216) 4.032 6.873 ( 1.344 -4.155 0.667) 4.417 7.049 ( 8.600 4.669 2.120) 10.013 7.598 ( -0.631 -17.840 -0.487) 17.858 8.106 ( -9.954 10.820 -5.481) 15.691 8.336 ( 5.063 -9.855 3.514) 11.624 8.886 ( 4.325 11.957 4.273) 13.414 9.099 ( -1.832 5.684 2.247) 6.381 9.510 ( -1.033 5.918 -1.040) 6.096 10.172 ( 0.979 4.383 -3.214) 5.523 10.426 ( -1.505 -4.627 1.633) 5.132 12.050 ( 0.997 -12.968 -2.520) 13.248 12.253 ( -3.537 -17.957 -1.596) 18.371 14.870 ( 4.190 -0.107 0.390) 4.210 15.230 ( 3.389 3.296 0.150) 4.730 16.285 ( 5.018 -2.703 -0.007) 5.699 16.516 ( -0.079 3.132 -1.370) 3.419 21.435 ( 0.140 -8.716 -0.121) 8.718 21.604 ( 0.169 3.550 -0.217) 3.561======================= Grid point 209 (81/322) =======================q-point: ( 0.62 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.072 ( 2.228 12.892 7.407) 15.034 2.356 ( -1.953 0.545 5.629) 5.984 2.698 ( -0.719 2.840 0.361) 2.952 3.133 ( -3.226 -1.319 3.116) 4.675 3.408 ( 6.878 -2.015 -1.187) 7.264 3.629 ( -1.225 -1.180 0.719) 1.847 3.687 ( 2.987 -5.074 1.315) 6.034 3.845 ( 4.165 -5.137 -0.679) 6.648 4.034 ( -6.211 1.263 -0.746) 6.382 4.165 ( 1.724 0.384 1.962) 2.640 4.308 ( -6.087 3.509 -2.649) 7.509 4.396 ( 1.153 0.301 -2.066) 2.385 4.490 ( -1.262 0.331 0.697) 1.479 5.119 ( -2.108 -0.176 -2.652) 3.392 5.444 ( 5.701 -1.142 -0.154) 5.817 5.656 ( -5.677 -2.632 -0.440) 6.273 5.722 ( -4.548 -7.574 -0.471) 8.847 6.204 ( 1.867 0.871 0.041) 2.061 6.911 ( 4.876 1.114 1.559) 5.239 7.013 ( 4.583 3.439 1.354) 5.888 7.803 ( -1.402 1.302 -1.136) 2.225 7.919 ( -7.075 -3.225 -2.977) 8.326 8.566 ( -0.363 -6.399 4.072) 7.593 8.696 ( 5.118 6.399 3.897) 9.074 9.006 ( -2.238 2.648 2.621) 4.347 9.405 ( -0.075 3.086 -2.192) 3.786 10.134 ( 0.732 0.227 -2.444) 2.561 10.519 ( -0.958 -3.616 0.734) 3.812 12.182 ( -1.771 -1.930 -2.794) 3.830 12.552 ( 1.899 -11.761 -2.314) 12.136 14.887 ( 2.168 0.483 1.022) 2.445 15.171 ( 1.096 4.053 -0.287) 4.208 16.327 ( 3.015 2.257 -0.624) 3.818 16.451 ( -2.036 1.463 -1.303) 2.825 21.533 ( 0.076 1.539 -0.169) 1.550 21.552 ( 0.133 -1.694 0.132) 1.704======================= Grid point 210 (82/322) =======================q-point: (-0.31 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.003 ( -2.699 -5.246 6.947) 9.114 2.394 ( -1.153 -4.529 5.120) 6.933 2.609 ( -2.245 5.370 0.208) 5.824 3.122 ( -3.374 0.859 3.258) 4.768 3.441 ( 3.993 2.597 -0.750) 4.821 3.618 ( -0.924 1.138 -0.401) 1.520 3.799 ( 7.135 -2.831 1.969) 7.925 3.912 ( -1.919 0.160 -3.037) 3.596 3.973 ( 0.294 2.689 0.458) 2.744 4.099 ( -7.785 3.676 -1.135) 8.684 4.248 ( 0.469 0.970 1.472) 1.825 4.400 ( 1.320 -0.379 -1.889) 2.336 4.484 ( -0.808 -0.135 0.408) 0.915 5.061 ( -1.141 4.299 -2.274) 4.995 5.486 ( 5.917 0.159 0.215) 5.923 5.640 ( -5.115 0.415 -0.382) 5.146 5.909 ( 0.994 -12.346 -0.215) 12.388 6.225 ( 1.015 -1.883 -0.243) 2.153 6.883 ( 8.014 7.348 2.955) 11.267 6.991 ( -1.431 -1.067 -0.054) 1.786 7.700 ( -6.811 2.063 -1.315) 7.237 7.976 ( 0.306 -0.036 -1.192) 1.232 8.435 ( -0.102 8.713 1.304) 8.811 8.870 ( 1.731 -10.539 5.314) 11.929 8.986 ( -2.918 -1.750 2.545) 4.249 9.409 ( 1.311 -3.689 -2.681) 4.746 10.133 ( 0.750 0.164 -2.329) 2.452 10.522 ( -0.865 3.013 0.676) 3.207 12.118 ( -1.058 6.879 -1.984) 7.237 12.688 ( 2.998 -0.421 -3.242) 4.436 14.879 ( -0.181 0.970 0.641) 1.177 15.083 ( 0.098 5.212 -0.133) 5.215 16.232 ( -0.703 6.379 -0.487) 6.436 16.435 ( -0.715 0.241 -1.072) 1.311 21.514 ( 0.076 -0.433 -0.093) 0.449 21.555 ( -0.186 2.003 0.094) 2.014======================= Grid point 211 (83/322) =======================q-point: (-0.23 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.190 ( -4.179 -11.903 5.607) 13.806 2.445 ( -0.819 9.759 0.783) 9.825 2.525 ( -2.055 -7.101 3.456) 8.160 3.071 ( -3.324 2.835 2.842) 5.212 3.355 ( 1.341 6.762 -0.408) 6.906 3.578 ( -0.777 2.584 -2.062) 3.396 3.815 ( -3.195 5.408 -4.453) 7.700 3.843 ( 3.676 5.266 -0.713) 6.462 3.937 ( 0.596 3.527 0.039) 3.577 3.972 ( -2.114 2.290 1.117) 3.311 4.229 ( -0.702 2.474 1.067) 2.784 4.414 ( 0.505 0.165 -0.392) 0.660 4.502 ( 2.156 -1.949 2.357) 3.742 4.952 ( 0.097 5.409 -0.765) 5.464 5.510 ( 4.454 0.692 0.536) 4.539 5.596 ( -3.046 1.373 -0.540) 3.384 6.209 ( 3.624 -16.472 -0.140) 16.866 6.281 ( 0.467 -3.083 -0.295) 3.132 6.738 ( 1.174 9.618 3.625) 10.345 6.995 ( -0.561 1.353 -0.780) 1.660 7.656 ( -2.652 -0.100 -0.150) 2.658 7.864 ( -0.773 11.938 -1.433) 12.049 8.352 ( 2.598 -0.489 -0.562) 2.703 9.040 ( -2.998 -4.854 2.638) 6.285 9.059 ( -1.998 -8.090 3.965) 9.228 9.541 ( 1.582 -8.467 -2.112) 8.868 10.153 ( 1.011 -3.002 -2.944) 4.325 10.423 ( -1.016 5.275 1.317) 5.531 11.910 ( 0.408 13.379 -0.532) 13.396 12.580 ( 1.663 12.307 -3.678) 12.952 14.848 ( -2.320 1.625 -1.473) 3.193 14.973 ( 0.864 5.921 1.679) 6.214 16.110 ( -1.086 4.855 0.091) 4.975 16.418 ( -0.234 0.820 -0.726) 1.120 21.439 ( -0.135 8.403 0.019) 8.404 21.585 ( 0.266 -5.164 -0.388) 5.186======================= Grid point 212 (84/322) =======================q-point: (-0.15 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.349 ( -2.243 -3.993 6.492) 7.945 2.178 ( 0.402 17.090 1.888) 17.198 2.649 ( -1.523 -4.765 1.162) 5.136 2.983 ( -2.339 4.754 1.647) 5.549 3.219 ( 1.275 7.531 0.350) 7.646 3.491 ( -1.831 5.254 -1.594) 5.788 3.645 ( -4.630 7.883 -8.541) 12.511 3.702 ( -0.290 16.291 -1.534) 16.366 3.744 ( -1.077 4.146 -1.612) 4.577 4.044 ( 6.375 -2.151 5.446) 8.656 4.115 ( -0.834 8.666 0.946) 8.757 4.380 ( -0.756 2.812 -0.409) 2.941 4.591 ( 4.477 -3.401 5.464) 7.840 4.889 ( -1.088 -0.069 0.070) 1.092 5.500 ( 0.435 1.871 -0.588) 2.008 5.544 ( 0.987 3.586 -0.552) 3.760 6.274 ( -0.453 8.127 -0.432) 8.151 6.463 ( -1.732 1.754 2.574) 3.564 6.687 ( 0.957 -14.174 1.872) 14.329 6.952 ( -1.102 -0.945 -1.207) 1.888 7.467 ( 1.642 25.232 -2.473) 25.406 7.679 ( -1.663 -1.023 1.390) 2.396 8.480 ( 4.950 -9.543 -1.807) 10.902 9.125 ( -3.742 -5.039 1.974) 6.580 9.207 ( -2.638 -8.617 3.286) 9.592 9.726 ( -0.045 -10.042 -2.709) 10.401 10.245 ( 1.484 -3.215 -3.434) 4.933 10.379 ( -0.512 -3.840 1.353) 4.103 11.626 ( 1.134 15.153 1.897) 15.313 12.223 ( -0.660 23.155 -3.115) 23.373 14.769 ( -1.403 4.774 -2.366) 5.510 14.897 ( 1.519 2.614 2.724) 4.070 16.043 ( -0.239 1.506 0.332) 1.561 16.410 ( 0.662 -0.242 -0.241) 0.745 21.208 ( -0.453 15.027 0.993) 15.066 21.713 ( 0.755 -7.078 -2.864) 7.673======================= Grid point 213 (85/322) =======================q-point: (-0.08 0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.325 ( 0.742 6.980 10.110) 12.308 1.806 ( 6.212 22.479 4.321) 23.719 2.646 ( 0.149 6.680 -3.298) 7.452 2.875 ( -0.983 4.912 1.670) 5.281 3.062 ( 1.152 10.491 1.077) 10.609 3.284 ( -3.694 18.991 -0.546) 19.355 3.367 ( -0.467 8.757 -0.932) 8.819 3.453 ( 1.087 9.781 -9.193) 13.467 3.682 ( -1.780 1.442 -1.076) 2.531 3.915 ( -2.638 9.664 2.108) 10.237 4.109 ( 3.552 0.376 6.204) 7.159 4.322 ( -0.184 1.691 -0.667) 1.827 4.663 ( 3.622 0.254 3.990) 5.395 4.929 ( -3.054 -3.598 1.047) 4.835 5.439 ( -0.120 4.128 -1.579) 4.422 5.469 ( 3.220 4.741 -0.198) 5.734 5.867 ( -1.124 29.769 -1.661) 29.837 6.331 ( -7.479 7.065 3.150) 10.760 6.843 ( -2.788 20.923 -0.629) 21.117 7.094 ( -3.035 -13.669 -0.668) 14.018 7.183 ( 0.508 -17.778 -0.222) 17.786 7.721 ( 3.412 -2.478 3.330) 5.373 8.730 ( 7.307 -11.406 -3.272) 13.935 9.179 ( -1.952 -1.288 1.980) 3.065 9.388 ( -4.137 -10.832 1.808) 11.736 9.926 ( -1.765 -11.478 -4.178) 12.341 10.247 ( 1.845 1.892 0.689) 2.731 10.545 ( 0.159 -9.139 -5.062) 10.449 11.383 ( 0.775 9.520 5.978) 11.268 11.704 ( -1.928 26.614 -0.790) 26.695 14.677 ( 4.128 4.141 0.337) 5.857 14.882 ( 1.483 0.284 0.635) 1.638 16.049 ( 1.150 -1.741 0.440) 2.133 16.441 ( 1.789 -2.254 0.011) 2.877 20.853 ( -0.653 20.654 1.940) 20.755 21.825 ( -0.676 -4.003 -8.061) 9.025======================= Grid point 217 (86/322) =======================q-point: ( 0.23 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.093 ( 11.217 0.000 20.825) 23.654 1.230 ( 25.590 0.000 8.080) 26.835 2.176 ( 40.130 0.000 0.020) 40.130 2.505 ( 3.433 0.000 -7.093) 7.880 2.637 ( -14.128 -0.000 6.287) 15.464 2.774 ( -2.748 -0.000 1.528) 3.144 2.904 ( -7.519 -0.000 -1.773) 7.725 3.319 ( 23.741 0.000 -1.965) 23.822 3.347 ( -3.885 -0.000 4.062) 5.621 3.421 ( -3.355 -0.000 2.039) 3.926 3.836 ( 2.576 0.000 -1.083) 2.795 3.937 ( -3.342 -0.000 2.316) 4.066 4.151 ( 0.242 0.000 0.439) 0.502 4.472 ( -0.618 -0.000 0.956) 1.138 4.929 ( -13.038 -0.000 -5.526) 14.161 5.233 ( -5.759 -0.000 7.410) 9.384 5.494 ( -9.489 -0.000 -0.004) 9.489 5.653 ( -5.559 -0.000 -4.665) 7.257 6.460 ( -6.567 -0.000 7.660) 10.090 7.415 ( -10.685 -0.000 0.194) 10.687 7.845 ( -2.226 -0.000 6.508) 6.878 8.433 ( 1.547 0.000 0.743) 1.716 8.753 ( 7.130 0.000 0.079) 7.131 9.273 ( 0.401 0.000 -6.861) 6.872 9.720 ( 1.096 0.000 0.698) 1.299 9.890 ( 9.871 0.000 0.732) 9.898 10.590 ( 3.921 0.000 -0.967) 4.039 10.642 ( -0.756 -0.000 -0.784) 1.089 10.716 ( -13.753 -0.000 1.336) 13.818 11.578 ( -2.333 -0.000 4.026) 4.653 14.878 ( 6.576 0.000 -3.935) 7.663 15.790 ( 0.090 0.000 -2.243) 2.245 16.763 ( 9.899 0.000 -0.395) 9.907 17.658 ( 15.943 0.000 -35.138) 38.586 19.873 ( -0.153 -0.000 0.077) 0.171 20.111 ( -0.039 -0.000 -0.045) 0.060======================= Grid point 218 (87/322) =======================q-point: ( 0.31 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.277 ( 11.777 -8.152 16.369) 21.751 1.622 ( 20.487 -18.709 6.068) 28.400 2.435 ( 10.782 -5.670 -3.169) 12.588 2.540 ( -3.211 -4.174 -0.163) 5.268 2.694 ( 10.245 -9.725 -3.725) 14.609 2.837 ( -3.085 -7.109 2.367) 8.103 2.938 ( -6.350 -7.314 -1.961) 9.882 3.403 ( 0.981 -2.431 1.713) 3.132 3.490 ( 2.180 -9.383 2.059) 9.851 3.532 ( 19.971 -7.772 4.094) 21.818 3.978 ( -2.112 -5.001 2.366) 5.922 4.115 ( -0.066 -19.949 -0.413) 19.954 4.248 ( -0.268 -11.460 1.855) 11.612 4.513 ( -1.348 -7.112 0.004) 7.238 4.871 ( -13.607 -3.914 -6.586) 15.616 5.211 ( -5.969 -0.396 4.514) 7.495 5.413 ( -8.017 2.080 -0.486) 8.296 5.622 ( -9.977 -3.211 -3.456) 11.036 6.375 ( -5.437 6.489 8.046) 11.679 7.277 ( -10.550 7.746 -0.440) 13.096 7.807 ( 0.568 3.861 5.386) 6.651 8.258 ( 2.093 13.909 1.465) 14.141 8.954 ( 4.985 -12.071 -0.501) 13.069 9.211 ( -0.976 5.161 -4.912) 7.192 9.752 ( 2.660 1.916 -1.408) 3.568 9.971 ( 6.472 -4.989 1.646) 8.336 10.389 ( -3.585 12.425 -0.476) 12.941 10.607 ( 2.659 0.507 -0.018) 2.707 10.875 ( -6.190 -12.469 -0.099) 13.921 11.491 ( -4.760 6.836 3.028) 8.863 14.899 ( 8.214 1.931 -2.428) 8.780 15.679 ( 3.173 10.478 -1.419) 11.040 16.773 ( 10.114 5.344 -0.511) 11.451 17.001 ( 18.638 42.652 -9.987) 47.606 20.034 ( -0.542 -15.286 1.043) 15.331 20.732 ( -10.507 -41.453 -11.027) 44.163======================= Grid point 219 (88/322) =======================q-point: ( 0.38 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.547 ( 11.327 -8.930 11.190) 18.256 2.077 ( 15.116 -15.126 4.222) 21.797 2.476 ( -11.167 -3.730 2.614) 12.060 2.680 ( -0.251 -7.830 -3.273) 8.490 2.979 ( 11.104 -10.003 -6.686) 16.372 2.999 ( -2.383 -10.211 1.232) 10.558 3.103 ( -0.802 -11.932 -1.076) 12.007 3.471 ( -1.544 -2.266 -0.842) 2.869 3.652 ( 4.213 -6.713 1.120) 8.004 3.895 ( 26.221 -13.481 6.382) 30.166 4.070 ( -2.591 -5.430 2.042) 6.354 4.293 ( -0.251 -0.719 2.052) 2.189 4.597 ( 0.561 -10.207 2.611) 10.551 4.711 ( -8.499 -13.239 -0.511) 15.741 5.103 ( -6.312 -28.816 -5.477) 30.003 5.197 ( -9.862 -2.821 -2.291) 10.510 5.369 ( -1.731 -3.416 1.329) 4.053 5.744 ( -14.811 -20.730 -2.698) 25.619 6.171 ( -5.992 11.800 7.345) 15.135 7.012 ( -9.028 12.035 -1.080) 15.084 7.710 ( 7.600 10.146 2.944) 13.014 8.046 ( 0.136 6.147 3.591) 7.120 9.011 ( -3.329 11.374 -7.636) 14.098 9.205 ( 2.872 -7.847 2.014) 8.595 9.639 ( 6.828 11.200 0.525) 13.128 9.979 ( -3.907 9.467 -1.146) 10.305 10.329 ( 5.002 -7.494 0.826) 9.047 10.585 ( -0.239 1.816 -0.848) 2.019 11.141 ( -2.774 -17.477 -0.656) 17.708 11.306 ( -7.006 6.972 2.963) 10.319 14.892 ( 7.953 2.989 -0.888) 8.543 15.490 ( 7.834 10.268 -0.167) 12.916 16.467 ( 11.388 19.132 -1.102) 22.292 16.730 ( 7.374 6.080 -0.672) 9.581 20.414 ( -0.761 -22.083 1.783) 22.168 21.291 ( -8.505 -23.267 -8.690) 26.253======================= Grid point 220 (89/322) =======================q-point: ( 0.46 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.741 ( 10.417 -1.598 7.575) 12.979 2.375 ( 4.613 -6.927 2.816) 8.786 2.517 ( -3.952 -6.287 3.635) 8.268 2.826 ( -1.640 -8.056 0.070) 8.221 3.161 ( 4.884 -6.934 -2.309) 8.790 3.220 ( -0.584 -11.112 0.594) 11.144 3.345 ( 3.374 -11.090 -3.002) 11.974 3.458 ( -2.851 0.321 -2.449) 3.772 3.835 ( 6.384 -7.477 1.842) 10.003 4.154 ( -4.808 -5.421 1.076) 7.326 4.224 ( 3.216 -1.765 0.574) 3.713 4.374 ( 18.033 -7.874 3.132) 19.925 4.606 ( -6.860 -0.420 -2.131) 7.196 4.845 ( -3.895 -1.598 3.595) 5.536 5.212 ( -12.775 -6.702 -6.173) 15.692 5.340 ( -3.462 -5.327 1.274) 6.479 5.846 ( 0.500 -25.049 -0.380) 25.056 5.896 ( -6.236 5.346 4.247) 9.247 6.286 ( -10.454 -38.359 -1.908) 39.804 6.753 ( -4.790 8.599 -0.393) 9.851 7.519 ( 10.247 13.261 2.436) 16.935 8.051 ( 0.983 -4.225 3.562) 5.612 8.692 ( -5.778 16.185 -7.303) 18.673 9.292 ( 0.487 1.017 3.353) 3.538 9.424 ( 7.860 14.672 1.583) 16.720 9.758 ( -2.147 8.558 -1.835) 9.012 10.382 ( 0.241 4.664 1.274) 4.841 10.573 ( 1.844 3.866 -2.576) 4.998 11.295 ( -5.319 -13.528 2.191) 14.700 11.502 ( -2.796 -19.898 -0.968) 20.117 14.887 ( 6.886 1.682 0.100) 7.090 15.383 ( 6.833 5.598 0.149) 8.835 16.281 ( 6.349 6.145 0.216) 8.839 16.655 ( 4.158 4.762 -0.937) 6.391 20.844 ( -0.540 -20.777 1.503) 20.838 21.559 ( -3.411 -9.551 -4.500) 11.095======================= Grid point 221 (90/322) =======================q-point: ( 0.54 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.716 ( 7.657 10.904 6.422) 14.790 2.424 ( -3.187 -0.017 4.445) 5.470 2.665 ( 1.982 -5.665 2.132) 6.369 2.970 ( -1.172 -6.892 2.234) 7.339 3.303 ( 7.556 -3.625 -1.539) 8.520 3.405 ( -3.624 -8.520 -0.062) 9.259 3.473 ( 0.583 -4.754 -0.567) 4.823 3.568 ( 4.742 -8.871 -2.672) 10.408 3.982 ( -1.375 -4.265 4.375) 6.263 4.162 ( -0.980 -0.101 -2.083) 2.304 4.295 ( 0.372 -4.468 -0.008) 4.484 4.454 ( -1.361 3.295 -1.306) 3.797 4.599 ( -0.885 2.389 -1.612) 3.015 4.927 ( 4.004 -7.721 2.186) 8.968 5.288 ( -9.195 -8.238 -5.566) 13.543 5.437 ( -2.770 -6.151 1.115) 6.838 5.643 ( -7.164 6.841 2.635) 10.251 6.274 ( 1.212 -5.553 -0.310) 5.692 6.713 ( -1.044 -8.299 -0.179) 8.366 6.949 ( -3.760 -28.933 -0.418) 29.180 7.378 ( 8.999 4.895 2.725) 10.601 8.179 ( 0.678 -6.112 2.119) 6.504 8.330 ( -5.261 14.394 -5.362) 16.237 9.178 ( 6.194 13.892 4.183) 15.775 9.213 ( -1.957 6.386 1.867) 6.935 9.618 ( -0.371 5.798 -1.123) 5.917 10.282 ( 0.556 4.944 -2.676) 5.649 10.422 ( -1.681 6.783 1.395) 7.127 11.694 ( 0.880 -23.535 -0.655) 23.560 11.856 ( -4.248 -18.233 -1.140) 18.756 14.904 ( 5.440 0.587 0.731) 5.520 15.323 ( 3.574 4.106 -0.103) 5.445 16.270 ( 4.712 -0.925 0.162) 4.804 16.586 ( 1.261 3.943 -1.370) 4.360 21.201 ( -0.104 -15.248 0.690) 15.264 21.638 ( -0.635 -0.813 -1.803) 2.078======================= Grid point 222 (91/322) =======================q-point: ( 0.62 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.448 ( 3.654 19.356 6.730) 20.815 2.390 ( -1.875 2.348 5.649) 6.398 2.728 ( -0.342 -0.164 0.836) 0.918 3.072 ( -1.681 -3.801 2.928) 5.084 3.401 ( 7.788 -2.662 -1.651) 8.394 3.540 ( -2.226 -6.877 -0.702) 7.262 3.593 ( 1.428 -5.654 2.184) 6.227 3.749 ( 4.942 -6.903 -1.461) 8.615 3.987 ( -9.539 -0.827 1.961) 9.773 4.201 ( 7.290 -0.556 0.235) 7.315 4.328 ( -5.346 2.451 -2.504) 6.392 4.387 ( -1.442 -1.060 -1.118) 2.110 4.522 ( -0.266 3.479 0.070) 3.490 5.062 ( -0.662 -3.917 -2.511) 4.700 5.402 ( 0.596 -6.126 -2.900) 6.804 5.540 ( -3.862 -5.822 1.093) 7.071 5.575 ( -4.407 -2.888 0.496) 5.292 6.256 ( 0.749 3.263 -0.357) 3.367 6.877 ( -0.195 -5.352 -0.119) 5.357 7.153 ( 6.287 3.599 2.728) 7.741 7.604 ( 1.334 -18.067 0.416) 18.121 7.989 ( -5.912 12.029 -4.153) 14.032 8.382 ( 1.107 -9.780 3.297) 10.380 8.944 ( 2.373 12.971 2.234) 13.374 9.086 ( -0.979 5.766 3.642) 6.890 9.495 ( -0.828 6.016 -1.418) 6.237 10.174 ( 0.970 4.450 -3.114) 5.517 10.413 ( -1.400 -5.014 1.500) 5.417 12.052 ( 0.936 -10.619 -2.054) 10.856 12.220 ( -1.525 -21.012 -1.582) 21.127 14.919 ( 3.397 0.836 1.280) 3.725 15.256 ( 1.153 4.044 -0.446) 4.229 16.339 ( 3.896 -2.614 -0.378) 4.706 16.501 ( -1.322 4.552 -1.589) 5.000 21.436 ( 0.173 -8.698 -0.050) 8.700 21.604 ( -0.007 3.214 -0.342) 3.232======================= Grid point 223 (92/322) =======================q-point: (-0.31 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.106 ( -0.549 14.795 6.979) 16.367 2.353 ( -1.527 0.489 5.840) 6.056 2.688 ( -0.957 3.488 0.098) 3.618 3.113 ( -1.651 -0.934 3.349) 3.849 3.480 ( 4.983 -1.063 -0.769) 5.153 3.606 ( -2.498 -1.476 -0.912) 3.041 3.730 ( 1.789 -6.630 1.851) 7.113 3.875 ( 2.199 -2.930 -0.336) 3.679 3.967 ( -3.892 -2.041 -0.357) 4.409 4.169 ( -1.981 6.070 -0.869) 6.444 4.272 ( 1.244 0.237 0.524) 1.370 4.405 ( 1.284 -0.230 -1.450) 1.950 4.478 ( -1.053 0.598 0.192) 1.226 5.088 ( -1.325 -0.268 -3.176) 3.451 5.500 ( 4.631 -2.318 -1.283) 5.336 5.596 ( -4.742 -2.281 0.396) 5.277 5.689 ( -0.976 -9.415 0.020) 9.466 6.215 ( 0.054 0.794 -0.679) 1.047 6.933 ( -0.020 -1.827 -0.019) 1.827 7.086 ( 3.758 6.337 3.048) 7.973 7.764 ( -1.914 7.689 -1.803) 8.126 7.887 ( 1.016 -9.335 -0.205) 9.393 8.561 ( -1.948 -2.939 3.059) 4.668 8.741 ( -0.153 3.710 2.547) 4.503 8.997 ( -0.318 3.169 3.322) 4.602 9.398 ( 0.117 2.431 -2.468) 3.466 10.136 ( 0.773 0.223 -2.349) 2.483 10.512 ( -0.563 -3.672 0.667) 3.774 12.167 ( 0.618 -1.456 -1.696) 2.320 12.559 ( 0.596 -12.860 -3.044) 13.228 14.910 ( 0.956 1.601 1.252) 2.246 15.177 ( 0.193 4.331 -0.495) 4.363 16.359 ( 2.533 5.590 -0.995) 6.217 16.420 ( -2.026 -0.680 -1.109) 2.408 21.532 ( -0.083 1.355 -0.262) 1.383 21.554 ( 0.123 -1.408 0.182) 1.425======================= Grid point 224 (93/322) =======================q-point: (-0.23 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.986 ( -3.479 -3.854 5.911) 7.868 2.393 ( -1.633 -4.662 4.952) 6.995 2.592 ( -0.578 5.766 -0.046) 5.795 3.103 ( -1.376 1.412 3.181) 3.742 3.474 ( 1.873 3.852 0.164) 4.286 3.592 ( -2.676 0.626 -2.372) 3.630 3.824 ( -5.519 -1.440 -0.879) 5.771 3.916 ( 8.477 -1.342 1.465) 8.707 3.984 ( -7.834 1.517 -2.614) 8.397 4.034 ( 3.982 4.862 -0.555) 6.309 4.265 ( 1.483 1.601 1.979) 2.946 4.416 ( 1.483 -0.268 -0.494) 1.586 4.484 ( 0.965 -1.298 1.060) 1.934 5.048 ( 0.229 3.690 -2.524) 4.476 5.534 ( -0.948 0.247 0.227) 1.005 5.601 ( 1.654 -0.149 0.094) 1.663 5.916 ( 0.442 -13.796 0.070) 13.804 6.223 ( -0.894 -1.927 -0.886) 2.302 6.946 ( -2.438 8.631 2.874) 9.418 6.977 ( 1.271 -1.583 0.000) 2.030 7.663 ( 2.403 2.612 -0.284) 3.560 7.982 ( 0.757 0.345 -0.704) 1.090 8.433 ( -0.785 7.397 0.653) 7.467 8.863 ( -4.874 -9.427 2.990) 11.026 8.981 ( 0.454 -1.346 3.510) 3.787 9.416 ( 1.102 -4.295 -2.398) 5.041 10.135 ( 0.745 0.148 -2.272) 2.396 10.516 ( -0.316 3.109 0.579) 3.179 12.118 ( 1.862 6.857 -1.021) 7.178 12.692 ( -0.349 -0.684 -4.085) 4.157 14.874 ( -1.029 2.099 0.077) 2.339 15.088 ( 0.681 4.900 0.295) 4.956 16.228 ( 0.271 7.000 -0.463) 7.021 16.430 ( 0.444 0.059 -0.910) 1.014 21.515 ( 0.228 -0.647 0.013) 0.686 21.553 ( -0.167 2.229 0.024) 2.236======================= Grid point 225 (94/322) =======================q-point: (-0.15 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.168 ( -2.220 -12.384 4.771) 13.456 2.440 ( -0.577 8.744 0.684) 8.790 2.519 ( -0.660 -6.238 3.225) 7.053 3.054 ( -0.747 3.288 2.220) 4.037 3.372 ( 1.472 6.885 0.443) 7.055 3.543 ( -2.911 2.302 -3.645) 5.202 3.743 ( -4.947 5.622 -3.033) 8.079 3.827 ( -5.843 5.939 -2.018) 8.572 3.950 ( 4.110 7.968 -0.886) 9.009 4.031 ( 6.301 -3.086 0.890) 7.073 4.233 ( 1.221 3.246 1.824) 3.918 4.415 ( -0.123 1.048 -0.822) 1.337 4.559 ( 5.442 -3.818 5.142) 8.405 4.947 ( -0.118 5.739 -1.170) 5.858 5.498 ( -6.207 0.526 0.030) 6.229 5.618 ( 5.955 1.571 0.306) 6.166 6.222 ( -1.520 -16.618 0.324) 16.690 6.273 ( -1.493 -3.645 -0.607) 3.985 6.733 ( -3.806 10.018 3.311) 11.216 6.988 ( -0.239 1.757 -1.089) 2.081 7.672 ( 5.066 -0.258 0.528) 5.100 7.855 ( 0.177 13.200 -1.507) 13.287 8.376 ( 1.543 -2.203 0.030) 2.690 8.981 ( -6.250 -6.588 0.546) 9.097 9.069 ( -0.000 -5.745 4.149) 7.086 9.548 ( 0.610 -8.027 -1.684) 8.224 10.157 ( 1.214 -3.187 -2.875) 4.461 10.420 ( -0.171 5.263 1.258) 5.414 11.927 ( 2.445 13.418 0.163) 13.640 12.561 ( -2.609 12.340 -4.415) 13.363 14.819 ( -1.660 2.485 -1.846) 3.513 15.001 ( 2.833 4.901 2.011) 6.008 16.110 ( 1.062 4.984 0.088) 5.097 16.424 ( 1.566 0.689 -0.500) 1.782 21.437 ( -0.140 8.506 -0.045) 8.507 21.588 ( 0.401 -5.212 -0.279) 5.234======================= Grid point 226 (95/322) =======================q-point: (-0.08 0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.362 ( 1.034 -5.333 6.185) 8.232 2.215 ( 4.621 15.040 2.163) 15.882 2.629 ( -2.327 -4.388 0.949) 5.057 2.975 ( 0.216 4.878 1.061) 4.996 3.240 ( 1.766 7.527 0.738) 7.767 3.454 ( -2.857 4.862 -2.389) 6.124 3.547 ( -5.226 9.747 -7.379) 13.295 3.705 ( -3.313 3.599 -2.100) 5.323 3.751 ( 5.137 14.172 -0.443) 15.081 4.106 ( 2.541 3.230 -1.168) 4.272 4.139 ( 3.820 4.126 5.705) 8.010 4.369 ( -0.777 2.990 -0.784) 3.187 4.681 ( 7.235 -2.360 7.438) 10.641 4.862 ( -3.056 0.359 -0.270) 3.089 5.454 ( -6.084 0.323 -0.751) 6.139 5.589 ( 4.546 4.482 -0.489) 6.402 6.250 ( -3.717 7.580 -0.188) 8.444 6.392 ( -10.489 2.329 1.696) 10.878 6.710 ( 1.782 -12.782 2.210) 13.093 6.944 ( 0.564 -1.513 -1.539) 2.231 7.422 ( -6.782 25.239 -2.256) 26.231 7.743 ( 10.032 0.440 1.508) 10.154 8.531 ( 4.194 -10.937 -0.699) 11.734 9.083 ( -3.879 -6.991 -0.149) 7.997 9.192 ( -1.504 -6.746 3.559) 7.774 9.708 ( -1.430 -8.928 -2.652) 9.423 10.255 ( 1.977 -3.716 -3.400) 5.411 10.386 ( 0.932 -3.790 1.559) 4.202 11.647 ( 1.326 15.383 2.329) 15.615 12.182 ( -4.477 22.731 -3.581) 23.442 14.756 ( 0.218 2.820 -2.305) 3.649 14.947 ( 5.649 3.358 2.691) 7.101 16.054 ( 2.023 1.521 0.296) 2.548 16.431 ( 2.913 -0.345 -0.098) 2.935 21.205 ( -0.453 15.012 0.888) 15.045 21.708 ( -0.143 -6.211 -2.768) 6.801======================= Grid point 231 (96/322) =======================q-point: ( 0.31 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.293 ( 13.281 0.000 16.258) 20.993 1.547 ( 24.687 0.000 6.242) 25.464 2.386 ( -12.032 -0.000 2.505) 12.290 2.509 ( -0.243 -0.000 -5.356) 5.362 2.663 ( 24.788 0.000 -3.770) 25.073 2.742 ( -3.204 -0.000 -0.613) 3.262 2.814 ( -5.871 -0.000 -1.640) 6.096 3.313 ( -4.090 -0.000 4.856) 6.349 3.421 ( 1.945 0.000 4.239) 4.664 3.638 ( 29.173 0.000 4.761) 29.558 3.861 ( 2.155 0.000 -1.363) 2.549 3.910 ( -2.523 -0.000 2.088) 3.275 4.152 ( -0.247 -0.000 0.383) 0.456 4.450 ( -2.891 -0.000 0.223) 2.899 4.766 ( -11.646 -0.000 -5.017) 12.681 5.171 ( -9.543 -0.000 2.806) 9.947 5.394 ( -6.396 -0.000 1.435) 6.555 5.527 ( -13.206 -0.000 -3.996) 13.798 6.434 ( -2.563 -0.000 8.915) 9.276 7.300 ( -8.942 -0.000 0.391) 8.951 7.843 ( -1.611 -0.000 6.250) 6.455 8.452 ( 1.483 0.000 0.360) 1.527 8.828 ( 5.624 0.000 0.040) 5.624 9.247 ( -1.203 -0.000 -5.747) 5.872 9.734 ( 0.892 0.000 0.385) 0.972 10.012 ( 10.276 0.000 1.188) 10.345 10.572 ( -11.147 -0.000 0.380) 11.153 10.627 ( 2.558 0.000 -0.259) 2.572 10.632 ( -0.600 -0.000 -0.595) 0.845 11.535 ( -5.961 -0.000 1.226) 6.086 14.972 ( 10.368 0.000 -0.977) 10.414 15.772 ( -1.936 -0.000 -1.638) 2.536 16.890 ( 11.701 0.000 -0.508) 11.712 17.672 ( 4.051 0.000 -24.782) 25.111 19.871 ( -0.144 -0.000 0.079) 0.164 20.111 ( -0.041 -0.000 -0.054) 0.068======================= Grid point 232 (97/322) =======================q-point: ( 0.38 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.471 ( 13.647 -6.957 12.774) 19.945 1.877 ( 20.175 -14.923 4.753) 25.541 2.323 ( -17.412 -3.060 4.290) 18.192 2.540 ( -3.448 -4.916 -4.040) 7.237 2.799 ( -2.393 -7.318 -1.093) 7.777 2.879 ( 1.533 -7.484 -2.492) 8.036 2.887 ( 15.113 -8.594 -5.067) 18.109 3.400 ( -2.263 -4.708 2.836) 5.944 3.508 ( 3.984 -8.850 2.331) 9.981 3.870 ( 24.996 -7.054 7.745) 27.103 3.962 ( 1.388 -5.096 1.139) 5.404 4.126 ( 1.529 -18.705 0.486) 18.774 4.253 ( 0.276 -11.746 2.631) 12.040 4.490 ( -1.907 -8.712 -0.184) 8.920 4.701 ( -11.402 -2.076 -5.989) 13.046 5.105 ( -13.311 -0.367 -2.577) 13.563 5.356 ( -2.597 1.058 4.125) 4.988 5.455 ( -15.374 -2.600 -3.510) 15.983 6.361 ( -2.048 7.617 9.040) 11.997 7.166 ( -7.923 8.239 0.012) 11.431 7.835 ( 1.084 1.073 5.677) 5.878 8.280 ( 1.059 14.175 0.689) 14.231 9.002 ( 3.344 -10.547 -1.077) 11.116 9.178 ( -1.650 5.158 -4.886) 7.294 9.779 ( 2.257 -1.090 -0.014) 2.506 10.055 ( 6.254 1.091 1.757) 6.587 10.351 ( -2.253 8.367 -0.529) 8.681 10.624 ( -0.249 1.538 0.660) 1.692 10.820 ( -2.939 -13.273 -0.517) 13.604 11.427 ( -6.539 6.933 0.189) 9.532 15.005 ( 9.951 2.786 0.415) 10.341 15.689 ( -0.348 6.671 -1.216) 6.790 16.892 ( 10.120 6.287 -0.731) 11.936 17.130 ( 9.325 37.432 -9.800) 39.801 20.031 ( -0.475 -15.246 0.907) 15.280 20.609 ( -6.137 -36.996 -6.399) 38.044======================= Grid point 233 (98/322) =======================q-point: ( 0.46 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.719 ( 12.465 -7.484 9.078) 17.141 2.243 ( 8.809 -10.369 3.300) 14.000 2.339 ( -11.372 -7.561 4.575) 14.402 2.649 ( -3.337 -8.787 -2.334) 9.685 2.970 ( -2.342 -10.961 -0.379) 11.215 3.054 ( 2.822 -8.731 -0.049) 9.176 3.144 ( 9.160 -10.813 -4.430) 14.848 3.442 ( -2.458 -0.798 -0.431) 2.620 3.718 ( 6.830 -8.412 0.895) 10.872 4.033 ( -4.838 -4.500 1.968) 6.894 4.199 ( 15.083 -5.714 2.041) 16.258 4.345 ( 12.877 -5.545 5.713) 15.139 4.583 ( -4.656 1.115 -2.677) 5.485 4.631 ( -3.339 -20.662 2.885) 21.128 4.972 ( -15.285 -16.358 -4.516) 22.838 5.096 ( -2.313 -16.478 -4.043) 17.123 5.380 ( 1.366 -7.287 3.155) 8.057 5.543 ( -16.922 -21.445 -2.419) 27.424 6.147 ( -2.650 13.353 6.947) 15.283 6.925 ( -5.333 11.087 0.046) 12.303 7.814 ( 8.222 7.169 3.208) 11.371 8.034 ( -3.745 6.345 2.601) 7.813 8.943 ( -3.301 12.471 -8.841) 15.639 9.243 ( 2.308 -7.133 2.964) 8.062 9.727 ( 7.451 9.401 0.809) 12.023 9.930 ( -4.127 10.669 -0.018) 11.440 10.393 ( 5.508 -7.317 0.811) 9.194 10.568 ( -2.587 1.575 -0.318) 3.045 11.115 ( -1.284 -17.871 -0.418) 17.922 11.228 ( -6.727 7.348 0.348) 9.968 14.987 ( 7.740 3.944 1.246) 8.776 15.546 ( 2.611 7.482 -0.698) 7.955 16.577 ( 7.846 21.140 -1.729) 22.616 16.803 ( 5.401 7.634 -1.386) 9.454 20.411 ( -0.648 -22.110 1.620) 22.179 21.191 ( -4.497 -25.136 -6.020) 26.235======================= Grid point 234 (99/322) =======================q-point: ( 0.54 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.880 ( 8.663 0.087 7.072) 11.184 2.356 ( -7.093 -4.959 4.535) 9.771 2.527 ( 1.578 -9.039 2.837) 9.604 2.821 ( 0.830 -8.812 0.308) 8.856 3.178 ( -1.256 -10.911 -0.739) 11.008 3.241 ( 2.870 -8.039 1.714) 8.706 3.396 ( 6.696 -9.693 -3.462) 12.279 3.430 ( -0.301 -1.167 -1.571) 1.980 3.903 ( 3.709 -5.280 3.009) 7.120 4.080 ( -6.984 -4.449 1.074) 8.350 4.258 ( 2.735 -0.904 -0.469) 2.918 4.502 ( -3.780 3.186 -2.947) 5.755 4.609 ( 12.559 -4.069 -0.356) 13.206 4.849 ( 4.123 -4.959 5.473) 8.458 4.999 ( -18.813 -9.739 -7.495) 22.471 5.320 ( -1.655 -5.189 1.646) 5.690 5.816 ( -4.759 8.197 3.770) 10.201 5.889 ( 1.892 -28.117 -0.631) 28.187 6.188 ( -5.128 -39.263 -0.924) 39.607 6.713 ( -2.057 7.336 0.417) 7.631 7.629 ( 6.327 12.961 2.043) 14.567 8.053 ( -1.814 -6.098 3.299) 7.166 8.616 ( -2.692 16.740 -7.541) 18.556 9.307 ( 0.100 2.349 3.965) 4.610 9.512 ( 5.684 15.539 2.246) 16.698 9.734 ( -0.901 6.753 -1.737) 7.031 10.379 ( -1.219 5.842 0.937) 6.041 10.585 ( 1.400 5.170 -2.097) 5.752 11.245 ( -3.800 -16.678 0.847) 17.126 11.478 ( -1.016 -18.990 -0.485) 19.024 14.964 ( 5.435 2.337 1.718) 6.161 15.434 ( 2.287 5.531 -0.631) 6.018 16.343 ( 3.826 6.993 -0.233) 7.975 16.688 ( 2.080 5.919 -1.455) 6.440 20.843 ( -0.420 -20.881 1.442) 20.935 21.520 ( -1.129 -11.203 -3.576) 11.814======================= Grid point 235 (100/322) =======================q-point: ( 0.62 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.803 ( 2.912 12.284 6.943) 14.408 2.405 ( -2.104 -1.428 5.642) 6.188 2.673 ( -1.159 -5.239 1.697) 5.627 2.977 ( 0.704 -6.051 1.939) 6.393 3.363 ( -2.959 -8.199 -1.075) 8.782 3.384 ( 5.758 -4.861 -0.370) 7.544 3.484 ( 0.767 -5.547 0.791) 5.655 3.628 ( 7.109 -8.789 -2.332) 11.542 3.926 ( -8.165 0.161 4.696) 9.421 4.177 ( 2.344 -5.505 -1.235) 6.109 4.315 ( 2.764 -2.722 -0.368) 3.897 4.394 ( -4.355 4.558 -2.470) 6.770 4.605 ( 0.655 4.497 -0.914) 4.636 4.957 ( -3.298 -5.531 -3.521) 7.340 5.196 ( 0.820 -13.081 -1.549) 13.198 5.411 ( -2.389 -5.383 1.003) 5.974 5.600 ( -2.462 6.826 1.706) 7.455 6.283 ( 0.526 -4.879 -0.488) 4.932 6.705 ( -0.258 -9.024 -0.143) 9.029 6.919 ( -1.083 -31.865 -0.281) 31.884 7.461 ( 2.561 5.585 2.834) 6.766 8.173 ( -0.691 -1.632 0.812) 1.949 8.290 ( -0.073 9.657 -3.171) 10.164 9.178 ( -3.639 9.728 0.329) 10.392 9.266 ( 5.117 11.737 6.120) 14.192 9.611 ( -0.225 6.147 -1.483) 6.327 10.279 ( 0.418 4.049 -2.390) 4.721 10.408 ( -1.242 7.499 0.897) 7.654 11.703 ( 0.809 -26.208 -0.850) 26.235 11.820 ( -1.323 -16.235 -0.666) 16.302 14.961 ( 3.241 1.183 2.034) 4.005 15.343 ( 0.255 4.547 -0.873) 4.637 16.309 ( 1.542 -0.946 -0.344) 1.841 16.589 ( 0.302 4.844 -1.648) 5.125 21.202 ( -0.044 -15.318 0.751) 15.336 21.629 ( 0.037 -1.405 -1.720) 2.221======================= Grid point 236 (101/322) =======================q-point: (-0.31 -0.69 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.486 ( -0.989 20.266 7.022) 21.471 2.393 ( -0.777 2.350 6.310) 6.778 2.721 ( -0.934 -0.146 0.541) 1.089 3.072 ( -0.129 -3.290 2.984) 4.443 3.456 ( 0.757 -3.470 -1.090) 3.715 3.522 ( 1.009 -5.515 -1.481) 5.799 3.603 ( -1.570 -6.193 2.429) 6.835 3.818 ( 7.654 -6.305 -1.234) 9.993 3.893 ( -6.692 -1.344 2.544) 7.284 4.245 ( -5.503 1.589 -2.141) 6.115 4.296 ( 6.933 1.710 0.115) 7.142 4.378 ( 0.442 -2.432 -0.599) 2.543 4.517 ( -0.750 3.696 -0.469) 3.801 5.029 ( -2.742 -4.284 -4.745) 6.956 5.418 ( 3.874 -7.838 -2.207) 9.017 5.505 ( -3.826 -4.301 0.627) 5.791 5.558 ( 1.465 -3.543 1.125) 3.995 6.255 ( -0.615 3.295 -0.885) 3.467 6.874 ( -0.174 -5.286 -0.266) 5.296 7.188 ( -1.793 1.808 2.038) 3.262 7.614 ( -0.288 -17.193 0.653) 17.208 7.974 ( 5.270 12.028 -1.710) 13.243 8.387 ( -1.751 -9.541 2.783) 10.092 8.932 ( -4.394 12.000 0.302) 12.783 9.116 ( 2.856 7.597 5.362) 9.728 9.482 ( -0.439 5.997 -1.956) 6.323 10.175 ( 0.900 4.466 -3.029) 5.471 10.406 ( -0.468 -5.341 1.445) 5.552 12.065 ( 1.995 -9.416 -1.049) 9.682 12.203 ( -0.400 -22.430 -2.164) 22.538 14.951 ( 0.933 1.580 2.136) 2.816 15.255 ( -0.903 4.029 -1.072) 4.266 16.359 ( -0.560 -3.178 -0.853) 3.338 16.488 ( 0.460 5.506 -1.584) 5.748 21.438 ( 0.153 -8.647 0.031) 8.648 21.602 ( -0.150 3.082 -0.478) 3.123======================= Grid point 237 (102/322) =======================q-point: (-0.23 -0.69 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.102 ( -3.590 15.779 6.778) 17.544 2.357 ( -1.089 0.846 6.030) 6.186 2.681 ( -0.130 3.504 -0.120) 3.509 3.115 ( 0.115 -0.602 3.451) 3.505 3.503 ( -1.347 -1.333 -0.076) 1.897 3.579 ( -0.536 -0.555 -1.298) 1.510 3.716 ( -3.651 -6.007 0.855) 7.081 3.900 ( -2.706 -1.674 0.552) 3.230 3.957 ( 5.658 -3.253 -0.673) 6.561 4.134 ( -2.225 4.469 -1.798) 5.306 4.322 ( 5.843 1.797 1.251) 6.240 4.412 ( 0.289 -0.971 -0.917) 1.366 4.473 ( 0.165 0.038 0.698) 0.718 5.073 ( 0.897 -1.116 -3.920) 4.174 5.504 ( -5.765 -1.163 -1.155) 5.993 5.584 ( 4.383 -5.072 -0.116) 6.705 5.703 ( 3.368 -7.969 0.579) 8.671 6.202 ( -1.566 0.881 -1.126) 2.121 6.925 ( -1.463 -1.546 -0.108) 2.131 7.085 ( -4.973 5.649 2.588) 7.959 7.777 ( 3.683 3.880 -1.331) 5.512 7.924 ( 5.578 -5.013 1.378) 7.625 8.547 ( -1.737 -2.592 2.349) 3.905 8.705 ( -6.355 3.281 1.401) 7.288 9.018 ( 1.353 4.015 4.061) 5.869 9.393 ( 0.434 1.971 -2.689) 3.362 10.137 ( 0.694 0.221 -2.287) 2.400 10.512 ( 0.180 -3.615 0.676) 3.682 12.186 ( 3.105 -1.467 -0.957) 3.565 12.547 ( -0.865 -12.655 -3.552) 13.173 14.914 ( -0.914 2.352 1.445) 2.908 15.172 ( -0.731 3.770 -0.722) 3.907 16.357 ( -2.237 4.946 -1.030) 5.525 16.421 ( 2.504 -0.397 -1.150) 2.784 21.530 ( -0.218 1.184 -0.316) 1.244 21.556 ( 0.083 -1.311 0.204) 1.329======================= Grid point 238 (103/322) =======================q-point: (-0.15 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.963 ( -3.346 -4.086 5.513) 7.635 2.387 ( -1.988 -3.847 4.946) 6.573 2.596 ( 1.334 5.189 -0.130) 5.359 3.110 ( 0.651 1.813 2.795) 3.394 3.481 ( -1.555 2.939 1.153) 3.520 3.557 ( -0.784 1.534 -2.410) 2.962 3.767 ( -4.192 -0.993 0.192) 4.312 3.866 ( -8.825 2.835 -3.242) 9.820 4.019 ( 7.056 -1.075 0.544) 7.159 4.076 ( 2.826 2.621 -1.257) 4.054 4.302 ( 3.890 2.697 1.243) 4.894 4.421 ( -0.064 -0.116 -1.261) 1.268 4.523 ( 4.321 -3.249 3.924) 6.680 5.055 ( 2.525 3.705 -2.779) 5.274 5.464 ( -8.297 0.408 -0.603) 8.329 5.674 ( 7.438 -0.379 0.816) 7.492 5.919 ( -0.117 -12.856 0.181) 12.858 6.202 ( -2.164 -2.030 -1.145) 3.180 6.875 ( -8.854 6.219 2.356) 11.074 6.992 ( 0.576 0.224 -0.026) 0.619 7.742 ( 8.766 2.644 0.245) 9.159 7.995 ( 2.512 1.508 0.114) 2.932 8.419 ( -1.751 6.497 0.146) 6.730 8.795 ( -7.371 -8.596 1.985) 11.496 9.002 ( 0.857 -1.403 3.721) 4.068 9.420 ( 0.782 -4.615 -2.060) 5.114 10.136 ( 0.656 0.075 -2.277) 2.371 10.518 ( 0.291 3.198 0.589) 3.265 12.151 ( 4.073 6.982 -0.647) 8.109 12.656 ( -3.222 -0.064 -4.461) 5.503 14.858 ( -1.452 2.617 -0.135) 2.996 15.099 ( 1.006 3.590 0.447) 3.755 16.235 ( 1.119 6.357 -0.367) 6.465 16.440 ( 1.590 -0.185 -0.916) 1.844 21.519 ( 0.336 -0.988 0.096) 1.048 21.551 ( -0.115 2.411 -0.037) 2.414======================= Grid point 239 (104/322) =======================q-point: (-0.08 0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.171 ( 0.380 -13.748 4.435) 14.450 2.435 ( -0.924 3.087 1.819) 3.700 2.533 ( 1.898 -1.121 2.225) 3.132 3.065 ( 1.386 3.574 1.723) 4.203 3.384 ( -0.449 6.041 1.098) 6.156 3.507 ( -0.843 2.809 -2.734) 4.009 3.685 ( -3.649 7.414 -2.534) 8.643 3.739 ( -6.908 2.925 -2.529) 7.917 3.992 ( 2.959 7.773 -0.403) 8.327 4.096 ( 4.753 -2.655 -0.593) 5.476 4.270 ( 3.750 3.564 1.571) 5.407 4.408 ( -0.369 1.291 -1.375) 1.922 4.651 ( 6.409 -5.333 6.351) 10.481 4.950 ( 1.701 7.507 -1.036) 7.767 5.406 ( -8.431 -0.062 -0.429) 8.442 5.689 ( 4.975 2.804 0.210) 5.714 6.169 ( -8.517 -13.006 0.576) 15.558 6.242 ( -2.986 -2.949 -0.494) 4.226 6.703 ( -1.324 5.220 2.859) 6.097 6.981 ( -0.311 2.288 -1.292) 2.646 7.715 ( -0.544 7.461 -0.481) 7.496 7.903 ( 10.160 8.416 0.378) 13.198 8.383 ( -0.642 -4.319 -0.393) 4.384 8.907 ( -6.385 -7.394 0.476) 9.781 9.083 ( 0.351 -5.141 3.505) 6.232 9.546 ( -0.167 -7.248 -1.250) 7.357 10.162 ( 1.259 -3.551 -2.937) 4.777 10.426 ( 0.367 5.004 1.387) 5.206 11.964 ( 3.564 14.035 0.158) 14.481 12.496 ( -5.827 12.681 -4.526) 14.671 14.800 ( -0.434 2.396 -1.657) 2.945 15.050 ( 4.417 3.102 1.822) 5.697 16.134 ( 2.870 4.800 0.113) 5.594 16.449 ( 2.837 0.150 -0.497) 2.884 21.435 ( -0.105 8.596 -0.109) 8.598 21.593 ( 0.466 -4.983 -0.182) 5.008======================= Grid point 245 (105/322) =======================q-point: ( 0.38 0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.504 ( 15.229 0.000 12.042) 19.414 1.841 ( 22.521 0.000 4.687) 23.003 2.186 ( -21.055 -0.000 4.963) 21.632 2.438 ( -10.468 -0.000 -2.400) 10.740 2.708 ( -0.300 -0.000 -4.362) 4.372 2.772 ( -1.108 -0.000 -0.713) 1.318 2.919 ( 19.203 0.000 -6.144) 20.162 3.283 ( -3.866 -0.000 5.579) 6.788 3.489 ( 7.246 0.000 3.214) 7.927 3.867 ( -2.958 -0.000 4.123) 5.075 3.877 ( 1.431 0.000 -1.685) 2.211 4.009 ( 24.716 0.000 5.003) 25.218 4.157 ( 1.940 0.000 0.255) 1.957 4.419 ( -2.421 -0.000 1.404) 2.799 4.639 ( -6.861 -0.000 -4.511) 8.211 5.008 ( -16.908 -0.000 -4.156) 17.411 5.348 ( -12.402 -0.000 0.022) 12.402 5.368 ( -2.559 -0.000 2.266) 3.418 6.447 ( -0.699 -0.000 10.518) 10.541 7.214 ( -5.830 -0.000 0.629) 5.864 7.846 ( -1.303 -0.000 6.272) 6.406 8.469 ( 1.228 0.000 0.169) 1.239 8.882 ( 3.483 0.000 -0.035) 3.483 9.214 ( -1.234 -0.000 -5.428) 5.566 9.743 ( 0.472 0.000 0.038) 0.474 10.131 ( 9.216 0.000 1.207) 9.295 10.457 ( -8.818 -0.000 0.391) 8.826 10.625 ( -0.273 -0.000 -0.366) 0.457 10.649 ( 1.161 0.000 -0.200) 1.178 11.460 ( -6.107 -0.000 -1.358) 6.256 15.098 ( 10.066 0.000 2.188) 10.301 15.740 ( -2.526 -0.000 -1.209) 2.801 17.019 ( 10.135 0.000 -1.652) 10.268 17.629 ( 1.013 0.000 -16.800) 16.831 19.870 ( -0.107 -0.000 0.081) 0.134 20.110 ( -0.030 -0.000 -0.064) 0.071======================= Grid point 246 (106/322) =======================q-point: ( 0.46 0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.672 ( 14.520 -5.716 9.652) 18.348 2.093 ( -3.825 -7.164 4.212) 9.148 2.141 ( 2.443 -9.153 4.484) 10.481 2.431 ( -12.691 -7.289 -2.062) 14.779 2.776 ( -0.517 -6.937 -2.094) 7.264 2.875 ( 1.210 -9.070 -0.648) 9.173 3.054 ( 12.452 -4.668 -3.793) 13.828 3.378 ( -2.573 -5.864 3.100) 7.114 3.593 ( 8.875 -7.532 0.208) 11.642 3.901 ( -5.760 -6.146 3.881) 9.274 4.110 ( 0.999 -14.340 -0.655) 14.390 4.218 ( 10.766 -10.237 3.680) 15.306 4.297 ( 9.058 -12.034 3.185) 15.395 4.474 ( -1.387 -11.226 -0.012) 11.312 4.591 ( -3.174 1.081 -4.436) 5.561 4.909 ( -14.778 -1.166 -4.443) 15.476 5.280 ( -11.399 -1.386 -3.659) 12.052 5.357 ( -0.634 0.667 5.724) 5.798 6.374 ( -1.002 8.636 10.185) 13.391 7.098 ( -3.788 8.309 0.728) 9.160 7.861 ( 0.118 -1.299 5.867) 6.010 8.289 ( 0.320 15.166 0.030) 15.169 9.019 ( 0.680 -6.659 -3.232) 7.433 9.154 ( 0.051 2.408 -3.215) 4.017 9.804 ( 1.830 -3.577 0.831) 4.103 10.115 ( 2.866 7.594 1.803) 8.315 10.340 ( 0.597 1.905 -0.806) 2.153 10.605 ( -3.059 2.368 0.698) 3.931 10.803 ( -0.018 -12.815 -0.269) 12.817 11.354 ( -4.971 6.926 -2.035) 8.765 15.117 ( 7.612 3.689 3.031) 8.986 15.674 ( -1.134 4.860 -0.964) 5.083 16.988 ( 6.066 7.251 -2.335) 9.738 17.180 ( 5.163 33.345 -7.409) 34.546 20.029 ( -0.358 -15.199 0.805) 15.225 20.547 ( -1.850 -34.275 -3.791) 34.534======================= Grid point 247 (107/322) =======================q-point: ( 0.54 0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.876 ( 7.684 -5.429 7.403) 11.972 2.161 ( -11.588 -9.107 5.043) 15.577 2.379 ( 3.247 -7.371 2.220) 8.355 2.609 ( -0.604 -13.427 -0.510) 13.450 2.949 ( -0.751 -10.755 -1.024) 10.830 3.076 ( 1.126 -9.835 2.090) 10.117 3.240 ( 7.769 -8.853 -2.397) 12.020 3.423 ( -0.298 -0.469 -0.010) 0.556 3.810 ( 8.112 -8.149 -0.017) 11.498 3.971 ( -6.953 -3.027 3.842) 8.501 4.241 ( -1.697 -2.058 -0.564) 2.727 4.534 ( -0.248 0.786 -3.419) 3.517 4.566 ( 8.944 -12.083 0.931) 15.062 4.598 ( -7.174 -14.334 -1.162) 16.071 4.788 ( -4.574 -8.613 0.150) 9.753 5.111 ( 5.359 -23.646 0.040) 24.246 5.360 ( -11.862 -21.497 -3.131) 24.751 5.413 ( 2.562 -10.627 3.372) 11.440 6.144 ( -1.648 14.290 6.857) 15.935 6.892 ( -0.735 10.550 1.305) 10.656 7.912 ( 6.151 2.166 3.710) 7.503 7.976 ( -6.692 10.138 1.074) 12.195 8.888 ( -1.194 12.478 -9.416) 15.678 9.277 ( 1.767 -6.662 3.769) 7.855 9.812 ( 6.587 6.954 0.645) 9.600 9.884 ( -3.959 12.518 1.229) 13.186 10.460 ( 5.293 -4.866 0.698) 7.224 10.522 ( -5.026 -1.204 -0.309) 5.177 11.108 ( -0.091 -17.357 -0.085) 17.357 11.162 ( -3.744 7.186 -1.570) 8.254 15.068 ( 4.374 4.731 3.173) 7.182 15.557 ( 0.106 6.168 -1.002) 6.250 16.635 ( 3.043 21.788 -1.939) 22.085 16.841 ( 1.777 8.596 -2.146) 9.036 20.410 ( -0.495 -22.143 1.515) 22.200 21.151 ( 0.350 -25.696 -4.269) 26.050======================= Grid point 248 (108/322) =======================q-point: (-0.38 -0.62 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.950 ( -2.309 1.047 6.799) 7.257 2.313 ( -0.420 -7.539 5.627) 9.417 2.531 ( -2.432 -8.012 1.619) 8.528 2.843 ( 2.327 -8.876 1.295) 9.266 3.158 ( -0.982 -10.643 -1.180) 10.753 3.267 ( 0.405 -8.598 2.801) 9.051 3.429 ( 2.320 -2.084 -1.531) 3.474 3.476 ( 5.495 -9.413 -1.262) 10.973 3.927 ( -2.497 1.782 5.066) 5.922 4.031 ( -0.109 -8.865 -0.325) 8.872 4.273 ( -0.430 -2.215 -1.103) 2.512 4.476 ( 2.412 4.121 -2.350) 5.322 4.678 ( 1.111 0.158 -3.510) 3.685 4.729 ( -21.287 -9.050 -6.463) 24.017 5.007 ( 16.157 -9.941 4.613) 19.523 5.304 ( -1.975 -4.500 0.942) 5.004 5.785 ( -2.073 8.906 3.279) 9.714 5.903 ( 0.718 -30.183 -0.860) 30.204 6.168 ( 1.958 -38.251 0.409) 38.304 6.707 ( 0.783 7.496 0.851) 7.585 7.658 ( -2.523 12.879 1.123) 13.171 8.045 ( -0.888 -6.923 3.267) 7.706 8.587 ( 1.529 15.997 -7.451) 17.713 9.319 ( -0.126 4.492 4.658) 6.473 9.562 ( 1.170 14.920 3.010) 15.265 9.729 ( 1.183 6.304 -1.844) 6.674 10.363 ( -1.653 5.731 0.328) 5.973 10.594 ( 1.270 6.741 -1.696) 7.067 11.215 ( -1.600 -18.998 -0.040) 19.065 11.475 ( 0.739 -18.649 -0.080) 18.664 15.015 ( 1.744 2.714 3.209) 4.550 15.437 ( -1.110 5.551 -1.372) 5.825 16.363 ( -0.391 7.346 -0.613) 7.382 16.694 ( -0.102 6.275 -1.842) 6.540 20.843 ( -0.306 -20.970 1.442) 21.021 21.512 ( 1.605 -11.332 -3.036) 11.841======================= Grid point 249 (109/322) =======================q-point: (-0.31 -0.62 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.815 ( -4.768 11.910 7.325) 14.773 2.419 ( 1.278 -1.401 6.360) 6.637 2.658 ( -2.074 -5.583 0.975) 6.035 2.988 ( -0.046 -5.474 2.292) 5.934 3.332 ( -1.293 -7.631 -1.710) 7.926 3.427 ( 1.252 -7.028 1.166) 7.233 3.492 ( 0.792 -3.474 0.822) 3.656 3.688 ( 2.087 -9.241 -1.293) 9.562 3.879 ( -0.786 1.159 4.000) 4.238 4.190 ( 1.471 -5.537 -0.922) 5.802 4.297 ( -4.192 -1.420 -1.013) 4.540 4.415 ( 6.135 3.406 -0.940) 7.079 4.602 ( -0.481 5.165 -1.062) 5.295 4.836 ( -10.153 -11.274 -7.280) 16.828 5.289 ( 10.881 -8.886 0.202) 14.050 5.390 ( -1.472 -5.447 0.326) 5.652 5.589 ( 0.452 6.488 1.723) 6.728 6.282 ( -0.337 -4.226 -0.560) 4.276 6.706 ( 0.524 -8.869 -0.172) 8.886 6.922 ( 1.662 -30.767 -0.145) 30.812 7.448 ( -5.416 4.636 2.465) 7.543 8.183 ( 0.408 -5.269 2.136) 5.700 8.297 ( 3.673 12.008 -4.040) 13.191 9.133 ( -4.114 11.666 1.734) 12.491 9.332 ( 2.631 10.897 5.864) 12.651 9.603 ( -0.082 6.606 -2.021) 6.908 10.278 ( 0.749 3.355 -2.566) 4.289 10.401 ( -0.266 7.734 0.868) 7.787 11.702 ( -0.669 -26.905 -0.880) 26.927 11.827 ( 2.913 -15.870 -0.423) 16.141 14.986 ( -0.273 1.477 3.227) 3.559 15.324 ( -2.742 4.454 -1.791) 5.529 16.301 ( -2.498 -0.885 -0.642) 2.727 16.585 ( -0.078 4.695 -1.785) 5.023 21.204 ( -0.029 -15.353 0.842) 15.376 21.629 ( 0.828 -1.089 -1.753) 2.223======================= Grid point 250 (110/322) =======================q-point: (-0.23 -0.62 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.470 ( -5.304 20.117 7.380) 22.074 2.409 ( -0.071 2.950 6.562) 7.195 2.713 ( -0.696 -0.616 0.214) 0.953 3.079 ( -0.611 -3.617 2.949) 4.707 3.432 ( -2.261 -3.969 -0.613) 4.609 3.549 ( 2.562 -2.853 -0.005) 3.834 3.574 ( -3.525 -6.421 1.316) 7.443 3.825 ( -4.004 -4.510 1.143) 6.138 3.922 ( 6.730 -3.553 -0.047) 7.611 4.188 ( -2.542 3.378 -1.191) 4.392 4.342 ( 1.217 -3.656 -2.343) 4.510 4.420 ( 5.713 0.472 1.983) 6.066 4.502 ( -0.789 3.989 -0.869) 4.158 4.987 ( -1.114 -7.654 -5.599) 9.549 5.424 ( -6.159 -2.835 -2.759) 7.319 5.488 ( 5.931 -4.972 0.158) 7.741 5.620 ( 7.108 -5.300 1.599) 9.010 6.239 ( -1.416 3.685 -0.967) 4.064 6.870 ( -0.546 -4.730 -0.211) 4.766 7.135 ( -7.350 2.546 1.785) 7.980 7.610 ( -0.217 -16.580 0.515) 16.589 8.074 ( 10.581 9.984 -1.089) 14.588 8.362 ( -3.865 -9.706 2.451) 10.730 8.873 ( -5.153 12.073 1.350) 13.196 9.162 ( 1.633 8.575 5.289) 10.207 9.474 ( 0.334 5.821 -2.537) 6.359 10.175 ( 0.676 4.415 -3.057) 5.413 10.412 ( 0.551 -5.390 1.546) 5.634 12.082 ( 0.612 -11.188 -0.945) 11.245 12.206 ( 2.904 -20.386 -2.111) 20.699 14.953 ( -1.680 1.933 2.872) 3.848 15.228 ( -2.993 3.321 -1.816) 4.826 16.326 ( -4.022 -2.798 -0.846) 4.972 16.498 ( 1.513 4.274 -1.707) 4.845 21.440 ( 0.094 -8.563 0.096) 8.564 21.598 ( -0.227 3.171 -0.583) 3.233======================= Grid point 251 (111/322) =======================q-point: (-0.15 -0.62 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.071 ( -5.069 15.584 7.199) 17.900 2.364 ( -0.873 1.419 6.072) 6.296 2.684 ( 0.575 3.039 -0.112) 3.095 3.129 ( 0.201 -1.005 2.749) 2.934 3.468 ( -3.864 -1.432 1.326) 4.329 3.584 ( 1.018 -0.026 -0.051) 1.020 3.674 ( -3.010 -4.893 -0.700) 5.787 3.850 ( -4.100 -0.445 0.278) 4.134 4.029 ( 5.014 -2.582 -0.791) 5.695 4.115 ( -0.462 1.946 -1.069) 2.267 4.387 ( 3.464 1.168 -2.854) 4.638 4.414 ( 1.306 1.647 0.341) 2.130 4.494 ( 2.918 -2.613 3.380) 5.174 5.084 ( 2.706 -2.208 -4.034) 5.336 5.411 ( -7.954 -0.924 -1.619) 8.169 5.645 ( 5.764 -6.593 -0.508) 8.772 5.763 ( 5.613 -4.818 0.671) 7.427 6.176 ( -2.139 1.159 -0.970) 2.619 6.887 ( -5.832 0.815 0.832) 5.947 7.028 ( -4.001 3.192 1.425) 5.313 7.802 ( 0.966 -2.585 -1.129) 2.982 8.027 ( 10.006 1.116 0.962) 10.114 8.537 ( -1.875 -6.337 2.787) 7.172 8.623 ( -6.967 7.208 1.555) 10.144 9.043 ( 0.526 4.437 4.136) 6.089 9.392 ( 0.755 1.809 -2.835) 3.447 10.137 ( 0.547 0.196 -2.304) 2.376 10.519 ( 0.645 -3.441 0.771) 3.585 12.225 ( 3.504 -2.242 -1.194) 4.328 12.524 ( -0.672 -10.888 -3.368) 11.417 14.901 ( -1.967 2.538 1.639) 3.605 15.155 ( -1.629 2.425 -0.964) 3.076 16.324 ( -2.632 1.577 -0.683) 3.143 16.448 ( 2.421 1.226 -1.465) 3.084 21.526 ( -0.298 0.971 -0.338) 1.070 21.557 ( 0.022 -1.335 0.215) 1.352======================= Grid point 252 (112/322) =======================q-point: (-0.08 0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.950 ( -1.524 -5.625 5.983) 8.352 2.379 ( -2.067 -2.674 5.105) 6.123 2.623 ( 3.124 3.890 0.021) 4.989 3.130 ( 1.360 1.588 1.941) 2.853 3.443 ( -5.233 1.561 2.003) 5.817 3.567 ( 2.614 2.589 -0.756) 3.756 3.712 ( -4.788 -1.158 -1.741) 5.224 3.785 ( -3.231 4.579 -1.197) 5.730 4.076 ( 2.839 -0.877 -0.655) 3.043 4.099 ( 1.790 1.411 -0.275) 2.296 4.350 ( 3.769 2.826 -0.418) 4.729 4.413 ( -0.187 -0.194 -1.820) 1.840 4.592 ( 3.693 -4.345 4.500) 7.264 5.086 ( 3.814 3.529 -2.318) 5.689 5.367 ( -6.657 0.615 -0.921) 6.748 5.751 ( 4.652 -0.164 0.477) 4.679 5.909 ( -2.057 -9.099 0.004) 9.329 6.170 ( -2.319 -1.969 -0.722) 3.126 6.787 ( -6.349 4.346 2.298) 8.030 6.995 ( 0.213 0.168 -0.388) 0.473 7.810 ( 2.046 1.955 -0.479) 2.870 8.065 ( 8.737 1.781 0.365) 8.924 8.396 ( -1.908 7.294 0.381) 7.549 8.715 ( -7.033 -8.695 2.617) 11.486 9.021 ( 0.282 -1.362 3.423) 3.695 9.421 ( 0.432 -4.626 -1.816) 4.988 10.136 ( 0.573 -0.036 -2.353) 2.422 10.525 ( 0.400 3.276 0.685) 3.371 12.200 ( 4.321 6.911 -1.212) 8.240 12.597 ( -4.270 1.579 -4.045) 6.090 14.843 ( -0.817 2.445 -0.004) 2.578 15.114 ( 1.358 1.568 0.376) 2.108 16.250 ( 1.686 4.750 -0.284) 5.048 16.458 ( 1.840 -0.583 -1.048) 2.196 21.524 ( 0.378 -1.366 0.126) 1.423 21.550 ( -0.044 2.494 -0.064) 2.495======================= Grid point 259 (113/322) =======================q-point: ( 0.46 0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.716 ( 14.092 0.000 8.900) 16.667 1.948 ( -20.880 -0.000 5.543) 21.603 2.087 ( 15.123 0.000 2.706) 15.363 2.273 ( -13.589 -0.000 -0.804) 13.613 2.703 ( 0.677 0.000 -2.735) 2.818 2.777 ( 2.581 0.000 -2.834) 3.833 3.078 ( 10.783 0.000 -1.312) 10.862 3.260 ( -3.128 -0.000 6.122) 6.875 3.590 ( 8.007 0.000 -0.117) 8.008 3.815 ( -7.813 -0.000 3.963) 8.761 3.883 ( 0.549 0.000 -1.995) 2.069 4.156 ( 2.227 0.000 3.960) 4.543 4.235 ( 2.315 0.000 -3.242) 3.984 4.392 ( -4.906 -0.000 0.775) 4.966 4.596 ( 1.445 0.000 -4.160) 4.404 4.853 ( 0.023 0.000 0.081) 0.085 5.214 ( -7.879 -0.000 -3.306) 8.545 5.374 ( -0.281 -0.000 5.449) 5.456 6.478 ( -0.208 -0.000 12.711) 12.713 7.171 ( -1.925 -0.000 0.858) 2.108 7.850 ( -1.306 -0.000 6.266) 6.400 8.481 ( 0.740 0.000 0.296) 0.797 8.908 ( 1.101 0.000 -0.125) 1.108 9.188 ( -0.148 -0.000 -5.929) 5.931 9.744 ( -0.108 -0.000 -0.269) 0.290 10.227 ( 6.088 0.000 1.211) 6.207 10.370 ( -5.855 -0.000 0.369) 5.866 10.624 ( 0.154 0.000 -0.152) 0.217 10.655 ( 0.203 0.000 -0.173) 0.266 11.397 ( -3.239 -0.000 -3.117) 4.495 15.202 ( 5.241 0.000 4.582) 6.962 15.715 ( -0.827 -0.000 -0.729) 1.102 17.090 ( 2.593 0.000 -4.173) 4.913 17.622 ( 5.970 0.000 -10.311) 11.914 19.869 ( -0.050 -0.000 0.084) 0.098 20.109 ( -0.008 -0.000 -0.073) 0.074======================= Grid point 260 (114/322) =======================q-point: (-0.46 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.797 ( -9.715 -4.111 6.875) 12.592 1.958 ( 3.225 -6.869 6.081) 9.725 2.243 ( -17.142 -8.041 -1.035) 18.962 2.340 ( 15.480 -11.365 2.277) 19.338 2.770 ( 0.437 -6.643 -1.328) 6.789 2.897 ( 2.617 -8.967 -0.911) 9.386 3.159 ( 6.709 -3.256 0.421) 7.469 3.366 ( -1.049 -6.690 3.242) 7.507 3.694 ( 7.873 -7.302 -2.140) 10.949 3.823 ( -10.993 -7.168 5.724) 14.318 4.089 ( -2.519 -12.458 -3.100) 13.082 4.257 ( -0.907 -10.004 3.977) 10.804 4.301 ( -17.484 -10.029 -4.810) 20.722 4.443 ( 0.819 -13.700 -2.331) 13.921 4.596 ( 5.585 0.729 -2.139) 6.025 4.909 ( 15.564 -1.409 3.331) 15.979 5.176 ( -4.609 -0.957 -3.248) 5.719 5.371 ( 0.662 0.558 4.162) 4.251 6.399 ( -0.639 9.756 11.926) 15.421 7.085 ( 0.926 7.769 1.472) 7.961 7.870 ( -1.772 -1.857 5.737) 6.285 8.289 ( -0.215 16.027 -0.267) 16.031 9.003 ( -0.724 -2.143 -5.303) 5.765 9.156 ( 1.180 -1.852 -1.946) 2.934 9.828 ( 1.688 -5.676 1.660) 6.150 10.133 ( -0.648 10.934 1.978) 11.130 10.349 ( 0.921 -1.992 -1.015) 2.418 10.573 ( -1.823 3.471 0.297) 3.932 10.809 ( 0.885 -12.408 0.178) 12.441 11.306 ( -1.589 6.976 -3.530) 7.978 15.187 ( 1.895 4.098 4.908) 6.668 15.665 ( 0.197 4.614 -0.800) 4.687 17.002 ( -1.729 7.768 -4.250) 9.022 17.223 ( 5.043 33.016 -5.017) 33.774 20.028 ( -0.221 -15.165 0.766) 15.186 20.541 ( 2.532 -33.937 -2.579) 34.129======================= Grid point 261 (115/322) =======================q-point: (-0.38 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.840 ( -15.859 -7.010 6.146) 18.396 2.178 ( 10.154 -8.642 5.719) 14.508 2.330 ( -10.439 -9.470 0.239) 14.097 2.663 ( 7.832 -12.121 1.427) 14.501 2.944 ( 0.369 -10.303 -0.829) 10.343 3.096 ( 0.991 -9.416 2.590) 9.815 3.295 ( 2.234 -7.884 -0.458) 8.207 3.442 ( 3.301 -1.398 0.747) 3.662 3.849 ( -6.006 -7.281 2.358) 9.729 3.938 ( 2.203 -3.944 2.637) 5.231 4.209 ( -1.818 -4.387 -2.855) 5.541 4.329 ( -26.302 -10.614 -7.710) 29.392 4.552 ( 0.897 -1.683 -2.067) 2.812 4.597 ( 2.364 -11.719 1.460) 12.044 4.924 ( 15.428 -13.312 2.144) 20.490 5.199 ( 5.518 -9.275 2.765) 11.140 5.252 ( -3.625 -25.584 -3.116) 26.027 5.477 ( 7.951 -15.529 1.416) 17.503 6.154 ( -0.401 14.992 8.011) 17.003 6.915 ( 3.644 10.692 2.064) 11.483 7.876 ( -9.590 5.570 1.781) 11.233 7.989 ( 3.864 7.238 2.008) 8.447 8.857 ( 0.972 11.498 -9.769) 15.118 9.306 ( 0.877 -6.918 3.952) 8.015 9.838 ( -3.588 10.851 2.677) 11.738 9.892 ( 5.684 9.181 0.533) 10.811 10.449 ( -6.393 0.518 -0.056) 6.414 10.525 ( 5.000 -7.466 0.452) 8.997 11.101 ( -0.799 -7.842 -1.792) 8.084 11.143 ( 1.125 -1.958 -1.079) 2.503 15.102 ( -0.607 4.968 4.647) 6.829 15.546 ( -1.477 6.611 -1.590) 6.958 16.634 ( -2.265 22.184 -1.968) 22.386 16.830 ( -2.276 8.528 -2.621) 9.207 20.409 ( -0.342 -22.173 1.496) 22.226 21.173 ( 5.554 -25.138 -3.526) 25.985======================= Grid point 262 (116/322) =======================q-point: (-0.31 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.869 ( -13.310 -2.263 6.651) 15.051 2.382 ( 6.746 -5.216 5.863) 10.349 2.479 ( -6.492 -10.141 0.646) 12.059 2.880 ( 3.045 -6.590 2.421) 7.653 3.152 ( 0.493 -10.296 -1.431) 10.406 3.271 ( -1.145 -8.055 2.824) 8.613 3.462 ( 3.294 -4.962 -1.224) 6.080 3.509 ( 0.956 -6.182 0.954) 6.328 3.891 ( -4.957 -0.917 4.764) 6.936 4.066 ( 4.266 -7.121 -0.655) 8.327 4.256 ( -0.676 -1.370 -0.242) 1.546 4.421 ( -21.987 -12.224 -7.545) 26.263 4.542 ( 5.060 -0.577 -1.939) 5.449 4.696 ( 2.794 2.256 -1.763) 4.001 5.199 ( 12.555 -7.515 0.588) 14.645 5.283 ( -0.281 -4.920 0.452) 4.949 5.795 ( 2.167 6.160 3.208) 7.275 5.907 ( 0.633 -26.218 0.634) 26.233 6.227 ( 7.278 -37.241 0.677) 37.952 6.734 ( 3.256 8.935 0.680) 9.534 7.588 ( -8.951 12.029 0.945) 15.024 8.046 ( -1.172 -5.826 2.833) 6.584 8.598 ( 3.940 14.230 -7.865) 16.729 9.336 ( 0.409 6.841 5.730) 8.933 9.553 ( -4.123 11.612 2.700) 12.614 9.754 ( 3.747 8.904 -1.058) 9.718 10.345 ( -1.384 4.398 -0.352) 4.624 10.604 ( 1.317 8.134 -1.211) 8.329 11.207 ( 0.259 -19.918 -0.611) 19.929 11.494 ( 2.340 -18.999 0.140) 19.144 15.023 ( -2.310 2.713 4.350) 5.623 15.398 ( -4.838 5.861 -2.421) 7.976 16.332 ( -4.275 7.153 -0.647) 8.358 16.675 ( -2.133 5.625 -1.938) 6.320 20.844 ( -0.223 -21.022 1.504) 21.077 21.538 ( 4.348 -9.928 -2.959) 11.235======================= Grid point 263 (117/322) =======================q-point: (-0.23 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.747 ( -10.099 9.468 7.473) 15.731 2.462 ( 1.928 0.421 6.237) 6.542 2.626 ( -3.909 -7.103 0.459) 8.121 2.994 ( 0.243 -4.456 2.610) 5.169 3.328 ( 1.397 -6.693 -1.048) 6.917 3.414 ( -4.012 -7.746 1.700) 8.888 3.523 ( 3.864 -1.428 0.797) 4.196 3.677 ( -2.106 -8.655 0.188) 8.909 3.900 ( 0.637 -1.408 2.539) 2.972 4.227 ( 3.907 -6.188 -1.375) 7.447 4.250 ( -1.910 1.490 0.130) 2.426 4.428 ( -5.212 -1.013 -2.033) 5.686 4.619 ( 4.975 5.644 -0.845) 7.571 4.732 ( -3.418 -14.073 -5.812) 15.605 5.320 ( -3.649 -4.119 -4.163) 6.900 5.454 ( 10.748 -5.983 1.642) 12.410 5.638 ( 6.835 5.351 2.628) 9.070 6.276 ( -0.249 -3.616 -0.300) 3.637 6.714 ( 0.868 -7.899 -0.303) 7.953 6.952 ( 3.232 -25.671 -0.214) 25.875 7.374 ( -7.758 1.356 2.675) 8.317 8.168 ( -4.096 -7.484 2.115) 8.790 8.350 ( 6.571 12.523 -5.379) 15.130 9.103 ( -2.233 13.651 3.936) 14.382 9.357 ( -1.371 9.182 5.387) 10.734 9.604 ( 1.551 7.487 -2.188) 7.953 10.280 ( 0.896 3.440 -3.202) 4.784 10.405 ( 0.263 7.204 1.374) 7.338 11.684 ( -1.683 -24.816 -1.018) 24.894 11.881 ( 6.273 -17.957 -0.280) 19.023 14.977 ( -3.062 1.381 4.123) 5.318 15.265 ( -6.259 3.736 -2.917) 7.851 16.255 ( -4.640 -0.859 -0.389) 4.734 16.572 ( -1.272 3.709 -1.866) 4.343 21.206 ( -0.056 -15.342 0.942) 15.371 21.637 ( 1.593 0.073 -1.890) 2.473======================= Grid point 264 (118/322) =======================q-point: (-0.15 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.416 ( -7.609 18.852 7.768) 21.763 2.429 ( 0.011 3.665 6.218) 7.218 2.697 ( -2.740 -1.974 0.344) 3.395 3.079 ( -0.080 -3.758 2.020) 4.267 3.416 ( -1.659 -2.462 2.396) 3.815 3.531 ( -2.518 -5.737 -0.423) 6.279 3.588 ( 3.216 -2.802 0.163) 4.269 3.790 ( -2.501 -4.101 1.724) 5.103 3.973 ( 2.537 -4.477 -0.426) 5.163 4.172 ( -0.768 4.208 -0.597) 4.319 4.342 ( 0.364 -3.909 -2.964) 4.919 4.454 ( -0.554 -2.752 1.625) 3.243 4.529 ( 4.792 5.416 -1.245) 7.338 4.966 ( 0.000 -10.306 -4.776) 11.359 5.335 ( -6.203 -1.798 -2.096) 6.790 5.590 ( 10.985 -2.965 -0.769) 11.404 5.707 ( 6.661 -4.692 0.691) 8.177 6.222 ( -0.885 4.246 -0.456) 4.362 6.852 ( -3.095 -2.860 0.319) 4.226 7.055 ( -6.105 2.339 1.745) 6.766 7.618 ( 1.362 -15.809 0.326) 15.871 8.176 ( 6.887 7.858 -3.286) 10.953 8.311 ( -6.102 -9.804 2.441) 11.803 8.843 ( -0.623 12.549 4.084) 13.211 9.181 ( -1.054 8.401 4.948) 9.807 9.475 ( 1.386 5.957 -2.913) 6.774 10.171 ( 0.366 4.236 -3.182) 5.311 10.426 ( 0.837 -5.210 1.730) 5.554 12.063 ( -2.747 -14.926 -2.071) 15.318 12.265 ( 7.583 -15.863 -1.154) 17.620 14.935 ( -2.893 1.853 3.347) 4.796 15.174 ( -5.082 1.737 -2.519) 5.933 16.273 ( -4.509 -2.964 -0.435) 5.413 16.503 ( 0.109 2.779 -1.868) 3.350 21.441 ( 0.022 -8.457 0.129) 8.458 21.593 ( -0.230 3.459 -0.632) 3.524======================= Grid point 265 (119/322) =======================q-point: (-0.08 -0.54 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.036 ( -4.641 14.064 7.950) 16.809 2.373 ( -0.831 2.057 5.934) 6.335 2.688 ( -0.292 1.363 0.297) 1.425 3.138 ( 0.628 -1.593 1.313) 2.157 3.426 ( -4.749 -0.215 3.328) 5.803 3.597 ( 1.377 -1.332 0.086) 1.918 3.654 ( 0.556 -2.480 -1.562) 2.983 3.821 ( -1.281 0.207 1.496) 1.981 4.065 ( 2.056 -2.509 -1.037) 3.406 4.110 ( 0.019 0.902 -0.389) 0.983 4.386 ( -0.505 -1.517 -2.901) 3.312 4.436 ( 1.748 3.602 -0.914) 4.106 4.538 ( 0.868 -2.973 1.979) 3.675 5.101 ( 1.985 -3.508 -2.928) 4.982 5.335 ( -3.437 -1.133 -1.246) 3.827 5.715 ( 6.161 -4.068 -0.522) 7.401 5.816 ( 2.975 -3.023 -0.626) 4.288 6.156 ( -0.540 1.657 -0.123) 1.747 6.808 ( -6.966 2.050 1.869) 7.498 7.008 ( -0.516 1.047 0.433) 1.245 7.803 ( 0.063 -3.538 -0.870) 3.644 8.117 ( 4.054 1.398 -2.380) 4.905 8.485 ( -7.320 -10.531 3.673) 13.341 8.615 ( 3.923 12.042 4.010) 13.284 9.053 ( -1.047 4.208 3.884) 5.822 9.393 ( 0.997 1.970 -2.908) 3.651 10.136 ( 0.443 0.114 -2.375) 2.418 10.529 ( 0.455 -3.213 0.881) 3.363 12.242 ( -0.189 -4.601 -2.617) 5.297 12.526 ( 3.093 -6.888 -2.226) 7.872 14.884 ( -1.694 2.192 1.756) 3.280 15.130 ( -2.031 0.317 -1.096) 2.330 16.294 ( -2.246 -0.792 -0.461) 2.425 16.464 ( 1.066 1.031 -1.595) 2.178 21.521 ( -0.301 0.721 -0.327) 0.847 21.558 ( -0.049 -1.428 0.215) 1.445======================= Grid point 273 (120/322) =======================q-point: (-0.46 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.647 ( -23.995 -0.000 6.634) 24.895 1.977 ( 16.681 0.000 6.532) 17.914 1.994 ( -21.329 -0.000 -0.854) 21.346 2.338 ( 14.078 0.000 1.458) 14.153 2.706 ( 1.156 0.000 -0.768) 1.388 2.807 ( 4.121 0.000 -3.805) 5.609 3.177 ( 6.144 0.000 2.609) 6.676 3.250 ( -1.795 -0.000 6.303) 6.554 3.630 ( -8.842 -0.000 -0.326) 8.848 3.703 ( -8.485 -0.000 1.501) 8.617 3.877 ( -0.345 -0.000 -2.238) 2.264 4.070 ( -18.251 -0.000 -5.235) 18.987 4.193 ( -0.368 -0.000 2.222) 2.252 4.349 ( 0.669 0.000 -1.267) 1.432 4.644 ( 8.651 0.000 -0.775) 8.686 5.013 ( 18.110 0.000 1.004) 18.137 5.145 ( -2.416 -0.000 -1.012) 2.620 5.398 ( 2.822 0.000 3.333) 4.367 6.520 ( -0.147 -0.000 15.430) 15.430 7.176 ( 2.203 0.000 1.029) 2.432 7.855 ( -1.134 -0.000 6.353) 6.453 8.487 ( -0.066 -0.000 0.670) 0.674 8.907 ( -1.303 -0.000 -0.191) 1.317 9.175 ( 1.404 0.000 -7.279) 7.413 9.738 ( -0.717 -0.000 -0.487) 0.867 10.246 ( -4.328 -0.000 3.379) 5.491 10.357 ( 4.325 0.000 -1.129) 4.470 10.628 ( 0.576 0.000 -0.005) 0.576 10.656 ( 0.188 0.000 0.055) 0.195 11.367 ( -0.001 -0.000 -4.433) 4.433 15.239 ( -1.595 -0.000 5.980) 6.189 15.721 ( 2.035 0.000 -0.320) 2.060 17.055 ( -5.247 -0.000 -5.023) 7.264 17.702 ( 11.614 0.000 -8.590) 14.445 19.869 ( 0.013 0.000 0.085) 0.086 20.109 ( 0.019 0.000 -0.080) 0.082======================= Grid point 274 (121/322) =======================q-point: (-0.38 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.582 ( -23.352 -6.746 6.599) 25.187 2.012 ( -20.232 -12.345 -0.623) 23.709 2.135 ( 15.626 -4.785 5.733) 17.318 2.508 ( 11.601 -8.817 0.717) 14.589 2.781 ( 2.060 -6.365 -0.037) 6.690 2.926 ( 2.634 -8.527 -0.626) 8.947 3.215 ( 1.668 -1.508 2.257) 3.186 3.372 ( -0.140 -7.838 2.869) 8.348 3.631 ( -25.825 -10.921 3.252) 28.228 3.741 ( 0.439 -8.152 -3.520) 8.890 4.023 ( -8.243 -6.644 -4.274) 11.418 4.079 ( -7.907 -11.347 -1.604) 13.923 4.256 ( -0.708 -9.507 2.894) 9.962 4.460 ( 2.197 -12.328 -1.225) 12.582 4.713 ( 13.549 -2.802 1.320) 13.898 5.091 ( 7.720 -0.699 -5.718) 9.632 5.166 ( 5.449 -1.307 4.068) 6.925 5.421 ( 7.962 0.084 1.872) 8.180 6.434 ( -0.213 10.618 14.212) 17.741 7.127 ( 5.205 6.832 1.961) 8.810 7.859 ( -2.942 0.029 5.550) 6.282 8.281 ( -1.025 16.222 -0.247) 16.256 8.976 ( -0.835 -0.876 -5.806) 5.931 9.160 ( 0.437 -3.523 -2.744) 4.486 9.857 ( 2.406 -8.282 2.497) 8.979 10.115 ( -3.511 10.006 2.831) 10.975 10.352 ( 0.526 0.855 -0.700) 1.224 10.571 ( 1.086 3.188 -0.089) 3.369 10.823 ( 1.341 -12.433 0.398) 12.512 11.291 ( 0.859 7.013 -4.788) 8.535 15.192 ( -3.585 3.836 6.082) 8.035 15.671 ( 0.929 6.009 -1.108) 6.180 16.940 ( -5.997 6.730 -3.656) 9.727 17.243 ( 0.495 37.729 -6.199) 38.238 20.028 ( -0.103 -15.155 0.795) 15.176 20.591 ( 7.480 -36.023 -2.579) 36.881======================= Grid point 275 (122/322) =======================q-point: (-0.31 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.643 ( -19.644 -10.124 6.360) 22.996 2.171 ( -15.473 -13.751 -0.031) 20.701 2.343 ( 12.918 -6.176 5.162) 15.221 2.760 ( 7.202 -9.515 1.143) 11.988 2.952 ( 1.050 -9.437 0.287) 9.499 3.115 ( 0.859 -8.543 2.399) 8.915 3.289 ( -3.559 -7.379 -0.415) 8.203 3.492 ( 3.978 -3.320 1.435) 5.377 3.733 ( -15.125 -10.931 3.880) 19.061 3.921 ( -10.082 -12.123 -5.057) 16.559 4.045 ( -10.690 -3.477 -1.236) 11.309 4.219 ( 3.106 -4.049 -0.998) 5.200 4.534 ( -1.480 -9.757 -1.048) 9.924 4.665 ( 6.708 -6.650 1.205) 9.522 5.105 ( 15.041 -16.653 1.275) 22.476 5.164 ( -4.383 -7.550 -3.371) 9.358 5.299 ( 4.992 -16.334 0.303) 17.083 5.615 ( 14.484 -17.946 0.207) 23.063 6.189 ( 1.607 15.126 10.270) 18.354 6.985 ( 7.061 11.495 2.077) 13.650 7.765 ( -9.762 9.237 1.122) 13.486 8.020 ( 0.393 5.530 2.119) 5.935 8.844 ( 1.819 10.187 -10.086) 14.450 9.317 ( -1.148 -8.079 3.064) 8.716 9.810 ( -3.031 15.110 4.947) 16.185 9.960 ( 5.756 6.633 -0.014) 8.782 10.376 ( -5.839 -1.798 0.015) 6.109 10.584 ( 4.751 -6.067 1.462) 7.843 11.087 ( 0.109 -2.007 -4.206) 4.662 11.165 ( 2.443 -7.850 -0.079) 8.222 15.087 ( -4.424 4.806 5.563) 8.580 15.504 ( -5.031 8.707 -2.853) 10.453 16.569 ( -7.783 22.008 -2.066) 23.435 16.777 ( -5.143 7.130 -2.435) 9.122 20.411 ( -0.228 -22.196 1.560) 22.252 21.257 ( 10.652 -23.366 -3.886) 25.972======================= Grid point 276 (123/322) =======================q-point: (-0.23 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.716 ( -15.553 -5.326 6.668) 17.741 2.350 ( -12.118 -11.997 0.768) 17.069 2.511 ( 8.037 -3.386 4.667) 9.891 2.930 ( 3.765 -4.372 3.267) 6.630 3.156 ( 0.521 -10.826 -1.289) 10.915 3.258 ( -2.435 -6.407 2.045) 7.152 3.467 ( -1.557 -11.164 -0.830) 11.303 3.544 ( 4.516 0.171 1.351) 4.717 3.853 ( -4.311 -4.532 5.878) 8.584 4.085 ( -0.678 -6.435 -2.306) 6.870 4.135 ( -20.535 -18.225 -6.246) 28.158 4.285 ( 3.734 -0.762 1.589) 4.129 4.590 ( 3.325 -0.737 -2.174) 4.041 4.747 ( 5.785 3.099 -1.052) 6.646 5.215 ( -1.622 -4.254 -4.372) 6.313 5.388 ( 11.213 -6.865 1.404) 13.222 5.847 ( 4.146 -8.965 1.771) 10.035 5.940 ( 4.670 -9.583 4.410) 11.537 6.331 ( 10.107 -36.028 -0.010) 37.419 6.785 ( 5.252 11.241 0.083) 12.408 7.475 ( -10.494 11.449 1.336) 15.588 8.027 ( -3.684 -4.162 2.491) 6.091 8.617 ( 3.456 12.389 -8.766) 15.565 9.365 ( 1.011 7.118 6.353) 9.594 9.495 ( -6.497 10.683 2.736) 12.800 9.803 ( 4.784 10.893 -0.510) 11.908 10.327 ( -1.496 2.408 -0.796) 2.944 10.616 ( 1.142 9.665 -0.767) 9.762 11.215 ( 1.451 -19.738 -0.841) 19.810 11.530 ( 3.729 -20.193 0.162) 20.535 14.994 ( -4.889 2.380 4.901) 7.320 15.304 ( -9.784 5.927 -3.638) 12.003 16.268 ( -6.117 6.020 -0.265) 8.586 16.633 ( -3.884 4.567 -1.739) 6.242 20.847 ( -0.194 -21.029 1.614) 21.092 21.593 ( 6.622 -7.172 -3.369) 10.327======================= Grid point 277 (124/322) =======================q-point: (-0.15 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.640 ( -11.695 6.808 7.367) 15.408 2.467 ( -5.552 -3.786 3.358) 7.512 2.593 ( -0.712 -3.213 2.482) 4.122 3.020 ( 2.684 -3.134 2.850) 5.015 3.348 ( -2.882 -4.127 2.537) 5.637 3.362 ( -0.332 -9.704 -1.678) 9.853 3.576 ( 4.423 -1.001 0.961) 4.636 3.660 ( -0.581 -8.435 -0.187) 8.457 3.905 ( -1.016 -3.048 3.936) 5.081 4.193 ( -3.997 -3.966 -2.270) 6.071 4.278 ( -3.389 -2.058 -1.801) 4.355 4.353 ( -0.370 -6.889 0.036) 6.899 4.640 ( -1.631 1.829 -5.644) 6.153 4.737 ( 5.018 -6.807 -0.122) 8.457 5.272 ( -0.860 -2.289 -3.182) 4.014 5.570 ( 7.614 -5.890 -0.176) 9.628 5.762 ( 12.975 5.495 2.548) 14.319 6.279 ( 0.777 -2.942 0.179) 3.048 6.720 ( 0.140 -6.088 -0.443) 6.105 6.991 ( 3.267 -15.405 0.124) 15.748 7.303 ( -5.015 -6.941 2.264) 8.857 8.108 ( -7.186 -6.639 2.108) 10.008 8.392 ( 3.803 10.981 -7.160) 13.649 9.111 ( 0.773 14.307 6.024) 15.543 9.337 ( -4.340 7.079 4.601) 9.493 9.627 ( 3.286 8.868 -1.872) 9.641 10.277 ( 0.422 3.958 -3.886) 5.563 10.413 ( -0.015 6.165 1.987) 6.477 11.659 ( -1.978 -22.360 -1.136) 22.476 11.966 ( 8.239 -20.027 -0.328) 21.658 14.947 ( -4.062 0.857 4.565) 6.170 15.162 ( -9.441 2.149 -3.876) 10.429 16.198 ( -4.947 -1.042 0.124) 5.058 16.542 ( -2.852 2.577 -1.798) 4.244 21.208 ( -0.120 -15.292 1.032) 15.327 21.653 ( 2.174 1.859 -2.108) 3.553======================= Grid point 278 (125/322) =======================q-point: (-0.08 -0.46 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.348 ( -7.986 16.822 7.845) 20.207 2.447 ( -0.233 3.594 5.388) 6.481 2.649 ( -5.452 -3.616 0.915) 6.606 3.100 ( 2.368 -2.905 1.554) 4.057 3.387 ( -4.546 -1.956 2.896) 5.734 3.524 ( 1.371 -6.270 -0.754) 6.462 3.631 ( 4.179 -1.562 0.460) 4.485 3.779 ( -0.211 -4.139 1.556) 4.427 3.992 ( 0.894 -5.030 0.516) 5.135 4.157 ( -1.283 3.126 -0.495) 3.415 4.324 ( -2.372 -3.371 -2.110) 4.631 4.457 ( 0.267 -3.542 0.993) 3.688 4.540 ( -2.096 4.384 -4.762) 6.804 4.957 ( 0.305 -10.718 -2.672) 11.050 5.296 ( 0.972 -1.172 -0.262) 1.545 5.698 ( 4.722 -3.425 -1.245) 5.965 5.802 ( 12.296 -0.072 -0.673) 12.315 6.220 ( 0.614 4.471 0.260) 4.521 6.797 ( -6.263 -0.144 1.626) 6.472 7.016 ( -1.671 0.145 1.020) 1.963 7.643 ( 2.869 -14.288 -0.206) 14.575 8.167 ( -8.090 0.584 -2.050) 8.366 8.274 ( 1.029 -3.491 -0.791) 3.724 8.885 ( 4.265 11.622 6.408) 13.940 9.171 ( -3.069 7.659 4.485) 9.391 9.487 ( 2.131 6.645 -2.979) 7.588 10.164 ( 0.182 3.892 -3.282) 5.094 10.438 ( 0.217 -5.019 1.837) 5.349 12.014 ( -3.977 -15.572 -2.572) 16.277 12.363 ( 9.340 -13.948 -1.026) 16.818 14.912 ( -2.657 1.493 3.384) 4.554 15.099 ( -6.039 -0.796 -2.816) 6.711 16.220 ( -4.272 -3.482 -0.065) 5.511 16.489 ( -1.460 1.418 -1.812) 2.725 21.441 ( -0.037 -8.357 0.129) 8.358 21.589 ( -0.166 3.893 -0.624) 3.946======================= Grid point 287 (126/322) =======================q-point: (-0.38 -0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.376 ( -25.466 -0.000 7.779) 26.628 1.717 ( -25.285 -0.000 -0.309) 25.287 2.201 ( 17.686 0.000 5.611) 18.555 2.471 ( 7.668 0.000 -0.990) 7.731 2.737 ( 4.742 0.000 0.795) 4.808 2.843 ( 3.652 0.000 -3.070) 4.771 3.197 ( -19.076 -0.000 3.137) 19.333 3.258 ( 0.006 0.000 5.954) 5.954 3.325 ( -19.631 -0.000 -2.923) 19.847 3.667 ( -3.468 -0.000 -0.819) 3.563 3.862 ( -1.105 -0.000 -2.369) 2.614 3.931 ( -3.981 -0.000 1.113) 4.133 4.181 ( -2.187 -0.000 1.586) 2.702 4.381 ( 3.835 0.000 -0.920) 3.944 4.781 ( 13.761 0.000 1.751) 13.872 5.093 ( -0.059 -0.000 -4.556) 4.557 5.211 ( 8.295 0.000 0.625) 8.319 5.494 ( 12.962 0.000 2.297) 13.164 6.568 ( -0.700 -0.000 17.784) 17.798 7.227 ( 5.991 0.000 1.107) 6.092 7.868 ( -0.002 -0.000 7.108) 7.108 8.483 ( -1.083 -0.000 1.074) 1.525 8.877 ( -3.603 -0.000 -0.208) 3.609 9.173 ( 2.558 0.000 -9.336) 9.680 9.725 ( -1.176 -0.000 -0.584) 1.313 10.200 ( -4.788 -0.000 6.590) 8.145 10.419 ( 6.279 0.000 -2.398) 6.722 10.637 ( 0.883 0.000 0.044) 0.884 10.663 ( 0.907 0.000 0.872) 1.258 11.362 ( 1.342 0.000 -5.791) 5.945 15.213 ( -5.665 -0.000 6.835) 8.877 15.750 ( 2.478 0.000 -0.650) 2.561 16.959 ( -8.234 -0.000 -3.683) 9.020 17.810 ( 11.655 0.000 -13.185) 17.598 19.870 ( 0.068 0.000 0.086) 0.110 20.109 ( 0.046 0.000 -0.082) 0.094======================= Grid point 288 (127/322) =======================q-point: (-0.31 -0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.330 ( -23.246 -8.605 7.863) 26.005 1.758 ( -22.560 -15.929 -0.086) 27.617 2.337 ( 15.278 -3.143 4.924) 16.357 2.604 ( 5.016 -8.962 -1.426) 10.369 2.822 ( 3.511 -5.143 1.753) 6.469 2.953 ( 2.363 -8.269 -0.206) 8.602 3.085 ( -33.303 -8.419 -1.046) 34.366 3.323 ( -4.152 -5.863 -1.683) 7.379 3.435 ( -0.866 -12.247 2.849) 12.604 3.701 ( -5.083 -5.696 2.331) 7.982 3.959 ( -3.075 -3.255 1.663) 4.777 4.053 ( 2.188 -14.468 -2.241) 14.803 4.258 ( -0.426 -10.196 2.119) 10.422 4.481 ( 1.600 -10.265 -0.968) 10.434 4.896 ( 15.677 -4.589 1.845) 16.439 5.098 ( -0.033 -1.480 -2.426) 2.842 5.245 ( 5.604 -0.095 -2.930) 6.325 5.573 ( 15.074 -0.153 1.304) 15.131 6.481 ( -0.067 10.557 16.057) 19.217 7.213 ( 8.287 5.910 2.008) 10.374 7.844 ( -2.160 3.740 6.029) 7.416 8.262 ( -2.170 16.143 -0.107) 16.288 8.947 ( -1.168 -1.867 -5.344) 5.780 9.144 ( -1.286 -2.978 -4.740) 5.743 9.897 ( 2.719 -12.812 1.442) 13.177 10.082 ( -3.472 10.307 6.758) 12.805 10.365 ( 1.972 5.627 -0.785) 6.013 10.590 ( 1.901 1.805 0.562) 2.681 10.844 ( 2.067 -12.297 0.055) 12.470 11.288 ( 1.131 6.940 -5.941) 9.206 15.153 ( -6.009 3.470 6.764) 9.691 15.666 ( -1.456 9.009 -2.570) 9.481 16.850 ( -7.478 5.173 -2.299) 9.379 17.175 ( -8.739 44.939 -9.445) 46.745 20.030 ( -0.031 -15.166 0.876) 15.191 20.702 ( 13.431 -40.000 -4.138) 42.397======================= Grid point 289 (128/322) =======================q-point: (-0.23 -0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.438 ( -18.572 -12.342 7.179) 23.426 1.973 ( -18.159 -16.784 -0.028) 24.728 2.501 ( 11.254 -4.078 4.347) 12.735 2.825 ( 3.206 -9.835 0.048) 10.344 2.960 ( -2.327 -8.159 1.416) 8.602 3.115 ( -5.638 -7.617 0.078) 9.477 3.188 ( -9.123 -14.961 -0.401) 17.528 3.499 ( -5.436 -13.892 -0.764) 14.937 3.599 ( -1.571 -6.125 0.511) 6.344 3.802 ( -6.693 -6.622 4.548) 10.456 3.988 ( -2.982 -2.440 -1.255) 4.052 4.265 ( 4.035 -4.194 0.136) 5.821 4.528 ( 1.046 -10.983 -0.099) 11.034 4.733 ( 3.367 -9.300 0.802) 9.923 5.113 ( -1.296 -5.128 -4.667) 7.054 5.283 ( 13.772 -18.220 1.667) 22.900 5.345 ( 3.926 -11.266 -2.045) 12.105 5.789 ( 14.805 -18.202 -1.005) 23.484 6.254 ( 3.511 14.300 12.226) 19.139 7.087 ( 9.234 12.627 1.565) 15.721 7.663 ( -8.018 12.387 0.931) 14.785 8.013 ( -2.648 5.549 2.489) 6.633 8.833 ( 1.594 9.248 -10.339) 13.962 9.294 ( -3.991 -9.331 1.730) 10.295 9.798 ( -2.306 17.021 6.453) 18.349 10.027 ( 5.888 5.900 -0.472) 8.349 10.318 ( -4.167 -1.526 0.464) 4.462 10.648 ( 4.916 -6.020 3.439) 8.499 11.073 ( 0.080 -0.732 -6.266) 6.310 11.195 ( 2.549 -10.021 0.507) 10.352 15.041 ( -6.195 4.790 5.682) 9.675 15.396 ( -11.887 11.424 -4.771) 17.163 16.446 ( -11.617 18.835 -1.921) 22.213 16.702 ( -6.197 5.543 -1.640) 8.475 20.414 ( -0.180 -22.210 1.685) 22.275 21.393 ( 14.948 -20.091 -5.489) 25.636======================= Grid point 290 (129/322) =======================q-point: (-0.15 -0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.560 ( -14.358 -7.300 6.919) 17.530 2.188 ( -15.176 -14.944 0.252) 21.300 2.611 ( 6.380 -0.739 3.900) 7.515 2.978 ( 1.942 -4.221 3.824) 6.017 3.134 ( -4.232 -10.912 -1.685) 11.825 3.243 ( 0.080 -6.957 0.932) 7.019 3.443 ( -1.781 -13.104 -0.976) 13.260 3.601 ( 4.170 0.116 0.665) 4.224 3.827 ( -4.054 -9.294 7.086) 12.371 3.914 ( -12.982 -15.863 -2.739) 20.680 4.056 ( -2.427 -6.253 -3.545) 7.587 4.334 ( 2.665 -1.643 1.853) 3.638 4.617 ( 2.678 0.110 -2.021) 3.357 4.790 ( 1.739 2.669 -1.170) 3.393 5.213 ( 4.267 -4.506 -3.870) 7.313 5.495 ( 6.437 -5.399 -0.462) 8.415 5.884 ( 1.875 -25.089 0.280) 25.161 6.052 ( 10.386 6.230 7.561) 14.278 6.459 ( 12.011 -34.273 -1.146) 36.335 6.856 ( 6.963 13.724 -0.562) 15.400 7.360 ( -9.696 11.496 1.490) 15.112 7.976 ( -6.271 -2.519 2.780) 7.308 8.621 ( 2.097 11.419 -9.378) 14.925 9.375 ( -3.837 -0.177 3.747) 5.366 9.446 ( -2.280 17.231 5.635) 18.272 9.858 ( 4.864 11.758 -0.741) 12.745 10.304 ( -2.106 0.547 -0.848) 2.335 10.623 ( 0.380 11.364 -0.846) 11.402 11.234 ( 2.196 -18.706 -0.370) 18.838 11.580 ( 4.695 -22.250 0.073) 22.740 14.943 ( -6.382 1.588 4.352) 7.886 15.153 ( -13.248 4.794 -3.981) 14.640 16.195 ( -6.105 4.292 0.214) 7.466 16.576 ( -4.916 3.671 -1.352) 6.282 20.850 ( -0.226 -20.992 1.744) 21.066 21.667 ( 7.914 -3.478 -4.230) 9.624======================= Grid point 291 (130/322) =======================q-point: (-0.08 -0.38 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.529 ( -10.867 4.778 7.132) 13.849 2.373 ( -9.929 -10.757 1.141) 14.683 2.617 ( 1.821 2.755 3.794) 5.030 3.060 ( 1.622 -2.974 3.381) 4.786 3.278 ( -6.026 -6.668 -0.296) 8.992 3.399 ( 3.894 -7.331 0.564) 8.320 3.626 ( 3.684 -2.552 0.663) 4.531 3.664 ( 1.669 -7.395 -1.644) 7.757 3.905 ( -1.578 -3.556 5.805) 6.988 4.133 ( -5.925 -5.019 -2.521) 8.164 4.184 ( -7.235 -10.813 -2.839) 13.316 4.387 ( 2.353 -2.494 0.619) 3.484 4.585 ( -3.655 2.587 -4.931) 6.661 4.790 ( 3.735 -3.831 0.258) 5.357 5.298 ( 6.068 -1.334 -1.068) 6.304 5.621 ( 1.667 -5.046 -1.446) 5.508 5.948 ( 16.930 4.394 2.179) 17.626 6.296 ( 2.030 -2.347 0.560) 3.153 6.713 ( -1.189 -2.623 -0.215) 2.888 7.018 ( 0.389 -1.733 1.244) 2.168 7.285 ( 1.660 -19.692 0.113) 19.762 8.013 ( -10.206 -5.124 2.337) 11.656 8.401 ( 2.136 10.142 -7.617) 12.862 9.147 ( 1.474 13.020 6.524) 14.637 9.294 ( -4.974 5.775 4.096) 8.653 9.664 ( 3.805 10.041 -1.752) 10.879 10.266 ( -0.069 4.172 -4.185) 5.910 10.414 ( -0.967 5.171 2.215) 5.708 11.633 ( -1.740 -19.929 -0.945) 20.027 12.065 ( 8.648 -21.629 -0.675) 23.303 14.915 ( -3.769 -0.317 4.445) 5.836 15.031 ( -10.245 0.066 -4.159) 11.057 16.142 ( -4.632 -1.259 0.462) 4.822 16.498 ( -3.734 1.602 -1.515) 4.336 21.210 ( -0.210 -15.217 1.093) 15.258 21.674 ( 2.421 3.902 -2.372) 5.168======================= Grid point 301 (131/322) =======================q-point: (-0.31 -0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.111 ( -24.550 -0.000 10.169) 26.572 1.408 ( -27.517 -0.000 0.734) 27.527 2.417 ( 16.009 0.000 4.797) 16.713 2.514 ( 1.700 0.000 -3.157) 3.585 2.683 ( -51.608 -0.000 -2.927) 51.691 2.814 ( 6.501 0.000 1.929) 6.781 2.874 ( 3.226 0.000 -1.981) 3.785 3.286 ( 1.718 0.000 5.142) 5.421 3.292 ( -1.148 -0.000 -2.886) 3.106 3.635 ( -1.896 -0.000 7.637) 7.868 3.838 ( -1.601 -0.000 -2.356) 2.848 3.934 ( 1.762 0.000 3.156) 3.615 4.162 ( -1.408 -0.000 0.565) 1.517 4.409 ( 1.230 0.000 -1.498) 1.938 4.951 ( 12.352 0.000 0.285) 12.355 5.085 ( 1.946 0.000 0.922) 2.154 5.274 ( 5.038 0.000 -5.590) 7.525 5.675 ( 14.899 0.000 1.513) 14.975 6.610 ( -1.930 -0.000 18.282) 18.384 7.319 ( 8.894 0.000 1.078) 8.959 7.905 ( 2.300 0.000 9.319) 9.599 8.469 ( -1.999 -0.000 1.346) 2.410 8.822 ( -5.646 -0.000 -0.184) 5.649 9.172 ( 2.722 0.000 -11.692) 12.005 9.709 ( -1.332 -0.000 -0.533) 1.435 10.194 ( -0.413 -0.000 11.734) 11.741 10.478 ( 5.084 0.000 -3.745) 6.314 10.648 ( 1.002 0.000 -0.014) 1.002 10.687 ( 2.497 0.000 1.947) 3.166 11.355 ( 0.631 0.000 -6.943) 6.972 15.162 ( -6.472 -0.000 7.295) 9.752 15.764 ( 0.470 0.000 -2.377) 2.423 16.850 ( -8.531 -0.000 -2.093) 8.784 17.866 ( 6.566 0.000 -24.340) 25.210 19.871 ( 0.102 0.000 0.086) 0.134 20.110 ( 0.066 0.000 -0.079) 0.103======================= Grid point 302 (132/322) =======================q-point: (-0.23 -0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.097 ( -21.197 -10.492 10.147) 25.736 1.490 ( -23.270 -19.357 0.794) 30.279 2.490 ( -9.673 -8.369 -0.253) 12.793 2.542 ( -21.909 -9.143 1.469) 23.786 2.659 ( -0.583 -10.596 -2.918) 11.005 2.907 ( 2.135 -5.329 2.733) 6.358 2.990 ( 4.410 -8.133 -0.196) 9.254 3.293 ( -2.528 -3.825 -3.359) 5.683 3.462 ( 2.205 -11.627 2.833) 12.169 3.674 ( -1.426 -4.459 7.833) 9.125 3.930 ( -2.682 -2.164 0.917) 3.566 4.106 ( 7.030 -15.300 0.230) 16.840 4.259 ( -0.328 -11.146 2.112) 11.349 4.483 ( -0.642 -9.959 -1.784) 10.138 5.020 ( 3.230 -2.636 -3.748) 5.606 5.151 ( 11.123 -3.551 4.316) 12.448 5.295 ( 5.886 -0.996 -5.989) 8.456 5.736 ( 11.453 0.618 0.211) 11.472 6.528 ( -0.409 9.243 16.024) 18.504 7.326 ( 9.705 5.411 1.584) 11.224 7.854 ( 0.379 8.334 7.850) 11.455 8.230 ( -3.281 16.294 0.096) 16.621 8.915 ( -1.786 -4.415 -4.337) 6.442 9.100 ( -2.910 -0.832 -6.886) 7.522 9.902 ( -2.290 -12.536 -1.785) 12.868 10.116 ( 4.623 8.977 13.113) 16.550 10.388 ( 2.312 8.132 -1.541) 8.594 10.618 ( 2.082 0.213 3.151) 3.782 10.868 ( 2.129 -11.403 -1.397) 11.683 11.276 ( 0.070 6.565 -6.295) 9.096 15.102 ( -6.162 3.435 6.734) 9.752 15.603 ( -7.964 14.770 -6.113) 17.859 16.757 ( -7.456 4.006 -1.210) 8.550 16.968 ( -21.034 48.898 -12.702) 54.724 20.033 ( -0.015 -15.191 0.989) 15.223 20.880 ( 20.411 -44.523 -8.307) 49.678======================= Grid point 303 (133/322) =======================q-point: (-0.15 -0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.262 ( -15.579 -14.112 8.607) 22.714 1.750 ( -20.030 -18.916 0.299) 27.552 2.622 ( 6.032 -2.645 2.371) 7.000 2.746 ( -22.665 -23.090 -0.936) 32.368 2.874 ( -0.331 -11.378 -2.606) 11.677 3.048 ( -1.535 -9.120 3.225) 9.795 3.184 ( 2.484 -9.498 1.152) 9.884 3.441 ( -3.253 -13.196 -2.875) 13.892 3.619 ( 1.597 -3.201 1.567) 3.906 3.790 ( 0.948 -4.447 8.564) 9.697 3.950 ( -2.681 -2.595 -1.849) 4.164 4.300 ( 1.644 -3.080 -0.143) 3.495 4.561 ( 3.384 -11.679 2.121) 12.343 4.743 ( -0.273 -9.803 -0.980) 9.855 5.118 ( 4.289 -7.374 -4.141) 9.483 5.355 ( 1.130 -14.686 -2.280) 14.905 5.443 ( 9.959 -7.870 0.026) 12.693 5.945 ( 12.166 -20.712 -1.346) 24.058 6.343 ( 5.114 11.975 12.215) 17.854 7.204 ( 9.719 13.375 0.920) 16.559 7.590 ( -4.651 16.231 0.985) 16.913 7.977 ( -5.065 6.186 3.360) 8.673 8.818 ( 1.478 8.747 -10.404) 13.673 9.241 ( -5.432 -9.933 1.229) 11.388 9.785 ( -3.852 15.368 6.076) 16.969 10.093 ( 5.746 7.131 -0.979) 9.210 10.282 ( -2.370 0.766 0.886) 2.644 10.720 ( 4.921 -4.885 5.166) 8.647 11.049 ( -0.374 -2.445 -6.692) 7.135 11.226 ( 2.246 -11.216 0.984) 11.481 14.974 ( -8.580 5.792 3.768) 11.016 15.199 ( -18.039 10.656 -5.261) 21.602 16.304 ( -11.312 12.507 -1.084) 16.898 16.626 ( -6.051 4.665 -0.862) 7.689 20.417 ( -0.202 -22.212 1.842) 22.289 21.563 ( 17.289 -15.169 -8.434) 24.498======================= Grid point 304 (134/322) =======================q-point: (-0.08 -0.31 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.431 ( -11.469 -8.422 7.516) 16.092 2.009 ( -15.152 -18.007 0.522) 23.539 2.678 ( 3.286 0.377 2.090) 3.913 2.973 ( -5.668 -8.032 3.280) 10.363 3.076 ( -2.508 -10.004 -2.146) 10.535 3.263 ( 2.224 -10.265 0.991) 10.549 3.420 ( -1.696 -14.087 -0.906) 14.217 3.638 ( 1.938 -1.439 -0.003) 2.414 3.755 ( -7.557 -18.618 -2.611) 20.262 3.865 ( 0.421 -1.711 8.927) 9.099 4.017 ( -2.236 -5.720 -3.433) 7.036 4.351 ( -0.209 -2.438 0.670) 2.537 4.631 ( -0.064 2.808 -0.952) 2.965 4.808 ( 3.460 0.702 -0.259) 3.540 5.279 ( 7.719 -4.822 -2.759) 9.510 5.531 ( 0.507 -4.518 -1.688) 4.850 5.898 ( 0.565 -27.698 0.095) 27.704 6.204 ( 10.479 5.830 8.216) 14.536 6.601 ( 12.828 -30.913 -2.173) 33.539 6.944 ( 8.418 15.342 -0.979) 17.527 7.262 ( -7.758 12.423 1.144) 14.691 7.900 ( -8.439 -0.788 3.341) 9.111 8.615 ( 2.183 11.074 -9.019) 14.448 9.315 ( -6.536 -0.229 2.786) 7.109 9.457 ( -0.656 15.844 6.076) 16.982 9.908 ( 4.169 12.075 -1.502) 12.862 10.275 ( -2.424 -0.721 -0.511) 2.580 10.617 ( -0.789 12.536 -1.870) 12.699 11.264 ( 2.718 -16.669 1.072) 16.923 11.636 ( 4.762 -24.750 -0.022) 25.204 14.859 ( -10.058 -0.811 0.855) 10.126 15.002 ( -9.536 3.172 -0.938) 10.094 16.129 ( -5.221 2.793 0.458) 5.939 16.515 ( -4.786 3.079 -0.896) 5.761 20.852 ( -0.312 -20.920 1.864) 21.005 21.745 ( 7.755 0.437 -5.417) 9.469======================= Grid point 315 (135/322) =======================q-point: (-0.23 -0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.874 ( -22.136 -0.000 14.248) 26.325 1.084 ( -28.768 -0.000 2.544) 28.880 2.038 ( -55.920 -0.000 -2.507) 55.976 2.509 ( -0.097 -0.000 -4.371) 4.372 2.608 ( 13.403 0.000 4.340) 14.088 2.865 ( 1.178 0.000 1.400) 1.830 2.926 ( 6.186 0.000 -0.243) 6.191 3.229 ( -6.803 -0.000 -4.441) 8.124 3.327 ( 2.594 0.000 4.174) 4.915 3.684 ( 4.163 0.000 12.494) 13.169 3.811 ( -1.709 -0.000 -2.185) 2.774 3.964 ( 0.643 0.000 2.170) 2.263 4.164 ( 2.032 0.000 2.728) 3.402 4.398 ( -1.921 -0.000 -2.732) 3.340 5.008 ( 1.733 0.000 -3.227) 3.663 5.202 ( 12.514 0.000 4.849) 13.421 5.308 ( 4.670 0.000 -6.876) 8.312 5.823 ( 9.198 0.000 0.593) 9.217 6.635 ( -2.786 -0.000 16.007) 16.248 7.436 ( 10.370 0.000 0.952) 10.413 7.984 ( 5.289 0.000 13.249) 14.266 8.446 ( -2.504 -0.000 1.459) 2.898 8.747 ( -7.090 -0.000 -0.149) 7.092 9.160 ( 1.777 0.000 -13.846) 13.959 9.692 ( -1.143 -0.000 -0.325) 1.188 10.277 ( 7.248 0.000 17.503) 18.945 10.514 ( 3.353 0.000 -2.071) 3.940 10.659 ( 0.913 0.000 -0.162) 0.927 10.730 ( 3.460 0.000 1.309) 3.699 11.332 ( -0.691 -0.000 -6.927) 6.962 15.112 ( -5.813 -0.000 6.896) 9.020 15.738 ( -3.070 -0.000 -6.581) 7.262 16.751 ( -7.543 -0.000 -1.028) 7.612 17.770 ( -6.960 -0.000 -45.285) 45.817 19.873 ( 0.109 0.000 0.084) 0.137 20.110 ( 0.074 0.000 -0.073) 0.104======================= Grid point 316 (136/322) =======================q-point: (-0.15 -0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.906 ( -17.424 -12.493 13.576) 25.377 1.222 ( -23.380 -21.827 2.055) 32.051 1.972 ( -45.624 -26.546 -0.784) 52.791 2.582 ( 2.025 -5.962 -2.736) 6.865 2.723 ( 7.620 -4.394 1.692) 8.957 2.927 ( -0.059 -4.795 3.115) 5.718 3.049 ( 4.925 -7.149 -0.097) 8.682 3.232 ( -5.557 -5.804 -3.848) 8.909 3.496 ( 2.136 -10.845 2.500) 11.332 3.719 ( 4.464 -4.336 7.799) 9.978 3.902 ( -2.747 -1.429 0.897) 3.224 4.190 ( 4.745 -14.266 -0.534) 15.044 4.281 ( 3.866 -10.509 4.731) 12.157 4.466 ( 0.652 -12.700 -2.201) 12.906 5.030 ( 2.419 -1.979 -3.228) 4.493 5.266 ( 4.175 -0.405 -1.720) 4.533 5.376 ( 11.022 -4.627 -1.274) 12.021 5.827 ( 3.697 0.929 -0.046) 3.812 6.569 ( -0.486 7.019 13.556) 15.273 7.442 ( 9.265 5.790 1.036) 10.974 7.904 ( 2.933 12.862 10.836) 17.072 8.187 ( -4.090 17.002 0.275) 17.489 8.881 ( -1.841 -8.142 -3.253) 8.959 9.038 ( -3.585 1.657 -8.319) 9.209 9.851 ( -4.929 -7.445 -0.943) 8.978 10.247 ( 9.280 7.998 12.072) 17.199 10.406 ( 1.683 9.076 -1.824) 9.409 10.664 ( 2.795 -1.267 8.638) 9.167 10.875 ( 0.300 -9.902 -3.935) 10.659 11.255 ( -0.232 5.524 -4.507) 7.133 15.051 ( -6.068 4.243 5.288) 9.099 15.403 ( -23.563 24.606 -13.037) 36.478 16.623 ( -28.207 36.641 -11.853) 47.736 16.674 ( -7.063 5.118 -0.271) 8.727 20.036 ( -0.056 -15.225 1.110) 15.266 21.121 ( 27.024 -47.110 -16.924) 56.887======================= Grid point 317 (137/322) =======================q-point: (-0.08 -0.23 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.134 ( -11.207 -15.335 10.635) 21.769 1.514 ( -20.163 -21.567 1.408) 29.558 2.439 ( -21.284 -33.026 -1.746) 39.329 2.710 ( 4.049 -5.540 0.580) 6.887 2.878 ( 0.661 -8.960 -0.835) 9.023 3.046 ( -1.200 -7.886 4.023) 8.934 3.215 ( 1.735 -7.787 1.163) 8.062 3.388 ( -3.943 -12.863 -4.739) 14.264 3.639 ( 1.092 -2.911 1.727) 3.557 3.864 ( 6.460 -3.372 7.849) 10.710 3.914 ( -2.875 -2.267 -0.805) 3.748 4.305 ( -0.074 -1.821 -1.023) 2.090 4.576 ( -2.851 -11.593 2.083) 12.119 4.787 ( 9.586 -8.110 0.384) 12.562 5.171 ( 6.171 -11.191 -3.544) 13.262 5.339 ( -2.316 -10.814 -3.605) 11.632 5.516 ( 2.324 -4.728 0.012) 5.268 6.056 ( 7.006 -22.940 -0.549) 23.992 6.448 ( 6.834 7.150 9.677) 13.837 7.309 ( 7.357 12.964 0.540) 14.916 7.567 ( 0.392 20.997 1.171) 21.033 7.918 ( -7.116 7.033 4.404) 10.931 8.807 ( 2.302 8.052 -9.926) 12.987 9.186 ( -4.387 -9.866 1.490) 10.900 9.741 ( -6.645 11.772 5.014) 14.418 10.148 ( 4.224 9.465 -2.061) 10.568 10.265 ( -1.249 3.408 0.819) 3.721 10.771 ( 0.685 -0.292 0.426) 0.858 11.046 ( 3.166 -8.171 0.131) 8.764 11.251 ( 1.428 -11.516 1.426) 11.691 14.813 ( -19.425 5.903 -3.332) 20.573 15.021 ( -9.049 3.949 1.040) 9.928 16.187 ( -8.075 6.846 -0.187) 10.588 16.560 ( -4.878 4.228 -0.376) 6.467 20.420 ( -0.287 -22.199 1.999) 22.291 21.729 ( 16.093 -9.304 -12.476) 22.388======================= Grid point 329 (138/322) =======================q-point: (-0.15 -0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.691 ( -18.055 -0.000 19.798) 26.794 0.760 ( -28.394 -0.000 5.933) 29.008 1.376 ( -56.181 -0.000 2.111) 56.221 2.491 ( -0.134 -0.000 -5.295) 5.297 2.753 ( 9.301 0.000 2.677) 9.678 2.871 ( -0.677 -0.000 1.423) 1.576 2.993 ( 4.857 0.000 0.373) 4.872 3.128 ( -7.693 -0.000 -3.419) 8.418 3.368 ( 2.318 0.000 3.315) 4.045 3.785 ( 5.653 0.000 11.940) 13.211 3.787 ( -1.314 -0.000 -1.866) 2.282 3.940 ( -4.746 -0.000 -2.171) 5.220 4.258 ( 11.376 0.000 10.205) 15.282 4.359 ( -2.210 -0.000 -3.056) 3.771 5.033 ( 4.411 0.000 -0.963) 4.515 5.277 ( 0.214 0.000 -4.770) 4.775 5.402 ( 12.057 0.000 0.379) 12.063 5.883 ( 0.478 0.000 0.320) 0.575 6.648 ( -2.362 -0.000 11.942) 12.173 7.559 ( 9.735 0.000 0.752) 9.764 8.116 ( 9.546 0.000 17.604) 20.025 8.422 ( -2.392 -0.000 1.466) 2.806 8.661 ( -7.218 -0.000 -0.119) 7.219 9.121 ( -1.045 -0.000 -15.855) 15.889 9.681 ( -0.690 -0.000 0.010) 0.690 10.427 ( 6.371 0.000 2.172) 6.731 10.616 ( 15.353 0.000 18.034) 23.684 10.668 ( 0.646 0.000 -0.367) 0.743 10.762 ( 2.797 0.000 4.105) 4.968 11.306 ( 0.053 0.000 -3.811) 3.811 15.067 ( -5.283 -0.000 5.162) 7.386 15.621 ( -13.606 -0.000 -19.924) 24.127 16.670 ( -5.828 -0.000 -0.792) 5.881 17.327 ( -41.860 -0.000 -74.686) 85.617 19.874 ( 0.085 0.000 0.082) 0.118 20.111 ( 0.070 0.000 -0.063) 0.094======================= Grid point 330 (139/322) =======================q-point: (-0.08 -0.15 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.782 ( -11.922 -14.411 17.432) 25.567 0.956 ( -23.641 -22.102 4.562) 32.683 1.509 ( -32.054 -40.498 3.966) 51.800 2.581 ( 0.567 -8.114 -4.677) 9.383 2.797 ( 3.519 -1.055 1.451) 3.950 2.936 ( 0.182 -4.714 3.389) 5.808 3.092 ( 2.320 -6.063 -0.171) 6.494 3.152 ( -5.550 -7.267 -4.165) 10.047 3.525 ( 1.624 -10.181 2.189) 10.540 3.809 ( 6.390 -4.884 1.354) 8.156 3.871 ( -2.813 -1.969 4.399) 5.580 4.199 ( -1.169 -15.408 -1.055) 15.488 4.329 ( 0.534 -1.188 0.573) 1.423 4.567 ( 17.483 -18.891 0.756) 25.751 5.073 ( 6.047 -1.406 0.396) 6.221 5.261 ( -1.987 -0.144 -5.376) 5.733 5.485 ( 5.537 -1.387 0.362) 5.719 5.823 ( -4.032 -1.790 0.551) 4.446 6.603 ( 0.057 4.547 10.195) 11.163 7.541 ( 6.904 7.126 0.890) 9.961 7.975 ( 1.509 15.930 13.546) 20.965 8.139 ( -3.877 19.124 -0.058) 19.513 8.859 ( 0.169 -10.593 -3.567) 11.179 8.972 ( -3.015 0.573 -7.167) 7.796 9.787 ( -6.005 -2.983 0.682) 6.740 10.346 ( 1.974 8.440 -1.701) 8.833 10.431 ( 3.234 12.438 2.362) 13.067 10.683 ( -7.951 -0.046 1.981) 8.194 10.911 ( 9.870 -8.206 10.917) 16.850 11.251 ( 1.049 4.576 -0.932) 4.787 14.887 ( -37.709 20.898 -13.319) 45.123 15.046 ( -12.674 4.968 -0.329) 13.617 16.304 ( -18.836 14.115 -4.152) 23.901 16.609 ( -4.414 3.246 -0.107) 5.480 20.038 ( -0.142 -15.261 1.218) 15.311 21.377 ( 27.687 -45.130 -31.042) 61.375======================= Grid point 343 (140/322) =======================q-point: (-0.08 -0.08 0.14)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.482 ( -22.289 -0.000 12.826) 25.715 0.556 ( -20.139 -0.000 18.629) 27.434 0.808 ( -38.375 -0.000 20.108) 43.324 2.475 ( 0.557 0.000 -6.110) 6.135 2.840 ( 4.858 0.000 1.045) 4.969 2.862 ( -1.566 -0.000 1.638) 2.266 3.038 ( 2.577 0.000 0.382) 2.605 3.039 ( -5.662 -0.000 -2.977) 6.397 3.398 ( 1.084 0.000 2.702) 2.911 3.771 ( -0.369 -0.000 -1.456) 1.502 3.831 ( -6.783 -0.000 0.144) 6.785 3.900 ( 3.523 0.000 4.449) 5.675 4.330 ( 0.100 0.000 -2.491) 2.493 4.502 ( 20.059 0.000 8.906) 21.947 5.115 ( 9.020 0.000 4.765) 10.201 5.240 ( -0.985 -0.000 -5.892) 5.974 5.523 ( 8.279 0.000 -0.984) 8.337 5.835 ( -8.631 -0.000 0.200) 8.633 6.656 ( -1.661 -0.000 8.949) 9.101 7.656 ( 6.078 0.000 0.507) 6.099 8.319 ( 14.586 0.000 13.942) 20.178 8.404 ( -0.988 -0.000 2.062) 2.287 8.587 ( -4.895 -0.000 -0.079) 4.895 9.013 ( -10.027 -0.000 -16.261) 19.104 9.677 ( -0.121 -0.000 0.393) 0.411 10.418 ( -7.085 -0.000 -12.153) 14.068 10.592 ( -16.178 -0.000 -9.257) 18.640 10.671 ( 0.269 0.000 -0.585) 0.644 11.200 ( 39.687 0.000 21.096) 44.945 11.366 ( 21.734 0.000 17.593) 27.962 14.977 ( -59.746 -0.000 -39.613) 71.686 15.040 ( -33.594 -0.000 -17.342) 37.807 16.435 ( -49.324 -0.000 -32.866) 59.271 16.625 ( -5.401 -0.000 -1.073) 5.506 19.875 ( 0.037 0.000 0.080) 0.088 20.112 ( 0.053 0.000 -0.053) 0.075======================= Grid point 344 (141/322) =======================q-point: ( 0.00 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.749 ( 1.285 0.000 15.610) 15.663 0.839 ( 7.719 0.000 17.134) 18.793 1.370 ( 2.266 0.000 28.042) 28.134 2.306 ( 1.040 0.000 -8.624) 8.686 2.737 ( 0.450 0.000 -9.980) 9.990 2.889 ( -1.291 -0.000 2.559) 2.866 3.043 ( -0.459 -0.000 -1.354) 1.429 3.083 ( -0.910 -0.000 7.305) 7.362 3.474 ( -1.106 -0.000 3.737) 3.897 3.621 ( -7.940 -0.000 -5.679) 9.762 3.739 ( 1.452 0.000 -1.960) 2.439 4.050 ( 0.271 0.000 3.177) 3.188 4.318 ( 3.724 0.000 -1.697) 4.092 4.435 ( -11.766 -0.000 -3.178) 12.188 5.151 ( 3.456 0.000 -0.166) 3.460 5.377 ( 7.280 0.000 -0.124) 7.281 5.563 ( 2.152 0.000 -1.206) 2.467 5.710 ( -3.958 -0.000 -2.633) 4.753 6.876 ( -5.265 -0.000 12.259) 13.342 7.698 ( -0.738 -0.000 0.333) 0.810 8.295 ( -16.917 -0.000 1.783) 17.011 8.442 ( -1.459 -0.000 2.891) 3.238 8.557 ( 0.235 0.000 -0.034) 0.238 8.893 ( 12.360 0.000 -4.123) 13.029 9.698 ( 0.535 0.000 0.957) 1.096 9.919 ( -16.808 -0.000 -3.506) 17.169 10.455 ( -0.223 -0.000 -2.120) 2.132 10.651 ( -0.183 -0.000 -1.005) 1.022 11.364 ( -1.597 -0.000 1.226) 2.014 11.551 ( -10.757 -0.000 0.865) 10.792 14.789 ( 40.616 0.000 0.697) 40.622 14.950 ( -0.818 -0.000 -0.689) 1.069 16.221 ( 5.375 0.000 0.969) 5.462 16.590 ( -0.492 -0.000 -0.417) 0.645 19.877 ( -0.031 -0.000 0.098) 0.103 20.111 ( 0.035 0.000 -0.057) 0.067======================= Grid point 345 (142/322) =======================q-point: ( 0.08 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.108 ( 13.050 -16.736 12.139) 24.449 1.191 ( 4.570 -21.558 15.331) 26.846 1.608 ( 7.919 -21.274 13.824) 26.578 2.449 ( 1.333 -13.026 -5.711) 14.285 2.765 ( 2.776 -3.198 -6.801) 8.012 2.946 ( -0.737 -5.201 -0.535) 5.280 3.030 ( -1.192 0.244 2.911) 3.155 3.103 ( -3.823 -5.053 2.039) 6.656 3.587 ( -6.238 -3.777 -3.793) 8.220 3.609 ( -0.900 -9.296 2.801) 9.750 4.086 ( 1.306 -9.641 2.415) 10.024 4.127 ( -1.608 -20.528 -2.003) 20.688 4.384 ( -3.846 0.114 0.205) 3.853 4.434 ( -1.760 -15.223 -3.299) 15.675 5.162 ( -0.379 -0.131 -1.546) 1.597 5.403 ( 2.423 -0.176 -0.633) 2.511 5.546 ( 1.309 10.233 0.959) 10.361 5.654 ( -2.596 -9.105 -1.947) 9.666 6.816 ( -7.385 3.806 11.654) 14.312 7.600 ( -3.991 8.418 0.175) 9.318 8.013 ( -9.477 15.658 4.104) 18.757 8.204 ( 1.556 15.362 4.000) 15.950 8.763 ( 3.691 -7.735 -1.248) 8.661 9.010 ( 8.001 -5.921 -5.315) 11.284 9.709 ( -3.337 1.565 2.505) 4.457 9.927 ( -6.116 -8.412 -3.808) 11.075 10.440 ( 0.948 5.817 -0.686) 5.934 10.500 ( -0.318 7.151 -1.639) 7.343 11.248 ( -10.590 2.280 3.037) 11.250 11.520 ( 5.337 1.943 5.795) 8.115 14.789 ( 5.171 6.125 -1.491) 8.153 14.950 ( 22.647 8.685 0.989) 24.275 16.207 ( 6.757 4.985 0.493) 8.411 16.563 ( 1.419 2.667 -0.300) 3.036 20.077 ( -0.677 -17.446 2.284) 17.608 20.780 ( -0.020 -44.976 -21.848) 50.002======================= Grid point 346 (143/322) =======================q-point: ( 0.15 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.485 ( 1.979 -7.958 16.805) 18.699 1.578 ( 13.837 -19.525 7.075) 24.954 2.206 ( 7.862 -25.890 -5.164) 27.545 2.740 ( -0.262 -15.180 -1.964) 15.309 2.851 ( -1.321 -5.322 0.370) 5.496 3.044 ( 3.423 -4.879 -0.956) 6.036 3.127 ( 1.881 -9.581 -0.756) 9.793 3.224 ( -2.418 -8.739 1.639) 9.214 3.646 ( -4.629 -2.022 0.827) 5.118 3.731 ( -0.976 -7.557 -0.550) 7.639 4.168 ( -2.367 -4.568 3.312) 6.118 4.348 ( -0.029 1.896 0.525) 1.967 4.573 ( 1.162 -15.003 -0.132) 15.049 4.884 ( -1.463 -21.651 2.657) 21.862 5.208 ( -0.974 -12.546 -4.591) 13.395 5.389 ( -5.287 0.736 -0.809) 5.399 5.440 ( 4.264 -0.263 -0.763) 4.340 5.954 ( -3.562 -22.548 -2.083) 22.923 6.703 ( -10.995 2.745 9.478) 14.774 7.343 ( -6.200 14.117 -0.341) 15.423 7.608 ( -2.154 21.348 0.282) 21.459 7.975 ( 4.925 10.189 5.620) 12.636 8.832 ( 8.061 3.862 -5.215) 10.348 9.142 ( 0.431 -4.664 -2.660) 5.387 9.611 ( -4.394 6.458 4.820) 9.178 10.014 ( 0.148 3.455 -4.727) 5.857 10.229 ( 0.376 3.115 0.017) 3.138 10.514 ( 1.151 0.223 -2.871) 3.101 11.283 ( -3.728 -11.004 1.608) 11.729 11.510 ( 0.024 1.138 6.147) 6.251 14.716 ( 2.278 2.899 -1.115) 3.852 14.936 ( 14.352 3.274 1.619) 14.809 16.139 ( 4.271 4.751 0.546) 6.411 16.513 ( 2.979 3.442 -0.163) 4.555 20.487 ( -1.371 -22.576 4.217) 23.008 21.379 ( -2.050 -20.730 -18.471) 27.841======================= Grid point 347 (144/322) =======================q-point: ( 0.23 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.605 ( 2.674 -0.382 10.565) 10.905 2.020 ( 10.735 -16.401 3.947) 19.995 2.573 ( 2.057 -9.536 -3.088) 10.232 2.905 ( -0.113 -5.610 1.305) 5.761 3.056 ( -2.956 -13.430 -2.077) 13.908 3.189 ( 2.897 -7.979 -1.716) 8.660 3.306 ( -1.231 -7.113 0.572) 7.241 3.489 ( 6.958 -15.279 0.703) 16.803 3.608 ( -2.779 0.941 -1.775) 3.429 3.943 ( 1.512 -11.842 1.252) 12.003 4.240 ( -0.208 -1.522 3.063) 3.426 4.311 ( -0.658 0.129 0.395) 0.778 4.749 ( -0.696 -4.638 1.652) 4.972 4.969 ( 0.163 3.215 2.219) 3.910 5.367 ( -3.850 -2.156 -1.981) 4.837 5.479 ( 0.776 -4.299 -2.264) 4.921 5.813 ( -0.752 -32.463 -1.241) 32.495 6.305 ( -9.171 -8.377 4.004) 13.051 6.756 ( -12.867 -20.653 0.830) 24.347 6.998 ( -8.405 14.777 -1.234) 17.045 7.221 ( 5.924 17.906 0.672) 18.872 7.885 ( 8.945 3.859 3.649) 10.403 8.704 ( 3.609 10.739 -6.632) 13.128 9.172 ( 0.956 2.136 -0.282) 2.357 9.442 ( -3.737 8.038 7.057) 11.330 9.809 ( -1.429 10.613 -3.428) 11.244 10.299 ( 3.967 -0.488 0.903) 4.098 10.441 ( 2.224 4.576 -4.819) 7.007 11.516 ( -2.440 -6.225 5.178) 8.456 11.635 ( -4.422 -21.304 -1.728) 21.826 14.700 ( 1.982 -0.117 -1.052) 2.247 14.991 ( 10.984 -0.677 1.485) 11.105 16.089 ( 3.505 2.401 0.566) 4.286 16.474 ( 3.904 2.391 -0.347) 4.591 20.905 ( -1.360 -19.384 3.422) 19.731 21.596 ( -1.362 -6.337 -9.325) 11.357======================= Grid point 348 (145/322) =======================q-point: ( 0.31 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.551 ( 3.764 9.194 7.246) 12.297 2.340 ( 7.117 -10.292 2.252) 12.714 2.646 ( -1.534 0.289 2.720) 3.136 3.040 ( 1.980 -6.068 3.681) 7.368 3.255 ( -1.975 -8.795 0.082) 9.014 3.366 ( 4.224 -7.439 -4.005) 9.446 3.430 ( -2.681 -7.371 -0.069) 7.844 3.593 ( -5.365 -3.776 -1.885) 6.826 3.818 ( 7.052 -11.610 -0.176) 13.585 4.123 ( 5.460 -1.369 -1.980) 5.967 4.255 ( 1.076 -3.170 2.624) 4.253 4.348 ( -0.759 -2.272 0.092) 2.397 4.794 ( -4.927 -0.856 -2.027) 5.396 4.918 ( 4.740 1.615 4.153) 6.506 5.364 ( -5.118 -0.314 -0.363) 5.141 5.581 ( -0.988 -6.241 -2.407) 6.761 6.189 ( -11.300 -2.788 1.408) 11.723 6.291 ( -8.098 -1.157 0.733) 8.214 6.761 ( -1.155 0.575 0.945) 1.599 6.973 ( 6.243 7.842 1.788) 10.181 7.271 ( -7.865 -26.751 -2.536) 27.998 7.931 ( 13.256 -1.358 2.140) 13.496 8.475 ( -2.277 10.886 -6.186) 12.726 9.074 ( 0.080 7.304 3.164) 7.960 9.302 ( -1.711 6.212 6.758) 9.338 9.633 ( -0.782 6.369 -2.504) 6.888 10.204 ( 1.670 7.463 -2.856) 8.164 10.423 ( 2.611 0.481 -0.118) 2.658 11.702 ( -0.756 -13.300 1.160) 13.372 12.034 ( -5.517 -20.521 -2.943) 21.453 14.733 ( 2.360 -1.907 -0.534) 3.081 15.074 ( 8.050 -1.376 0.798) 8.206 16.099 ( 3.905 -1.314 0.557) 4.158 16.462 ( 3.817 1.163 -0.916) 4.094 21.226 ( -0.752 -13.518 1.510) 13.623 21.630 ( -0.035 0.525 -3.451) 3.491======================= Grid point 349 (146/322) =======================q-point: ( 0.38 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.338 ( 4.136 14.568 7.546) 16.920 2.503 ( 1.238 -2.459 3.586) 4.521 2.625 ( 2.593 0.386 3.127) 4.080 3.142 ( 0.922 -2.776 2.944) 4.150 3.388 ( -5.034 -6.372 2.684) 8.553 3.507 ( 5.512 -4.942 -0.231) 7.407 3.554 ( -2.207 -5.983 -3.813) 7.430 3.670 ( -3.029 -6.243 0.636) 6.968 4.021 ( 3.865 -5.769 -0.305) 6.951 4.114 ( 3.613 1.961 -1.307) 4.314 4.343 ( 3.275 -2.318 0.635) 4.063 4.364 ( -0.440 0.040 -1.248) 1.324 4.711 ( -6.408 4.050 -2.680) 8.040 4.995 ( 4.879 -4.111 -0.232) 6.384 5.339 ( -2.364 0.147 1.288) 2.696 5.687 ( -1.659 -5.352 -2.066) 5.972 6.024 ( -15.636 6.120 -0.588) 16.801 6.222 ( -0.287 4.193 0.539) 4.237 6.807 ( 4.409 0.348 3.908) 5.902 6.956 ( 0.820 -2.197 -0.336) 2.369 7.649 ( -4.159 -14.495 -1.256) 15.132 8.066 ( 11.576 -0.883 -1.811) 11.750 8.305 ( -3.530 -0.418 -1.109) 3.723 8.931 ( -1.772 7.429 5.607) 9.474 9.185 ( -1.237 5.517 5.405) 7.821 9.507 ( -0.124 6.822 -2.163) 7.157 10.097 ( 1.106 3.177 -3.561) 4.899 10.461 ( 0.518 -3.751 0.945) 3.903 11.976 ( 1.828 -12.764 -2.209) 13.082 12.331 ( -5.138 -13.187 -3.027) 14.472 14.794 ( 2.229 -2.724 0.450) 3.549 15.127 ( 4.648 -0.035 -0.025) 4.649 16.178 ( 4.023 -3.766 0.175) 5.513 16.459 ( 2.525 1.117 -1.544) 3.164 21.432 ( -0.086 -7.695 -0.025) 7.695 21.591 ( 0.518 2.745 -0.464) 2.832======================= Grid point 350 (147/322) =======================q-point: ( 0.46 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.137 ( 1.761 6.393 8.929) 11.122 2.498 ( -2.154 0.793 6.599) 6.987 2.677 ( 3.553 -1.439 0.850) 3.926 3.176 ( 0.090 -0.373 1.143) 1.205 3.447 ( -7.337 -2.989 4.092) 8.917 3.607 ( 3.596 -1.335 -1.561) 4.141 3.632 ( 2.673 -3.201 0.603) 4.214 3.781 ( -0.530 -5.179 0.610) 5.242 4.068 ( 0.527 0.839 -1.625) 1.903 4.135 ( 4.163 -0.774 1.484) 4.487 4.350 ( 0.218 0.837 -1.875) 2.065 4.383 ( 0.731 -0.727 -0.615) 1.201 4.584 ( -7.833 3.712 -2.619) 9.055 5.073 ( 2.948 -1.004 -4.058) 5.115 5.341 ( 2.133 -0.003 1.759) 2.765 5.749 ( -2.342 -1.977 -1.706) 3.508 5.853 ( -5.449 3.875 -0.630) 6.716 6.163 ( 0.830 1.628 0.509) 1.897 6.821 ( 0.980 0.315 3.367) 3.521 6.990 ( 0.127 -1.095 0.047) 1.103 7.792 ( -0.101 -2.067 -1.116) 2.351 8.030 ( -3.246 1.209 -5.401) 6.416 8.511 ( 8.235 -13.351 5.499) 16.623 8.763 ( -4.567 9.329 6.268) 12.131 9.109 ( -1.725 1.669 4.539) 5.134 9.366 ( 0.397 5.753 -3.322) 6.655 10.075 ( 0.698 -0.189 -3.210) 3.291 10.545 ( 0.043 -3.071 0.619) 3.133 12.159 ( 0.257 -4.602 -4.131) 6.189 12.489 ( -0.406 -5.287 -2.640) 5.923 14.860 ( 1.020 -2.642 1.342) 3.135 15.130 ( 1.460 1.424 -0.552) 2.113 16.264 ( 1.985 -2.264 -0.399) 3.037 16.440 ( 0.867 1.368 -1.818) 2.435 21.526 ( 0.241 -0.938 -0.274) 1.007 21.552 ( 0.094 0.033 0.228) 0.249======================= Grid point 351 (148/322) =======================q-point: (-0.46 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.191 ( -3.752 -10.362 8.208) 13.741 2.511 ( -1.596 -2.225 6.429) 6.988 2.687 ( -2.567 1.219 0.620) 2.908 3.177 ( 2.415 0.852 0.982) 2.742 3.441 ( -6.601 0.042 3.253) 7.360 3.611 ( 3.286 2.608 -1.006) 4.314 3.689 ( 4.088 -0.248 1.778) 4.465 3.832 ( 0.483 0.807 -1.503) 1.773 4.042 ( -1.887 1.075 -0.924) 2.360 4.171 ( 4.857 -0.215 3.487) 5.982 4.322 ( -1.987 1.818 -1.406) 3.038 4.374 ( -6.548 -0.412 -3.310) 7.349 4.496 ( -1.055 1.358 -1.314) 2.164 5.041 ( 0.317 4.401 -4.120) 6.037 5.358 ( 5.060 0.800 1.655) 5.384 5.730 ( -2.507 1.800 -1.303) 3.350 5.827 ( 5.696 -1.266 -0.495) 5.856 6.176 ( 2.011 -1.781 0.303) 2.703 6.819 ( -1.479 0.134 3.320) 3.637 7.009 ( -0.504 -0.899 0.120) 1.038 7.778 ( -0.448 2.163 -1.228) 2.527 8.003 ( -3.371 -0.412 -4.493) 5.632 8.522 ( -5.469 12.400 4.672) 14.335 8.840 ( 7.877 -12.980 7.052) 16.741 9.123 ( -3.627 -4.020 4.136) 6.813 9.323 ( 1.576 -1.796 -4.114) 4.758 10.076 ( 0.666 0.125 -3.056) 3.130 10.549 ( -0.241 2.663 0.555) 2.731 12.130 ( -2.751 5.814 -3.728) 7.434 12.526 ( 5.568 2.942 -3.171) 7.051 14.906 ( -1.341 -1.799 1.193) 2.541 15.089 ( -1.132 2.715 -0.450) 2.975 16.260 ( -1.959 2.487 -0.338) 3.184 16.428 ( 0.094 -0.252 -1.737) 1.758 21.513 ( -0.164 0.973 -0.066) 0.989 21.560 ( -0.131 0.324 0.064) 0.355======================= Grid point 352 (149/322) =======================q-point: (-0.38 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.433 ( -8.223 -13.954 6.638) 17.504 2.526 ( -4.017 4.359 2.534) 6.447 2.641 ( -3.371 -2.007 3.393) 5.186 3.172 ( 2.564 1.521 1.979) 3.578 3.364 ( -6.142 4.840 1.328) 7.932 3.549 ( 2.448 4.715 -0.146) 5.315 3.697 ( 5.134 2.789 -0.711) 5.885 3.748 ( 0.963 6.897 -3.771) 7.919 4.011 ( -2.949 0.127 1.292) 3.222 4.156 ( -7.410 4.505 0.417) 8.682 4.232 ( -3.949 3.841 -3.192) 6.367 4.387 ( 4.267 -2.788 1.591) 5.340 4.498 ( -0.402 -0.884 -0.344) 1.031 4.924 ( 1.239 6.276 -0.887) 6.459 5.374 ( 6.786 1.400 1.041) 7.007 5.659 ( -2.133 3.515 -1.688) 4.445 5.966 ( 15.572 -6.113 0.058) 16.729 6.244 ( 1.562 -4.009 0.269) 4.310 6.803 ( -3.545 1.155 3.721) 5.267 7.009 ( -1.741 0.220 -0.225) 1.770 7.658 ( 2.634 12.537 -1.188) 12.865 7.995 ( -9.014 -2.470 -2.904) 9.788 8.286 ( 0.200 7.810 1.173) 7.900 9.100 ( 2.917 -9.101 6.268) 11.429 9.221 ( -4.896 -6.955 4.142) 9.460 9.435 ( 3.281 -8.265 -3.870) 9.698 10.090 ( 0.435 -2.547 -3.155) 4.078 10.469 ( -0.908 4.074 0.855) 4.261 11.917 ( -2.262 13.107 -1.803) 13.422 12.409 ( 7.409 12.618 -3.732) 15.101 14.909 ( -4.774 0.058 -1.627) 5.044 15.018 ( -2.493 3.006 1.997) 4.386 16.177 ( -3.855 3.406 0.271) 5.151 16.430 ( -1.472 -0.488 -1.351) 2.056 21.441 ( -0.049 7.001 -0.089) 7.002 21.576 ( -0.032 -2.297 -0.339) 2.322======================= Grid point 353 (150/322) =======================q-point: (-0.31 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.587 ( -8.991 -4.909 7.150) 12.492 2.300 ( -8.002 13.862 2.245) 16.162 2.702 ( -0.829 -2.269 2.282) 3.323 3.140 ( -4.192 3.927 4.130) 7.075 3.194 ( -1.771 7.949 -1.781) 8.337 3.468 ( 3.716 5.791 0.507) 6.899 3.549 ( -0.999 10.214 -6.886) 12.359 3.669 ( 3.926 3.638 -1.893) 5.677 3.905 ( -14.281 12.680 -4.411) 19.600 4.017 ( -1.264 -0.692 2.084) 2.534 4.131 ( 1.689 5.511 2.157) 6.154 4.426 ( -1.253 2.830 2.306) 3.860 4.558 ( 3.940 -5.486 2.195) 7.102 4.859 ( 3.829 1.399 1.884) 4.491 5.372 ( 7.111 3.614 -0.514) 7.993 5.568 ( -1.236 4.366 -2.056) 4.982 6.183 ( 12.360 -2.232 1.648) 12.667 6.341 ( 5.978 -2.470 -0.083) 6.469 6.726 ( 0.024 2.060 2.195) 3.011 7.029 ( -4.746 -5.318 1.171) 7.224 7.289 ( 5.442 25.822 -2.700) 26.527 7.930 ( -13.362 0.736 1.633) 13.482 8.307 ( 5.935 -6.318 -3.269) 9.265 9.260 ( -4.159 -6.063 1.725) 7.552 9.343 ( -2.545 -8.498 6.012) 10.716 9.640 ( 3.197 -10.507 -3.809) 11.625 10.184 ( 0.052 -6.547 -2.617) 7.051 10.424 ( -2.207 -0.905 0.025) 2.386 11.626 ( 0.704 14.824 1.271) 14.895 12.108 ( 6.042 21.142 -3.173) 22.216 14.830 ( -7.121 3.554 -3.315) 8.621 14.973 ( -3.834 0.232 3.623) 5.280 16.105 ( -4.090 1.209 0.575) 4.303 16.432 ( -2.586 -1.305 -0.695) 2.979 21.238 ( -0.374 13.696 1.540) 13.787 21.628 ( 2.021 -2.007 -3.600) 4.590======================= Grid point 354 (151/322) =======================q-point: (-0.23 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.546 ( -6.455 5.153 10.578) 13.420 1.918 ( -9.798 19.845 4.592) 22.604 2.656 ( -4.506 8.118 -3.101) 9.789 2.941 ( -3.835 9.249 1.144) 10.078 3.058 ( 0.971 10.358 -0.050) 10.403 3.299 ( 1.835 11.814 -1.289) 12.025 3.376 ( -1.322 6.669 -2.409) 7.213 3.516 ( -12.530 15.062 -2.217) 19.717 3.653 ( 1.775 -0.166 -2.578) 3.134 3.952 ( -0.215 6.752 -0.952) 6.822 4.116 ( 3.515 -1.223 8.068) 8.885 4.336 ( -1.667 4.343 -0.041) 4.652 4.673 ( 0.585 -1.968 4.002) 4.497 4.904 ( 6.701 -2.166 1.699) 7.244 5.304 ( 5.909 6.602 -1.890) 9.059 5.468 ( -1.179 5.227 -2.086) 5.750 5.878 ( -0.815 29.511 -1.613) 29.566 6.453 ( 2.480 2.942 3.254) 5.039 6.707 ( 12.737 19.308 0.957) 23.150 7.014 ( 9.381 -15.374 -1.632) 18.084 7.209 ( -6.671 -14.580 1.289) 16.085 7.885 ( -10.064 -3.422 3.723) 11.263 8.499 ( 6.249 -8.890 -4.286) 11.682 9.282 ( -4.878 1.008 -0.384) 4.996 9.557 ( -4.080 -12.905 5.289) 14.531 9.860 ( 1.826 -11.057 -5.171) 12.342 10.258 ( -1.777 -0.323 0.985) 2.058 10.497 ( -2.705 -7.957 -5.618) 10.109 11.398 ( 4.698 9.674 5.564) 12.109 11.678 ( 3.389 23.449 -0.653) 23.701 14.705 ( -7.313 4.054 -1.260) 8.456 14.964 ( -5.947 -1.656 1.917) 6.465 16.090 ( -3.798 -1.849 0.599) 4.267 16.457 ( -2.862 -2.961 -0.209) 4.123 20.908 ( -0.575 19.824 3.335) 20.111 21.634 ( 4.840 3.494 -9.841) 11.511======================= Grid point 355 (152/322) =======================q-point: (-0.15 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.373 ( -3.319 12.012 15.169) 19.631 1.456 ( -9.664 20.506 9.451) 24.561 2.220 ( -8.533 30.696 -2.844) 31.987 2.734 ( 0.519 14.304 0.684) 14.330 2.862 ( 0.737 5.516 -2.154) 5.967 3.112 ( -0.864 7.306 2.396) 7.737 3.166 ( -7.551 9.531 -6.761) 13.912 3.264 ( -1.595 7.703 2.004) 8.118 3.676 ( 1.130 0.149 0.644) 1.309 3.803 ( -3.343 6.373 -2.853) 7.742 4.155 ( 2.695 2.739 7.231) 8.189 4.287 ( 2.889 -0.330 -0.359) 2.929 4.571 ( -2.665 13.407 0.792) 13.692 4.926 ( 4.405 15.171 0.094) 15.798 5.166 ( 5.173 8.470 -3.008) 10.371 5.257 ( 2.929 6.819 0.371) 7.431 5.498 ( -0.924 3.051 -1.733) 3.628 6.040 ( 0.524 23.615 -4.111) 23.976 6.739 ( 1.372 -5.304 10.480) 11.826 7.373 ( 3.502 -13.712 -0.303) 14.156 7.611 ( 3.407 -25.945 -0.077) 26.167 7.970 ( -7.631 -9.601 6.165) 13.726 8.677 ( 6.216 -5.440 -4.685) 9.497 9.159 ( -1.514 9.292 -1.210) 9.492 9.742 ( -7.439 -6.886 3.184) 10.625 10.068 ( -0.475 -8.717 -6.371) 10.807 10.253 ( -1.800 -4.218 -0.303) 4.597 10.576 ( -4.548 -0.291 -6.356) 7.821 11.285 ( 3.467 7.131 2.500) 8.313 11.376 ( 6.146 5.417 9.914) 12.861 14.594 ( -5.114 3.268 1.045) 6.158 14.971 ( -8.081 -2.889 0.614) 8.604 16.128 ( -3.647 -3.769 0.699) 5.291 16.510 ( -2.567 -3.919 -0.137) 4.687 20.484 ( -0.602 22.700 4.032) 23.063 21.453 ( 6.771 18.319 -19.954) 27.921======================= Grid point 356 (153/322) =======================q-point: (-0.08 0.00 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.001 ( -4.048 17.886 13.831) 22.970 1.139 ( -3.386 20.923 15.939) 26.519 1.537 ( -4.425 26.069 14.605) 30.207 2.457 ( 0.269 12.427 -5.619) 13.641 2.782 ( -0.954 2.754 -5.645) 6.353 2.967 ( -1.760 6.716 -1.360) 7.075 3.032 ( -1.143 0.610 1.847) 2.256 3.128 ( -1.604 5.175 2.320) 5.893 3.602 ( 0.457 8.677 2.990) 9.189 3.675 ( -5.904 2.977 -5.419) 8.549 4.047 ( 2.910 13.653 2.977) 14.273 4.155 ( -2.070 16.387 -0.836) 16.538 4.336 ( 4.590 2.786 0.117) 5.371 4.550 ( -5.183 9.814 -6.752) 12.991 5.145 ( 1.704 1.066 -1.535) 2.529 5.301 ( 13.040 -1.630 2.744) 13.425 5.527 ( 1.885 -3.995 0.504) 4.446 5.722 ( -6.287 5.396 -3.070) 8.835 6.841 ( -3.755 -3.904 11.858) 13.037 7.610 ( 2.204 -8.227 0.172) 8.519 8.101 ( -4.968 -19.977 1.078) 20.614 8.198 ( -3.702 -17.173 5.555) 18.425 8.735 ( 2.201 3.282 -2.707) 4.790 8.935 ( 5.723 11.607 -2.504) 13.182 9.749 ( -3.968 1.836 1.179) 4.528 10.062 ( -12.245 2.643 -8.490) 15.133 10.445 ( -1.344 -6.257 -0.861) 6.457 10.517 ( -2.203 -6.068 -2.132) 6.798 11.292 ( 3.610 -3.708 1.245) 5.323 11.450 ( 2.423 -6.924 10.710) 12.982 14.557 ( 10.820 0.281 5.193) 12.005 14.974 ( -9.999 -2.400 -0.086) 10.283 16.181 ( -2.538 -3.036 1.027) 4.088 16.567 ( -1.825 -2.876 -0.308) 3.420 20.076 ( -0.378 17.335 2.247) 17.484 20.825 ( 4.865 46.487 -24.065) 52.572======================= Grid point 358 (154/322) =======================q-point: ( 0.08 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.885 ( 13.364 0.000 12.966) 18.620 1.096 ( 22.420 0.000 14.741) 26.832 1.524 ( 11.167 0.000 20.546) 23.385 2.301 ( 2.721 0.000 -8.755) 9.168 2.760 ( 9.236 0.000 -8.637) 12.645 2.877 ( -2.232 -0.000 3.189) 3.892 3.016 ( -3.291 -0.000 -1.714) 3.710 3.069 ( -5.500 -0.000 7.159) 9.028 3.468 ( -1.890 -0.000 3.785) 4.231 3.528 ( -5.530 -0.000 -2.794) 6.196 3.755 ( 2.200 0.000 -2.055) 3.010 4.055 ( -1.226 -0.000 2.114) 2.444 4.228 ( -10.887 -0.000 -1.503) 10.990 4.424 ( 5.447 0.000 1.198) 5.577 5.142 ( -6.037 -0.000 -1.849) 6.313 5.404 ( -1.565 -0.000 -0.220) 1.581 5.571 ( 2.311 0.000 -0.645) 2.399 5.677 ( -2.946 -0.000 -3.169) 4.327 6.830 ( -9.185 -0.000 12.616) 15.606 7.651 ( -7.086 -0.000 0.454) 7.100 8.126 ( -12.828 -0.000 7.825) 15.027 8.443 ( -0.340 -0.000 3.164) 3.182 8.591 ( 5.197 0.000 -0.055) 5.198 9.017 ( 10.910 0.000 -7.577) 13.283 9.709 ( 0.719 0.000 0.781) 1.062 9.801 ( -3.130 -0.000 2.156) 3.801 10.469 ( 3.326 0.000 -1.926) 3.843 10.645 ( -0.410 -0.000 -0.911) 0.999 11.168 ( -22.167 -0.000 2.567) 22.315 11.589 ( 6.866 0.000 3.947) 7.919 14.794 ( -6.217 -0.000 -4.632) 7.753 15.394 ( 38.864 0.000 -12.113) 40.708 16.409 ( 28.578 0.000 -8.456) 29.803 16.605 ( 3.617 0.000 -0.440) 3.644 19.877 ( -0.091 -0.000 0.099) 0.135 20.111 ( 0.001 0.000 -0.061) 0.061======================= Grid point 359 (155/322) =======================q-point: ( 0.15 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.295 ( 12.152 -21.079 9.680) 26.186 1.351 ( 12.094 -9.797 17.185) 23.185 1.793 ( 19.049 -17.850 3.080) 26.287 2.452 ( 2.411 -12.803 -6.065) 14.371 2.798 ( 2.162 -0.384 -1.106) 2.459 2.964 ( 3.433 -7.763 -0.725) 8.519 3.023 ( 1.543 -0.234 2.194) 2.692 3.057 ( -4.491 -5.622 2.114) 7.499 3.517 ( -4.101 -4.153 -0.518) 5.859 3.598 ( -2.372 -9.259 2.614) 9.909 4.077 ( -3.128 -3.217 2.286) 5.036 4.109 ( -0.975 -25.283 -3.270) 25.512 4.295 ( -4.350 -12.029 0.414) 12.798 4.487 ( 4.587 -6.217 0.656) 7.754 5.096 ( -9.313 -0.918 -3.025) 9.835 5.380 ( -4.121 0.955 0.505) 4.260 5.545 ( -2.638 7.270 -2.202) 8.041 5.650 ( 1.536 -7.108 -0.758) 7.312 6.744 ( -10.602 4.537 12.556) 17.048 7.523 ( -8.942 8.131 0.178) 12.087 7.937 ( -5.554 13.141 5.305) 15.221 8.243 ( 2.513 13.137 4.026) 13.968 8.813 ( 5.249 -9.932 -1.001) 11.278 9.070 ( 5.349 -1.382 -7.567) 9.369 9.700 ( 0.464 3.037 2.585) 4.015 9.894 ( 0.897 -9.005 -0.136) 9.050 10.447 ( -0.525 12.878 -0.136) 12.890 10.506 ( 2.838 0.571 -1.639) 3.326 11.114 ( -12.631 -4.762 2.338) 13.699 11.586 ( 2.345 3.902 4.268) 6.241 14.751 ( -1.388 1.075 -4.199) 4.551 15.309 ( 28.154 18.977 -3.965) 34.183 16.345 ( 17.256 13.007 -2.763) 21.785 16.600 ( 4.993 2.878 -0.344) 5.773 20.074 ( -0.935 -17.461 2.165) 17.619 20.699 ( -3.077 -41.749 -16.966) 45.170======================= Grid point 360 (156/322) =======================q-point: ( 0.23 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.568 ( 3.529 -6.518 15.004) 16.735 1.775 ( 15.919 -17.252 5.021) 24.005 2.308 ( 12.359 -19.705 -6.941) 24.274 2.734 ( 1.064 -14.657 -4.003) 15.231 2.819 ( -4.652 -3.587 2.593) 6.421 3.075 ( -0.605 -5.694 2.286) 6.166 3.161 ( -0.223 -7.552 -0.563) 7.576 3.259 ( 12.803 -12.547 1.373) 17.978 3.602 ( -2.751 -2.203 1.781) 3.949 3.723 ( -0.050 -8.969 0.912) 9.016 4.150 ( -2.166 -5.210 2.594) 6.210 4.334 ( -1.905 -0.550 -0.230) 1.996 4.594 ( 2.303 -13.516 1.528) 13.796 4.874 ( -2.950 -19.064 2.531) 19.456 5.155 ( -4.896 -19.884 -5.697) 21.255 5.326 ( -4.330 0.867 -0.744) 4.479 5.447 ( -2.543 0.631 -2.265) 3.463 5.909 ( -3.829 -20.771 -1.204) 21.155 6.580 ( -14.448 5.848 10.551) 18.822 7.241 ( -10.400 14.210 -0.702) 17.623 7.613 ( 2.559 17.964 1.104) 18.179 8.053 ( 4.838 8.433 5.516) 11.178 8.888 ( 4.271 5.723 -8.118) 10.812 9.147 ( 2.045 -5.274 -1.479) 5.847 9.597 ( -0.663 7.768 5.050) 9.289 10.006 ( 0.125 6.039 -2.413) 6.504 10.246 ( 2.498 -1.594 0.516) 3.007 10.528 ( 2.417 1.976 -2.011) 3.714 11.234 ( -4.966 -13.672 0.823) 14.570 11.502 ( -4.170 3.432 3.961) 6.698 14.728 ( 2.958 1.237 -2.127) 3.848 15.154 ( 19.025 9.588 0.495) 21.310 16.212 ( 7.946 7.645 0.089) 11.027 16.562 ( 5.410 3.732 -0.364) 6.582 20.482 ( -1.647 -22.542 3.974) 22.949 21.287 ( -4.353 -22.792 -15.146) 27.710======================= Grid point 361 (157/322) =======================q-point: ( 0.31 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.681 ( 5.027 0.038 9.439) 10.694 2.168 ( 12.464 -13.307 2.939) 18.468 2.590 ( 1.702 -6.148 -0.898) 6.442 2.915 ( 0.427 -7.816 3.274) 8.484 3.016 ( -1.785 -13.375 -3.590) 13.963 3.220 ( 2.123 -8.296 -0.085) 8.563 3.302 ( 0.314 -6.821 0.647) 6.859 3.511 ( -3.427 -2.742 -1.308) 4.579 3.646 ( 9.493 -8.715 0.179) 12.888 3.995 ( 7.269 -13.385 1.623) 15.318 4.244 ( -0.193 -3.404 1.772) 3.842 4.299 ( -1.690 1.067 1.124) 2.293 4.729 ( -3.555 -2.380 0.658) 4.328 4.963 ( -2.270 0.001 0.739) 2.388 5.314 ( -4.079 -2.109 -2.344) 5.155 5.451 ( -3.892 -4.049 -2.667) 6.218 5.806 ( 0.072 -33.498 -0.790) 33.507 6.208 ( -9.998 -0.060 5.904) 11.611 6.583 ( -16.015 -26.023 -0.530) 30.560 6.896 ( -7.992 12.993 -0.918) 15.282 7.313 ( 9.015 15.639 1.617) 18.124 7.999 ( 8.077 1.659 4.003) 9.166 8.686 ( -2.297 12.303 -9.390) 15.646 9.210 ( 5.116 2.500 0.777) 5.746 9.434 ( -1.532 8.014 7.722) 11.234 9.782 ( -1.745 10.539 -2.297) 10.927 10.349 ( 3.745 2.823 1.143) 4.827 10.459 ( 3.305 1.958 -4.321) 5.782 11.480 ( -5.819 -6.324 3.429) 9.253 11.576 ( -4.528 -21.234 -1.316) 21.751 14.735 ( 4.720 0.067 -0.465) 4.743 15.139 ( 12.770 2.470 0.495) 13.016 16.142 ( 5.300 3.233 0.582) 6.235 16.525 ( 5.025 2.868 -0.765) 5.836 20.899 ( -1.422 -19.467 3.192) 19.778 21.547 ( -2.298 -8.759 -7.941) 12.044======================= Grid point 362 (158/322) =======================q-point: ( 0.38 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.636 ( 6.737 9.563 7.688) 13.998 2.437 ( 7.637 -7.185 2.443) 10.766 2.643 ( -0.335 -0.565 3.266) 3.332 3.081 ( 2.030 -6.035 5.275) 8.269 3.207 ( -4.765 -8.507 -1.000) 9.801 3.407 ( 3.720 -8.361 -3.109) 9.665 3.436 ( 3.369 -5.708 0.637) 6.658 3.523 ( -5.654 -5.011 -1.094) 7.634 3.897 ( 6.435 -9.394 0.566) 11.401 4.186 ( 4.778 2.394 -1.418) 5.529 4.276 ( 2.192 -5.689 -0.202) 6.100 4.349 ( 1.128 -2.798 1.756) 3.491 4.709 ( -8.134 0.620 -3.826) 9.010 4.951 ( -0.419 -1.097 1.845) 2.187 5.328 ( -1.247 -1.150 -0.553) 1.784 5.535 ( -4.986 -7.061 -2.524) 9.005 6.004 ( -17.914 5.099 2.180) 18.753 6.257 ( -0.585 -6.119 0.313) 6.155 6.746 ( -1.619 -4.435 0.189) 4.725 7.038 ( 0.812 -3.655 1.819) 4.163 7.212 ( 1.605 -15.546 -0.421) 15.634 8.082 ( 10.719 -3.452 2.507) 11.537 8.399 ( -6.576 11.784 -7.815) 15.595 9.108 ( 3.373 9.231 4.328) 10.739 9.306 ( -1.198 6.225 6.464) 9.054 9.616 ( -0.872 5.707 -1.979) 6.103 10.214 ( 1.599 8.010 -2.867) 8.657 10.448 ( 1.345 1.742 0.115) 2.204 11.691 ( -1.241 -15.537 -0.231) 15.588 11.960 ( -5.774 -19.936 -1.772) 20.831 14.776 ( 5.008 -1.237 0.507) 5.184 15.172 ( 8.199 1.037 -0.193) 8.267 16.154 ( 4.993 -1.135 0.587) 5.154 16.503 ( 3.659 1.963 -1.442) 4.396 21.223 ( -0.623 -13.669 1.423) 13.757 21.618 ( -0.339 -0.914 -3.099) 3.248======================= Grid point 363 (159/322) =======================q-point: ( 0.46 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.425 ( 6.303 15.826 8.403) 18.994 2.519 ( -0.881 0.721 5.423) 5.541 2.681 ( 4.970 -1.360 1.737) 5.437 3.166 ( 1.813 -1.525 2.337) 3.328 3.316 ( -6.990 -6.260 2.222) 9.643 3.553 ( 2.245 -5.997 -0.967) 6.476 3.570 ( 4.264 -4.539 0.129) 6.229 3.646 ( -0.707 -8.111 0.149) 8.143 4.066 ( 4.118 -3.708 -0.390) 5.555 4.139 ( 0.379 1.323 0.976) 1.687 4.352 ( 0.019 -1.126 -2.295) 2.556 4.387 ( 2.304 0.148 0.456) 2.353 4.601 ( -9.114 3.649 -3.705) 10.493 5.021 ( 0.700 -4.404 -2.716) 5.221 5.351 ( 2.276 -0.930 0.883) 2.612 5.639 ( -4.623 -6.255 -1.843) 7.993 5.833 ( -15.783 1.530 -0.446) 15.863 6.229 ( 0.974 4.069 0.399) 4.203 6.868 ( 2.709 -2.564 1.590) 4.055 6.996 ( 6.726 3.294 2.312) 7.838 7.605 ( -2.363 -16.853 -0.651) 17.031 8.094 ( -4.574 8.410 -6.432) 11.533 8.327 ( 6.632 -9.996 3.568) 12.515 8.942 ( 0.530 9.638 5.819) 11.271 9.185 ( -1.643 5.756 5.017) 7.810 9.494 ( -0.785 6.707 -2.171) 7.093 10.099 ( 1.169 3.501 -3.535) 5.111 10.464 ( -0.628 -3.573 1.009) 3.765 11.986 ( 1.377 -12.730 -3.050) 13.163 12.267 ( -4.416 -14.792 -1.937) 15.558 14.835 ( 4.229 -1.623 1.343) 4.724 15.179 ( 4.347 1.963 -0.711) 4.822 16.229 ( 4.509 -2.921 0.065) 5.373 16.478 ( 1.417 2.084 -1.962) 3.194 21.432 ( 0.058 -7.780 -0.011) 7.780 21.595 ( 0.341 2.383 -0.512) 2.461======================= Grid point 364 (160/322) =======================q-point: ( 0.54 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.191 ( 2.379 9.595 8.898) 13.300 2.493 ( -2.185 0.657 6.763) 7.138 2.707 ( 0.889 1.203 0.589) 1.607 3.197 ( 2.364 -0.409 1.558) 2.861 3.380 ( -4.318 -3.388 2.417) 5.997 3.639 ( 1.369 -1.172 -0.664) 1.921 3.677 ( 3.853 -3.806 2.348) 5.902 3.789 ( 2.125 -5.302 -0.743) 5.760 4.059 ( -1.465 1.873 -1.326) 2.723 4.186 ( 2.967 -1.756 2.991) 4.565 4.341 ( -7.315 2.271 -2.624) 8.096 4.354 ( 1.186 1.230 -1.414) 2.218 4.506 ( -2.777 1.214 -1.581) 3.419 5.069 ( -0.638 -0.569 -4.929) 5.002 5.390 ( 4.040 -0.740 0.758) 4.177 5.701 ( -4.176 -2.543 -1.126) 5.017 5.780 ( -6.341 -3.073 -0.545) 7.068 6.182 ( 1.818 1.227 0.051) 2.194 6.879 ( 6.120 2.876 2.817) 7.325 6.998 ( 1.746 0.212 0.993) 2.020 7.789 ( 0.017 -1.502 -1.130) 1.879 7.948 ( -7.150 -0.627 -4.140) 8.286 8.627 ( 6.646 -13.712 5.648) 16.251 8.741 ( -1.581 11.303 5.185) 12.535 9.096 ( -2.768 2.349 4.127) 5.497 9.358 ( 0.050 5.039 -3.289) 6.018 10.074 ( 0.897 -0.122 -3.143) 3.271 10.542 ( -0.755 -3.155 0.588) 3.297 12.141 ( -0.838 -3.006 -3.675) 4.821 12.486 ( 1.050 -8.472 -2.854) 9.001 14.884 ( 2.212 -0.977 1.688) 2.949 15.146 ( 1.517 3.009 -0.825) 3.469 16.286 ( 2.141 0.011 -0.528) 2.205 16.437 ( -0.417 1.533 -1.900) 2.476 21.527 ( 0.163 -1.018 -0.338) 1.085 21.554 ( 0.120 0.397 0.252) 0.485======================= Grid point 365 (161/322) =======================q-point: (-0.38 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.172 ( -3.803 -6.713 7.391) 10.684 2.512 ( -1.520 -2.651 6.211) 6.922 2.649 ( -3.683 3.583 0.280) 5.146 3.210 ( 0.928 0.708 2.716) 2.956 3.399 ( -0.850 0.701 1.049) 1.522 3.624 ( -0.804 2.444 -0.589) 2.639 3.754 ( 6.105 -0.766 1.749) 6.396 3.843 ( 2.316 1.525 -3.043) 4.117 4.008 ( -3.387 1.561 -0.190) 3.734 4.183 ( -9.133 3.174 -0.488) 9.682 4.251 ( 0.085 0.641 -0.736) 0.980 4.368 ( 3.512 -1.364 1.289) 3.982 4.488 ( -0.816 0.044 -1.003) 1.294 5.024 ( -0.812 3.619 -3.459) 5.072 5.423 ( 4.949 0.044 0.230) 4.954 5.687 ( -3.572 1.165 -0.327) 3.772 5.881 ( 3.319 -8.106 -0.142) 8.760 6.201 ( 1.985 -1.824 -0.326) 2.715 6.854 ( 5.567 3.907 3.508) 7.653 7.003 ( -0.671 -0.373 0.061) 0.770 7.748 ( -4.552 1.055 -1.433) 4.888 7.955 ( -1.802 0.036 -2.276) 2.904 8.485 ( -3.020 11.994 2.901) 12.704 8.942 ( 5.523 -11.701 7.060) 14.739 9.084 ( -4.978 -3.060 3.340) 6.731 9.331 ( 1.844 -2.685 -3.935) 5.108 10.076 ( 0.883 0.227 -3.014) 3.149 10.543 ( -0.965 2.679 0.440) 2.881 12.093 ( -1.643 6.141 -2.604) 6.870 12.575 ( 4.457 1.062 -4.215) 6.226 14.896 ( -0.834 0.453 0.575) 1.109 15.081 ( -0.101 3.778 0.032) 3.780 16.237 ( -1.650 4.251 -0.386) 4.576 16.420 ( -0.501 0.047 -1.477) 1.560 21.512 ( -0.005 1.019 -0.004) 1.019 21.558 ( -0.206 0.522 0.035) 0.562======================= Grid point 366 (162/322) =======================q-point: (-0.31 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.363 ( -7.025 -12.437 5.862) 15.440 2.488 ( -3.233 8.039 1.324) 8.765 2.620 ( -2.407 -4.756 4.078) 6.711 3.182 ( -2.931 2.252 4.049) 5.482 3.327 ( -0.118 6.266 -0.742) 6.311 3.554 ( -1.375 3.455 -1.898) 4.175 3.735 ( 2.502 7.824 -4.904) 9.567 3.779 ( 5.410 4.197 -0.235) 6.851 3.976 ( -4.949 0.150 0.699) 5.000 4.022 ( -8.374 5.803 -2.302) 10.445 4.229 ( 1.149 2.839 -0.339) 3.081 4.445 ( 1.119 -1.308 4.367) 4.695 4.496 ( 2.536 -2.804 0.261) 3.789 4.935 ( 0.750 4.221 -0.439) 4.309 5.449 ( 5.875 0.778 0.002) 5.926 5.627 ( -2.663 2.855 -0.452) 3.930 6.125 ( 10.679 -11.967 0.121) 16.039 6.264 ( 1.584 -3.336 -0.153) 3.696 6.796 ( 0.372 4.358 4.361) 6.177 6.990 ( -1.274 1.539 -1.029) 2.247 7.675 ( -0.002 7.367 -0.871) 7.418 7.880 ( -7.678 3.998 -1.635) 8.810 8.310 ( 2.911 4.082 0.160) 5.016 9.122 ( -2.276 -5.680 2.464) 6.597 9.185 ( -3.299 -7.847 6.542) 10.736 9.463 ( 3.302 -8.755 -3.496) 9.989 10.087 ( 0.818 -2.305 -3.106) 3.954 10.456 ( -1.502 4.360 0.613) 4.651 11.898 ( -0.305 12.187 -0.681) 12.210 12.467 ( 4.595 12.063 -4.777) 13.764 14.854 ( -3.577 2.496 -2.076) 4.830 15.006 ( -0.811 3.528 2.347) 4.315 16.137 ( -2.973 3.938 0.203) 4.939 16.411 ( -1.061 0.155 -0.945) 1.429 21.440 ( -0.087 7.039 -0.069) 7.040 21.575 ( 0.130 -2.676 -0.345) 2.702======================= Grid point 367 (163/322) =======================q-point: (-0.23 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.522 ( -5.897 -5.601 7.035) 10.753 2.238 ( -3.868 15.342 2.629) 16.039 2.693 ( -1.614 -1.668 1.555) 2.794 3.075 ( -6.243 6.876 2.729) 9.680 3.203 ( 1.835 5.708 -0.190) 5.998 3.461 ( -3.727 4.718 -5.172) 7.931 3.553 ( 4.260 10.643 -2.873) 11.818 3.701 ( 2.438 5.004 -1.939) 5.895 3.735 ( -11.544 13.359 -3.528) 18.004 4.032 ( 2.200 -0.869 0.461) 2.410 4.159 ( 1.639 4.184 3.815) 5.894 4.405 ( -2.523 3.309 0.756) 4.229 4.626 ( 5.353 -4.807 5.391) 8.990 4.896 ( 1.182 -0.109 1.036) 1.576 5.440 ( 5.415 3.880 -0.820) 6.712 5.546 ( -1.619 3.883 -1.085) 4.345 6.262 ( 2.076 7.107 0.025) 7.404 6.448 ( 9.480 -8.322 1.030) 12.657 6.735 ( -0.061 -2.696 3.500) 4.419 6.967 ( -5.021 -4.031 -0.600) 6.467 7.362 ( 7.239 25.548 -2.578) 26.678 7.784 ( -11.369 -1.057 0.845) 11.450 8.373 ( 6.536 -6.402 -1.799) 9.325 9.205 ( -5.396 -4.676 0.227) 7.144 9.332 ( -2.953 -8.676 6.713) 11.361 9.658 ( 1.871 -9.699 -3.993) 10.654 10.180 ( 0.705 -6.359 -2.497) 6.868 10.397 ( -1.844 0.088 -0.478) 1.907 11.646 ( 1.706 12.838 2.409) 13.173 12.149 ( 2.703 21.289 -3.950) 21.820 14.759 ( -3.503 4.204 -2.291) 5.933 14.946 ( -2.171 2.041 2.714) 4.030 16.067 ( -2.612 1.306 0.447) 2.955 16.408 ( -1.167 -0.817 -0.354) 1.468 21.237 ( -0.569 13.544 1.600) 13.650 21.638 ( 1.662 -2.649 -3.831) 4.945======================= Grid point 368 (164/322) =======================q-point: (-0.15 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.528 ( -2.525 3.416 11.280) 12.053 1.863 ( -1.942 21.110 5.330) 21.858 2.598 ( -2.962 11.759 -4.014) 12.773 2.917 ( -1.432 5.679 1.209) 5.981 3.069 ( 0.924 10.697 0.682) 10.759 3.290 ( -4.165 8.302 -9.260) 13.116 3.335 ( -2.421 16.488 1.050) 16.698 3.410 ( -3.562 8.517 1.329) 9.327 3.662 ( 0.637 -0.366 -2.164) 2.285 3.946 ( -0.656 8.656 -0.331) 8.687 4.182 ( 3.236 -2.225 6.549) 7.637 4.321 ( -0.845 3.435 -0.086) 3.538 4.699 ( 1.805 1.523 4.197) 4.816 4.959 ( 1.543 -4.439 1.231) 4.858 5.363 ( 5.518 6.134 -1.208) 8.338 5.453 ( -0.568 5.165 -1.466) 5.399 5.857 ( -1.712 30.067 -1.750) 30.167 6.452 ( -3.511 11.047 1.708) 11.716 6.829 ( 6.508 14.615 2.429) 16.182 7.100 ( 3.441 -12.936 -1.037) 13.426 7.159 ( -1.006 -19.531 0.071) 19.557 7.794 ( -5.935 -5.001 3.011) 8.325 8.571 ( 7.847 -8.635 -3.260) 12.115 9.228 ( -3.967 -0.026 -0.893) 4.067 9.518 ( -5.271 -10.979 5.587) 13.399 9.855 ( 0.251 -10.735 -5.254) 11.955 10.247 ( -0.332 0.931 0.752) 1.242 10.456 ( -1.060 -7.009 -5.645) 9.062 11.463 ( 3.259 7.573 6.049) 10.226 11.699 ( 0.463 22.897 -0.945) 22.921 14.660 ( -0.330 4.071 0.235) 4.091 14.908 ( -3.772 0.346 0.839) 3.879 16.060 ( -1.513 -1.683 0.545) 2.327 16.435 ( -0.733 -2.557 -0.053) 2.661 20.910 ( -0.880 19.595 3.500) 19.925 21.647 ( 2.734 3.235 -10.457) 11.282======================= Grid point 369 (165/322) =======================q-point: (-0.08 0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.418 ( 1.778 9.983 16.399) 19.281 1.441 ( 2.555 21.496 9.624) 23.691 2.167 ( 0.656 29.877 -3.222) 30.058 2.743 ( 0.362 15.517 0.449) 15.528 2.857 ( -0.016 6.002 -2.220) 6.399 3.061 ( -4.850 6.344 -3.720) 8.809 3.119 ( 0.265 8.076 -0.596) 8.103 3.248 ( -2.280 7.491 1.719) 8.017 3.682 ( -1.228 -0.284 0.898) 1.548 3.755 ( -2.885 8.411 -2.147) 9.147 4.179 ( -1.159 3.911 4.428) 6.021 4.328 ( 2.935 -2.591 1.077) 4.061 4.562 ( 0.560 14.820 0.109) 14.831 4.913 ( -3.878 19.970 -0.139) 20.344 5.206 ( 3.117 9.879 -3.293) 10.870 5.344 ( 9.029 0.031 1.365) 9.132 5.462 ( -4.342 2.586 -1.181) 5.190 6.006 ( -3.481 23.553 -3.556) 24.073 6.761 ( -3.705 -2.456 9.571) 10.552 7.385 ( -1.180 -14.103 -0.037) 14.153 7.635 ( -0.449 -24.668 -0.456) 24.676 7.928 ( -1.295 -10.267 5.905) 11.914 8.749 ( 8.150 -4.203 -4.106) 10.047 9.147 ( 0.004 6.727 -2.158) 7.065 9.666 ( -7.165 -6.196 4.275) 10.392 10.036 ( -0.984 -4.779 -6.592) 8.201 10.234 ( -1.083 -4.993 -0.349) 5.121 10.525 ( -1.377 0.664 -4.255) 4.522 11.305 ( -0.823 8.688 2.028) 8.960 11.466 ( 3.623 1.571 8.395) 9.278 14.629 ( 8.409 0.439 3.286) 9.039 14.890 ( -4.372 -0.938 -0.907) 4.563 16.110 ( 0.294 -3.504 0.727) 3.591 16.495 ( 0.086 -3.569 -0.109) 3.572 20.488 ( -0.992 22.636 4.233) 23.050 21.441 ( 2.045 18.962 -20.354) 27.893======================= Grid point 372 (166/322) =======================q-point: ( 0.15 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.117 ( 19.564 0.000 9.550) 21.770 1.355 ( 10.963 0.000 19.829) 22.658 1.773 ( 25.885 0.000 1.596) 25.934 2.315 ( 4.257 0.000 -8.388) 9.406 2.844 ( 0.274 0.000 -0.834) 0.878 2.857 ( -3.045 -0.000 3.382) 4.551 2.956 ( -6.012 -0.000 -1.887) 6.301 3.071 ( 10.339 0.000 4.974) 11.474 3.454 ( -2.481 -0.000 4.159) 4.843 3.480 ( -2.086 -0.000 1.018) 2.321 3.776 ( 2.536 0.000 -2.361) 3.465 4.025 ( -4.500 -0.000 2.126) 4.977 4.157 ( -1.439 -0.000 -0.231) 1.457 4.474 ( 1.794 0.000 0.131) 1.799 5.019 ( -12.363 -0.000 -2.054) 12.533 5.371 ( -3.364 -0.000 1.109) 3.542 5.575 ( -6.975 -0.000 -2.667) 7.467 5.620 ( -0.710 -0.000 -2.214) 2.325 6.757 ( -9.492 -0.000 14.268) 17.137 7.548 ( -10.279 -0.000 0.636) 10.299 8.044 ( -6.630 -0.000 9.307) 11.427 8.450 ( -0.061 -0.000 2.598) 2.598 8.667 ( 7.358 0.000 -0.069) 7.358 9.091 ( 6.210 0.000 -9.067) 10.990 9.719 ( 0.757 0.000 0.457) 0.885 9.834 ( 5.861 0.000 3.538) 6.846 10.514 ( 4.913 0.000 -1.519) 5.143 10.637 ( -0.516 -0.000 -0.726) 0.891 10.938 ( -18.495 -0.000 2.646) 18.683 11.651 ( 0.814 0.000 3.210) 3.312 14.755 ( 2.620 0.000 -4.040) 4.815 15.642 ( 13.078 0.000 -9.253) 16.021 16.652 ( 8.352 0.000 -1.591) 8.502 16.774 ( 33.562 0.000 -20.660) 39.412 19.876 ( -0.136 -0.000 0.101) 0.169 20.111 ( -0.028 -0.000 -0.070) 0.075======================= Grid point 373 (167/322) =======================q-point: ( 0.23 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.465 ( 9.676 -11.260 13.633) 20.156 1.532 ( 12.653 -14.311 10.595) 21.844 2.059 ( 26.228 -12.603 -5.973) 29.706 2.468 ( 3.590 -12.065 -6.134) 14.003 2.769 ( -6.902 0.967 2.896) 7.547 2.938 ( -5.386 -6.234 2.485) 8.605 2.989 ( -5.839 -6.933 -0.522) 9.079 3.213 ( 22.503 -3.966 1.957) 22.934 3.503 ( 1.832 -4.545 4.187) 6.445 3.573 ( -2.927 -8.789 2.598) 9.620 4.047 ( -2.935 -4.428 1.859) 5.628 4.088 ( -0.241 -22.150 -2.437) 22.285 4.282 ( 0.095 -14.795 1.752) 14.898 4.515 ( -0.007 -6.162 -0.876) 6.224 4.950 ( -13.240 -1.414 -2.779) 13.602 5.333 ( -4.886 1.881 0.803) 5.297 5.469 ( -7.401 3.662 -3.035) 8.797 5.647 ( -2.812 -4.909 -1.701) 5.908 6.667 ( -9.127 6.083 14.606) 18.265 7.404 ( -11.041 8.341 0.285) 13.840 7.915 ( -1.457 10.842 5.731) 12.350 8.279 ( 1.482 11.661 3.565) 12.284 8.874 ( 5.551 -9.753 -1.495) 11.322 9.088 ( 2.186 0.997 -8.157) 8.503 9.725 ( 2.252 2.747 1.775) 3.971 9.936 ( 5.177 -7.048 2.206) 9.019 10.425 ( -2.843 14.317 0.031) 14.596 10.551 ( 4.913 -0.807 -0.907) 5.061 10.982 ( -10.556 -9.313 1.379) 14.144 11.587 ( -3.982 5.558 1.855) 7.084 14.772 ( 6.817 0.836 -2.188) 7.208 15.533 ( 13.538 14.260 -5.310) 20.367 16.563 ( 20.736 20.989 -6.946) 30.311 16.677 ( 8.624 4.772 -1.299) 9.941 20.069 ( -1.080 -17.360 1.920) 17.499 20.612 ( -3.914 -37.781 -11.798) 39.774======================= Grid point 374 (168/322) =======================q-point: ( 0.31 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.661 ( 5.265 -5.881 12.116) 14.461 1.971 ( 15.239 -15.903 3.729) 22.339 2.438 ( 11.844 -11.773 -4.772) 17.368 2.729 ( -2.597 -12.215 -1.473) 12.574 2.783 ( 0.871 -6.921 0.136) 6.977 3.056 ( -3.159 -8.251 1.307) 8.931 3.134 ( -2.986 -9.686 0.997) 10.185 3.429 ( 9.902 -5.901 -0.016) 11.527 3.608 ( 2.765 -1.366 1.126) 3.283 3.776 ( 10.950 -13.154 4.760) 17.764 4.133 ( -2.120 -5.664 2.177) 6.428 4.316 ( -0.701 -1.638 -0.169) 1.789 4.632 ( 2.486 -10.742 3.203) 11.481 4.809 ( -8.886 -13.943 -0.357) 16.538 5.074 ( -5.341 -28.630 -5.116) 29.570 5.267 ( -7.315 -1.463 -2.190) 7.775 5.394 ( -3.078 0.474 -1.202) 3.338 5.835 ( -8.703 -20.283 -2.008) 22.163 6.457 ( -11.956 10.916 12.393) 20.389 7.114 ( -10.417 13.588 -0.442) 17.127 7.669 ( 6.193 14.988 1.562) 16.293 8.113 ( 2.294 6.257 5.324) 8.530 8.874 ( -1.218 8.893 -10.719) 13.981 9.184 ( 4.307 -7.324 0.183) 8.499 9.626 ( 2.864 8.814 4.812) 10.442 9.995 ( -1.221 9.716 -0.598) 9.811 10.289 ( 4.286 -6.347 0.863) 7.707 10.552 ( 2.359 3.839 -1.234) 4.671 11.179 ( -4.511 -15.838 0.270) 16.471 11.437 ( -8.291 4.641 1.381) 9.601 14.789 ( 8.148 1.627 -0.176) 8.310 15.347 ( 13.759 10.620 -1.553) 17.450 16.319 ( 10.305 11.662 -0.757) 15.581 16.632 ( 6.684 4.558 -0.825) 8.132 20.474 ( -1.744 -22.543 3.564) 22.890 21.191 ( -4.683 -24.453 -11.495) 27.423======================= Grid point 375 (169/322) =======================q-point: ( 0.38 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.782 ( 7.581 -0.184 8.532) 11.415 2.321 ( 11.702 -10.878 2.564) 16.181 2.600 ( -0.556 -3.836 1.703) 4.234 2.909 ( -4.474 -10.674 4.776) 12.520 3.027 ( 6.661 -10.316 -3.541) 12.780 3.231 ( -0.290 -10.375 -0.026) 10.380 3.313 ( 0.994 -8.695 0.900) 8.798 3.460 ( -3.890 1.385 -1.471) 4.384 3.756 ( 8.635 -8.915 -0.131) 12.411 4.120 ( 11.063 -11.193 0.470) 15.745 4.257 ( 1.874 -7.214 2.799) 7.962 4.285 ( -0.060 3.476 1.030) 3.626 4.660 ( -8.131 0.501 -1.772) 8.337 4.932 ( -2.952 -2.101 1.111) 3.790 5.237 ( -8.517 -4.668 -5.360) 11.094 5.391 ( -4.359 -3.916 -0.604) 5.890 5.812 ( 1.320 -33.548 -0.497) 33.578 6.111 ( -10.010 10.106 7.113) 15.904 6.398 ( -14.434 -33.446 -1.505) 36.458 6.812 ( -5.985 10.395 -0.105) 11.995 7.437 ( 10.924 13.587 2.364) 17.593 8.088 ( 4.736 -0.708 4.129) 6.323 8.605 ( -5.646 13.539 -10.389) 17.976 9.282 ( 5.897 2.005 1.064) 6.319 9.457 ( 1.416 9.650 7.704) 12.429 9.754 ( -1.980 10.167 -1.522) 10.469 10.387 ( 2.035 6.762 0.896) 7.118 10.489 ( 3.576 -0.109 -3.438) 4.961 11.407 ( -7.589 -8.644 1.449) 11.594 11.525 ( -3.666 -20.413 -0.602) 20.748 14.810 ( 7.858 0.863 1.102) 7.982 15.275 ( 10.277 4.450 -0.846) 11.231 16.212 ( 6.191 4.338 0.419) 7.572 16.581 ( 4.812 3.771 -1.314) 6.253 20.892 ( -1.336 -19.663 2.902) 19.921 21.497 ( -2.249 -10.969 -6.478) 12.936======================= Grid point 376 (170/322) =======================q-point: ( 0.46 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.752 ( 8.589 9.924 8.239) 15.497 2.514 ( 3.007 -2.994 4.078) 5.885 2.667 ( 2.868 -3.165 2.602) 5.001 3.084 ( -5.348 -8.519 6.215) 11.824 3.194 ( 4.855 -3.760 -1.871) 6.419 3.437 ( 2.985 -8.110 -1.278) 8.736 3.457 ( -5.175 -6.310 -0.448) 8.173 3.488 ( 4.578 -7.610 -0.013) 8.881 3.976 ( 6.928 -7.991 0.989) 10.623 4.197 ( -2.552 4.295 1.205) 5.139 4.288 ( -0.150 -4.786 -1.706) 5.083 4.404 ( 5.851 -1.357 0.175) 6.009 4.596 ( -7.390 0.789 -4.480) 8.678 4.937 ( -1.605 -2.399 0.150) 2.890 5.289 ( -5.904 -5.383 -4.250) 9.050 5.477 ( -2.992 -6.663 -0.039) 7.304 5.820 ( -14.146 8.111 2.656) 16.521 6.259 ( 0.565 -6.422 0.102) 6.447 6.727 ( -1.597 -6.827 -0.052) 7.011 6.997 ( -5.495 -24.770 -0.407) 25.376 7.311 ( 11.480 2.853 3.532) 12.345 8.186 ( 5.154 -3.706 1.905) 6.628 8.291 ( -6.607 10.791 -7.043) 14.481 9.168 ( 4.249 10.778 3.617) 12.137 9.314 ( -0.788 7.141 6.574) 9.739 9.601 ( -0.712 5.391 -1.785) 5.723 10.223 ( 1.427 8.350 -2.677) 8.884 10.452 ( -0.748 2.876 0.114) 2.974 11.677 ( -0.521 -18.225 -1.056) 18.263 11.892 ( -5.091 -19.171 -0.962) 19.859 14.851 ( 6.956 -0.246 1.780) 7.185 15.256 ( 6.159 2.904 -1.101) 6.898 16.216 ( 5.153 -0.866 0.369) 5.238 16.534 ( 2.434 3.022 -1.936) 4.336 21.221 ( -0.441 -13.868 1.344) 13.940 21.604 ( -0.379 -2.184 -2.771) 3.548======================= Grid point 377 (171/322) =======================q-point: ( 0.54 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.527 ( 6.128 17.522 8.711) 20.505 2.522 ( -1.513 1.724 6.477) 6.871 2.733 ( 2.595 -0.269 1.069) 2.819 3.180 ( -2.771 -3.077 4.978) 6.476 3.286 ( 3.539 -4.475 -1.464) 5.890 3.565 ( -1.653 -6.303 0.055) 6.516 3.601 ( 2.653 -6.008 1.921) 6.843 3.673 ( 4.554 -7.811 -0.905) 9.087 4.096 ( -2.286 3.192 -0.911) 4.031 4.143 ( 2.697 -4.533 2.972) 6.054 4.333 ( -3.368 -0.125 -2.275) 4.066 4.382 ( -1.638 1.739 -2.058) 3.153 4.525 ( -1.903 2.596 -1.406) 3.512 5.008 ( -0.604 -4.018 -4.373) 5.969 5.358 ( -1.048 -4.170 -2.423) 4.935 5.591 ( -2.842 -5.935 0.386) 6.592 5.673 ( -10.816 -0.682 0.075) 10.838 6.241 ( 0.765 3.601 -0.249) 3.690 6.879 ( -0.298 -5.281 0.023) 5.290 7.112 ( 9.853 5.035 3.693) 11.665 7.596 ( 1.088 -17.393 0.564) 17.436 7.989 ( -8.268 9.561 -5.770) 13.895 8.415 ( 4.968 -11.395 3.873) 13.020 8.973 ( 1.533 11.502 4.349) 12.392 9.179 ( -1.824 6.345 4.971) 8.264 9.476 ( -1.057 6.813 -2.195) 7.236 10.103 ( 1.266 3.725 -3.365) 5.177 10.453 ( -1.536 -3.809 0.937) 4.213 11.993 ( 1.618 -11.808 -2.810) 12.245 12.217 ( -3.255 -16.960 -1.758) 17.359 14.897 ( 5.184 -0.238 2.204) 5.638 15.219 ( 2.844 3.316 -1.259) 4.546 16.282 ( 4.443 -2.178 -0.277) 4.956 16.478 ( -0.253 3.126 -2.210) 3.837 21.433 ( 0.185 -7.815 0.019) 7.817 21.596 ( 0.115 2.034 -0.570) 2.116======================= Grid point 378 (172/322) =======================q-point: ( 0.62 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.239 ( 1.003 12.800 8.236) 15.254 2.491 ( -1.900 0.750 7.028) 7.319 2.704 ( -1.133 3.198 0.227) 3.400 3.213 ( -1.757 -0.972 4.556) 4.979 3.389 ( 5.159 -2.847 -0.739) 5.939 3.627 ( -2.712 -1.324 -0.662) 3.089 3.734 ( 4.222 -4.722 3.067) 7.037 3.820 ( 3.559 -4.452 -1.770) 5.968 4.021 ( -4.624 1.729 -0.384) 4.952 4.197 ( -4.183 2.632 0.319) 4.952 4.258 ( -1.214 0.402 -2.160) 2.510 4.379 ( 2.999 -0.055 1.232) 3.243 4.483 ( -1.600 0.629 -1.339) 2.179 5.039 ( -1.847 -0.565 -4.938) 5.302 5.427 ( 3.165 -2.347 -1.488) 4.212 5.656 ( -3.631 -2.289 0.664) 4.343 5.715 ( -4.057 -7.566 -0.449) 8.597 6.197 ( 0.800 0.879 -0.737) 1.398 6.930 ( 1.160 -0.944 0.377) 1.542 7.068 ( 8.638 5.640 3.725) 10.968 7.766 ( -3.960 4.361 -2.533) 6.413 7.878 ( -1.644 -7.162 -0.811) 7.393 8.658 ( -2.900 -2.699 4.583) 6.058 8.781 ( 4.073 1.685 4.373) 6.209 9.075 ( -2.452 3.331 3.677) 5.534 9.348 ( -0.049 4.154 -3.129) 5.201 10.077 ( 1.070 -0.058 -3.025) 3.209 10.533 ( -1.054 -3.259 0.495) 3.461 12.126 ( 0.123 -1.957 -2.475) 3.158 12.488 ( 0.928 -10.649 -3.682) 11.306 14.917 ( 2.303 0.944 1.890) 3.125 15.158 ( 0.999 3.771 -0.984) 4.023 16.311 ( 2.416 2.477 -0.861) 3.566 16.419 ( -1.588 0.967 -1.751) 2.554 21.528 ( 0.060 -0.908 -0.337) 0.970 21.556 ( 0.108 0.480 0.221) 0.539======================= Grid point 379 (173/322) =======================q-point: (-0.31 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.147 ( -4.208 -3.818 6.511) 8.641 2.514 ( -1.622 -3.204 6.180) 7.148 2.612 ( -2.510 5.016 0.111) 5.610 3.207 ( -2.837 1.153 4.946) 5.817 3.426 ( 4.203 2.377 -0.862) 4.905 3.592 ( -3.701 2.231 -1.843) 4.698 3.839 ( 5.885 -2.259 1.698) 6.529 3.850 ( 1.091 2.865 -2.951) 4.256 3.977 ( -1.166 1.244 -0.127) 1.710 4.061 ( -8.767 4.775 -2.466) 10.284 4.264 ( 1.090 0.574 -0.236) 1.254 4.427 ( 3.301 -1.896 4.849) 6.165 4.471 ( -0.078 -0.747 -1.694) 1.853 5.002 ( -1.219 2.481 -3.425) 4.401 5.482 ( 5.918 -0.785 -0.530) 5.993 5.644 ( -4.364 0.861 0.692) 4.501 5.907 ( 1.396 -12.509 0.030) 12.586 6.212 ( 0.146 -2.129 -0.963) 2.342 6.947 ( 6.294 3.560 2.278) 7.582 6.999 ( 0.510 3.150 1.572) 3.557 7.673 ( -5.915 0.807 -1.270) 6.103 7.953 ( 1.536 0.843 -0.882) 1.962 8.464 ( -1.931 10.255 1.359) 10.523 8.998 ( -2.231 -10.732 7.157) 13.091 9.042 ( -1.160 -1.331 2.550) 3.102 9.342 ( 2.010 -3.886 -3.749) 5.762 10.077 ( 0.988 0.298 -2.987) 3.160 10.533 ( -0.955 2.802 0.336) 2.979 12.080 ( 0.535 6.147 -1.540) 6.360 12.599 ( 2.060 0.052 -5.074) 5.477 14.888 ( -0.890 2.588 0.161) 2.742 15.085 ( 0.605 3.982 0.325) 4.041 16.221 ( -0.805 5.623 -0.487) 5.701 16.411 ( -0.301 0.018 -1.236) 1.272 21.513 ( 0.160 0.938 0.039) 0.952 21.556 ( -0.238 0.728 0.010) 0.766======================= Grid point 380 (174/322) =======================q-point: (-0.23 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.308 ( -5.186 -12.040 5.406) 14.180 2.464 ( -1.493 9.025 1.007) 9.203 2.608 ( -1.990 -5.398 4.352) 7.214 3.148 ( -4.283 3.611 4.738) 7.337 3.344 ( 2.794 6.921 -0.833) 7.510 3.510 ( -3.756 3.402 -4.273) 6.628 3.739 ( -0.130 7.301 -2.478) 7.711 3.829 ( 0.672 6.737 -2.017) 7.064 3.895 ( -2.598 7.203 -2.428) 8.033 3.997 ( 1.141 -2.737 0.630) 3.031 4.244 ( 1.298 2.367 1.059) 2.900 4.430 ( -2.505 0.911 0.200) 2.673 4.570 ( 6.730 -5.187 5.176) 9.950 4.931 ( -0.994 3.196 -1.279) 3.583 5.519 ( 5.667 1.047 0.213) 5.767 5.590 ( -3.362 2.078 -0.084) 3.953 6.210 ( 4.205 -16.301 0.274) 16.837 6.272 ( -0.187 -3.686 -0.554) 3.732 6.825 ( 0.806 8.847 4.549) 9.980 6.973 ( -0.859 2.207 -1.293) 2.698 7.653 ( -1.568 -0.532 -0.177) 1.665 7.829 ( -0.984 12.353 -1.739) 12.514 8.345 ( 2.780 1.169 -0.198) 3.022 9.073 ( -5.850 -4.855 0.908) 7.656 9.181 ( -1.883 -7.076 7.250) 10.305 9.488 ( 2.605 -8.561 -3.117) 9.476 10.089 ( 1.075 -2.282 -3.140) 4.028 10.442 ( -0.952 4.616 0.482) 4.738 11.904 ( 1.487 11.603 0.097) 11.698 12.484 ( 0.975 11.790 -5.403) 13.006 14.814 ( -2.294 3.596 -1.692) 4.589 15.012 ( 0.761 3.996 1.921) 4.498 16.112 ( -1.157 4.362 0.138) 4.515 16.403 ( 0.139 0.386 -0.738) 0.844 21.438 ( -0.152 7.195 -0.038) 7.197 21.577 ( 0.334 -2.990 -0.376) 3.032======================= Grid point 381 (175/322) =======================q-point: (-0.15 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.494 ( -2.647 -6.946 6.994) 10.207 2.227 ( 0.543 15.043 2.791) 15.309 2.676 ( -1.905 -0.866 1.457) 2.550 3.028 ( -3.130 6.474 2.591) 7.644 3.226 ( 2.125 6.313 0.298) 6.668 3.392 ( -3.645 5.868 -6.957) 9.804 3.564 ( -4.603 9.365 -0.373) 10.441 3.653 ( 1.358 11.575 -3.661) 12.216 3.711 ( 0.428 7.635 -1.343) 7.764 4.058 ( 2.172 0.248 -0.933) 2.377 4.194 ( 2.009 2.675 4.425) 5.548 4.380 ( -1.918 2.834 -0.042) 3.422 4.715 ( 6.753 -3.126 6.460) 9.854 4.890 ( -2.250 -1.157 -0.070) 2.531 5.487 ( 0.306 3.648 -0.622) 3.713 5.529 ( 1.480 3.772 -0.935) 4.158 6.265 ( -0.827 8.849 -0.394) 8.897 6.509 ( -1.070 -4.985 1.604) 5.345 6.746 ( 0.262 -8.270 3.844) 9.124 6.922 ( -1.903 -1.672 -1.641) 3.019 7.415 ( 1.598 25.915 -2.380) 26.073 7.703 ( -1.002 -2.820 0.821) 3.103 8.441 ( 5.742 -7.516 -1.748) 9.618 9.142 ( -5.272 -4.998 -0.139) 7.266 9.317 ( -3.122 -7.745 6.978) 10.883 9.659 ( 0.528 -8.562 -3.790) 9.378 10.184 ( 1.271 -6.433 -2.530) 7.028 10.384 ( 0.047 0.580 -0.647) 0.870 11.676 ( 1.650 11.829 2.896) 12.290 12.145 ( -1.034 21.195 -4.294) 21.651 14.729 ( -0.987 3.424 -1.591) 3.903 14.946 ( 1.133 3.538 2.050) 4.243 16.051 ( -0.324 1.347 0.406) 1.444 16.405 ( 0.847 -0.601 -0.288) 1.077 21.235 ( -0.722 13.455 1.616) 13.571 21.642 ( 1.098 -2.573 -3.883) 4.785======================= Grid point 382 (176/322) =======================q-point: (-0.08 0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.552 ( 0.403 1.597 11.316) 11.436 1.905 ( 5.969 19.640 5.049) 21.139 2.569 ( 0.178 11.794 -3.995) 12.454 2.908 ( -0.816 4.645 0.972) 4.815 3.080 ( -0.058 11.200 0.544) 11.213 3.198 ( -3.498 10.198 -6.890) 12.795 3.323 ( -1.673 11.107 0.703) 11.254 3.419 ( 3.637 12.031 1.110) 12.618 3.648 ( -2.009 -0.754 -2.036) 2.958 3.937 ( -0.568 10.331 0.524) 10.360 4.224 ( 1.055 -0.889 4.752) 4.949 4.315 ( -0.252 1.652 -0.051) 1.672 4.735 ( 1.824 4.063 3.026) 5.385 4.963 ( -0.589 -4.632 1.977) 5.070 5.403 ( -0.041 4.059 -1.830) 4.453 5.455 ( 2.768 4.482 -1.096) 5.381 5.831 ( -1.587 31.286 -1.655) 31.370 6.393 ( -7.257 12.319 2.236) 14.472 6.855 ( -3.944 16.832 2.229) 17.431 7.079 ( -4.300 -14.566 -0.789) 15.208 7.176 ( 2.019 -19.663 -0.450) 19.771 7.791 ( 3.964 -5.202 3.133) 7.251 8.652 ( 7.452 -9.280 -3.985) 12.551 9.186 ( -2.456 -1.242 -1.137) 2.978 9.474 ( -5.111 -9.223 6.252) 12.259 9.836 ( -0.851 -10.597 -4.574) 11.573 10.259 ( 2.110 1.510 0.641) 2.673 10.438 ( 0.820 -6.077 -5.214) 8.049 11.507 ( 0.808 6.705 5.951) 9.001 11.682 ( -2.578 21.880 -1.424) 22.078 14.680 ( 2.346 1.366 -0.065) 2.715 14.900 ( 2.983 2.232 1.029) 3.865 16.059 ( 1.123 -1.891 0.535) 2.263 16.441 ( 1.768 -2.326 -0.104) 2.923 20.909 ( -1.164 19.433 3.533) 19.786 21.633 ( 0.452 4.296 -10.261) 11.134======================= Grid point 386 (177/322) =======================q-point: ( 0.23 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.387 ( 21.865 0.000 6.682) 22.863 1.493 ( 4.514 0.000 17.545) 18.116 2.109 ( 31.032 0.000 -6.223) 31.649 2.347 ( 5.220 0.000 -7.505) 9.142 2.750 ( -12.984 -0.000 4.123) 13.623 2.821 ( -5.460 -0.000 2.384) 5.957 2.871 ( -6.685 -0.000 -1.171) 6.787 3.326 ( 23.168 0.000 1.119) 23.195 3.437 ( -2.828 -0.000 4.751) 5.529 3.505 ( 7.476 0.000 7.635) 10.685 3.798 ( 2.450 0.000 -2.769) 3.697 3.984 ( -3.425 -0.000 2.311) 4.131 4.157 ( 0.398 0.000 0.211) 0.451 4.462 ( -2.646 -0.000 -2.395) 3.569 4.864 ( -12.991 -0.000 -0.854) 13.019 5.320 ( -8.233 -0.000 0.131) 8.234 5.458 ( -7.262 -0.000 -2.245) 7.602 5.583 ( -6.282 -0.000 -2.633) 6.811 6.714 ( -5.744 -0.000 16.862) 17.813 7.426 ( -10.524 -0.000 0.844) 10.558 8.014 ( -3.829 -0.000 9.331) 10.086 8.457 ( 0.085 0.000 1.621) 1.623 8.753 ( 7.126 0.000 -0.092) 7.126 9.111 ( 2.424 0.000 -9.244) 9.557 9.729 ( 0.682 0.000 0.081) 0.687 9.935 ( 8.985 0.000 3.586) 9.674 10.566 ( 4.353 0.000 -1.039) 4.475 10.629 ( -0.480 -0.000 -0.495) 0.690 10.752 ( -14.647 -0.000 2.348) 14.834 11.621 ( -6.550 -0.000 0.103) 6.551 14.834 ( 11.628 0.000 -0.176) 11.630 15.708 ( 3.955 0.000 -6.036) 7.217 16.751 ( 9.694 0.000 -0.691) 9.719 17.046 ( 24.227 0.000 -24.036) 34.127 19.875 ( -0.156 -0.000 0.103) 0.187 20.110 ( -0.046 -0.000 -0.079) 0.092======================= Grid point 387 (178/322) =======================q-point: ( 0.31 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.593 ( 6.190 -5.260 13.359) 15.635 1.736 ( 17.677 -16.891 4.555) 24.870 2.333 ( 20.996 -6.484 -5.097) 22.558 2.493 ( 2.845 -10.469 -4.833) 11.877 2.687 ( -5.498 -2.141 2.881) 6.566 2.869 ( -7.399 -7.473 0.080) 10.517 2.928 ( -4.249 -8.127 1.566) 9.304 3.411 ( 8.123 -1.060 -0.796) 8.230 3.539 ( -2.686 -7.384 2.993) 8.408 3.678 ( 24.052 -7.043 8.977) 26.622 4.021 ( -2.430 -5.063 2.160) 6.017 4.094 ( 2.022 -21.221 -1.458) 21.367 4.289 ( 0.038 -15.570 1.844) 15.679 4.492 ( -2.044 -7.555 -2.681) 8.273 4.783 ( -13.764 -0.203 -1.666) 13.866 5.226 ( -13.400 2.077 -2.804) 13.847 5.407 ( -2.167 1.726 -0.390) 2.798 5.560 ( -10.466 -3.864 -2.565) 11.448 6.633 ( -5.021 8.101 17.051) 19.533 7.278 ( -10.199 8.725 0.577) 13.434 7.932 ( 0.948 7.853 6.116) 9.999 8.298 ( 0.051 11.198 2.548) 11.484 8.923 ( 3.561 -6.190 -3.612) 8.002 9.080 ( 1.097 -0.092 -6.568) 6.660 9.759 ( 2.577 0.586 1.184) 2.896 10.017 ( 6.806 -3.640 3.150) 8.336 10.386 ( -3.603 12.626 0.247) 13.133 10.604 ( 4.035 0.012 -0.079) 4.035 10.880 ( -7.425 -11.853 0.728) 14.005 11.509 ( -8.919 6.030 -1.484) 10.868 14.890 ( 12.889 2.081 1.711) 13.168 15.621 ( 5.200 9.181 -4.390) 11.428 16.749 ( 13.020 11.783 -3.099) 17.831 16.794 ( 13.812 18.304 -8.180) 24.346 20.062 ( -1.066 -17.153 1.626) 17.263 20.539 ( -3.217 -34.085 -7.673) 35.085======================= Grid point 388 (179/322) =======================q-point: ( 0.38 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.770 ( 7.767 -5.983 9.521) 13.667 2.153 ( 14.049 -14.227 2.843) 20.196 2.507 ( -0.684 -4.901 0.807) 5.014 2.671 ( -5.197 -10.522 1.456) 11.825 2.867 ( 13.409 -10.795 -3.152) 17.500 3.013 ( -4.450 -10.265 0.500) 11.200 3.112 ( -1.317 -11.271 1.522) 11.449 3.470 ( -0.813 -0.140 0.795) 1.146 3.649 ( 4.589 -6.118 -1.220) 7.744 4.000 ( 18.764 -9.072 2.894) 21.042 4.125 ( 1.351 -6.887 4.264) 8.212 4.326 ( 2.764 -1.453 0.425) 3.152 4.634 ( -7.849 1.314 0.243) 7.962 4.709 ( -2.990 -20.855 1.031) 21.094 5.011 ( -2.782 -33.760 -3.601) 34.065 5.120 ( -14.791 -1.471 -4.251) 15.460 5.387 ( 0.685 -2.482 -0.284) 2.590 5.691 ( -14.152 -20.961 -2.223) 25.389 6.384 ( -7.583 15.657 13.276) 21.884 7.006 ( -7.704 12.326 0.374) 14.540 7.761 ( 8.335 12.490 1.822) 15.125 8.135 ( -1.312 4.341 5.043) 6.782 8.807 ( -3.645 11.019 -11.600) 16.410 9.239 ( 4.539 -8.263 1.147) 9.497 9.687 ( 5.040 8.769 3.783) 10.799 9.974 ( -2.347 12.130 0.709) 12.375 10.347 ( 5.061 -8.845 0.901) 10.230 10.570 ( 0.831 5.090 -0.436) 5.176 11.135 ( -2.933 -17.209 0.083) 17.458 11.325 ( -10.368 4.775 -1.174) 11.475 14.908 ( 11.114 3.204 2.505) 11.835 15.463 ( 7.526 8.837 -2.406) 11.855 16.437 ( 10.052 15.163 -1.713) 18.273 16.706 ( 6.301 5.778 -1.583) 8.694 20.465 ( -1.630 -22.577 3.103) 22.848 21.112 ( -3.423 -25.459 -8.365) 27.016======================= Grid point 389 (180/322) =======================q-point: ( 0.46 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.908 ( 9.421 -0.471 8.092) 12.428 2.442 ( 6.495 -7.721 3.263) 10.604 2.589 ( -2.061 -5.501 3.392) 6.783 2.863 ( -4.494 -10.910 2.923) 12.156 3.130 ( 10.456 -7.792 -0.030) 13.041 3.218 ( -1.117 -12.068 -0.102) 12.120 3.330 ( 1.430 -10.137 0.737) 10.264 3.417 ( -2.538 1.895 -1.475) 3.494 3.850 ( 7.768 -9.225 -0.200) 12.061 4.174 ( -0.741 -5.650 0.084) 5.699 4.253 ( -2.186 1.375 2.926) 3.903 4.402 ( 14.342 -3.944 -0.439) 14.881 4.546 ( -8.021 0.388 -3.715) 8.848 4.912 ( -1.081 -1.892 2.765) 3.520 5.075 ( -15.275 -6.924 -7.257) 18.274 5.354 ( -2.157 -5.486 0.180) 5.897 5.833 ( 2.399 -31.869 -0.497) 31.963 6.018 ( -9.782 15.558 7.019) 19.672 6.252 ( -9.274 -39.197 -1.288) 40.299 6.756 ( -3.860 8.664 0.469) 9.497 7.573 ( 10.482 11.898 2.995) 16.137 8.132 ( 0.550 -2.917 4.157) 5.108 8.506 ( -5.102 14.381 -10.309) 18.415 9.344 ( 3.799 1.750 2.175) 4.714 9.513 ( 4.240 11.670 6.190) 13.874 9.726 ( -2.066 9.405 -1.279) 9.714 10.402 ( 0.248 8.396 0.768) 8.434 10.516 ( 2.621 1.062 -2.918) 4.064 11.322 ( -7.017 -12.638 0.261) 14.457 11.489 ( -2.241 -19.335 -0.244) 19.466 14.917 ( 8.978 2.046 2.854) 9.641 15.367 ( 6.040 5.152 -1.737) 8.127 16.283 ( 5.588 5.443 -0.016) 7.801 16.625 ( 3.449 4.900 -1.893) 6.284 20.886 ( -1.124 -19.920 2.624) 20.124 21.457 ( -1.335 -12.531 -5.262) 13.656======================= Grid point 390 (181/322) =======================q-point: ( 0.54 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.877 ( 7.809 10.885 8.662) 15.953 2.536 ( -1.077 -1.139 6.063) 6.262 2.708 ( 1.849 -4.248 1.949) 5.026 3.040 ( -3.779 -8.601 4.297) 10.331 3.273 ( 8.304 -1.537 -1.407) 8.562 3.399 ( -4.677 -8.127 -0.015) 9.377 3.474 ( 3.639 -8.298 0.504) 9.075 3.538 ( 4.232 -8.779 -0.341) 9.752 4.056 ( 4.038 -6.719 2.322) 8.176 4.148 ( -4.857 3.692 1.401) 6.260 4.277 ( 0.121 -3.642 -1.644) 3.998 4.404 ( -4.604 2.736 -3.591) 6.448 4.563 ( 2.296 0.736 -2.063) 3.173 4.924 ( -1.227 -2.563 -2.806) 3.993 5.185 ( -6.624 -10.209 -4.091) 12.839 5.453 ( -2.365 -6.103 0.537) 6.567 5.700 ( -7.926 9.229 2.801) 12.484 6.267 ( 0.670 -5.769 -0.370) 5.819 6.710 ( -1.118 -8.087 -0.181) 8.166 6.940 ( -3.586 -30.405 -0.454) 30.619 7.456 ( 9.894 5.215 4.996) 12.249 8.163 ( -4.723 11.177 -5.783) 13.442 8.267 ( 1.582 -4.879 1.273) 5.284 9.214 ( 1.374 11.108 2.500) 11.468 9.336 ( 1.450 9.265 6.672) 11.509 9.588 ( -0.579 5.366 -1.892) 5.719 10.230 ( 1.078 8.336 -2.350) 8.728 10.435 ( -1.929 3.493 -0.061) 3.990 11.674 ( 0.681 -21.143 -1.226) 21.190 11.838 ( -3.662 -17.883 -0.637) 18.265 14.942 ( 6.953 0.849 3.002) 7.621 15.305 ( 2.907 3.968 -1.724) 5.212 16.270 ( 3.883 -0.695 -0.137) 3.947 16.547 ( 0.985 4.131 -2.241) 4.802 21.221 ( -0.257 -14.071 1.288) 14.132 21.593 ( -0.158 -3.015 -2.533) 3.941======================= Grid point 391 (182/322) =======================q-point: ( 0.62 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.611 ( 3.182 19.471 8.514) 21.488 2.528 ( -0.959 1.998 7.346) 7.673 2.746 ( -0.565 0.866 0.834) 1.328 3.155 ( -2.890 -4.451 5.094) 7.356 3.362 ( 8.395 -3.283 -2.271) 9.295 3.528 ( -3.785 -6.465 -0.442) 7.505 3.643 ( 2.245 -6.585 2.820) 7.507 3.727 ( 5.401 -7.341 -0.864) 9.155 4.022 ( -8.222 2.258 1.560) 8.668 4.214 ( 6.391 -3.162 0.755) 7.170 4.262 ( -5.221 3.645 -3.914) 7.474 4.373 ( 0.205 -1.927 0.333) 1.967 4.511 ( -0.749 3.208 -1.220) 3.513 4.972 ( -3.269 -3.592 -6.135) 7.824 5.343 ( 1.413 -7.352 -2.695) 7.957 5.555 ( -3.799 -5.657 0.315) 6.822 5.594 ( -3.642 -1.232 1.123) 4.005 6.243 ( -0.092 3.387 -0.882) 3.501 6.873 ( -0.447 -5.548 -0.192) 5.569 7.215 ( 5.036 1.145 3.058) 6.002 7.628 ( 2.645 -15.629 2.303) 16.018 7.898 ( -3.014 10.455 -4.883) 11.926 8.457 ( 0.394 -11.255 3.743) 11.868 8.991 ( -0.905 11.999 2.747) 12.343 9.183 ( 0.413 7.528 4.965) 9.028 9.457 ( -1.141 6.896 -2.136) 7.309 10.107 ( 1.242 3.831 -3.159) 5.118 10.438 ( -1.381 -4.272 0.835) 4.567 12.010 ( 2.584 -10.418 -1.896) 10.900 12.178 ( -2.344 -19.104 -2.306) 19.385 14.962 ( 4.307 1.214 2.944) 5.357 15.235 ( 0.625 3.832 -1.682) 4.231 16.326 ( 3.126 -2.214 -0.794) 3.912 16.461 ( -1.130 4.349 -2.185) 4.997 21.436 ( 0.243 -7.792 0.052) 7.796 21.594 ( -0.087 1.771 -0.616) 1.877======================= Grid point 392 (183/322) =======================q-point: (-0.31 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.261 ( -1.490 15.282 7.581) 17.124 2.493 ( -1.490 1.181 7.335) 7.578 2.690 ( -1.141 3.848 0.154) 4.017 3.204 ( -1.788 -1.087 5.568) 5.948 3.459 ( 5.785 -1.716 -1.621) 6.248 3.582 ( -3.814 -1.223 -1.252) 4.196 3.771 ( -0.564 -5.350 2.114) 5.780 3.869 ( 6.196 -3.288 -0.535) 7.034 3.961 ( -5.078 0.054 0.061) 5.079 4.132 ( -4.389 5.579 -2.855) 7.651 4.276 ( 3.142 -0.317 -0.215) 3.165 4.419 ( 1.279 -1.467 2.856) 3.456 4.463 ( 0.404 0.527 -1.348) 1.502 4.997 ( -2.172 -1.350 -5.725) 6.270 5.471 ( 4.933 -4.104 -1.363) 6.560 5.608 ( -4.887 -1.937 0.699) 5.303 5.688 ( -0.322 -8.980 -0.034) 8.986 6.195 ( -0.550 0.829 -1.193) 1.553 6.932 ( -0.360 -1.972 -0.060) 2.006 7.164 ( 3.296 6.138 4.240) 8.156 7.715 ( -1.023 5.802 -2.911) 6.571 7.893 ( 3.004 -7.852 0.832) 8.448 8.627 ( -3.788 1.723 3.059) 5.165 8.812 ( -1.849 -1.847 4.539) 5.238 9.073 ( 0.588 4.210 3.435) 5.465 9.338 ( -0.012 3.270 -3.007) 4.443 10.080 ( 1.060 0.012 -2.938) 3.123 10.524 ( -0.551 -3.306 0.431) 3.380 12.132 ( 1.937 -1.457 -1.611) 2.910 12.481 ( -0.005 -11.634 -4.302) 12.403 14.944 ( 1.006 2.770 1.987) 3.554 15.161 ( 0.097 3.571 -1.054) 3.725 16.335 ( 1.876 5.324 -1.326) 5.798 16.394 ( -1.366 -1.050 -1.390) 2.213 21.526 ( -0.078 -0.716 -0.298) 0.779 21.558 ( 0.095 0.343 0.172) 0.396======================= Grid point 393 (184/322) =======================q-point: (-0.23 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.117 ( -4.104 -2.328 6.260) 7.839 2.512 ( -1.999 -3.114 6.217) 7.235 2.594 ( -0.556 5.366 0.256) 5.401 3.192 ( -2.128 1.974 5.519) 6.235 3.471 ( 3.463 3.241 -0.905) 4.828 3.539 ( -3.327 2.466 -2.325) 4.749 3.815 ( -3.090 0.889 -0.054) 3.215 3.922 ( -8.491 2.753 -3.438) 9.565 3.938 ( 7.442 -1.337 0.732) 7.596 4.014 ( 2.168 3.935 -1.476) 4.729 4.280 ( 1.939 0.896 0.345) 2.163 4.423 ( -2.307 -0.036 -0.684) 2.406 4.526 ( 6.163 -3.710 4.301) 8.381 4.978 ( -0.338 1.786 -4.312) 4.680 5.540 ( -1.296 -0.811 0.364) 1.571 5.604 ( 2.170 0.228 0.120) 2.185 5.918 ( 0.606 -14.056 0.141) 14.070 6.202 ( -1.208 -2.187 -1.162) 2.755 6.968 ( -0.926 -1.646 -0.241) 1.904 7.025 ( -1.272 9.139 4.115) 10.103 7.648 ( 3.522 1.535 -1.305) 4.057 7.972 ( 1.721 1.594 -0.201) 2.354 8.445 ( -1.798 8.356 0.499) 8.562 8.944 ( -7.493 -6.272 4.719) 10.851 9.069 ( 1.358 -3.403 4.876) 6.100 9.354 ( 1.959 -5.031 -3.550) 6.462 10.079 ( 0.906 0.328 -3.015) 3.165 10.526 ( -0.239 2.934 0.325) 2.962 12.094 ( 2.526 6.160 -1.154) 6.757 12.592 ( -0.556 -0.132 -5.359) 5.390 14.876 ( -1.265 3.946 0.132) 4.146 15.095 ( 0.814 3.459 0.323) 3.569 16.217 ( 0.349 6.179 -0.546) 6.213 16.408 ( 0.549 -0.244 -1.158) 1.305 21.516 ( 0.284 0.783 0.038) 0.834 21.553 ( -0.209 0.861 0.009) 0.886======================= Grid point 394 (185/322) =======================q-point: (-0.15 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.279 ( -2.552 -12.568 5.589) 13.990 2.459 ( 0.152 8.265 1.185) 8.351 2.601 ( -1.492 -4.816 4.497) 6.756 3.124 ( -2.077 4.343 4.631) 6.680 3.378 ( 3.037 7.184 -0.003) 7.799 3.460 ( -1.777 3.664 -4.157) 5.820 3.709 ( -4.402 7.888 -0.572) 9.051 3.770 ( -5.600 5.468 -3.588) 8.610 3.923 ( 4.862 7.902 -1.650) 9.424 4.028 ( 3.650 -3.081 -0.719) 4.830 4.268 ( 2.070 2.031 1.991) 3.517 4.403 ( -1.886 0.846 -1.046) 2.317 4.670 ( 7.101 -5.863 5.660) 10.809 4.914 ( -0.392 3.732 -2.072) 4.287 5.501 ( -7.458 0.898 0.273) 7.516 5.619 ( 6.610 2.304 -0.286) 7.006 6.226 ( -1.758 -15.885 0.080) 15.982 6.262 ( -1.043 -5.004 -0.419) 5.129 6.814 ( -4.803 9.279 4.382) 11.330 6.963 ( -0.357 2.766 -1.279) 3.068 7.674 ( 4.695 -0.584 -0.399) 4.748 7.827 ( 2.058 14.036 -1.048) 14.225 8.366 ( 0.839 -1.220 -0.937) 1.752 9.006 ( -6.006 -5.092 1.774) 8.072 9.181 ( -1.746 -6.112 6.630) 9.185 9.504 ( 1.676 -7.936 -2.710) 8.552 10.092 ( 1.148 -2.475 -3.271) 4.259 10.439 ( 0.212 4.575 0.547) 4.613 11.929 ( 2.412 11.607 0.056) 11.855 12.458 ( -2.371 11.861 -5.305) 13.208 14.789 ( -1.215 3.768 -1.086) 4.105 15.036 ( 2.382 3.620 1.326) 4.532 16.112 ( 1.071 4.535 0.124) 4.661 16.411 ( 1.578 0.214 -0.802) 1.783 21.436 ( -0.203 7.391 -0.022) 7.394 21.581 ( 0.511 -3.120 -0.407) 3.187======================= Grid point 395 (186/322) =======================q-point: (-0.08 0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.503 ( 0.559 -8.320 7.033) 10.909 2.265 ( 4.330 13.042 2.574) 13.981 2.659 ( -1.843 -0.471 1.926) 2.707 3.018 ( -0.093 6.156 2.951) 6.827 3.251 ( 1.683 7.309 0.347) 7.508 3.352 ( 0.425 6.699 -5.646) 8.772 3.488 ( -6.359 9.770 -0.419) 11.664 3.651 ( -2.532 3.541 -2.876) 5.218 3.740 ( 5.865 13.358 -0.735) 14.608 4.081 ( 2.816 1.486 -1.390) 3.474 4.229 ( 1.692 2.194 3.730) 4.647 4.361 ( -1.246 2.426 -0.357) 2.750 4.816 ( 5.800 1.690 4.892) 7.774 4.857 ( -1.919 -4.418 0.265) 4.824 5.437 ( -6.154 1.514 -0.837) 6.393 5.570 ( 3.507 5.243 -1.360) 6.452 6.247 ( -2.233 8.594 -0.050) 8.879 6.431 ( -12.105 -2.466 1.809) 12.485 6.762 ( 0.176 -8.135 2.685) 8.568 6.918 ( 2.289 -3.322 -0.676) 4.090 7.370 ( -6.722 25.999 -2.598) 26.980 7.777 ( 11.141 -1.047 1.542) 11.296 8.486 ( 2.780 -9.262 -3.437) 10.263 9.089 ( -3.545 -5.872 0.958) 6.926 9.305 ( -2.536 -6.804 7.008) 10.091 9.648 ( -0.365 -7.369 -3.207) 8.045 10.193 ( 1.593 -6.861 -2.696) 7.542 10.395 ( 2.043 0.388 -0.455) 2.128 11.698 ( 0.564 11.981 2.425) 12.237 12.102 ( -3.973 20.945 -3.941) 21.680 14.721 ( 0.363 2.456 -1.169) 2.745 14.990 ( 5.359 3.354 1.543) 6.508 16.062 ( 2.057 1.362 0.457) 2.509 16.425 ( 2.745 -0.705 -0.496) 2.877 21.231 ( -0.790 13.445 1.581) 13.560 21.639 ( 0.481 -1.795 -3.741) 4.177======================= Grid point 400 (187/322) =======================q-point: ( 0.31 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.599 ( 6.422 0.000 12.403) 13.967 1.661 ( 21.902 0.000 4.389) 22.337 2.385 ( 4.367 0.000 -5.915) 7.353 2.389 ( 10.958 0.000 -1.972) 11.134 2.649 ( 1.820 0.000 2.436) 3.040 2.725 ( -10.051 -0.000 -0.918) 10.093 2.817 ( -3.573 -0.000 1.280) 3.795 3.419 ( -2.920 -0.000 5.488) 6.216 3.467 ( 5.945 0.000 0.322) 5.954 3.784 ( 28.146 0.000 8.746) 29.473 3.815 ( 2.022 0.000 -3.189) 3.776 3.959 ( -2.342 -0.000 3.153) 3.927 4.158 ( -0.234 -0.000 0.224) 0.324 4.423 ( -1.445 -0.000 -3.327) 3.627 4.715 ( -12.142 -0.000 -0.092) 12.142 5.154 ( -17.352 -0.000 -3.350) 17.673 5.402 ( -6.837 -0.000 -3.245) 7.568 5.478 ( -6.679 -0.000 0.449) 6.694 6.729 ( -1.801 -0.000 19.719) 19.801 7.315 ( -8.752 -0.000 1.038) 8.813 8.006 ( -2.689 -0.000 9.190) 9.576 8.463 ( 0.468 0.000 0.670) 0.818 8.827 ( 5.565 0.000 -0.140) 5.567 9.095 ( 0.020 0.000 -9.536) 9.536 9.735 ( 0.496 0.000 -0.244) 0.553 10.054 ( 9.180 0.000 2.972) 9.649 10.575 ( -6.526 -0.000 0.157) 6.527 10.623 ( -0.308 -0.000 -0.277) 0.415 10.639 ( -2.042 -0.000 1.590) 2.588 11.515 ( -9.865 -0.000 -3.400) 10.434 15.005 ( 15.425 0.000 4.506) 16.070 15.715 ( 0.408 0.000 -4.222) 4.242 16.866 ( 10.004 0.000 -1.789) 10.163 17.202 ( 15.256 0.000 -20.220) 25.330 19.873 ( -0.147 -0.000 0.105) 0.181 20.109 ( -0.048 -0.000 -0.089) 0.101======================= Grid point 401 (188/322) =======================q-point: ( 0.38 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.713 ( 8.613 -5.104 9.831) 14.031 1.960 ( 18.330 -14.021 2.810) 23.248 2.407 ( -10.607 -2.804 3.144) 11.413 2.471 ( -1.461 -6.870 -2.234) 7.370 2.759 ( 4.013 -8.295 -1.215) 9.294 2.804 ( 8.901 -7.708 -1.334) 11.850 2.896 ( -2.117 -8.949 1.419) 9.305 3.459 ( 0.402 -0.205 2.378) 2.420 3.534 ( 2.009 -7.750 1.030) 8.072 3.975 ( 7.767 -4.044 0.067) 8.757 4.040 ( 14.867 -6.468 8.561) 18.335 4.114 ( 1.902 -21.837 -1.600) 21.978 4.300 ( 1.544 -16.104 1.695) 16.267 4.466 ( -0.922 -8.447 -3.452) 9.172 4.633 ( -10.687 1.261 0.249) 10.764 5.031 ( -16.966 0.783 -3.814) 17.407 5.336 ( -11.777 -0.761 -5.419) 12.987 5.456 ( -3.683 -0.483 2.095) 4.264 6.649 ( -2.238 10.457 19.098) 21.888 7.178 ( -7.176 8.704 1.007) 11.326 7.969 ( 1.597 4.120 6.692) 8.019 8.298 ( -0.922 12.284 1.234) 12.380 8.923 ( -0.345 1.571 -7.946) 8.107 9.087 ( 2.562 -6.044 -2.707) 7.100 9.792 ( 2.514 -2.111 0.899) 3.403 10.104 ( 5.963 0.555 3.210) 6.795 10.348 ( -2.844 9.054 0.218) 9.493 10.635 ( 0.669 1.276 0.726) 1.614 10.817 ( -3.399 -13.227 0.342) 13.661 11.387 ( -9.569 6.003 -4.249) 12.069 15.062 ( 13.724 3.789 5.262) 15.179 15.644 ( 1.331 6.231 -3.301) 7.176 16.860 ( 7.714 5.361 -2.544) 9.732 16.924 ( 12.667 25.653 -9.469) 30.136 20.055 ( -0.895 -16.891 1.371) 16.971 20.491 ( -1.672 -31.401 -4.944) 31.831======================= Grid point 402 (189/322) =======================q-point: ( 0.46 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.901 ( 9.880 -6.075 7.861) 14.011 2.309 ( 9.792 -10.661 2.675) 14.720 2.437 ( -10.034 -6.869 4.722) 13.045 2.626 ( -3.541 -10.875 -0.011) 11.437 2.965 ( -3.276 -11.806 0.258) 12.255 3.043 ( 14.862 -8.459 0.050) 17.101 3.113 ( 1.541 -12.130 0.569) 12.241 3.448 ( -2.607 1.769 1.087) 3.332 3.715 ( 7.205 -8.517 -1.076) 11.207 4.067 ( -1.004 -4.657 0.950) 4.858 4.248 ( 6.336 -2.852 3.358) 7.717 4.415 ( 13.343 -5.122 0.225) 14.294 4.503 ( -8.883 -0.866 -4.614) 10.047 4.692 ( -5.913 -15.142 1.928) 16.369 4.918 ( -13.793 -13.656 0.502) 19.416 5.019 ( 4.399 -22.228 -3.596) 22.943 5.372 ( -3.898 -11.678 -3.732) 12.864 5.528 ( -10.968 -17.399 0.619) 20.577 6.355 ( -4.734 18.962 13.218) 23.594 6.941 ( -3.833 11.281 1.198) 11.975 7.867 ( 8.485 10.955 1.875) 13.983 8.112 ( -5.242 2.718 4.926) 7.690 8.730 ( -2.958 11.910 -11.723) 16.971 9.293 ( 3.804 -8.589 1.819) 9.568 9.760 ( 5.554 7.863 2.327) 9.904 9.948 ( -2.683 13.670 1.727) 14.037 10.410 ( 5.232 -9.584 0.653) 10.938 10.563 ( -2.070 5.235 0.270) 5.636 11.113 ( -0.920 -17.646 0.118) 17.671 11.201 ( -9.198 4.523 -3.010) 10.683 15.048 ( 10.198 4.879 4.683) 12.236 15.515 ( 2.950 7.003 -2.428) 7.977 16.534 ( 7.354 17.295 -2.284) 18.932 16.762 ( 4.213 6.991 -2.478) 8.530 20.456 ( -1.330 -22.626 2.718) 22.827 21.063 ( -1.058 -25.855 -6.233) 26.616======================= Grid point 403 (190/322) =======================q-point: ( 0.54 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.040 ( 8.024 -0.060 7.936) 11.286 2.467 ( -3.896 -5.626 5.946) 9.065 2.589 ( -0.242 -8.338 3.005) 8.866 2.841 ( -0.007 -10.991 1.353) 11.074 3.173 ( -2.201 -10.793 0.400) 11.022 3.279 ( 8.213 -6.915 2.434) 11.008 3.353 ( 2.702 -8.828 -1.028) 9.289 3.402 ( 1.602 -1.754 -1.072) 2.606 3.935 ( 6.524 -8.755 0.225) 10.921 4.137 ( -6.293 -2.102 4.198) 7.852 4.246 ( 0.293 0.622 -0.423) 0.807 4.423 ( -3.345 2.467 -4.678) 6.257 4.570 ( 6.984 -1.989 -3.687) 8.144 4.849 ( -18.208 -5.660 -6.822) 20.251 4.949 ( 6.218 -6.451 4.149) 9.874 5.332 ( -2.067 -5.679 -0.549) 6.068 5.861 ( 2.734 -29.559 -0.639) 29.692 5.930 ( -8.196 10.630 5.730) 14.595 6.180 ( -2.804 -36.903 0.330) 37.011 6.724 ( -1.744 8.197 0.418) 8.391 7.682 ( 5.562 10.993 3.540) 12.818 8.133 ( -2.120 -4.700 4.171) 6.632 8.434 ( -1.542 14.372 -9.990) 17.571 9.387 ( 2.163 3.123 3.871) 5.424 9.584 ( 4.548 12.599 4.338) 14.079 9.699 ( -1.829 8.319 -1.676) 8.681 10.397 ( -1.542 8.201 0.951) 8.399 10.532 ( 1.963 4.049 -2.964) 5.388 11.253 ( -4.707 -16.859 -0.193) 17.505 11.472 ( -0.578 -18.504 -0.064) 18.513 15.025 ( 7.164 3.050 4.249) 8.870 15.406 ( 1.782 5.320 -2.197) 6.025 16.335 ( 3.120 6.285 -0.513) 7.035 16.648 ( 1.593 5.780 -2.328) 6.432 20.883 ( -0.833 -20.170 2.422) 20.332 21.435 ( 0.214 -13.198 -4.512) 13.949======================= Grid point 404 (191/322) =======================q-point: (-0.38 -0.69 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.970 ( 2.770 12.218 8.750) 15.281 2.543 ( -0.737 -1.990 7.396) 7.695 2.712 ( -1.961 -4.116 1.918) 4.946 3.030 ( -0.225 -7.685 3.106) 8.292 3.340 ( -2.174 -5.119 -1.272) 5.705 3.366 ( 5.015 -5.387 -1.069) 7.437 3.514 ( 1.532 -7.990 2.153) 8.416 3.598 ( 6.609 -9.103 -0.850) 11.281 4.022 ( -7.709 2.062 4.481) 9.152 4.151 ( 1.681 -5.104 -1.255) 5.518 4.307 ( 5.703 -2.665 -0.061) 6.295 4.336 ( -3.721 3.159 -2.967) 5.712 4.576 ( 0.699 3.016 -2.068) 3.723 4.835 ( -10.846 -5.693 -7.775) 14.508 5.183 ( 6.724 -9.764 -0.203) 11.857 5.420 ( -3.161 -5.779 -0.043) 6.587 5.644 ( -3.391 8.854 2.514) 9.809 6.270 ( 0.200 -4.709 -0.775) 4.777 6.701 ( -0.340 -8.796 -0.304) 8.808 6.913 ( -0.773 -32.005 -0.244) 32.015 7.545 ( 1.634 4.792 5.624) 7.568 8.123 ( 1.988 12.552 -5.969) 14.040 8.275 ( -1.200 -7.087 1.810) 7.412 9.217 ( -1.805 11.815 3.418) 12.431 9.386 ( 3.460 10.759 5.249) 12.461 9.573 ( -0.989 5.519 -2.221) 6.031 10.232 ( 0.512 7.864 -2.072) 8.148 10.415 ( -1.163 3.709 -0.176) 3.891 11.682 ( 0.933 -24.309 -1.123) 24.353 11.806 ( -1.105 -15.750 -0.618) 15.801 15.022 ( 4.580 1.725 3.989) 6.314 15.312 ( -0.604 4.371 -2.265) 4.960 16.299 ( 0.929 -0.672 -0.605) 1.296 16.547 ( 0.326 4.830 -2.298) 5.359 21.223 ( -0.112 -14.225 1.261) 14.281 21.585 ( 0.275 -3.248 -2.423) 4.062======================= Grid point 405 (192/322) =======================q-point: (-0.31 -0.69 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.648 ( -1.286 20.761 8.198) 22.358 2.545 ( -0.470 2.459 7.965) 8.349 2.734 ( -1.440 0.736 0.713) 1.768 3.152 ( -0.592 -4.460 4.728) 6.526 3.423 ( 0.877 -4.004 -2.243) 4.673 3.499 ( 1.485 -5.206 -0.874) 5.484 3.654 ( -2.046 -6.003 2.618) 6.861 3.795 ( 5.620 -7.236 -1.206) 9.241 3.949 ( -4.167 1.328 3.044) 5.329 4.184 ( -3.984 2.449 -3.901) 6.090 4.289 ( 3.531 -0.650 -0.615) 3.643 4.395 ( 3.828 -2.338 2.554) 5.162 4.497 ( -0.996 3.320 -1.531) 3.789 4.902 ( -3.891 -5.764 -7.487) 10.218 5.372 ( 3.215 -6.950 -2.214) 7.972 5.516 ( -3.815 -4.549 0.607) 5.968 5.580 ( 2.066 -2.750 0.802) 3.532 6.234 ( -0.772 3.479 -1.043) 3.713 6.869 ( -0.114 -5.399 -0.162) 5.403 7.238 ( -2.547 -1.165 2.636) 3.847 7.642 ( -1.643 -12.970 2.307) 13.276 7.917 ( 7.937 8.922 -4.094) 12.624 8.454 ( -2.442 -10.893 3.601) 11.729 8.969 ( -3.820 12.199 3.124) 13.159 9.219 ( 2.740 8.701 4.244) 10.061 9.436 ( -1.269 6.696 -2.221) 7.168 10.111 ( 0.975 3.802 -3.048) 4.970 10.430 ( -0.208 -4.584 0.827) 4.662 12.040 ( 2.905 -9.030 -1.255) 9.568 12.149 ( -0.874 -20.729 -2.866) 20.944 15.009 ( 1.710 2.466 3.532) 4.634 15.223 ( -1.692 3.498 -2.162) 4.446 16.339 ( -0.714 -2.810 -1.055) 3.085 16.449 ( 0.598 5.132 -2.056) 5.561 21.439 ( 0.212 -7.700 0.061) 7.703 21.590 ( -0.209 1.632 -0.619) 1.758======================= Grid point 406 (193/322) =======================q-point: (-0.23 -0.69 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.255 ( -3.455 16.430 7.544) 18.406 2.500 ( -1.359 1.722 7.445) 7.761 2.682 ( -0.246 3.760 0.229) 3.775 3.207 ( -1.097 -0.750 5.492) 5.650 3.480 ( -0.911 -2.013 -2.210) 3.125 3.566 ( 2.282 -0.209 -0.148) 2.297 3.738 ( -5.465 -4.635 1.445) 7.310 3.900 ( -4.276 -0.519 -0.797) 4.380 3.954 ( 6.586 -2.165 0.704) 6.968 4.091 ( -1.000 3.632 -2.663) 4.614 4.316 ( 3.284 0.641 -0.676) 3.414 4.409 ( -1.507 0.734 -1.069) 1.988 4.505 ( 4.427 -2.581 3.242) 6.064 4.968 ( 1.034 -2.450 -6.293) 6.831 5.475 ( -5.777 -3.222 -1.440) 6.770 5.590 ( 3.081 -4.983 0.687) 5.899 5.709 ( 3.864 -7.148 -0.022) 8.126 6.179 ( -1.353 0.995 -1.045) 1.978 6.926 ( -0.746 -1.811 0.162) 1.965 7.150 ( -6.843 5.576 3.765) 9.597 7.735 ( 4.553 2.712 -2.802) 5.995 7.944 ( 5.358 -4.501 0.490) 7.015 8.602 ( -1.609 2.591 2.903) 4.211 8.771 ( -7.053 -1.591 4.955) 8.765 9.103 ( 2.037 4.604 3.668) 6.229 9.329 ( 0.148 2.383 -3.182) 3.978 10.082 ( 0.861 0.063 -2.933) 3.058 10.524 ( 0.358 -3.229 0.453) 3.280 12.157 ( 3.035 -1.463 -1.722) 3.783 12.464 ( -0.515 -11.396 -4.255) 12.175 14.951 ( -0.858 4.005 2.035) 4.574 15.153 ( -0.912 2.576 -1.106) 2.948 16.333 ( -1.361 4.685 -1.215) 5.027 16.393 ( 1.841 -0.868 -1.470) 2.511 21.524 ( -0.215 -0.609 -0.247) 0.692 21.560 ( 0.080 0.143 0.132) 0.210======================= Grid point 407 (194/322) =======================q-point: (-0.15 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.096 ( -2.702 -2.381 6.961) 7.837 2.507 ( -2.118 -1.993 6.239) 6.884 2.601 ( 1.432 4.410 0.578) 4.673 3.189 ( -1.482 2.357 4.909) 5.643 3.481 ( -0.179 1.327 -1.784) 2.231 3.534 ( 2.540 4.531 0.615) 5.230 3.764 ( -7.833 -1.233 -1.128) 8.010 3.816 ( -4.920 5.374 -0.704) 7.320 4.016 ( 5.209 -0.729 -0.737) 5.311 4.046 ( 3.743 2.442 -1.878) 4.847 4.311 ( 2.828 1.176 0.641) 3.129 4.394 ( -1.771 -0.171 -1.979) 2.661 4.610 ( 5.184 -4.532 4.157) 8.044 4.980 ( 3.346 1.789 -4.414) 5.821 5.455 ( -9.352 -0.390 -0.211) 9.362 5.685 ( 7.442 -0.259 0.208) 7.449 5.920 ( -0.430 -13.146 -0.078) 13.154 6.181 ( -1.588 -2.285 -0.732) 2.877 6.929 ( -7.319 2.906 2.425) 8.240 6.997 ( -2.189 3.961 0.959) 4.626 7.728 ( 8.446 1.339 -1.680) 8.715 7.995 ( 2.949 2.495 -0.320) 3.876 8.427 ( -1.391 8.033 0.851) 8.197 8.870 ( -7.465 -6.299 5.158) 11.046 9.094 ( 0.297 -2.220 5.006) 5.484 9.364 ( 1.589 -5.786 -3.373) 6.883 10.079 ( 0.737 0.313 -3.096) 3.198 10.529 ( 0.518 3.007 0.417) 3.080 12.126 ( 3.383 6.219 -1.759) 7.295 12.557 ( -2.349 0.532 -4.845) 5.411 14.861 ( -1.252 4.313 0.432) 4.512 15.105 ( 0.854 2.275 0.102) 2.432 16.225 ( 1.324 5.664 -0.510) 5.839 16.416 ( 1.403 -0.578 -1.302) 1.999 21.520 ( 0.335 0.682 -0.026) 0.760 21.551 ( -0.119 0.800 0.055) 0.811======================= Grid point 408 (195/322) =======================q-point: (-0.08 0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.287 ( 0.795 -13.516 6.435) 14.991 2.475 ( 1.685 6.146 1.885) 6.646 2.603 ( -0.405 -3.241 4.293) 5.394 3.126 ( -0.134 4.074 4.068) 5.759 3.405 ( 0.718 6.578 0.642) 6.648 3.456 ( 3.026 4.424 -1.836) 5.666 3.630 ( -7.415 7.967 -2.967) 11.280 3.709 ( -3.811 4.186 -0.327) 5.670 3.975 ( 4.577 7.229 -1.215) 8.642 4.071 ( 4.318 -2.116 -1.710) 5.104 4.302 ( 2.705 2.047 2.005) 3.941 4.380 ( -1.249 0.530 -1.726) 2.195 4.743 ( 1.721 -5.819 1.950) 6.373 4.930 ( 4.524 4.687 -0.550) 6.538 5.404 ( -8.218 0.004 0.225) 8.221 5.681 ( 3.567 3.870 -0.973) 5.352 6.171 ( -8.308 -13.213 -0.370) 15.612 6.238 ( -2.488 -3.546 0.105) 4.333 6.777 ( -2.089 4.531 4.242) 6.549 6.956 ( -0.150 3.093 -1.043) 3.267 7.694 ( -1.902 9.331 -1.389) 9.623 7.912 ( 12.533 6.552 0.065) 14.142 8.352 ( -2.440 -2.433 -2.032) 4.000 8.952 ( -4.378 -5.840 3.766) 8.213 9.182 ( -1.366 -5.617 5.988) 8.323 9.510 ( 0.752 -7.261 -2.346) 7.668 10.095 ( 1.122 -2.806 -3.444) 4.582 10.449 ( 0.912 4.201 0.751) 4.364 11.956 ( 2.387 12.152 -0.874) 12.415 12.401 ( -4.546 12.286 -4.403) 13.820 14.780 ( 0.214 3.439 -0.374) 3.466 15.075 ( 3.837 2.143 0.678) 4.447 16.137 ( 2.920 4.345 0.156) 5.237 16.432 ( 2.550 -0.312 -1.108) 2.798 21.434 ( -0.185 7.564 -0.023) 7.567 21.586 ( 0.583 -3.022 -0.432) 3.108======================= Grid point 414 (196/322) =======================q-point: ( 0.38 0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.730 ( 10.315 0.000 9.020) 13.703 1.919 ( 20.107 0.000 2.460) 20.256 2.295 ( -18.308 -0.000 5.148) 19.018 2.384 ( -4.143 -0.000 -2.554) 4.867 2.623 ( -4.195 -0.000 -2.796) 5.042 2.781 ( -3.100 -0.000 0.663) 3.170 2.855 ( 22.986 0.000 0.160) 22.986 3.404 ( -2.764 -0.000 6.274) 6.856 3.533 ( 4.939 0.000 1.238) 5.092 3.824 ( 1.369 0.000 -3.550) 3.805 3.933 ( -2.049 -0.000 2.712) 3.399 4.091 ( 13.732 0.000 -0.190) 13.733 4.181 ( 7.281 0.000 5.233) 8.966 4.414 ( 0.587 0.000 -3.079) 3.134 4.587 ( -9.557 -0.000 -0.465) 9.568 4.938 ( -15.340 -0.000 -1.759) 15.441 5.248 ( -12.506 -0.000 -6.355) 14.028 5.456 ( -1.262 -0.000 2.333) 2.652 6.787 ( 0.264 0.000 22.500) 22.502 7.234 ( -5.664 -0.000 1.177) 5.785 8.005 ( -2.418 -0.000 8.798) 9.124 8.473 ( 1.074 0.000 0.204) 1.093 8.879 ( 3.396 0.000 -0.201) 3.402 9.056 ( -1.171 -0.000 -10.553) 10.618 9.738 ( 0.175 0.000 -0.444) 0.477 10.162 ( 7.985 0.000 1.949) 8.220 10.477 ( -8.462 -0.000 1.713) 8.634 10.620 ( -0.028 -0.000 -0.126) 0.129 10.650 ( 0.990 0.000 0.687) 1.205 11.391 ( -8.180 -0.000 -5.562) 9.892 15.197 ( 13.071 0.000 7.619) 15.130 15.700 ( -0.685 -0.000 -2.899) 2.979 16.957 ( 6.456 0.000 -4.296) 7.755 17.301 ( 11.680 0.000 -14.613) 18.707 19.872 ( -0.110 -0.000 0.107) 0.153 20.108 ( -0.036 -0.000 -0.096) 0.102======================= Grid point 415 (197/322) =======================q-point: ( 0.46 0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.858 ( 11.127 -4.785 7.644) 14.323 2.166 ( 11.880 -10.088 2.021) 15.716 2.243 ( -13.225 -5.969 5.465) 15.505 2.404 ( -10.274 -6.980 -0.496) 12.431 2.733 ( 0.089 -9.970 -1.282) 10.053 2.872 ( -0.999 -10.265 -0.117) 10.315 3.025 ( 17.781 -4.182 1.274) 18.311 3.451 ( -2.365 -0.857 3.767) 4.530 3.590 ( 6.299 -7.447 -0.241) 9.757 3.978 ( -1.534 -4.377 3.123) 5.591 4.088 ( -3.880 -18.262 -1.017) 18.697 4.266 ( 12.143 -11.257 -1.786) 16.654 4.339 ( 1.397 -15.537 3.906) 16.082 4.432 ( -3.154 -3.513 -4.673) 6.643 4.538 ( -7.241 -1.279 -0.856) 7.403 4.876 ( -3.479 -1.363 1.607) 4.068 5.172 ( -10.056 -0.633 -6.447) 11.962 5.436 ( -2.271 0.941 1.284) 2.774 6.693 ( -1.051 13.133 20.687) 24.526 7.122 ( -2.839 8.032 1.538) 8.657 8.002 ( -0.019 0.434 7.258) 7.271 8.288 ( -0.841 14.847 0.029) 14.871 8.879 ( -1.556 5.840 -10.382) 12.013 9.113 ( 2.384 -9.808 -0.926) 10.136 9.823 ( 2.350 -4.717 0.750) 5.323 10.168 ( 3.032 6.255 3.346) 7.714 10.327 ( -0.692 3.065 -0.420) 3.170 10.622 ( -2.954 2.089 1.333) 3.856 10.803 ( 0.276 -13.134 0.236) 13.139 11.276 ( -6.407 6.098 -5.677) 10.510 15.222 ( 9.581 5.054 7.205) 13.010 15.642 ( 0.101 4.906 -2.393) 5.460 16.911 ( 3.088 6.711 -4.894) 8.862 17.029 ( 9.412 24.925 -7.069) 27.565 20.050 ( -0.623 -16.661 1.210) 16.716 20.470 ( 0.373 -30.149 -3.549) 30.360======================= Grid point 416 (198/322) =======================q-point: (-0.46 -0.62 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.030 ( 5.846 -5.153 6.906) 10.413 2.285 ( -9.776 -9.126 6.538) 14.886 2.428 ( 0.050 -7.711 2.597) 8.137 2.601 ( 1.774 -14.291 -0.540) 14.410 2.941 ( -0.931 -11.241 0.477) 11.290 3.114 ( 1.320 -12.438 1.087) 12.555 3.220 ( 10.720 -6.960 0.972) 12.818 3.429 ( -0.505 1.788 0.687) 1.981 3.804 ( 7.970 -8.806 -0.271) 11.880 4.061 ( -0.969 -3.698 4.242) 5.710 4.228 ( -8.220 -1.992 -0.433) 8.469 4.443 ( -2.711 -2.207 -6.060) 6.996 4.491 ( -9.626 -4.166 -5.455) 11.823 4.594 ( 1.703 -9.854 0.398) 10.008 4.855 ( 2.011 -17.282 4.826) 18.055 5.112 ( 11.019 -16.529 -0.139) 19.866 5.271 ( -8.505 -25.807 -4.782) 27.590 5.463 ( -2.077 -10.940 0.703) 11.158 6.355 ( -2.179 21.072 13.516) 25.129 6.923 ( 0.054 11.175 1.355) 11.257 7.955 ( 4.157 13.300 1.211) 13.987 8.053 ( -6.271 -1.089 5.581) 8.465 8.673 ( -0.553 11.597 -11.492) 16.336 9.337 ( 2.489 -9.079 1.997) 9.624 9.828 ( 5.176 6.788 0.927) 8.586 9.925 ( -2.335 15.178 2.628) 15.580 10.471 ( 4.447 -10.925 -0.188) 11.797 10.525 ( -4.159 5.612 1.408) 7.126 11.100 ( -5.655 0.235 -2.870) 6.346 11.115 ( 0.711 -13.170 -0.849) 13.216 15.161 ( 5.868 5.912 5.893) 10.204 15.524 ( -0.002 6.306 -2.410) 6.751 16.589 ( 3.116 18.534 -2.399) 18.947 16.784 ( 1.039 7.621 -3.160) 8.316 20.451 ( -0.928 -22.671 2.494) 22.826 21.050 ( 2.003 -25.753 -5.305) 26.370======================= Grid point 417 (199/322) =======================q-point: (-0.38 -0.62 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.107 ( -2.775 0.134 7.865) 8.341 2.450 ( 0.078 -7.999 7.274) 10.812 2.575 ( -4.124 -8.015 2.551) 9.368 2.866 ( 3.236 -10.282 0.594) 10.796 3.148 ( -1.705 -10.059 0.451) 10.212 3.332 ( 0.249 -7.001 3.495) 7.829 3.382 ( 3.422 -4.270 -2.779) 6.137 3.462 ( 6.633 -6.890 -0.403) 9.572 4.002 ( 4.741 -5.693 0.478) 7.424 4.068 ( -7.171 0.167 5.582) 9.089 4.248 ( 0.355 -3.552 -1.069) 3.726 4.421 ( 4.306 3.600 -2.951) 6.341 4.526 ( -13.698 -9.179 -8.692) 18.639 4.669 ( -4.902 0.413 -2.118) 5.356 5.077 ( 11.638 -6.863 2.504) 13.741 5.297 ( -3.160 -4.799 -1.565) 5.956 5.864 ( -3.304 -16.908 1.249) 17.273 5.902 ( 2.283 -5.001 3.470) 6.501 6.183 ( 2.552 -33.493 1.133) 33.609 6.717 ( 0.396 8.740 -0.163) 8.750 7.708 ( -3.239 10.656 4.183) 11.897 8.122 ( -1.606 -5.643 3.957) 7.077 8.409 ( 2.359 13.509 -9.690) 16.791 9.422 ( 1.565 4.896 5.197) 7.309 9.626 ( -0.825 11.633 2.568) 11.942 9.687 ( 2.174 8.910 -1.845) 9.355 10.376 ( -2.497 7.147 0.978) 7.633 10.547 ( 2.185 6.710 -2.888) 7.625 11.213 ( -2.035 -19.842 -0.153) 19.947 11.474 ( 0.963 -18.140 -0.054) 18.166 15.101 ( 2.960 3.523 5.108) 6.875 15.396 ( -2.145 5.547 -2.743) 6.549 16.349 ( -0.538 6.745 -0.699) 6.802 16.649 ( -0.107 5.921 -2.441) 6.405 20.882 ( -0.531 -20.351 2.338) 20.491 21.435 ( 2.108 -12.879 -4.342) 13.753======================= Grid point 418 (200/322) =======================q-point: (-0.31 -0.62 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.984 ( -5.115 11.800 8.555) 15.446 2.570 ( 1.056 -1.866 7.880) 8.167 2.685 ( -3.239 -4.780 1.550) 5.979 3.041 ( 0.151 -6.809 2.767) 7.351 3.302 ( -1.839 -6.875 -1.186) 7.215 3.429 ( 5.019 -4.293 -1.108) 6.697 3.519 ( -1.260 -6.696 1.891) 7.071 3.657 ( 2.586 -8.884 -1.705) 9.408 3.975 ( -2.179 2.392 4.905) 5.876 4.161 ( 2.348 -4.135 -1.675) 5.041 4.280 ( -3.495 0.303 -0.529) 3.547 4.400 ( 5.732 -0.321 -0.294) 5.749 4.573 ( 0.330 4.442 -1.832) 4.816 4.684 ( -8.062 -11.583 -7.379) 15.925 5.260 ( 3.393 -6.124 -2.573) 7.459 5.400 ( 1.790 -6.522 0.543) 6.785 5.639 ( 1.455 8.706 2.830) 9.269 6.268 ( -0.066 -3.837 -0.812) 3.923 6.700 ( 0.430 -8.933 -0.388) 8.952 6.918 ( 1.582 -30.802 -0.277) 30.843 7.530 ( -6.325 4.187 5.664) 9.467 8.162 ( 6.726 11.814 -6.797) 15.199 8.255 ( -3.007 -8.043 2.472) 8.936 9.207 ( -1.798 13.498 5.017) 14.512 9.438 ( 2.312 10.453 4.258) 11.521 9.551 ( -1.068 5.948 -2.948) 6.724 10.229 ( 0.039 7.232 -2.094) 7.529 10.411 ( 0.572 3.744 0.025) 3.788 11.681 ( -0.690 -25.251 -1.092) 25.284 11.815 ( 3.004 -15.236 -0.733) 15.547 15.068 ( 0.763 2.145 4.704) 5.226 15.276 ( -4.153 4.213 -3.070) 6.665 16.288 ( -2.180 -0.596 -0.516) 2.318 16.542 ( 0.012 4.635 -2.248) 5.152 21.226 ( -0.028 -14.283 1.265) 14.339 21.584 ( 0.835 -2.849 -2.454) 3.851======================= Grid point 419 (201/322) =======================q-point: (-0.23 -0.62 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.635 ( -5.220 20.512 8.069) 22.652 2.561 ( -1.083 3.075 7.667) 8.331 2.723 ( -0.845 -0.030 0.715) 1.108 3.153 ( -2.414 -4.497 4.170) 6.591 3.407 ( 0.583 -4.553 -1.892) 4.965 3.542 ( 4.168 -3.877 -0.685) 5.734 3.616 ( -5.476 -4.765 2.609) 7.713 3.814 ( -1.086 -6.344 -1.890) 6.708 3.961 ( 3.040 -0.155 3.525) 4.658 4.152 ( 0.171 3.874 -2.406) 4.563 4.296 ( -0.567 -3.037 -1.818) 3.585 4.467 ( 5.337 -0.386 2.239) 5.801 4.478 ( -1.106 2.114 -1.285) 2.710 4.860 ( 0.891 -8.465 -6.526) 10.726 5.359 ( -4.601 -4.820 -3.268) 7.421 5.504 ( 3.256 -3.204 1.245) 4.734 5.640 ( 6.393 -4.346 0.358) 7.739 6.222 ( -0.727 3.818 -0.643) 3.939 6.869 ( -0.044 -5.058 0.053) 5.059 7.184 ( -7.466 0.770 2.903) 8.048 7.627 ( -1.222 -13.142 1.365) 13.269 8.010 ( 8.793 6.560 -5.123) 12.107 8.428 ( -4.038 -11.012 3.846) 12.343 8.941 ( -2.252 13.253 4.918) 14.315 9.261 ( 1.874 9.087 3.985) 10.098 9.415 ( -0.855 6.231 -2.874) 6.915 10.110 ( 0.543 3.625 -3.078) 4.787 10.438 ( 1.006 -4.523 0.937) 4.727 12.048 ( -1.217 -11.460 -2.249) 11.742 12.161 ( 4.695 -18.013 -2.150) 18.738 15.022 ( -1.269 3.298 3.837) 5.217 15.183 ( -3.851 2.234 -2.665) 5.189 16.310 ( -3.266 -2.490 -0.630) 4.155 16.457 ( 1.366 4.032 -2.151) 4.769 21.441 ( 0.120 -7.533 0.031) 7.534 21.586 ( -0.238 1.623 -0.564) 1.735======================= Grid point 420 (202/322) =======================q-point: (-0.15 -0.62 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.233 ( -4.177 15.918 8.054) 18.322 2.506 ( -1.523 1.981 7.212) 7.633 2.687 ( 0.861 3.249 0.415) 3.387 3.197 ( -3.277 -1.187 3.801) 5.157 3.477 ( 2.085 -1.684 -0.545) 2.735 3.603 ( 2.924 0.347 1.277) 3.210 3.659 ( -7.866 -3.726 0.008) 8.704 3.859 ( -2.408 0.482 0.321) 2.477 4.019 ( 4.257 -2.125 0.098) 4.759 4.088 ( 1.208 1.908 -1.649) 2.796 4.336 ( 0.665 -1.044 -1.813) 2.195 4.402 ( 1.191 2.842 -1.314) 3.349 4.559 ( 2.201 -3.804 2.314) 4.967 4.985 ( 4.759 -3.328 -5.356) 7.900 5.381 ( -7.648 -1.913 -1.168) 7.970 5.644 ( 5.275 -7.286 0.453) 9.007 5.762 ( 4.313 -4.302 -0.731) 6.135 6.162 ( -1.010 1.336 -0.344) 1.710 6.909 ( -3.111 -0.555 1.157) 3.365 7.067 ( -7.312 4.686 2.501) 9.038 7.771 ( 2.358 -1.499 -1.951) 3.408 8.010 ( 5.420 -1.340 -2.564) 6.144 8.613 ( 0.760 -1.721 4.591) 4.962 8.699 ( -6.401 3.850 5.588) 9.328 9.133 ( 0.645 4.848 4.177) 6.432 9.322 ( 0.554 1.632 -3.677) 4.061 10.082 ( 0.625 0.058 -2.995) 3.060 10.534 ( 0.897 -3.027 0.536) 3.203 12.181 ( 1.686 -2.496 -2.965) 4.226 12.452 ( 1.070 -9.436 -3.350) 10.070 14.939 ( -1.990 4.263 1.988) 5.107 15.134 ( -1.740 0.993 -1.092) 2.282 16.309 ( -1.993 1.625 -0.719) 2.670 16.413 ( 2.128 0.657 -1.810) 2.869 21.520 ( -0.289 -0.666 -0.192) 0.751 21.561 ( 0.037 -0.024 0.108) 0.116======================= Grid point 421 (203/322) =======================q-point: (-0.08 0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.101 ( -0.344 -3.833 8.135) 8.999 2.502 ( -2.042 -1.139 6.421) 6.833 2.631 ( 3.346 3.200 0.776) 4.694 3.182 ( -1.724 1.424 2.923) 3.680 3.483 ( -0.212 1.983 1.640) 2.582 3.572 ( 2.905 4.114 1.580) 5.278 3.654 ( -6.849 0.290 -3.251) 7.587 3.790 ( -1.425 4.832 1.134) 5.164 4.056 ( 2.475 -0.116 -1.314) 2.805 4.087 ( 3.906 0.761 -0.817) 4.063 4.344 ( 2.098 0.452 0.376) 2.179 4.374 ( -0.089 0.405 -2.342) 2.378 4.647 ( -1.126 -4.490 0.463) 4.652 5.026 ( 6.045 1.587 -3.326) 7.079 5.359 ( -5.848 -0.310 0.287) 5.863 5.749 ( 3.171 0.600 -0.668) 3.295 5.903 ( -2.622 -9.833 -0.524) 10.191 6.164 ( -1.070 -2.114 0.097) 2.371 6.845 ( -6.612 3.596 3.280) 8.210 6.989 ( -0.063 1.273 -0.103) 1.279 7.788 ( 2.420 1.118 -1.583) 3.100 8.038 ( 3.930 0.813 -3.134) 5.092 8.433 ( 2.237 10.762 3.329) 11.485 8.807 ( -6.220 -7.478 6.070) 11.465 9.108 ( -0.630 -1.553 4.835) 5.118 9.369 ( 0.982 -6.034 -3.303) 6.949 10.078 ( 0.635 0.259 -3.184) 3.257 10.538 ( 0.642 3.034 0.547) 3.149 12.155 ( 2.471 5.892 -3.134) 7.117 12.515 ( -2.288 2.277 -3.627) 4.855 14.853 ( -0.404 3.817 0.889) 3.940 15.116 ( 1.094 0.523 -0.218) 1.232 16.243 ( 1.830 4.241 -0.425) 4.639 16.430 ( 1.580 -0.964 -1.576) 2.431 21.523 ( 0.308 0.754 -0.150) 0.828 21.551 ( 0.002 0.462 0.145) 0.484======================= Grid point 428 (204/322) =======================q-point: (-0.54 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.889 ( 10.922 0.000 7.163) 13.061 2.082 ( -19.171 -0.000 6.917) 20.380 2.122 ( 9.421 0.000 0.476) 9.433 2.274 ( -8.514 -0.000 0.830) 8.554 2.626 ( 4.835 0.000 -3.460) 5.946 2.749 ( -2.208 -0.000 -0.740) 2.328 3.097 ( 16.384 0.000 3.459) 16.746 3.394 ( -2.378 -0.000 6.974) 7.369 3.579 ( 2.417 0.000 -0.930) 2.590 3.824 ( 0.623 0.000 -3.793) 3.844 3.915 ( -3.643 -0.000 6.015) 7.032 4.139 ( -0.625 -0.000 -4.835) 4.875 4.258 ( -4.928 -0.000 3.629) 6.120 4.357 ( -9.087 -0.000 -3.673) 9.801 4.525 ( 5.021 0.000 -2.052) 5.424 4.883 ( 5.033 0.000 1.781) 5.339 5.123 ( -3.962 -0.000 -4.743) 6.180 5.439 ( -2.430 -0.000 0.406) 2.463 6.869 ( 0.921 0.000 24.904) 24.921 7.193 ( -1.835 -0.000 1.226) 2.207 8.003 ( -2.363 -0.000 8.117) 8.454 8.489 ( 1.383 0.000 0.462) 1.458 8.905 ( 1.042 0.000 -0.238) 1.069 9.006 ( -1.184 -0.000 -12.316) 12.373 9.736 ( -0.278 -0.000 -0.498) 0.570 10.251 ( 6.467 0.000 0.861) 6.524 10.398 ( -6.229 -0.000 2.673) 6.778 10.621 ( 0.303 0.000 -0.074) 0.312 10.659 ( 0.252 0.000 0.812) 0.850 11.300 ( -4.099 -0.000 -6.371) 7.576 15.337 ( 5.960 0.000 8.535) 10.411 15.691 ( 0.736 0.000 -1.785) 1.930 16.983 ( 0.867 0.000 -5.770) 5.835 17.391 ( 10.493 0.000 -11.871) 15.843 19.871 ( -0.054 -0.000 0.107) 0.120 20.108 ( -0.010 -0.000 -0.098) 0.099======================= Grid point 429 (205/322) =======================q-point: (-0.46 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.946 ( -10.810 -3.770 6.904) 13.369 2.096 ( 3.331 -6.424 6.788) 9.922 2.243 ( -16.322 -9.601 1.184) 18.974 2.368 ( 13.908 -9.700 0.215) 16.958 2.752 ( 2.848 -7.954 -0.090) 8.449 2.868 ( 1.063 -12.139 -1.954) 12.341 3.193 ( 9.053 -1.841 3.103) 9.745 3.438 ( -1.554 -1.270 3.322) 3.882 3.664 ( 5.902 -9.493 -0.382) 11.185 3.963 ( -8.425 -6.889 8.065) 13.546 4.003 ( -7.219 -10.713 -5.267) 13.950 4.220 ( -19.649 -11.606 -2.741) 22.985 4.326 ( -3.191 -9.067 1.536) 9.734 4.373 ( 5.369 -11.757 -4.579) 13.712 4.578 ( 11.679 -2.076 1.149) 11.918 4.929 ( 4.738 -2.766 -2.386) 5.983 5.119 ( 5.177 -0.346 -1.226) 5.331 5.407 ( -2.120 1.273 -0.857) 2.617 6.751 ( -0.425 15.465 21.505) 26.492 7.122 ( 1.687 7.033 2.144) 7.543 8.008 ( -2.797 -0.642 7.206) 7.757 8.282 ( -0.213 16.812 -0.412) 16.818 8.832 ( -0.565 6.710 -11.214) 13.081 9.129 ( 0.669 -11.527 -0.764) 11.572 9.851 ( 2.240 -7.375 0.408) 7.719 10.197 ( 0.218 11.251 4.116) 11.982 10.325 ( 0.508 -1.839 -1.301) 2.309 10.594 ( -1.917 2.817 2.015) 3.959 10.813 ( 1.055 -12.681 0.183) 12.726 11.207 ( -2.343 6.223 -6.167) 9.069 15.317 ( 2.453 5.252 7.622) 9.576 15.638 ( 0.532 5.337 -1.991) 5.721 16.907 ( -0.886 6.324 -4.596) 7.868 17.089 ( 4.292 26.779 -7.656) 28.181 20.048 ( -0.326 -16.530 1.158) 16.574 20.478 ( 2.817 -30.495 -3.383) 30.811======================= Grid point 430 (206/322) =======================q-point: (-0.38 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.986 ( -15.318 -6.997 7.436) 18.410 2.308 ( 7.855 -9.090 6.264) 13.549 2.357 ( -10.432 -10.100 2.609) 14.753 2.670 ( 7.837 -12.466 -0.976) 14.757 2.946 ( 1.442 -10.125 1.109) 10.287 3.133 ( 1.465 -12.501 0.566) 12.599 3.290 ( 0.598 -4.770 0.427) 4.827 3.455 ( 4.539 -0.264 0.516) 4.576 3.882 ( 4.336 -8.270 1.174) 9.412 4.028 ( -15.112 -4.620 4.276) 16.371 4.128 ( -3.881 -8.340 -3.097) 9.706 4.226 ( -13.742 -4.200 -2.614) 14.605 4.500 ( 3.032 -0.823 -2.924) 4.292 4.624 ( 3.191 -7.774 0.697) 8.432 4.955 ( 11.645 -17.283 1.391) 20.886 5.162 ( -5.557 -16.518 -4.403) 17.976 5.238 ( 5.912 -17.247 -0.053) 18.232 5.480 ( 6.439 -16.457 -1.013) 17.701 6.389 ( 0.636 22.081 14.272) 26.299 6.948 ( 3.479 12.063 0.684) 12.573 7.916 ( -9.358 11.783 2.503) 15.253 8.058 ( 2.166 0.652 4.365) 4.916 8.645 ( 1.656 10.513 -10.914) 15.244 9.359 ( 0.279 -9.953 1.406) 10.056 9.887 ( 4.827 6.370 -0.152) 7.994 9.911 ( -1.605 16.543 3.324) 16.949 10.447 ( -5.716 -2.626 -0.231) 6.295 10.551 ( 5.519 -3.623 2.279) 6.985 11.037 ( -3.165 1.995 -3.905) 5.408 11.134 ( 2.318 -14.712 -0.179) 14.895 15.215 ( 0.140 6.103 6.327) 8.792 15.500 ( -2.817 7.096 -3.056) 8.224 16.588 ( -2.217 19.253 -2.394) 19.528 16.768 ( -1.891 7.105 -3.122) 7.987 20.450 ( -0.535 -22.707 2.456) 22.846 21.076 ( 5.378 -25.199 -5.648) 26.378======================= Grid point 431 (207/322) =======================q-point: (-0.31 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.026 ( -13.501 -2.938 8.056) 15.994 2.501 ( -7.149 -9.305 3.198) 12.162 2.525 ( 4.825 -6.789 5.901) 10.207 2.911 ( 4.127 -8.295 0.238) 9.268 3.142 ( 0.361 -8.753 0.764) 8.794 3.327 ( -2.523 -7.194 2.555) 8.040 3.415 ( 3.183 -7.222 -3.001) 8.444 3.514 ( 2.880 -3.622 -0.700) 4.680 4.007 ( -4.320 0.711 4.460) 6.250 4.053 ( 1.439 -7.438 0.899) 7.629 4.265 ( -0.139 -3.046 0.790) 3.150 4.271 ( -16.392 -12.106 -5.881) 21.210 4.499 ( 5.799 0.421 -2.561) 6.353 4.669 ( 4.372 3.002 -0.793) 5.362 5.163 ( -0.188 -4.194 -3.495) 5.463 5.294 ( 6.316 -6.718 0.487) 9.234 5.847 ( -0.139 -21.056 0.753) 21.070 5.959 ( 5.437 0.568 4.783) 7.264 6.237 ( 6.027 -32.474 0.411) 33.031 6.732 ( 2.537 9.942 -0.843) 10.295 7.645 ( -9.259 10.034 4.739) 14.452 8.114 ( -2.125 -4.749 3.461) 6.249 8.421 ( 4.130 12.003 -9.162) 15.655 9.456 ( 1.131 4.578 5.474) 7.225 9.591 ( -4.468 10.996 0.959) 11.908 9.727 ( 4.401 11.058 -1.254) 11.967 10.350 ( -2.327 5.621 0.846) 6.142 10.566 ( 2.367 8.567 -2.583) 9.255 11.203 ( 0.174 -21.060 0.233) 21.062 11.493 ( 2.339 -18.413 -0.216) 18.562 15.123 ( -1.805 3.418 5.398) 6.639 15.337 ( -6.443 5.870 -3.610) 9.434 16.321 ( -3.686 6.469 -0.378) 7.455 16.631 ( -1.643 5.388 -2.186) 6.043 20.885 ( -0.286 -20.428 2.385) 20.568 21.457 ( 4.016 -11.620 -4.778) 13.190======================= Grid point 432 (208/322) =======================q-point: (-0.23 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.914 ( -10.659 9.234 8.212) 16.319 2.594 ( -2.912 -1.644 5.310) 6.275 2.655 ( -1.482 -5.103 3.043) 6.124 3.049 ( 0.237 -4.835 2.746) 5.565 3.302 ( 2.402 -7.081 -1.363) 7.600 3.448 ( -3.164 -6.556 1.337) 7.402 3.524 ( 3.285 -2.978 -0.511) 4.463 3.649 ( -1.759 -8.814 -2.522) 9.335 3.988 ( 0.898 0.734 5.343) 5.468 4.193 ( 0.789 -5.977 -1.198) 6.146 4.251 ( 0.264 4.516 -0.720) 4.581 4.377 ( -6.406 -7.139 -2.841) 10.004 4.576 ( -0.214 1.222 -3.507) 3.720 4.666 ( 6.621 -6.698 -0.018) 9.418 5.231 ( -3.321 -4.988 -4.360) 7.411 5.473 ( 8.011 -5.762 0.322) 9.874 5.698 ( 6.923 8.827 2.984) 11.608 6.267 ( 0.490 -3.242 -0.522) 3.320 6.707 ( 0.843 -8.588 -0.356) 8.637 6.946 ( 3.331 -26.836 -0.370) 27.044 7.453 ( -9.152 2.239 5.088) 10.708 8.202 ( 1.611 3.737 -5.608) 6.929 8.233 ( -0.715 -1.144 0.854) 1.597 9.214 ( 0.154 14.598 6.403) 15.942 9.451 ( -2.645 7.307 3.562) 8.548 9.545 ( 2.297 8.530 -3.394) 9.463 10.221 ( -0.247 6.954 -2.403) 7.361 10.425 ( 1.446 3.475 0.460) 3.791 11.662 ( -1.721 -22.987 -1.072) 23.076 11.867 ( 6.164 -17.345 -1.009) 18.435 15.071 ( -2.582 1.990 5.091) 6.045 15.195 ( -7.688 3.374 -4.009) 9.304 16.251 ( -3.756 -0.605 0.068) 3.805 16.530 ( -1.019 3.827 -2.103) 4.484 21.230 ( -0.012 -14.228 1.300) 14.287 21.590 ( 1.405 -1.899 -2.622) 3.529======================= Grid point 433 (209/322) =======================q-point: (-0.15 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.583 ( -7.681 18.769 7.896) 21.763 2.566 ( -1.885 3.015 6.377) 7.301 2.712 ( -2.035 -1.259 1.233) 2.692 3.128 ( -2.378 -3.572 2.700) 5.070 3.440 ( 5.008 -4.431 -0.537) 6.708 3.534 ( -6.834 -4.876 0.947) 8.448 3.597 ( 3.083 -2.380 0.976) 4.015 3.787 ( -1.978 -6.124 -2.068) 6.760 4.008 ( 2.702 -0.985 3.693) 4.681 4.154 ( 0.205 4.337 -0.984) 4.452 4.287 ( 0.752 -3.333 -2.311) 4.125 4.467 ( -0.816 -3.166 -0.375) 3.290 4.500 ( -0.431 2.724 -1.822) 3.305 4.878 ( 4.033 -9.133 -3.450) 10.563 5.293 ( -3.189 -3.389 -1.793) 4.987 5.587 ( 9.259 -2.365 0.432) 9.566 5.707 ( 5.014 -3.410 -0.658) 6.099 6.218 ( 0.223 4.191 0.036) 4.197 6.865 ( -1.183 -4.094 0.757) 4.328 7.101 ( -7.523 2.627 2.747) 8.429 7.624 ( 0.174 -14.063 0.382) 14.070 8.071 ( 4.699 5.578 -6.657) 9.875 8.379 ( -6.569 -11.272 4.049) 13.660 8.960 ( 2.532 13.451 6.801) 15.283 9.279 ( -1.273 8.618 4.429) 9.773 9.404 ( 0.984 6.279 -3.957) 7.487 10.105 ( 0.196 3.317 -3.167) 4.590 10.456 ( 1.236 -4.231 1.053) 4.532 12.009 ( -3.425 -13.986 -2.973) 14.703 12.232 ( 7.952 -14.660 -1.922) 16.788 15.006 ( -3.289 3.623 3.334) 5.921 15.120 ( -5.243 -0.026 -2.504) 5.810 16.267 ( -3.785 -2.530 -0.072) 4.553 16.461 ( 0.272 2.696 -2.109) 3.434 21.442 ( 0.027 -7.314 -0.026) 7.314 21.581 ( -0.205 1.736 -0.471) 1.810======================= Grid point 434 (210/322) =======================q-point: (-0.08 -0.54 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.210 ( -4.059 13.739 8.445) 16.630 2.509 ( -1.639 2.037 6.794) 7.279 2.698 ( 0.221 1.637 0.677) 1.785 3.170 ( -1.908 -1.551 1.647) 2.960 3.500 ( -2.312 -0.153 3.698) 4.364 3.584 ( -1.122 -2.894 -1.929) 3.654 3.644 ( 3.042 -0.089 1.263) 3.295 3.840 ( -1.198 -0.102 -0.091) 1.206 4.053 ( 0.957 -1.113 -0.301) 1.498 4.109 ( 3.475 0.604 0.810) 3.618 4.331 ( 0.100 -1.527 -2.391) 2.838 4.417 ( 0.854 3.099 -0.848) 3.325 4.547 ( -4.523 -4.238 -1.470) 6.370 5.029 ( 4.154 -4.149 -4.110) 7.167 5.324 ( -0.949 -1.329 0.465) 1.697 5.713 ( 5.635 -4.709 0.314) 7.350 5.789 ( 1.352 -2.821 -1.848) 3.634 6.159 ( 0.569 1.726 0.365) 1.853 6.857 ( -5.819 1.511 2.748) 6.611 7.019 ( -1.967 2.018 0.743) 2.915 7.780 ( 0.476 -2.657 -1.281) 2.988 8.036 ( 0.892 -0.318 -5.102) 5.189 8.583 ( -7.311 -11.904 5.617) 15.057 8.728 ( 6.634 13.953 6.587) 16.795 9.141 ( -1.609 4.655 4.456) 6.642 9.320 ( 1.137 1.394 -4.097) 4.475 10.079 ( 0.538 -0.016 -3.054) 3.101 10.545 ( 0.615 -2.799 0.592) 2.926 12.170 ( -1.511 -4.566 -4.066) 6.298 12.475 ( 4.310 -5.899 -2.637) 7.767 14.921 ( -1.979 3.486 1.719) 4.362 15.109 ( -1.856 -0.941 -0.880) 2.259 16.284 ( -1.969 -0.563 -0.428) 2.092 16.427 ( 1.166 0.672 -1.881) 2.313 21.516 ( -0.270 -0.826 -0.132) 0.879 21.561 ( -0.040 -0.164 0.088) 0.190======================= Grid point 442 (211/322) =======================q-point: (-0.46 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.808 ( -22.033 -0.000 8.217) 23.515 2.000 ( -20.351 -0.000 1.462) 20.403 2.117 ( 14.952 0.000 6.596) 16.343 2.351 ( 11.076 0.000 -0.248) 11.079 2.687 ( 6.467 0.000 -1.603) 6.663 2.732 ( 0.542 0.000 -2.725) 2.778 3.243 ( 6.017 0.000 4.109) 7.286 3.392 ( -1.779 -0.000 7.414) 7.625 3.560 ( -8.196 -0.000 -4.604) 9.401 3.814 ( -19.777 -0.000 6.762) 20.902 3.816 ( -0.086 -0.000 -3.876) 3.877 4.004 ( -6.894 -0.000 -0.007) 6.894 4.241 ( -2.248 -0.000 1.101) 2.503 4.307 ( 3.594 0.000 -2.673) 4.479 4.645 ( 13.158 0.000 1.294) 13.222 4.931 ( 3.538 0.000 -7.155) 7.982 5.155 ( 6.816 0.000 0.345) 6.825 5.423 ( 1.803 0.000 -0.759) 1.956 6.956 ( -0.020 -0.000 25.952) 25.952 7.199 ( 2.188 0.000 1.171) 2.482 8.006 ( -1.103 -0.000 7.817) 7.894 8.505 ( 0.775 0.000 1.154) 1.390 8.902 ( -1.295 -0.000 -0.221) 1.313 8.955 ( -0.231 -0.000 -14.305) 14.307 9.729 ( -0.756 -0.000 -0.419) 0.864 10.320 ( 5.036 0.000 -1.358) 5.216 10.351 ( -3.260 -0.000 5.481) 6.377 10.627 ( 0.607 0.000 -0.127) 0.620 10.667 ( 0.887 0.000 1.249) 1.532 11.253 ( -0.883 -0.000 -6.697) 6.755 15.384 ( -1.787 -0.000 8.022) 8.218 15.707 ( 2.256 0.000 -1.337) 2.622 16.950 ( -3.178 -0.000 -4.894) 5.835 17.455 ( 6.738 0.000 -14.398) 15.897 19.871 ( 0.007 0.000 0.107) 0.107 20.107 ( 0.023 0.000 -0.096) 0.099======================= Grid point 443 (212/322) =======================q-point: (-0.38 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.749 ( -21.335 -5.920 8.866) 23.850 2.026 ( -19.702 -12.457 2.050) 23.399 2.262 ( 14.200 -4.482 6.078) 16.083 2.500 ( 8.647 -8.834 -1.420) 12.443 2.794 ( 4.220 -6.643 1.221) 7.964 2.887 ( 3.411 -12.725 -2.931) 13.496 3.242 ( -2.878 0.280 0.224) 2.900 3.426 ( -4.148 -3.726 1.857) 5.877 3.630 ( -20.613 -13.995 -1.033) 24.936 3.786 ( -4.254 -4.905 6.012) 8.848 3.986 ( 0.930 -10.993 -0.208) 11.034 4.068 ( -7.046 -7.139 1.627) 10.162 4.300 ( -1.645 -10.458 0.822) 10.619 4.426 ( 4.563 -11.570 -2.004) 12.597 4.745 ( 14.758 -3.505 1.943) 15.293 4.955 ( 5.496 -1.920 -7.297) 9.335 5.187 ( 1.330 -0.759 -1.939) 2.470 5.431 ( 8.848 1.058 -0.579) 8.930 6.813 ( -0.427 16.321 21.138) 26.709 7.171 ( 5.244 6.219 2.463) 8.499 7.990 ( -3.480 2.709 6.760) 8.071 8.277 ( -0.525 16.493 -0.071) 16.502 8.799 ( 0.742 6.219 -11.081) 12.729 9.121 ( -1.700 -12.479 -1.160) 12.647 9.875 ( 1.696 -10.145 -0.631) 10.305 10.208 ( -0.270 12.559 5.430) 13.685 10.327 ( 0.844 -0.805 -1.590) 1.972 10.600 ( 1.636 2.297 3.269) 4.318 10.825 ( 0.911 -12.147 -0.248) 12.184 11.177 ( 0.174 5.956 -6.231) 8.622 15.331 ( -3.398 4.628 7.440) 9.398 15.633 ( -0.831 7.485 -2.971) 8.095 16.867 ( -3.734 5.144 -3.371) 7.195 17.070 ( -3.304 29.826 -9.807) 31.570 20.049 ( -0.073 -16.517 1.211) 16.561 20.515 ( 5.581 -32.393 -4.492) 33.176======================= Grid point 444 (213/322) =======================q-point: (-0.31 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.805 ( -18.495 -9.343 8.770) 22.501 2.196 ( -15.851 -14.065 2.513) 21.339 2.459 ( 11.180 -6.327 5.632) 14.027 2.746 ( 5.623 -11.133 -2.246) 12.673 2.980 ( 3.240 -8.765 2.041) 9.565 3.149 ( 0.686 -11.071 0.704) 11.114 3.246 ( -7.596 -5.909 -3.331) 10.184 3.514 ( 3.968 -3.170 0.671) 5.122 3.752 ( -23.011 -14.459 -3.068) 27.349 3.916 ( -1.039 -7.134 5.169) 8.871 4.061 ( -6.428 -0.365 2.939) 7.077 4.217 ( 5.202 -6.503 1.260) 8.423 4.505 ( 0.618 -5.420 -2.148) 5.863 4.696 ( 7.225 -6.283 1.626) 9.712 5.068 ( -4.301 -6.987 -4.862) 9.537 5.123 ( 12.776 -20.609 -0.231) 24.249 5.272 ( 1.955 -16.118 -2.777) 16.472 5.601 ( 13.101 -17.611 -1.501) 22.001 6.456 ( 2.785 21.829 14.730) 26.481 7.007 ( 6.399 13.548 -0.399) 14.988 7.804 ( -10.554 11.186 2.866) 15.643 8.088 ( 0.373 2.986 4.281) 5.233 8.637 ( 2.324 9.373 -10.057) 13.942 9.349 ( -2.539 -10.746 0.367) 11.048 9.906 ( -1.217 15.821 2.913) 16.133 9.943 ( 4.978 7.878 -0.479) 9.332 10.382 ( -5.167 -2.110 0.497) 5.604 10.632 ( 6.766 -3.596 2.926) 8.202 10.997 ( -1.671 -0.085 -3.797) 4.149 11.165 ( 3.013 -13.546 -0.158) 13.878 15.208 ( -4.556 5.987 6.137) 9.709 15.430 ( -7.598 8.781 -4.510) 12.457 16.522 ( -7.522 18.155 -2.295) 19.785 16.727 ( -3.646 6.051 -2.218) 7.405 20.454 ( -0.241 -22.739 2.595) 22.888 21.139 ( 8.592 -24.160 -7.262) 26.651======================= Grid point 445 (214/322) =======================q-point: (-0.23 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.877 ( -15.529 -5.227 8.382) 18.405 2.379 ( -13.255 -12.509 2.266) 18.365 2.621 ( 6.023 -3.390 5.323) 8.724 2.962 ( 4.575 -7.371 -0.333) 8.682 3.156 ( 0.751 -8.049 1.520) 8.226 3.286 ( -5.241 -7.304 0.456) 9.001 3.422 ( -0.307 -11.066 -2.772) 11.412 3.548 ( 3.970 0.736 -1.408) 4.276 3.962 ( -7.741 -12.717 -1.958) 15.016 4.035 ( -6.082 -4.516 4.067) 8.598 4.073 ( -7.397 -8.863 0.312) 11.548 4.325 ( 4.606 -1.309 2.462) 5.384 4.539 ( 3.492 0.277 -3.086) 4.668 4.747 ( 6.689 3.469 1.306) 7.647 5.117 ( -1.657 -4.459 -5.041) 6.931 5.394 ( 8.448 -6.500 -0.530) 10.672 5.859 ( 1.609 -26.929 -0.380) 26.979 6.064 ( 9.542 9.383 6.762) 14.994 6.319 ( 8.074 -32.515 -1.152) 33.522 6.771 ( 4.655 11.426 -1.231) 12.399 7.536 ( -11.410 9.645 4.553) 15.618 8.092 ( -3.506 -3.020 3.666) 5.904 8.437 ( 3.185 10.807 -8.618) 14.185 9.465 ( -2.826 -1.605 2.173) 3.910 9.556 ( -1.689 17.138 4.184) 17.722 9.773 ( 4.299 11.408 -2.292) 12.405 10.326 ( -2.149 4.021 0.733) 4.618 10.582 ( 1.521 9.787 -2.581) 10.235 11.218 ( 2.140 -20.415 1.157) 20.559 11.527 ( 3.640 -19.462 -0.456) 19.804 15.094 ( -6.055 2.737 4.367) 7.951 15.225 ( -10.192 5.738 -3.597) 12.236 16.267 ( -5.269 5.274 0.206) 7.458 16.597 ( -3.100 4.669 -1.682) 5.852 20.890 ( -0.154 -20.396 2.550) 20.555 21.497 ( 5.568 -9.613 -5.758) 12.512======================= Grid point 446 (215/322) =======================q-point: (-0.15 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.801 ( -12.351 6.705 7.775) 16.061 2.520 ( -9.801 -7.849 2.130) 12.736 2.675 ( 1.098 0.158 4.719) 4.848 3.075 ( 2.842 -2.491 2.474) 4.517 3.331 ( 1.036 -8.992 -1.280) 9.141 3.394 ( -4.275 -5.777 1.902) 7.434 3.574 ( 4.784 -1.910 -1.332) 5.320 3.617 ( -1.847 -9.129 -3.483) 9.944 4.018 ( 0.512 -0.056 6.255) 6.276 4.144 ( -5.123 -5.138 -3.071) 7.879 4.236 ( -6.643 -8.381 -1.379) 10.783 4.346 ( 3.880 -0.452 -0.534) 3.943 4.552 ( -1.453 0.565 -2.949) 3.336 4.751 ( 5.694 -3.078 1.694) 6.690 5.212 ( 3.025 -4.474 -2.513) 5.957 5.552 ( 5.165 -5.741 -1.437) 7.855 5.820 ( 12.398 9.857 2.825) 16.089 6.278 ( 1.472 -2.772 -0.234) 3.147 6.715 ( 0.585 -7.780 -0.010) 7.802 6.993 ( 4.646 -19.569 -0.078) 20.113 7.359 ( -8.832 -2.751 3.202) 9.789 8.165 ( -6.501 -6.836 3.200) 9.962 8.238 ( 2.849 9.677 -7.535) 12.591 9.247 ( 1.496 13.996 6.767) 15.618 9.412 ( -4.816 5.029 2.657) 7.453 9.574 ( 3.802 10.314 -3.098) 11.421 10.209 ( -0.471 6.907 -2.691) 7.427 10.441 ( 0.748 2.895 0.724) 3.076 11.639 ( -1.612 -20.209 -0.759) 20.288 11.946 ( 7.804 -19.297 -1.535) 20.872 15.044 ( -4.607 0.570 4.611) 6.543 15.078 ( -9.699 2.432 -4.083) 10.801 16.205 ( -4.337 -0.792 0.562) 4.444 16.505 ( -2.295 2.885 -1.744) 4.078 21.234 ( -0.067 -14.080 1.366) 14.146 21.600 ( 1.859 -0.584 -2.908) 3.500======================= Grid point 447 (216/322) =======================q-point: (-0.08 -0.46 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.510 ( -8.593 16.288 7.399) 19.846 2.556 ( -2.833 0.867 4.620) 5.488 2.679 ( -4.183 -1.474 2.142) 4.925 3.134 ( 2.104 -1.925 1.697) 3.319 3.445 ( -7.952 -3.623 2.528) 9.097 3.505 ( 4.955 -5.712 -0.946) 7.621 3.642 ( 4.134 -2.053 0.531) 4.646 3.760 ( -1.004 -6.496 -3.106) 7.270 4.032 ( -0.910 -0.769 2.541) 2.807 4.159 ( 1.261 0.823 1.041) 1.831 4.296 ( 0.244 -1.667 -0.270) 1.706 4.405 ( -7.262 -4.199 -5.450) 10.004 4.494 ( 0.766 2.658 -0.132) 2.769 4.910 ( 2.269 -8.185 -1.809) 8.685 5.299 ( 4.388 -2.286 0.639) 4.989 5.670 ( 2.523 -4.131 -1.420) 5.045 5.792 ( 12.352 1.853 -0.226) 12.492 6.227 ( 1.150 4.291 0.408) 4.461 6.841 ( -3.726 -1.928 2.334) 4.801 7.039 ( -4.033 1.803 1.333) 4.615 7.634 ( 1.642 -14.015 -0.631) 14.125 8.074 ( -1.393 5.563 -5.977) 8.283 8.312 ( -5.868 -11.071 3.411) 12.986 9.030 ( 4.817 11.774 7.329) 14.681 9.261 ( -3.881 7.467 4.235) 9.421 9.413 ( 2.600 7.280 -4.161) 8.779 10.096 ( 0.156 2.926 -3.201) 4.340 10.469 ( 0.344 -4.017 1.038) 4.163 11.958 ( -3.478 -13.939 -2.699) 14.618 12.324 ( 8.615 -13.388 -2.647) 16.139 14.967 ( -4.572 2.833 0.916) 5.456 15.055 ( -4.527 -2.365 -0.371) 5.121 16.222 ( -3.958 -2.898 0.228) 4.911 16.450 ( -0.935 1.481 -1.800) 2.512 21.442 ( -0.025 -7.109 -0.075) 7.109 21.578 ( -0.137 1.965 -0.383) 2.006======================= Grid point 456 (217/322) =======================q-point: (-0.38 -0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.574 ( -22.187 -0.000 10.552) 24.569 1.745 ( -23.942 -0.000 3.088) 24.140 2.323 ( 16.178 0.000 5.732) 17.163 2.438 ( 3.987 0.000 -2.122) 4.517 2.752 ( 4.749 0.000 -2.713) 5.470 2.764 ( 7.023 0.000 -0.979) 7.091 3.157 ( -33.999 -0.000 -5.783) 34.487 3.331 ( -10.271 -0.000 3.535) 10.863 3.399 ( -1.019 -0.000 7.426) 7.496 3.744 ( 2.398 0.000 6.697) 7.114 3.799 ( -0.634 -0.000 -3.777) 3.829 3.989 ( 0.034 0.000 4.919) 4.920 4.196 ( -3.785 -0.000 -0.349) 3.801 4.362 ( 3.831 0.000 -0.959) 3.949 4.809 ( 12.839 0.000 0.304) 12.843 4.973 ( 8.564 0.000 -5.618) 10.242 5.177 ( -1.345 -0.000 -4.109) 4.323 5.514 ( 12.607 0.000 -0.335) 12.611 7.018 ( -3.291 -0.000 24.341) 24.563 7.250 ( 5.867 0.000 1.022) 5.956 8.037 ( 2.448 0.000 9.040) 9.366 8.511 ( -0.561 -0.000 1.682) 1.773 8.873 ( -3.539 -0.000 -0.155) 3.543 8.913 ( 0.996 0.000 -15.702) 15.733 9.717 ( -1.073 -0.000 -0.225) 1.096 10.327 ( -0.153 -0.000 0.186) 0.241 10.396 ( 5.325 0.000 5.012) 7.313 10.634 ( 0.800 0.000 -0.270) 0.845 10.691 ( 2.319 0.000 2.081) 3.116 11.231 ( 0.476 0.000 -6.735) 6.752 15.362 ( -5.539 -0.000 7.744) 9.521 15.716 ( -0.204 -0.000 -3.224) 3.231 16.886 ( -5.454 -0.000 -3.327) 6.388 17.438 ( -1.219 -0.000 -20.738) 20.773 19.872 ( 0.061 0.000 0.105) 0.122 20.108 ( 0.056 0.000 -0.090) 0.105======================= Grid point 457 (218/322) =======================q-point: (-0.31 -0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.535 ( -20.215 -7.011 11.160) 24.132 1.792 ( -21.522 -15.330 3.389) 26.640 2.439 ( 11.917 -3.200 4.320) 13.074 2.564 ( 4.404 -9.061 -2.250) 10.323 2.853 ( 2.895 -6.032 0.787) 6.737 2.924 ( 3.754 -11.602 -2.186) 12.389 3.011 ( -33.037 -8.219 -5.204) 34.439 3.323 ( -7.065 -5.398 2.017) 9.117 3.519 ( -0.857 -8.161 4.798) 9.506 3.795 ( -1.563 -4.460 4.974) 6.862 4.021 ( -2.529 -5.771 4.260) 7.606 4.026 ( 5.510 -11.255 0.819) 12.558 4.291 ( -0.364 -12.234 0.763) 12.264 4.453 ( 0.666 -10.722 -1.744) 10.883 4.890 ( 8.537 -2.683 -3.384) 9.567 5.051 ( 13.262 -2.788 -0.376) 13.557 5.158 ( -0.897 -0.320 -5.588) 5.669 5.570 ( 13.047 0.881 -1.556) 13.169 6.865 ( -1.956 15.015 19.585) 24.756 7.253 ( 7.380 5.565 1.830) 9.423 7.983 ( -0.839 9.518 6.812) 11.734 8.267 ( -1.409 14.818 0.795) 14.906 8.778 ( 1.196 5.478 -10.329) 11.752 9.082 ( -4.035 -12.946 -1.563) 13.650 9.881 ( -0.104 -11.627 -1.941) 11.788 10.233 ( 1.639 11.711 5.241) 12.934 10.339 ( 2.019 3.382 -0.939) 4.049 10.652 ( 5.047 0.411 5.850) 7.737 10.830 ( 0.340 -10.926 -1.410) 11.022 11.168 ( 1.368 5.033 -5.367) 7.484 15.296 ( -6.231 4.327 7.227) 10.478 15.582 ( -6.345 10.714 -6.237) 13.926 16.802 ( -5.749 4.350 -2.579) 7.657 16.945 ( -12.323 30.753 -11.208) 34.975 20.054 ( 0.089 -16.600 1.355) 16.655 20.579 ( 8.403 -35.559 -7.090) 37.220======================= Grid point 458 (219/322) =======================q-point: (-0.23 -0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.626 ( -16.852 -10.512 10.347) 22.395 2.005 ( -18.050 -16.349 3.226) 24.566 2.590 ( 8.046 -4.404 3.724) 9.900 2.788 ( 3.253 -11.364 -3.074) 12.214 2.982 ( -13.041 -10.575 -0.697) 16.804 3.086 ( -5.120 -9.468 -1.782) 10.910 3.178 ( 1.045 -12.299 -0.400) 12.350 3.491 ( -8.174 -15.258 0.438) 17.315 3.615 ( 0.670 -1.480 0.448) 1.685 3.901 ( -3.396 -6.760 3.155) 8.197 4.019 ( -3.062 -0.058 5.850) 6.603 4.276 ( 3.227 -5.795 1.047) 6.715 4.531 ( 5.243 -7.296 0.080) 8.985 4.760 ( 0.603 -9.998 2.033) 10.221 5.002 ( -0.394 -5.881 -6.278) 8.611 5.276 ( 6.238 -20.733 -3.552) 21.940 5.301 ( 9.793 -9.878 -0.528) 13.919 5.751 ( 13.395 -17.977 -2.650) 22.575 6.539 ( 3.316 19.907 14.365) 24.772 7.093 ( 8.722 15.033 -1.317) 17.430 7.697 ( -8.927 13.297 2.464) 16.204 8.094 ( -1.693 4.321 5.246) 7.004 8.632 ( 1.889 8.610 -9.105) 12.673 9.306 ( -4.599 -11.072 -0.357) 11.994 9.895 ( -2.137 13.015 1.939) 13.331 10.000 ( 5.187 10.314 -1.064) 11.594 10.332 ( -3.662 -1.385 0.857) 4.008 10.716 ( 5.251 0.378 1.371) 5.440 10.982 ( 1.184 -4.839 -0.724) 5.034 11.202 ( 3.388 -12.564 0.117) 13.013 15.146 ( -9.246 6.784 3.723) 12.057 15.293 ( -12.589 8.822 -4.422) 15.996 16.409 ( -10.196 14.219 -1.489) 17.560 16.672 ( -4.743 5.353 -1.227) 7.257 20.460 ( -0.093 -22.763 2.881) 22.945 21.227 ( 11.001 -22.631 -10.054) 27.097======================= Grid point 459 (220/322) =======================q-point: (-0.15 -0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.730 ( -13.921 -6.188 8.906) 17.647 2.217 ( -15.282 -14.686 2.643) 21.359 2.687 ( 2.885 -1.599 2.931) 4.412 3.010 ( 3.767 -8.335 -0.974) 9.198 3.124 ( -8.347 -9.873 0.792) 12.953 3.250 ( 0.895 -8.236 -0.263) 8.289 3.405 ( -0.983 -10.774 -2.137) 11.027 3.591 ( 3.918 1.218 -2.082) 4.601 3.819 ( -11.240 -19.889 -3.492) 23.111 4.014 ( -3.662 -5.389 -0.279) 6.521 4.028 ( -1.713 -1.999 8.911) 9.292 4.365 ( 0.729 -2.884 1.458) 3.313 4.584 ( 5.747 3.178 -1.282) 6.692 4.795 ( 1.001 2.016 1.789) 2.875 5.136 ( 7.023 -6.057 -3.458) 9.898 5.468 ( 4.469 -5.042 -2.021) 7.034 5.876 ( 1.531 -29.230 -1.040) 29.289 6.217 ( 12.052 14.350 7.861) 20.322 6.419 ( 10.284 -33.526 -2.714) 35.172 6.833 ( 6.575 12.896 -1.386) 14.542 7.414 ( -11.376 10.114 3.588) 15.639 8.053 ( -5.627 -1.222 4.451) 7.278 8.443 ( 2.466 10.315 -7.859) 13.200 9.411 ( -5.745 -2.128 0.028) 6.126 9.569 ( -0.093 16.780 5.998) 17.820 9.813 ( 4.073 11.457 -3.490) 12.650 10.303 ( -2.255 2.689 0.776) 3.594 10.579 ( -0.609 9.989 -3.396) 10.568 11.260 ( 3.956 -17.611 2.734) 18.255 11.574 ( 4.715 -21.170 -0.615) 21.698 14.994 ( -12.269 1.253 -1.095) 12.381 15.107 ( -8.268 4.621 1.195) 9.547 16.203 ( -5.651 3.739 0.594) 6.802 16.550 ( -4.064 4.019 -1.094) 5.820 20.896 ( -0.166 -20.267 2.799) 20.460 21.547 ( 6.382 -7.221 -7.127) 11.986======================= Grid point 460 (221/322) =======================q-point: (-0.08 -0.38 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.684 ( -11.409 5.230 7.392) 14.565 2.404 ( -10.512 -11.307 1.956) 15.562 2.696 ( 0.234 1.985 3.507) 4.036 3.122 ( 3.177 -1.864 2.391) 4.391 3.270 ( -8.031 -9.017 -0.019) 12.075 3.414 ( 4.357 -6.698 0.565) 8.010 3.583 ( -1.390 -8.738 -4.840) 10.085 3.625 ( 4.421 -2.862 -1.807) 5.568 4.015 ( -3.777 -2.228 2.647) 5.122 4.101 ( -6.459 -5.253 -0.460) 8.338 4.118 ( -5.768 -10.937 -2.065) 12.536 4.403 ( 3.850 1.005 2.379) 4.636 4.534 ( -0.035 2.450 -1.408) 2.826 4.808 ( 3.790 -2.540 1.821) 4.912 5.280 ( 8.185 -3.854 -0.586) 9.066 5.580 ( 0.847 -5.073 -2.411) 5.680 5.998 ( 16.143 8.805 2.422) 18.547 6.299 ( 2.409 -1.975 -0.211) 3.122 6.720 ( 0.125 -5.756 0.866) 5.822 7.042 ( 2.388 -6.305 1.035) 6.822 7.282 ( -3.911 -14.472 -0.235) 14.993 8.070 ( -11.235 -3.576 2.773) 12.112 8.259 ( 4.505 7.626 -5.771) 10.572 9.277 ( -0.247 11.139 5.202) 12.297 9.366 ( -4.257 5.393 3.521) 7.720 9.609 ( 3.854 10.743 -3.433) 11.919 10.194 ( -0.409 6.783 -2.747) 7.329 10.442 ( -0.941 2.013 0.547) 2.288 11.624 ( -0.673 -17.417 0.056) 17.430 12.033 ( 7.863 -20.543 -2.292) 22.116 14.942 ( -9.769 -1.804 -4.091) 10.743 15.010 ( -4.565 1.457 4.373) 6.487 16.155 ( -4.542 -1.027 0.685) 4.707 16.469 ( -2.968 2.014 -1.216) 3.787 21.237 ( -0.193 -13.886 1.453) 13.963 21.614 ( 2.087 0.827 -3.261) 3.959======================= Grid point 470 (222/322) =======================q-point: (-0.31 -0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.366 ( -19.658 -0.000 13.533) 23.866 1.469 ( -25.407 -0.000 5.056) 25.905 2.442 ( -0.870 -0.000 -3.994) 4.087 2.518 ( 13.319 0.000 4.810) 14.161 2.628 ( -47.658 -0.000 -2.707) 47.735 2.805 ( 5.383 0.000 -3.349) 6.340 2.850 ( 7.403 0.000 0.768) 7.442 3.263 ( -6.216 -0.000 0.998) 6.296 3.414 ( -0.247 -0.000 6.925) 6.930 3.778 ( -0.917 -0.000 -3.496) 3.614 3.822 ( 5.316 0.000 8.835) 10.311 4.013 ( 0.358 0.000 5.165) 5.178 4.169 ( 0.309 0.000 0.103) 0.326 4.370 ( -1.487 -0.000 -2.752) 3.129 4.907 ( 5.384 0.000 -4.562) 7.057 5.110 ( 14.509 0.000 2.251) 14.683 5.156 ( 1.749 0.000 -5.621) 5.887 5.664 ( 12.655 0.000 -2.592) 12.918 7.024 ( -7.504 -0.000 20.212) 21.560 7.339 ( 8.688 0.000 0.813) 8.726 8.124 ( 6.814 0.000 11.490) 13.358 8.503 ( -1.772 -0.000 1.859) 2.568 8.819 ( -5.579 -0.000 -0.077) 5.579 8.880 ( 1.610 0.000 -16.099) 16.179 9.704 ( -1.077 -0.000 0.065) 1.079 10.332 ( 1.196 0.000 -2.764) 3.012 10.498 ( 8.903 0.000 7.956) 11.940 10.643 ( 0.831 0.000 -0.470) 0.955 10.734 ( 3.717 0.000 3.385) 5.027 11.221 ( 1.393 0.000 -5.261) 5.442 15.312 ( -6.935 -0.000 7.600) 10.288 15.665 ( -6.229 -0.000 -8.439) 10.488 16.806 ( -6.583 -0.000 -2.251) 6.958 17.278 ( -13.961 -0.000 -27.874) 31.175 19.873 ( 0.095 0.000 0.103) 0.140 20.108 ( 0.080 0.000 -0.080) 0.113======================= Grid point 471 (223/322) =======================q-point: (-0.23 -0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.355 ( -17.060 -7.800 13.934) 23.367 1.551 ( -21.763 -17.849 5.035) 28.594 2.480 ( -33.802 -14.394 -0.580) 36.744 2.529 ( -7.704 -7.646 -3.391) 11.372 2.647 ( 8.816 -5.122 1.309) 10.280 2.929 ( 3.550 -7.702 -0.670) 8.507 2.983 ( 5.675 -8.782 -0.089) 10.457 3.262 ( -5.336 -4.691 0.817) 7.151 3.539 ( 0.907 -8.448 4.429) 9.582 3.779 ( -2.059 -3.780 1.764) 4.652 4.009 ( -2.099 -0.774 7.185) 7.525 4.119 ( 7.547 -14.391 0.800) 16.269 4.305 ( 2.749 -13.441 2.214) 13.897 4.427 ( -3.331 -10.887 -4.156) 12.120 4.935 ( 3.526 -1.143 -4.693) 5.981 5.159 ( 4.192 -0.222 -4.296) 6.007 5.233 ( 14.617 -4.077 1.978) 15.304 5.700 ( 10.146 1.248 -3.659) 10.857 6.883 ( -4.733 11.751 16.966) 21.174 7.351 ( 8.649 5.339 0.715) 10.189 8.017 ( 3.028 18.242 6.648) 19.650 8.251 ( -2.091 12.462 2.690) 12.919 8.759 ( 0.898 4.821 -9.392) 10.595 9.021 ( -5.470 -13.356 -1.639) 14.526 9.862 ( -1.966 -10.676 -2.106) 11.058 10.265 ( 1.823 8.312 -0.462) 8.522 10.374 ( 3.795 9.244 1.659) 10.129 10.748 ( 5.442 0.703 5.790) 7.977 10.829 ( 2.209 -10.526 0.415) 10.763 11.180 ( 3.091 3.630 -2.185) 5.244 15.233 ( -8.350 5.190 5.838) 11.435 15.426 ( -16.315 14.059 -10.991) 24.179 16.688 ( -15.692 16.838 -8.558) 24.556 16.756 ( -10.342 12.908 -3.030) 16.815 20.060 ( 0.138 -16.752 1.573) 16.826 20.663 ( 10.674 -39.433 -11.345) 42.398======================= Grid point 472 (224/322) =======================q-point: (-0.15 -0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.484 ( -13.249 -11.034 12.219) 21.133 1.799 ( -19.157 -17.900 4.466) 26.596 2.620 ( -11.198 -9.515 -3.503) 15.106 2.738 ( -9.531 -19.225 1.064) 21.484 2.824 ( 2.071 -9.782 -2.347) 10.271 3.098 ( 1.541 -7.893 1.353) 8.156 3.201 ( 2.581 -10.008 0.175) 10.337 3.408 ( -6.856 -13.371 0.119) 15.027 3.641 ( 2.043 -0.378 0.386) 2.114 3.869 ( -2.465 -5.664 -0.141) 6.179 4.026 ( 0.488 -0.731 8.555) 8.600 4.290 ( -0.504 -3.923 -0.956) 4.069 4.628 ( 8.149 -8.007 4.285) 12.202 4.721 ( -3.783 -11.979 -1.166) 12.616 5.034 ( 6.745 -8.429 -3.996) 11.511 5.290 ( 0.636 -16.421 -3.300) 16.761 5.427 ( 8.930 -6.496 -1.854) 11.198 5.894 ( 12.387 -20.560 -3.258) 24.223 6.616 ( 2.502 15.971 13.222) 20.884 7.198 ( 9.877 15.705 -1.636) 18.624 7.618 ( -5.341 17.388 1.808) 18.279 8.080 ( -3.982 5.939 6.335) 9.553 8.627 ( 1.994 7.955 -7.958) 11.428 9.247 ( -4.967 -11.114 -0.584) 12.187 9.865 ( -3.913 9.967 1.452) 10.806 10.051 ( 4.204 11.883 -2.461) 12.842 10.300 ( -2.488 0.246 0.737) 2.606 10.731 ( -1.912 4.687 -5.160) 7.228 11.047 ( 8.299 -8.999 7.003) 14.103 11.245 ( 3.564 -11.566 1.054) 12.148 14.980 ( -18.971 7.485 -3.987) 20.780 15.156 ( -9.438 5.293 2.049) 11.013 16.288 ( -9.634 9.319 -0.346) 13.408 16.611 ( -5.125 4.828 -0.591) 7.066 20.469 ( -0.110 -22.770 3.265) 23.003 21.326 ( 11.827 -20.776 -13.689) 27.549======================= Grid point 473 (225/322) =======================q-point: (-0.08 -0.31 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.614 ( -10.576 -6.131 9.676) 15.590 2.050 ( -14.398 -17.182 3.484) 22.686 2.701 ( -1.415 -2.738 -0.319) 3.099 3.012 ( -8.512 -12.424 -0.434) 15.066 3.043 ( 1.751 -9.614 -0.147) 9.773 3.276 ( 2.452 -9.565 0.024) 9.875 3.390 ( -0.436 -8.588 -1.901) 8.806 3.619 ( 0.990 -1.460 -1.968) 2.643 3.686 ( -9.790 -15.575 -3.172) 18.668 3.968 ( -2.551 -5.890 -0.806) 6.469 4.059 ( 1.623 -0.377 8.534) 8.695 4.357 ( -1.812 -4.220 0.244) 4.600 4.646 ( 3.307 5.276 2.123) 6.579 4.823 ( 4.483 -0.486 1.810) 4.859 5.226 ( 8.498 -6.428 -2.224) 10.885 5.485 ( 0.116 -4.580 -2.615) 5.275 5.884 ( 0.514 -29.570 -1.393) 29.607 6.370 ( 9.064 10.743 6.674) 15.560 6.549 ( 13.401 -30.070 -2.072) 32.986 6.915 ( 8.246 14.390 -1.600) 16.662 7.299 ( -9.632 11.794 2.381) 15.412 7.984 ( -8.619 1.038 4.533) 9.794 8.456 ( 3.886 9.686 -6.249) 12.164 9.344 ( -5.603 -1.597 -0.138) 5.827 9.576 ( -1.972 14.814 5.553) 15.943 9.844 ( 3.307 11.348 -4.490) 12.644 10.279 ( -2.244 1.550 0.950) 2.888 10.546 ( -2.593 9.126 -4.711) 10.592 11.324 ( 4.958 -13.381 4.419) 14.939 11.630 ( 4.885 -22.820 -0.621) 23.346 14.832 ( -12.749 -1.466 -2.736) 13.122 15.030 ( -6.688 3.166 2.879) 7.940 16.141 ( -5.200 2.519 0.665) 5.816 16.499 ( -4.047 3.456 -0.570) 5.352 20.903 ( -0.317 -20.065 3.081) 20.303 21.597 ( 6.159 -4.979 -8.611) 11.699======================= Grid point 484 (226/322) =======================q-point: (-0.23 -0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.191 ( -25.127 -0.000 7.671) 26.272 1.204 ( -16.068 -0.000 16.757) 23.216 2.049 ( -49.239 -0.000 3.035) 49.333 2.408 ( -2.021 -0.000 -5.638) 5.989 2.676 ( 10.378 0.000 2.047) 10.578 2.851 ( 3.604 0.000 -1.621) 3.952 2.934 ( 6.424 0.000 0.273) 6.430 3.186 ( -7.108 -0.000 0.709) 7.143 3.435 ( 0.260 0.000 6.008) 6.014 3.758 ( -0.846 -0.000 -3.069) 3.183 3.898 ( 2.791 0.000 5.352) 6.036 4.002 ( -4.387 -0.000 4.605) 6.360 4.234 ( 9.846 0.000 3.194) 10.351 4.321 ( -3.835 -0.000 -5.439) 6.655 4.950 ( 5.855 0.000 -2.445) 6.344 5.175 ( 2.940 0.000 -4.250) 5.168 5.286 ( 13.233 0.000 2.913) 13.549 5.778 ( 8.516 0.000 -4.778) 9.765 6.977 ( -9.429 -0.000 16.012) 18.582 7.453 ( 10.121 0.000 0.591) 10.138 8.257 ( 9.055 0.000 12.436) 15.384 8.484 ( -2.370 -0.000 2.029) 3.120 8.745 ( -7.060 -0.000 -0.023) 7.060 8.847 ( 1.166 0.000 -15.633) 15.676 9.693 ( -0.768 -0.000 0.409) 0.870 10.329 ( 0.409 0.000 -6.416) 6.429 10.624 ( 5.929 0.000 2.196) 6.322 10.650 ( 0.697 0.000 -0.686) 0.978 10.826 ( 12.049 0.000 9.104) 15.101 11.247 ( 5.315 0.000 0.960) 5.401 15.247 ( -8.255 -0.000 6.364) 10.423 15.489 ( -18.896 -0.000 -18.358) 26.345 16.716 ( -8.035 -0.000 -3.329) 8.697 16.942 ( -26.883 -0.000 -26.484) 37.737 19.875 ( 0.101 0.000 0.101) 0.142 20.109 ( 0.090 0.000 -0.070) 0.114======================= Grid point 485 (227/322) =======================q-point: (-0.15 -0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.227 ( -13.013 -8.724 16.658) 22.867 1.320 ( -20.862 -19.297 7.241) 29.326 2.004 ( -38.580 -22.536 3.034) 44.782 2.504 ( -1.062 -9.999 -4.473) 11.006 2.745 ( 6.495 -2.041 0.130) 6.810 2.959 ( 1.963 -7.341 0.177) 7.601 3.045 ( 4.293 -7.179 -0.519) 8.381 3.195 ( -6.534 -5.203 0.796) 8.391 3.562 ( 0.856 -8.419 3.860) 9.301 3.767 ( -0.421 -3.642 -1.415) 3.929 4.010 ( -1.846 -2.435 7.373) 7.981 4.174 ( 2.004 -14.563 -0.935) 14.730 4.335 ( -2.693 -9.399 -1.468) 9.886 4.419 ( 8.811 -13.394 -1.058) 16.067 4.987 ( 7.959 -0.088 -1.112) 8.037 5.187 ( 1.669 -0.900 -3.275) 3.784 5.390 ( 10.756 -3.105 1.050) 11.244 5.777 ( 5.055 0.731 -4.456) 6.778 6.866 ( -5.905 8.008 14.233) 17.366 7.456 ( 8.942 6.010 0.213) 10.776 8.081 ( 4.088 25.858 3.718) 26.442 8.238 ( -2.424 10.526 6.201) 12.455 8.741 ( 0.653 3.762 -8.183) 9.030 8.953 ( -4.907 -14.183 -1.358) 15.069 9.827 ( -2.820 -8.458 -1.346) 9.016 10.264 ( -0.594 5.609 -5.675) 8.001 10.425 ( 3.456 12.706 1.485) 13.251 10.716 ( -7.136 -0.674 -6.002) 9.349 10.976 ( 15.436 -5.329 11.088) 19.739 11.235 ( 6.065 4.083 4.403) 8.535 15.054 ( -27.832 14.200 -11.492) 33.291 15.201 ( -12.053 4.966 1.592) 13.133 16.442 ( -18.532 14.290 -5.243) 23.982 16.668 ( -6.059 4.153 -0.394) 7.356 20.066 ( 0.069 -16.948 1.831) 17.047 20.750 ( 11.369 -43.182 -16.866) 47.732======================= Grid point 486 (228/322) =======================q-point: (-0.08 -0.23 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.397 ( -8.595 -11.181 14.132) 19.966 1.597 ( -17.589 -19.601 6.543) 27.137 2.387 ( -18.032 -26.826 -3.810) 32.547 2.727 ( 0.371 -12.687 1.222) 12.751 2.850 ( 2.493 -6.742 -2.064) 7.479 3.111 ( -0.009 -7.610 1.770) 7.813 3.226 ( 0.894 -8.940 -1.333) 9.083 3.316 ( -8.287 -11.220 -0.574) 13.961 3.660 ( 1.244 -0.493 0.412) 1.400 3.842 ( -1.900 -5.018 -2.369) 5.865 4.082 ( 3.988 -1.396 9.318) 10.231 4.276 ( -0.308 -2.426 -1.809) 3.042 4.618 ( -5.705 -11.563 1.352) 12.964 4.810 ( 12.558 -10.633 2.284) 16.613 5.104 ( 6.734 -10.528 -3.049) 12.865 5.271 ( -2.145 -11.687 -2.545) 12.152 5.491 ( 3.480 -4.082 -2.419) 5.885 6.005 ( 7.722 -22.876 -3.734) 24.431 6.681 ( 2.128 10.539 11.791) 15.957 7.304 ( 8.426 14.785 -1.164) 17.057 7.588 ( -0.460 22.674 0.951) 22.699 8.038 ( -6.727 8.006 6.604) 12.367 8.636 ( 3.663 6.870 -6.334) 10.037 9.193 ( -3.684 -10.732 -0.711) 11.369 9.813 ( -5.877 7.967 1.981) 10.097 10.078 ( 1.948 11.517 -4.463) 12.505 10.276 ( -1.997 2.291 0.213) 3.047 10.661 ( -5.559 3.037 -7.547) 9.853 11.187 ( 9.847 -6.856 8.291) 14.584 11.294 ( 3.869 -10.155 4.012) 11.584 14.739 ( -17.782 1.505 -3.280) 18.145 15.063 ( -8.429 4.134 2.520) 9.721 16.189 ( -7.135 5.638 0.399) 9.102 16.553 ( -4.411 4.353 -0.267) 6.203 20.477 ( -0.289 -22.749 3.678) 23.046 21.409 ( 10.411 -19.088 -17.387) 27.840======================= Grid point 498 (229/322) =======================q-point: (-0.15 -0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.942 ( -21.869 -0.000 11.111) 24.529 1.079 ( -16.618 -0.000 17.674) 24.260 1.540 ( -38.637 -0.000 12.476) 40.602 2.366 ( -1.625 -0.000 -6.998) 7.184 2.768 ( 4.863 0.000 -1.370) 5.052 2.879 ( 1.653 0.000 0.101) 1.656 2.998 ( 4.525 0.000 -0.312) 4.536 3.109 ( -6.311 -0.000 2.222) 6.690 3.455 ( 0.250 0.000 4.964) 4.971 3.741 ( -0.364 -0.000 -2.573) 2.599 3.867 ( -7.699 -0.000 -4.916) 9.134 4.000 ( 0.535 0.000 8.679) 8.696 4.270 ( -0.947 -0.000 -5.099) 5.186 4.393 ( 13.909 0.000 2.258) 14.091 5.052 ( 11.937 0.000 1.608) 12.045 5.174 ( -1.634 -0.000 -2.749) 3.198 5.425 ( 9.263 0.000 1.219) 9.343 5.824 ( 1.822 0.000 -5.574) 5.864 6.920 ( -7.727 -0.000 13.610) 15.651 7.571 ( 9.485 0.000 0.410) 9.494 8.392 ( 6.911 0.000 8.878) 11.251 8.465 ( -1.635 -0.000 2.662) 3.124 8.660 ( -7.217 -0.000 -0.004) 7.217 8.808 ( 0.083 0.000 -13.414) 13.414 9.689 ( -0.287 -0.000 0.730) 0.784 10.292 ( -3.245 -0.000 -9.799) 10.323 10.605 ( -6.617 -0.000 -4.806) 8.178 10.654 ( 0.438 0.000 -0.873) 0.977 11.063 ( 19.679 0.000 3.940) 20.069 11.395 ( 17.897 0.000 13.539) 22.441 15.029 ( -40.613 -0.000 -24.482) 47.421 15.185 ( -12.105 -0.000 2.840) 12.433 16.488 ( -24.771 -0.000 -12.167) 27.598 16.681 ( -7.843 -0.000 -1.635) 8.012 19.876 ( 0.077 0.000 0.099) 0.126 20.110 ( 0.085 0.000 -0.062) 0.105======================= Grid point 499 (230/322) =======================q-point: (-0.08 -0.15 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.107 ( -18.066 -15.913 11.677) 26.757 1.161 ( -9.068 -15.394 16.579) 24.373 1.653 ( -22.881 -28.586 9.088) 37.726 2.477 ( -0.768 -11.389 -5.312) 12.590 2.792 ( 1.957 -1.604 -2.182) 3.341 2.976 ( 0.655 -7.092 0.150) 7.124 3.059 ( -2.015 -4.557 -1.604) 5.234 3.137 ( -2.625 -5.250 2.423) 6.350 3.583 ( 0.864 -8.242 3.343) 8.936 3.744 ( -2.635 -2.958 -4.519) 6.010 4.015 ( -0.012 -8.997 5.260) 10.422 4.176 ( -0.781 -16.093 -0.997) 16.143 4.307 ( 0.510 -5.275 -1.979) 5.657 4.537 ( 8.898 -10.842 -2.814) 14.306 5.113 ( 11.892 1.542 0.277) 11.994 5.175 ( -0.680 -1.767 0.055) 1.895 5.486 ( 5.616 -0.612 -0.308) 5.657 5.785 ( -1.647 -1.546 -3.860) 4.473 6.847 ( -4.277 5.242 12.623) 14.321 7.553 ( 7.025 7.174 0.177) 10.042 8.118 ( 1.047 25.807 -0.179) 25.829 8.229 ( -3.740 13.777 8.244) 16.485 8.728 ( 1.195 1.222 -5.745) 5.994 8.911 ( -0.815 -14.661 -1.229) 14.735 9.790 ( -3.241 -5.563 -0.229) 6.442 10.207 ( -6.089 3.498 -9.026) 11.436 10.454 ( 0.848 12.025 0.008) 12.055 10.593 ( -8.943 0.321 -5.287) 10.394 11.180 ( 13.362 -1.551 3.505) 13.901 11.350 ( 7.898 9.290 13.414) 18.128 14.661 ( -26.139 3.631 -6.380) 27.150 15.090 ( -10.212 3.316 2.814) 11.100 16.259 ( -11.010 6.007 -0.570) 12.555 16.605 ( -4.353 3.283 -0.286) 5.459 20.072 ( -0.112 -17.156 2.077) 17.281 20.813 ( 9.386 -45.807 -21.994) 51.673======================= Grid point 512 (231/322) =======================q-point: (-0.08 -0.08 0.29)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.772 ( -13.047 -0.000 14.691) 19.648 0.883 ( -21.727 -0.000 16.234) 27.123 1.319 ( -10.132 -0.000 25.376) 27.324 2.329 ( -0.495 -0.000 -8.018) 8.034 2.777 ( -0.947 -0.000 -6.603) 6.671 2.891 ( -0.014 -0.000 1.521) 1.521 3.036 ( 2.192 0.000 -0.863) 2.356 3.071 ( -1.908 -0.000 5.627) 5.942 3.470 ( -0.291 -0.000 4.134) 4.144 3.734 ( 0.485 0.000 -2.150) 2.204 3.743 ( -9.353 -0.000 -6.563) 11.426 4.031 ( 0.709 0.000 5.530) 5.575 4.272 ( 3.407 0.000 -2.996) 4.537 4.515 ( 3.813 0.000 -3.036) 4.874 5.132 ( -1.195 -0.000 -2.305) 2.596 5.231 ( 14.780 0.000 4.052) 15.326 5.513 ( 5.815 0.000 -0.044) 5.815 5.787 ( -4.995 -0.000 -4.705) 6.862 6.889 ( -4.613 -0.000 12.777) 13.584 7.665 ( 5.857 0.000 0.314) 5.865 8.421 ( -3.757 -0.000 2.113) 4.311 8.470 ( -2.397 -0.000 0.810) 2.530 8.586 ( -4.877 -0.000 -0.011) 4.877 8.795 ( 5.037 0.000 -5.798) 7.680 9.691 ( 0.187 0.000 0.935) 0.954 10.157 ( -15.322 -0.000 -11.486) 19.149 10.500 ( -6.546 -0.000 -3.100) 7.243 10.655 ( 0.121 0.000 -0.989) 0.997 11.256 ( 13.520 0.000 -0.196) 13.522 11.638 ( 7.831 0.000 4.674) 9.120 14.539 ( -16.544 -0.000 -1.496) 16.612 15.066 ( -11.450 -0.000 2.189) 11.657 16.255 ( -10.908 -0.000 -0.632) 10.926 16.616 ( -3.693 -0.000 -0.445) 3.719 19.877 ( 0.029 0.000 0.098) 0.102 20.110 ( 0.065 0.000 -0.057) 0.086======================= Grid point 513 (232/322) =======================q-point: ( 0.00 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 0.982 ( 0.518 0.000 6.759) 6.779 1.091 ( 2.994 0.000 7.152) 7.753 1.785 ( 1.632 0.000 11.908) 12.019 2.165 ( 0.278 0.000 -4.471) 4.480 2.574 ( -0.682 -0.000 -5.052) 5.098 2.943 ( -0.144 -0.000 2.683) 2.687 3.004 ( -0.482 -0.000 -2.329) 2.378 3.192 ( -0.542 -0.000 2.670) 2.724 3.528 ( -2.889 -0.000 -2.653) 3.922 3.540 ( -0.869 -0.000 2.345) 2.500 3.700 ( 1.015 0.000 -1.577) 1.875 4.086 ( -0.433 -0.000 0.612) 0.750 4.278 ( 0.454 0.000 -1.621) 1.684 4.398 ( -2.503 -0.000 -0.614) 2.577 5.166 ( 1.294 0.000 0.907) 1.580 5.376 ( 2.780 0.000 0.211) 2.788 5.547 ( 0.055 0.000 -0.463) 0.466 5.647 ( -0.796 -0.000 -2.545) 2.666 7.076 ( -2.818 -0.000 6.124) 6.741 7.703 ( -0.331 -0.000 0.151) 0.364 8.324 ( -6.578 -0.000 0.955) 6.647 8.486 ( 0.630 0.000 1.152) 1.313 8.556 ( 0.108 0.000 -0.023) 0.110 8.822 ( 5.014 0.000 -2.251) 5.496 9.713 ( 0.241 0.000 0.448) 0.509 9.865 ( -4.986 -0.000 -1.555) 5.223 10.421 ( -0.026 -0.000 -1.038) 1.038 10.635 ( -0.086 -0.000 -0.465) 0.473 11.382 ( -0.789 -0.000 0.532) 0.952 11.564 ( -2.925 -0.000 0.363) 2.947 14.801 ( 11.750 0.000 0.390) 11.757 14.938 ( -0.609 -0.000 -0.388) 0.722 16.236 ( 1.598 0.000 0.436) 1.656 16.583 ( -0.236 -0.000 -0.205) 0.313 19.879 ( -0.014 -0.000 0.044) 0.046 20.110 ( 0.016 0.000 -0.026) 0.030======================= Grid point 514 (233/322) =======================q-point: ( 0.08 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.277 ( 7.891 -14.299 3.712) 16.749 1.407 ( 8.108 -28.989 5.571) 30.612 1.785 ( -0.808 -0.655 3.116) 3.285 2.381 ( -0.843 -18.133 -1.174) 18.191 2.644 ( 7.633 -5.634 -3.207) 10.015 2.972 ( -0.384 -2.030 1.705) 2.678 3.028 ( -0.807 -3.202 -1.195) 3.512 3.177 ( -2.387 -1.855 2.963) 4.233 3.527 ( -1.218 -5.591 -1.116) 5.830 3.665 ( -1.165 -7.427 1.986) 7.776 4.062 ( -0.257 -25.938 -2.270) 26.038 4.136 ( -1.115 -4.352 1.263) 4.667 4.357 ( -7.464 -11.106 -1.190) 13.433 4.429 ( 7.132 -6.287 0.823) 9.543 5.148 ( -3.438 1.071 -0.291) 3.613 5.384 ( -0.445 -0.260 -1.250) 1.352 5.532 ( -0.528 8.161 -1.186) 8.263 5.630 ( 0.544 -8.343 -0.178) 8.362 7.015 ( -4.380 4.770 6.636) 9.272 7.604 ( -3.574 8.634 0.250) 9.348 8.072 ( -6.081 20.515 2.487) 21.541 8.250 ( 4.159 11.411 0.357) 12.151 8.772 ( 1.421 -2.261 1.559) 3.092 8.897 ( 3.704 -9.746 -5.197) 11.649 9.751 ( -1.173 -1.551 1.587) 2.510 9.885 ( 0.162 -3.940 -0.250) 3.951 10.436 ( 1.735 0.138 0.179) 1.750 10.470 ( -0.473 12.138 -1.016) 12.189 11.293 ( -9.244 2.203 1.502) 9.621 11.592 ( 4.055 0.211 1.517) 4.335 14.740 ( -7.293 2.475 -3.291) 8.375 14.963 ( 20.605 6.079 0.393) 21.486 16.211 ( 4.289 4.132 -0.133) 5.957 16.560 ( 1.527 2.572 -0.056) 2.992 20.121 ( -0.677 -21.126 1.672) 21.203 20.507 ( 0.279 -33.027 -6.531) 33.668======================= Grid point 515 (234/322) =======================q-point: ( 0.15 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.664 ( 10.544 -17.647 0.684) 20.569 1.750 ( 0.415 -1.512 7.387) 7.551 2.087 ( 7.120 -26.390 -4.459) 27.695 2.708 ( -2.829 -14.635 -0.188) 14.907 2.841 ( 3.242 -9.207 -1.046) 9.817 3.040 ( 6.441 -4.267 0.774) 7.765 3.140 ( 0.657 -9.210 0.695) 9.259 3.274 ( -1.050 -7.880 2.580) 8.357 3.665 ( -3.270 -0.134 1.031) 3.431 3.726 ( 1.041 -8.471 0.323) 8.541 4.214 ( -2.332 -4.778 1.534) 5.534 4.339 ( -1.423 -0.544 -1.300) 2.003 4.577 ( 2.844 -16.001 0.315) 16.254 4.930 ( -0.310 -24.051 1.471) 24.098 5.139 ( -3.732 -11.453 -2.106) 12.228 5.346 ( -5.352 2.241 -3.015) 6.539 5.432 ( 1.594 -0.608 0.250) 1.725 5.931 ( -1.578 -22.655 0.108) 22.710 6.875 ( -8.388 6.202 6.221) 12.146 7.343 ( -6.511 14.660 0.375) 16.045 7.609 ( -1.284 22.752 -0.091) 22.788 8.050 ( 6.456 11.138 1.731) 12.990 8.732 ( 1.855 5.782 -4.906) 7.806 9.099 ( 1.845 -7.444 -0.664) 7.698 9.714 ( -2.823 4.440 4.946) 7.221 9.945 ( 3.359 4.239 -1.964) 5.754 10.234 ( 1.132 3.585 0.432) 3.784 10.476 ( 1.844 1.862 -0.788) 2.736 11.309 ( -4.297 -9.810 0.884) 10.746 11.579 ( -2.102 1.075 0.703) 2.464 14.680 ( -1.211 0.616 -2.302) 2.673 14.964 ( 14.359 3.422 1.026) 14.797 16.145 ( 3.863 4.469 0.048) 5.907 16.510 ( 2.754 3.479 -0.111) 4.439 20.573 ( -1.612 -22.977 3.352) 23.276 21.103 ( -0.595 -25.548 -7.715) 26.694======================= Grid point 516 (235/322) =======================q-point: ( 0.23 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.751 ( 2.598 2.601 3.128) 4.827 2.063 ( 9.406 -15.583 -0.099) 18.202 2.541 ( 4.441 -14.866 0.352) 15.519 2.912 ( 1.193 -8.392 0.409) 8.486 3.047 ( -2.628 -12.841 0.709) 13.126 3.180 ( 4.769 -5.510 0.731) 7.324 3.333 ( -1.307 -7.606 1.559) 7.874 3.507 ( 6.657 -13.230 0.969) 14.842 3.582 ( -2.115 2.423 -0.610) 3.273 3.953 ( 1.966 -9.953 -0.130) 10.146 4.270 ( -1.570 -0.221 -0.038) 1.586 4.326 ( 0.308 -1.554 0.804) 1.776 4.773 ( -1.573 -3.142 0.410) 3.537 4.978 ( -1.830 1.900 -1.208) 2.901 5.324 ( -4.600 -3.292 -2.249) 6.087 5.439 ( -0.353 -4.808 -1.312) 4.997 5.810 ( -0.097 -32.855 0.891) 32.867 6.375 ( -5.307 -13.876 3.180) 15.193 6.782 ( -15.143 -11.121 1.017) 18.816 6.982 ( -8.710 15.012 -0.346) 17.359 7.233 ( 7.571 16.849 0.481) 18.478 7.934 ( 10.400 5.481 1.183) 11.815 8.567 ( -2.046 9.422 -6.475) 11.614 9.189 ( 3.294 -0.044 2.098) 3.906 9.585 ( -2.563 7.307 6.663) 10.216 9.751 ( 0.436 11.174 -2.481) 11.455 10.323 ( 4.967 -3.235 1.236) 6.055 10.357 ( 1.520 7.918 -2.926) 8.578 11.569 ( -5.317 -5.589 -1.501) 7.858 11.620 ( -2.782 -19.255 1.767) 19.535 14.686 ( 2.421 -0.954 -0.341) 2.624 15.007 ( 9.966 -0.236 0.106) 9.969 16.098 ( 3.653 2.267 0.296) 4.310 16.465 ( 3.303 2.692 -0.483) 4.289 20.971 ( -1.461 -17.699 2.457) 17.929 21.449 ( -0.721 -11.642 -4.275) 12.423======================= Grid point 517 (236/322) =======================q-point: ( 0.31 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.666 ( 5.566 9.318 3.790) 11.497 2.367 ( 7.156 -10.318 0.182) 12.557 2.700 ( -0.184 -1.611 2.300) 2.813 3.110 ( 2.691 -7.701 2.829) 8.634 3.265 ( 1.360 -8.631 -0.289) 8.742 3.324 ( 2.112 -8.490 1.061) 8.813 3.436 ( -2.005 -4.559 0.756) 5.037 3.581 ( -4.471 -5.547 0.723) 7.161 3.817 ( 8.786 -11.209 0.339) 14.246 4.078 ( 4.376 -0.753 -2.347) 5.022 4.265 ( -1.399 -1.668 -1.973) 2.938 4.380 ( 1.629 -1.754 3.076) 3.898 4.734 ( -7.310 2.435 -4.057) 8.708 4.951 ( 1.553 0.494 -0.679) 1.766 5.361 ( -4.698 -2.466 0.046) 5.306 5.540 ( -1.631 -6.427 -1.304) 6.758 6.207 ( -9.464 -2.043 0.398) 9.690 6.311 ( -9.068 2.757 1.105) 9.542 6.772 ( -2.224 -2.280 0.165) 3.189 7.021 ( 8.006 8.735 2.422) 12.094 7.234 ( -7.154 -27.429 -0.903) 28.361 7.955 ( 14.139 0.372 0.188) 14.145 8.356 ( -5.531 7.541 -5.075) 10.640 9.155 ( 2.560 5.277 4.609) 7.459 9.435 ( -2.087 7.583 5.959) 9.868 9.577 ( 0.305 6.439 -3.226) 7.208 10.160 ( 1.088 8.934 -1.420) 9.111 10.414 ( 3.129 -1.541 -0.442) 3.515 11.702 ( -2.437 -11.176 -1.265) 11.509 12.006 ( -4.393 -19.562 0.384) 20.053 14.738 ( 3.670 -2.362 1.026) 4.483 15.072 ( 6.796 -1.000 -0.993) 6.940 16.110 ( 4.080 -1.151 0.406) 4.259 16.442 ( 2.993 1.539 -1.011) 3.514 21.256 ( -0.736 -11.792 1.186) 11.874 21.573 ( -0.018 -2.690 -1.889) 3.287======================= Grid point 518 (237/322) =======================q-point: ( 0.38 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.471 ( 6.298 13.864 5.031) 16.038 2.552 ( 4.336 -4.861 1.244) 6.631 2.686 ( 0.940 2.058 2.263) 3.200 3.187 ( -1.857 -1.438 1.361) 2.715 3.449 ( 6.379 -6.520 -0.072) 9.122 3.488 ( -8.306 -7.024 1.694) 11.009 3.534 ( 5.157 -5.889 1.666) 8.003 3.690 ( -3.596 -6.770 1.235) 7.765 4.020 ( 3.787 -3.963 0.455) 5.500 4.093 ( 7.804 -0.359 -0.579) 7.834 4.291 ( -0.428 -1.477 -3.732) 4.036 4.404 ( 1.176 0.660 3.113) 3.393 4.621 ( -8.013 3.301 -5.963) 10.519 4.969 ( 0.939 -1.460 -2.171) 2.780 5.369 ( -2.029 -0.680 1.424) 2.570 5.649 ( -1.786 -5.491 -1.456) 5.955 6.003 ( -15.415 6.539 -1.344) 16.799 6.235 ( -0.422 4.244 0.664) 4.316 6.865 ( 2.138 -1.594 1.362) 2.994 6.970 ( 3.463 0.140 1.694) 3.857 7.631 ( -3.460 -14.959 -0.337) 15.358 7.995 ( 5.946 4.242 -3.917) 8.288 8.312 ( 1.849 -7.964 0.906) 8.226 9.050 ( -0.572 6.668 5.916) 8.933 9.288 ( -1.980 6.574 4.534) 8.228 9.446 ( 0.416 7.647 -4.247) 8.757 10.042 ( 0.624 3.056 -1.572) 3.493 10.472 ( 0.899 -3.829 0.280) 3.943 11.928 ( 0.570 -11.207 -2.275) 11.450 12.301 ( -4.370 -12.739 0.189) 13.469 14.817 ( 3.406 -3.049 1.801) 4.913 15.112 ( 3.749 -0.003 -1.492) 4.034 16.182 ( 3.985 -3.235 0.113) 5.134 16.429 ( 1.759 1.206 -1.294) 2.494 21.433 ( -0.095 -6.599 0.153) 6.602 21.581 ( 0.417 1.073 -0.488) 1.250======================= Grid point 519 (238/322) =======================q-point: ( 0.46 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.281 ( 2.878 6.837 4.710) 8.787 2.599 ( -0.891 0.210 2.946) 3.085 2.693 ( 3.276 -0.686 0.611) 3.402 3.191 ( -1.472 -0.167 0.340) 1.520 3.526 ( -8.503 -2.589 3.040) 9.394 3.562 ( 6.657 -1.248 -2.043) 7.074 3.678 ( 3.777 -4.119 3.207) 6.443 3.783 ( -2.269 -3.711 -0.501) 4.378 4.042 ( 0.762 0.365 -0.831) 1.185 4.181 ( 6.812 -1.746 3.258) 7.750 4.305 ( 2.067 -0.092 -2.228) 3.040 4.383 ( -3.627 1.072 -0.289) 3.793 4.509 ( -5.652 2.450 -3.944) 7.314 4.994 ( 0.654 -0.547 -3.048) 3.165 5.378 ( 1.146 -0.151 1.420) 1.831 5.716 ( -1.721 -2.233 -1.261) 3.089 5.841 ( -5.523 3.068 -0.668) 6.353 6.172 ( 0.175 1.731 0.423) 1.790 6.874 ( 0.889 0.585 1.521) 1.856 6.999 ( 0.732 -0.854 0.808) 1.385 7.769 ( 0.432 -0.894 -1.050) 1.445 7.942 ( -2.356 -0.479 -2.759) 3.660 8.598 ( 8.884 -14.741 2.544) 17.398 8.884 ( -6.002 10.146 5.275) 12.915 9.188 ( -1.802 2.467 3.078) 4.337 9.292 ( 1.073 5.947 -3.990) 7.241 10.025 ( 0.349 -0.284 -1.461) 1.529 10.553 ( 0.174 -2.821 0.207) 2.834 12.090 ( 0.399 -4.346 -2.381) 4.971 12.454 ( -1.211 -4.645 -0.578) 4.835 14.890 ( 1.537 -2.277 1.567) 3.162 15.113 ( 1.071 0.970 -1.102) 1.818 16.258 ( 1.941 -1.995 -0.209) 2.791 16.409 ( 0.402 1.091 -1.071) 1.580 21.520 ( 0.154 -2.160 -0.318) 2.189 21.557 ( 0.134 1.003 0.216) 1.034======================= Grid point 520 (239/322) =======================q-point: (-0.46 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.304 ( -3.570 -8.547 2.521) 9.599 2.604 ( -0.752 -0.871 2.427) 2.686 2.696 ( -3.042 0.664 0.259) 3.124 3.190 ( 2.501 0.451 0.342) 2.564 3.504 ( -6.935 0.846 2.880) 7.557 3.583 ( 5.161 2.209 -1.852) 5.911 3.722 ( 1.672 1.818 0.434) 2.508 3.785 ( 0.102 2.611 -2.082) 3.341 4.034 ( -1.375 0.096 0.041) 1.379 4.230 ( 1.901 0.315 0.777) 2.078 4.293 ( -11.288 2.721 -2.249) 11.827 4.343 ( 6.264 -1.796 2.220) 6.884 4.475 ( 0.649 -0.336 -0.341) 0.806 4.977 ( 0.571 2.183 -1.543) 2.734 5.385 ( 2.666 0.717 0.682) 2.844 5.708 ( -1.224 1.866 -0.540) 2.296 5.828 ( 6.013 -1.774 0.507) 6.290 6.178 ( 1.033 -1.792 -0.099) 2.070 6.872 ( -0.899 -0.214 1.633) 1.876 7.010 ( -0.963 -0.243 -0.159) 1.006 7.760 ( -0.642 0.994 -0.302) 1.222 7.934 ( -0.286 0.689 -1.884) 2.026 8.598 ( -7.770 14.102 2.425) 16.282 8.935 ( 7.987 -12.562 1.211) 14.935 9.197 ( -3.234 -4.687 3.122) 6.494 9.255 ( 1.478 -1.784 -2.047) 3.092 10.026 ( 0.331 0.127 -1.577) 1.616 10.555 ( -0.213 2.638 0.017) 2.647 12.077 ( -1.452 4.880 -1.216) 5.234 12.470 ( 3.471 3.625 -2.101) 5.441 14.913 ( -1.792 0.229 -0.526) 1.882 15.092 ( -0.803 0.944 0.769) 1.459 16.256 ( -1.981 2.061 -0.056) 2.860 16.403 ( 0.077 -0.553 -0.585) 0.808 21.514 ( -0.134 1.992 0.171) 2.004 21.560 ( -0.136 -0.659 -0.090) 0.679======================= Grid point 521 (240/322) =======================q-point: (-0.38 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.514 ( -7.931 -13.703 1.018) 15.866 2.556 ( -5.091 5.733 0.651) 7.694 2.695 ( -1.911 -2.796 1.409) 3.668 3.196 ( 3.767 1.080 0.383) 3.937 3.403 ( -7.480 6.082 2.448) 9.946 3.536 ( 2.594 4.233 -1.296) 5.131 3.618 ( -0.519 8.181 -5.779) 10.030 3.712 ( 4.404 5.560 -0.867) 7.146 4.028 ( -2.311 -0.255 0.259) 2.340 4.115 ( -13.918 5.931 -3.117) 15.447 4.223 ( 1.606 2.129 2.531) 3.677 4.455 ( 4.300 -3.538 -0.211) 5.572 4.498 ( 3.189 -1.480 4.429) 5.655 4.928 ( 1.513 2.790 1.408) 3.473 5.385 ( 4.529 1.539 -0.087) 4.784 5.637 ( -0.225 4.561 -0.315) 4.578 5.978 ( 15.390 -6.563 1.070) 16.766 6.245 ( 0.992 -4.185 -0.241) 4.308 6.861 ( -1.778 2.071 1.670) 3.200 7.000 ( -3.746 -0.820 -0.888) 3.936 7.637 ( 2.703 14.062 -0.789) 14.341 7.955 ( -5.576 -4.465 -0.295) 7.149 8.313 ( -2.506 9.809 0.958) 10.169 9.141 ( 0.086 -6.911 -2.359) 7.303 9.328 ( -1.846 -6.794 5.576) 8.981 9.368 ( 2.946 -9.059 -2.231) 9.784 10.042 ( 0.038 -2.746 -1.429) 3.096 10.475 ( -0.972 3.925 -0.047) 4.044 11.900 ( -0.930 11.473 0.306) 11.515 12.337 ( 5.554 12.396 -3.099) 13.933 14.862 ( -4.547 2.479 -2.569) 5.781 15.070 ( -2.782 0.710 2.626) 3.891 16.181 ( -3.948 3.054 0.143) 4.993 16.415 ( -1.247 -0.906 -0.048) 1.542 21.438 ( 0.036 6.184 -0.231) 6.189 21.574 ( -0.202 -0.764 0.161) 0.807======================= Grid point 522 (241/322) =======================q-point: (-0.31 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.685 ( -7.772 -7.326 2.141) 10.893 2.346 ( -7.481 11.951 2.056) 14.249 2.725 ( -1.069 0.529 -0.050) 1.194 3.155 ( -1.556 8.476 -2.036) 8.855 3.218 ( -4.462 5.033 3.506) 7.585 3.413 ( -1.656 10.196 -6.365) 12.134 3.460 ( 2.642 4.660 -1.232) 5.496 3.618 ( 4.181 5.489 -2.727) 7.419 3.839 ( -12.000 11.936 -2.075) 17.052 4.040 ( -2.574 0.807 1.313) 3.000 4.201 ( 2.139 1.144 3.900) 4.593 4.436 ( -3.046 3.017 -1.761) 4.634 4.637 ( 8.311 -5.286 5.281) 11.176 4.909 ( 1.760 0.401 2.880) 3.398 5.364 ( 5.873 4.178 -0.239) 7.212 5.537 ( 0.407 5.398 -0.880) 5.484 6.205 ( 10.429 -0.772 0.571) 10.473 6.331 ( 7.553 -3.816 -0.855) 8.505 6.763 ( 1.919 3.254 1.226) 3.971 7.046 ( -7.001 -7.171 0.080) 10.022 7.242 ( 5.482 26.764 -1.664) 27.370 7.949 ( -13.987 -1.328 0.538) 14.061 8.290 ( 6.780 -4.919 1.426) 8.497 9.239 ( -4.292 -4.599 -3.267) 7.089 9.465 ( -1.299 -7.907 4.887) 9.386 9.561 ( 2.437 -9.072 -3.650) 10.078 10.151 ( -0.399 -8.464 -0.612) 8.495 10.415 ( -2.819 1.373 -0.509) 3.177 11.663 ( 2.260 12.024 2.254) 12.440 12.043 ( 4.801 19.636 -2.955) 20.429 14.773 ( -5.382 2.895 -2.367) 6.554 15.036 ( -5.331 0.694 2.593) 5.969 16.113 ( -4.195 1.109 0.113) 4.341 16.428 ( -2.404 -1.610 0.289) 2.908 21.262 ( 0.079 11.887 0.634) 11.904 21.570 ( 1.053 2.035 -1.681) 2.842======================= Grid point 523 (242/322) =======================q-point: (-0.23 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.718 ( -4.174 0.344 5.901) 7.236 2.014 ( -8.951 17.100 4.368) 19.789 2.585 ( -5.711 13.662 -3.545) 15.226 2.937 ( -1.940 7.867 -1.439) 8.230 3.057 ( 1.477 13.403 -0.138) 13.485 3.226 ( -3.872 6.356 -3.967) 8.434 3.353 ( 0.108 8.348 -0.485) 8.363 3.514 ( -9.742 12.751 0.430) 16.052 3.599 ( 3.044 -2.333 -2.317) 4.481 3.947 ( -0.897 7.851 0.263) 7.907 4.234 ( 2.649 -2.260 3.765) 5.128 4.336 ( -1.433 5.114 -0.146) 5.313 4.749 ( 1.343 0.247 2.941) 3.243 4.941 ( 4.890 -1.929 2.030) 5.635 5.291 ( 5.917 5.890 0.680) 8.376 5.436 ( -0.117 5.172 -0.931) 5.257 5.841 ( -0.610 31.407 -1.945) 31.473 6.439 ( 2.956 14.153 -3.032) 14.773 6.765 ( 14.193 7.589 2.933) 16.359 6.987 ( 9.315 -15.221 -0.914) 17.868 7.232 ( -8.010 -15.234 0.727) 17.227 7.934 ( -10.905 -5.463 1.155) 12.252 8.476 ( 6.017 -8.287 2.089) 10.452 9.244 ( -4.604 1.232 -2.908) 5.583 9.644 ( -2.124 -9.796 2.470) 10.323 9.755 ( 1.181 -10.903 -4.467) 11.842 10.289 ( -2.689 -0.385 2.204) 3.498 10.395 ( -2.991 -5.664 -4.307) 7.718 11.502 ( 5.464 7.737 4.561) 10.512 11.658 ( 3.176 19.030 -1.454) 19.348 14.687 ( -4.425 2.480 -0.475) 5.094 14.996 ( -8.096 -0.584 1.196) 8.205 16.099 ( -3.801 -2.016 0.219) 4.308 16.457 ( -2.820 -2.957 0.243) 4.093 20.971 ( 0.145 18.078 2.370) 18.234 21.465 ( 2.695 10.314 -5.801) 12.136======================= Grid point 524 (243/322) =======================q-point: (-0.15 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.594 ( -7.308 17.699 7.329) 20.503 1.684 ( -1.898 5.786 11.127) 12.684 2.128 ( -7.771 25.847 -5.893) 27.625 2.743 ( 2.746 17.781 -1.872) 18.089 2.816 ( -2.961 6.455 0.017) 7.102 3.069 ( -6.351 5.630 -2.441) 8.831 3.145 ( -1.924 8.704 0.332) 8.920 3.296 ( -1.372 7.403 0.592) 7.552 3.680 ( 2.139 -2.217 -0.300) 3.095 3.752 ( -2.872 9.178 -2.177) 9.860 4.229 ( 0.533 5.369 0.441) 5.413 4.305 ( 4.218 -1.046 2.009) 4.788 4.577 ( -3.079 16.239 0.186) 16.530 4.937 ( 0.839 22.263 0.549) 22.286 5.127 ( 4.892 9.510 -0.801) 10.724 5.288 ( 5.583 0.535 2.492) 6.137 5.456 ( -0.118 1.610 -2.040) 2.602 5.963 ( 0.719 23.027 -3.071) 23.242 6.899 ( 3.029 -7.094 4.181) 8.773 7.358 ( 5.304 -14.576 -1.035) 15.545 7.608 ( 2.087 -24.528 -0.047) 24.617 8.049 ( -7.526 -11.155 1.764) 13.571 8.653 ( 4.442 -5.744 2.166) 7.577 9.120 ( -2.386 8.914 -2.190) 9.484 9.776 ( -2.515 -4.046 -0.470) 4.787 9.957 ( -2.971 -6.574 -3.731) 8.122 10.244 ( -1.775 -3.940 -0.544) 4.356 10.490 ( -2.503 -1.796 -2.376) 3.891 11.313 ( 3.634 8.813 0.582) 9.550 11.534 ( 4.570 0.219 5.255) 6.968 14.631 ( -0.145 1.662 2.412) 2.933 14.975 ( -11.487 -3.073 -0.160) 11.892 16.140 ( -3.606 -4.046 0.503) 5.443 16.509 ( -2.571 -3.705 -0.021) 4.510 20.569 ( 0.092 23.099 3.577) 23.375 21.133 ( 3.147 24.861 -10.519) 27.178======================= Grid point 525 (244/322) =======================q-point: (-0.08 0.00 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.231 ( -4.349 14.340 7.999) 16.986 1.380 ( -5.960 28.757 7.882) 30.408 1.759 ( 1.455 3.229 5.995) 6.963 2.382 ( 0.704 17.896 -1.520) 17.975 2.659 ( -6.505 5.157 -4.494) 9.439 2.974 ( -0.665 2.724 1.152) 3.031 3.031 ( 0.540 2.815 -1.211) 3.112 3.187 ( -0.635 2.435 2.002) 3.216 3.563 ( -3.194 5.049 -4.350) 7.391 3.665 ( 0.075 7.281 1.967) 7.542 4.051 ( 2.323 24.204 -0.992) 24.335 4.151 ( -1.387 6.500 -0.195) 6.649 4.344 ( 6.017 8.415 0.505) 10.358 4.457 ( -6.674 7.735 -2.652) 10.554 5.139 ( 3.885 -0.666 0.485) 3.971 5.348 ( 6.083 -0.318 2.241) 6.490 5.526 ( 2.331 -5.773 -0.278) 6.232 5.656 ( -3.697 6.688 -2.834) 8.151 7.030 ( -1.461 -4.801 5.363) 7.344 7.609 ( 2.681 -8.490 -0.212) 8.906 8.107 ( 0.737 -23.378 -0.595) 23.397 8.246 ( -4.502 -10.431 0.305) 11.365 8.750 ( 1.454 -1.305 3.292) 3.828 8.877 ( 1.374 13.688 -2.769) 14.033 9.764 ( -1.279 3.162 0.231) 3.418 9.930 ( -6.211 2.016 -4.712) 8.053 10.436 ( -1.692 -1.113 0.010) 2.025 10.477 ( -0.352 -11.039 -1.612) 11.162 11.307 ( 6.772 -2.592 0.113) 7.252 11.578 ( -2.708 -2.036 3.064) 4.569 14.660 ( 12.330 -1.398 4.753) 13.288 14.969 ( -15.051 -3.630 -0.299) 15.486 16.201 ( -2.734 -3.511 0.836) 4.528 16.562 ( -1.736 -2.676 -0.231) 3.199 20.120 ( -0.056 20.954 1.733) 21.026 20.519 ( 1.474 33.823 -7.821) 34.747======================= Grid point 527 (245/322) =======================q-point: ( 0.08 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.065 ( 10.333 0.000 3.890) 11.042 1.272 ( 23.882 0.000 2.101) 23.974 1.785 ( -5.615 -0.000 4.700) 7.323 2.168 ( 2.423 0.000 -3.459) 4.224 2.651 ( 14.481 0.000 -2.051) 14.626 2.941 ( -1.674 -0.000 2.809) 3.270 2.976 ( -3.128 -0.000 -1.902) 3.661 3.174 ( -3.322 -0.000 2.949) 4.442 3.510 ( 0.131 0.000 1.556) 1.562 3.536 ( -1.158 -0.000 2.579) 2.827 3.709 ( 1.527 0.000 -2.168) 2.652 4.085 ( -0.529 -0.000 0.997) 1.129 4.203 ( -7.396 -0.000 -0.258) 7.401 4.440 ( 4.551 0.000 0.444) 4.573 5.123 ( -7.945 -0.000 -0.462) 7.958 5.375 ( -1.720 -0.000 -2.372) 2.930 5.560 ( 1.143 0.000 -1.050) 1.552 5.622 ( -2.292 -0.000 -0.710) 2.399 7.051 ( -4.892 -0.000 7.781) 9.191 7.661 ( -6.679 -0.000 0.467) 6.695 8.255 ( -6.536 -0.000 5.986) 8.863 8.498 ( 0.326 0.000 1.517) 1.552 8.589 ( 5.135 0.000 -0.119) 5.136 8.872 ( 5.587 0.000 -6.677) 8.707 9.717 ( 0.286 0.000 0.027) 0.287 9.856 ( 2.528 0.000 3.950) 4.690 10.441 ( 3.712 0.000 -0.622) 3.764 10.633 ( -0.229 -0.000 -0.220) 0.317 11.213 ( -19.947 -0.000 1.942) 20.041 11.649 ( 7.753 0.000 2.057) 8.021 14.701 ( -7.512 -0.000 -4.871) 8.953 15.213 ( 27.964 0.000 -6.516) 28.713 16.315 ( 12.347 0.000 -2.755) 12.650 16.601 ( 3.389 0.000 0.056) 3.390 19.879 ( -0.073 -0.000 0.047) 0.087 20.110 ( -0.021 -0.000 -0.036) 0.042======================= Grid point 528 (246/322) =======================q-point: ( 0.15 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.402 ( 12.062 -18.164 0.790) 21.818 1.613 ( 22.836 -18.869 5.172) 30.071 1.760 ( -2.411 -2.362 -3.101) 4.584 2.372 ( 0.727 -16.089 -1.558) 16.181 2.765 ( 9.364 -2.822 -1.580) 9.907 2.989 ( 2.843 -5.310 1.961) 6.334 3.002 ( -2.840 -4.365 -1.260) 5.358 3.163 ( -0.132 -2.006 4.349) 4.791 3.534 ( 2.303 -5.231 2.933) 6.424 3.651 ( -2.287 -6.678 1.977) 7.330 4.041 ( -1.191 -22.677 -2.356) 22.830 4.122 ( -2.429 -5.156 1.987) 6.035 4.305 ( -1.365 -14.798 0.373) 14.865 4.489 ( 2.003 -6.222 -0.492) 6.555 5.065 ( -9.607 0.419 -0.284) 9.621 5.348 ( -3.390 1.129 -3.382) 4.920 5.498 ( -4.795 5.269 -1.880) 7.368 5.649 ( 0.987 -6.296 0.959) 6.444 6.976 ( -5.737 5.768 8.787) 11.975 7.531 ( -8.679 8.454 0.708) 12.137 8.019 ( -3.951 19.010 3.515) 19.732 8.307 ( 4.037 10.839 1.713) 11.693 8.795 ( 2.242 -2.592 -1.771) 3.858 8.925 ( 3.897 -7.849 -5.633) 10.418 9.751 ( 0.082 -0.887 2.122) 2.301 9.924 ( 5.007 -4.269 3.433) 7.421 10.453 ( -1.325 14.154 0.499) 14.225 10.480 ( 4.721 -1.411 -0.415) 4.945 11.157 ( -13.243 -3.947 1.962) 13.958 11.628 ( -0.065 4.315 -0.224) 4.321 14.674 ( 1.036 -0.135 -3.517) 3.669 15.224 ( 21.480 10.218 -4.204) 24.155 16.299 ( 11.246 7.229 -1.915) 13.505 16.596 ( 4.611 2.821 -0.013) 5.406 20.115 ( -1.194 -20.883 1.432) 20.966 20.487 ( -0.629 -31.671 -4.675) 32.020======================= Grid point 529 (247/322) =======================q-point: ( 0.23 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.758 ( 2.292 -3.927 1.434) 4.768 1.827 ( 13.395 -14.180 -0.095) 19.507 2.208 ( 14.835 -22.915 -0.760) 27.309 2.690 ( -0.705 -15.110 0.210) 15.128 2.845 ( -1.521 -5.041 -0.084) 5.266 3.095 ( 0.129 -5.870 0.446) 5.889 3.172 ( 2.128 -8.775 0.993) 9.084 3.313 ( 8.605 -10.218 2.790) 13.647 3.637 ( -2.103 2.485 1.433) 3.557 3.752 ( 3.802 -10.507 2.151) 11.379 4.192 ( -2.125 -5.227 1.901) 5.954 4.308 ( -2.220 -2.527 -2.380) 4.121 4.624 ( 4.721 -14.847 0.911) 15.606 4.900 ( -6.574 -14.841 -0.132) 16.233 5.074 ( -5.559 -21.130 -2.284) 21.968 5.286 ( -3.359 -0.058 -2.585) 4.239 5.418 ( -3.524 -0.440 -0.376) 3.572 5.899 ( -4.781 -21.352 0.506) 21.887 6.783 ( -10.385 10.467 8.229) 16.885 7.239 ( -10.679 15.173 0.581) 18.564 7.621 ( 3.368 19.079 -0.222) 19.376 8.134 ( 6.112 9.219 2.213) 11.281 8.716 ( -0.961 7.440 -8.439) 11.291 9.135 ( 4.132 -8.134 0.616) 9.144 9.711 ( -0.604 5.122 5.823) 7.779 9.980 ( 2.749 8.123 -0.185) 8.577 10.260 ( 2.953 -0.941 0.759) 3.191 10.505 ( 3.236 3.463 0.002) 4.739 11.251 ( -5.710 -12.505 0.730) 13.766 11.526 ( -6.857 2.378 -1.679) 7.449 14.697 ( 5.894 -0.176 -0.878) 5.962 15.145 ( 15.320 7.098 -1.232) 16.929 16.210 ( 7.089 6.362 -0.318) 9.531 16.554 ( 4.818 3.907 -0.328) 6.211 20.560 ( -2.206 -23.031 2.821) 23.308 21.068 ( -1.782 -25.754 -5.451) 26.385======================= Grid point 530 (248/322) =======================q-point: ( 0.31 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.805 ( 5.534 1.007 2.410) 6.119 2.190 ( 12.401 -13.182 -1.054) 18.129 2.603 ( 4.832 -9.862 2.281) 11.217 2.939 ( 3.119 -11.397 0.351) 11.821 3.021 ( -2.376 -12.889 2.493) 13.341 3.226 ( 2.127 -6.198 0.890) 6.613 3.330 ( 0.025 -6.856 1.634) 7.048 3.509 ( -4.502 0.527 1.256) 4.704 3.645 ( 9.909 -10.278 -0.050) 14.276 4.000 ( 6.841 -9.452 -0.941) 11.706 4.253 ( -0.741 -0.141 -1.082) 1.319 4.331 ( 0.000 -3.351 1.776) 3.792 4.731 ( -6.489 2.133 -0.723) 6.869 4.943 ( -2.135 -2.247 -2.551) 4.014 5.250 ( -7.076 -4.798 -3.490) 9.234 5.421 ( -1.959 -3.699 -0.223) 4.192 5.813 ( -0.042 -33.452 1.322) 33.478 6.314 ( -7.183 -5.432 4.600) 10.112 6.584 ( -18.208 -15.145 0.244) 23.684 6.887 ( -7.123 12.674 -0.074) 14.539 7.341 ( 10.386 14.013 0.999) 17.471 8.056 ( 9.197 3.186 1.454) 9.842 8.502 ( -4.817 10.555 -8.150) 14.179 9.249 ( 5.237 0.035 2.929) 6.001 9.585 ( -1.149 7.664 6.910) 10.383 9.745 ( -0.483 11.687 -1.588) 11.804 10.368 ( 1.703 9.964 -1.716) 10.253 10.392 ( 5.741 -3.818 0.345) 6.903 11.489 ( -7.034 -7.427 -2.418) 10.512 11.582 ( -4.513 -19.017 1.670) 19.617 14.742 ( 7.002 -0.543 1.144) 7.116 15.130 ( 10.742 2.396 -1.333) 11.086 16.152 ( 5.272 2.888 0.285) 6.018 16.508 ( 4.241 3.266 -0.865) 5.422 20.960 ( -1.696 -18.069 2.215) 18.283 21.424 ( -1.345 -12.620 -3.321) 13.118======================= Grid point 531 (249/322) =======================q-point: ( 0.38 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.762 ( 8.563 8.848 4.297) 13.042 2.465 ( 9.121 -8.172 0.121) 12.247 2.707 ( 0.009 -1.105 2.726) 2.941 3.143 ( 1.555 -4.878 0.409) 5.136 3.260 ( -3.899 -11.181 6.459) 13.488 3.348 ( 4.049 -6.251 -2.791) 7.954 3.456 ( 3.619 -5.503 1.434) 6.741 3.527 ( -5.075 -6.573 1.362) 8.416 3.914 ( 7.078 -9.626 1.576) 12.051 4.151 ( 8.994 -0.344 -2.080) 9.237 4.239 ( -1.481 -1.689 -3.206) 3.915 4.410 ( 1.381 -2.062 3.870) 4.597 4.616 ( -10.047 2.671 -5.454) 11.740 4.941 ( -2.018 -0.180 -2.695) 3.372 5.305 ( -5.626 -4.382 -1.563) 7.300 5.510 ( -2.388 -6.423 0.190) 6.855 6.034 ( -16.721 8.826 0.728) 18.922 6.271 ( -1.245 -5.357 0.950) 5.581 6.748 ( -2.022 -5.280 -0.086) 5.655 7.058 ( -4.444 -13.993 0.196) 14.683 7.234 ( 9.005 -6.151 2.289) 11.143 8.106 ( 10.753 0.162 -0.215) 10.756 8.265 ( -6.529 6.168 -4.818) 10.192 9.204 ( 3.002 6.930 5.126) 9.128 9.431 ( -1.526 8.040 5.496) 9.858 9.567 ( -0.240 6.232 -3.088) 6.959 10.170 ( 1.354 9.325 -1.442) 9.532 10.443 ( 1.656 -0.027 -0.334) 1.689 11.670 ( -1.942 -13.786 -1.649) 14.019 11.950 ( -5.398 -19.218 0.806) 19.978 14.805 ( 6.711 -1.437 2.288) 7.234 15.149 ( 6.978 1.114 -2.074) 7.364 16.164 ( 4.850 -0.941 0.357) 4.953 16.473 ( 2.885 2.317 -1.381) 3.949 21.251 ( -0.690 -12.114 1.170) 12.190 21.566 ( -0.222 -3.501 -1.739) 3.915======================= Grid point 532 (250/322) =======================q-point: ( 0.46 0.08 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.569 ( 7.548 15.503 5.181) 18.004 2.599 ( 2.430 -1.376 2.252) 3.587 2.716 ( 3.021 0.267 1.450) 3.362 3.182 ( 1.229 -0.549 -0.409) 1.407 3.391 ( -8.725 -6.403 4.270) 11.635 3.530 ( 6.531 -6.007 -0.878) 8.916 3.597 ( 4.181 -6.133 2.232) 7.751 3.655 ( -2.480 -7.557 0.669) 7.982 4.059 ( 3.253 -0.632 0.053) 3.315 4.173 ( 3.253 -1.715 1.972) 4.172 4.297 ( 4.186 -2.495 -2.572) 5.510 4.394 ( -5.686 2.554 -0.573) 6.259 4.519 ( -4.256 2.070 -3.553) 5.918 4.951 ( -1.739 -2.471 -3.688) 4.767 5.350 ( -2.568 -2.925 -1.014) 4.022 5.623 ( -1.659 -5.700 0.279) 5.943 5.816 ( -14.867 2.647 -1.054) 15.138 6.235 ( -0.009 4.122 0.137) 4.124 6.882 ( 0.296 -4.372 0.117) 4.383 7.051 ( 8.788 4.864 2.258) 10.295 7.603 ( -0.913 -16.449 0.524) 16.483 7.986 ( -4.285 7.530 -3.593) 9.379 8.381 ( 7.812 -12.029 1.374) 14.408 9.057 ( -1.287 9.305 5.327) 10.799 9.279 ( -2.024 6.851 3.939) 8.158 9.434 ( 0.019 7.459 -4.019) 8.473 10.046 ( 0.890 3.384 -1.426) 3.779 10.476 ( -0.452 -3.613 0.318) 3.655 11.933 ( 1.515 -11.673 -1.900) 11.924 12.248 ( -4.797 -13.917 0.125) 14.721 14.876 ( 5.313 -1.518 2.629) 6.119 15.150 ( 3.703 1.688 -2.184) 4.618 16.230 ( 4.141 -2.449 -0.009) 4.811 16.441 ( 0.887 2.025 -1.492) 2.668 21.434 ( 0.044 -6.711 0.182) 6.713 21.584 ( 0.273 0.827 -0.542) 1.026======================= Grid point 533 (251/322) =======================q-point: ( 0.54 0.08 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.327 ( 2.498 10.598 4.003) 11.601 2.598 ( -0.799 0.615 3.183) 3.339 2.716 ( 0.242 1.823 0.225) 1.853 3.211 ( 4.781 -0.592 -0.127) 4.819 3.444 ( -7.033 -3.183 3.641) 8.535 3.618 ( 3.051 -0.958 -1.402) 3.492 3.726 ( 3.246 -3.095 1.198) 4.642 3.769 ( 0.805 -4.065 -0.095) 4.145 4.043 ( -0.515 1.361 -0.269) 1.479 4.231 ( 0.802 -1.141 -0.107) 1.399 4.280 ( -10.293 2.922 -2.411) 10.968 4.361 ( 6.361 -0.812 2.490) 6.879 4.474 ( -0.765 0.433 -1.151) 1.448 4.981 ( -1.064 -1.284 -3.189) 3.599 5.385 ( -0.009 -1.605 -1.234) 2.024 5.697 ( -1.161 -2.284 0.805) 2.685 5.766 ( -6.323 -3.841 -0.840) 7.446 6.178 ( 0.526 1.390 -0.381) 1.534 6.912 ( 3.430 1.116 0.460) 3.636 7.028 ( 4.818 2.394 1.477) 5.579 7.764 ( -1.126 0.219 -1.109) 1.595 7.901 ( -3.168 -3.073 -0.150) 4.416 8.709 ( 7.633 -15.058 1.772) 16.975 8.828 ( -5.049 12.718 3.015) 14.011 9.167 ( -3.370 3.060 2.805) 5.347 9.295 ( 1.166 5.086 -2.874) 5.957 10.026 ( 0.616 -0.141 -1.360) 1.499 10.550 ( -0.755 -2.879 0.185) 2.982 12.089 ( 0.602 -3.236 -1.174) 3.495 12.439 ( -0.837 -7.172 -1.476) 7.370 14.919 ( 2.476 0.113 1.670) 2.989 15.124 ( 1.367 2.050 -1.273) 2.773 16.279 ( 1.775 0.114 -0.212) 1.791 16.405 ( -0.548 1.045 -1.105) 1.617 21.520 ( 0.172 -2.074 -0.305) 2.103 21.559 ( 0.084 1.155 0.189) 1.173======================= Grid point 534 (252/322) =======================q-point: (-0.38 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.268 ( -3.694 -4.905 1.747) 6.384 2.604 ( -0.605 -0.364 2.357) 2.461 2.653 ( -3.835 2.166 0.201) 4.409 3.244 ( 5.495 0.756 0.484) 5.568 3.438 ( -5.464 1.053 2.673) 6.174 3.606 ( -1.246 2.668 -0.977) 3.102 3.741 ( 4.088 3.386 -4.143) 6.734 3.809 ( 3.574 1.317 0.646) 3.863 4.014 ( -2.329 0.675 0.588) 2.495 4.130 ( -11.530 3.863 -3.628) 12.689 4.257 ( 0.967 0.292 1.695) 1.973 4.422 ( 3.437 -1.890 -0.064) 3.923 4.489 ( 2.149 -1.641 4.095) 4.907 4.971 ( -1.092 1.088 -1.435) 2.106 5.411 ( 2.930 -0.555 -1.331) 3.266 5.696 ( -1.567 1.605 1.180) 2.535 5.883 ( 3.175 -8.848 0.306) 9.405 6.190 ( 0.971 -2.068 -0.803) 2.422 6.905 ( 5.371 2.663 1.226) 6.119 7.004 ( 0.214 1.538 -0.078) 1.555 7.732 ( -4.602 -0.172 0.081) 4.606 7.931 ( 0.622 1.091 0.154) 1.266 8.525 ( -5.409 13.357 0.698) 14.428 9.018 ( 5.784 -8.625 -1.101) 10.443 9.161 ( -4.473 -6.662 4.872) 9.388 9.268 ( 1.616 -1.946 -1.904) 3.166 10.027 ( 0.554 0.275 -1.525) 1.646 10.547 ( -0.977 2.698 -0.018) 2.870 12.064 ( -0.440 5.331 -0.069) 5.350 12.499 ( 2.651 1.774 -2.996) 4.376 14.895 ( -0.981 2.771 -0.659) 3.013 15.090 ( -0.041 1.757 0.766) 1.917 16.233 ( -1.860 3.771 -0.042) 4.205 16.399 ( -0.439 -0.403 -0.503) 0.780 21.514 ( -0.014 2.019 0.186) 2.027 21.558 ( -0.196 -0.473 -0.105) 0.523======================= Grid point 535 (253/322) =======================q-point: (-0.31 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.433 ( -6.183 -12.541 0.871) 14.010 2.507 ( -3.462 7.411 0.508) 8.196 2.682 ( -1.245 -3.562 1.682) 4.131 3.242 ( 3.321 1.885 0.829) 3.908 3.327 ( -5.846 7.470 1.599) 9.619 3.505 ( -5.128 4.918 -2.538) 7.545 3.642 ( 5.814 8.155 -4.181) 10.853 3.762 ( 4.184 5.984 -1.673) 7.491 3.957 ( -11.000 6.923 -1.357) 13.067 4.010 ( -1.259 -1.355 0.757) 1.998 4.253 ( 1.973 1.429 2.629) 3.584 4.440 ( -2.376 -0.041 -2.925) 3.769 4.594 ( 6.691 -4.730 6.933) 10.734 4.934 ( -1.309 1.472 0.208) 1.981 5.438 ( 5.686 0.598 -1.015) 5.807 5.631 ( -1.591 3.998 0.836) 4.383 6.136 ( 10.288 -12.318 0.937) 16.076 6.257 ( 1.160 -3.791 -0.540) 4.001 6.860 ( 1.359 4.094 1.620) 4.608 6.967 ( -1.588 2.139 -1.248) 2.942 7.663 ( 1.146 9.002 -0.188) 9.077 7.863 ( -8.173 2.755 0.359) 8.632 8.317 ( 1.940 4.830 0.367) 5.218 9.115 ( -2.721 -4.506 -2.567) 5.857 9.326 ( -1.872 -6.839 6.058) 9.326 9.396 ( 3.126 -9.211 -2.798) 10.122 10.040 ( 0.337 -2.514 -1.413) 2.903 10.459 ( -1.523 4.382 -0.109) 4.640 11.901 ( 0.522 10.568 0.988) 10.627 12.379 ( 3.359 11.768 -3.521) 12.735 14.813 ( -2.649 3.855 -1.825) 5.021 15.050 ( -1.738 2.155 1.873) 3.342 16.140 ( -3.059 3.656 0.081) 4.768 16.401 ( -1.064 -0.315 -0.008) 1.110 21.438 ( 0.047 6.172 -0.163) 6.175 21.573 ( -0.120 -1.036 0.065) 1.045======================= Grid point 536 (254/322) =======================q-point: (-0.23 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.620 ( -4.489 -8.384 2.360) 9.799 2.287 ( -3.611 13.206 1.971) 13.832 2.711 ( -1.163 1.686 0.203) 2.059 3.104 ( -4.507 10.893 -0.203) 11.790 3.214 ( 0.717 3.104 1.428) 3.491 3.345 ( -4.926 7.960 -4.884) 10.559 3.515 ( 6.093 7.347 -1.931) 9.738 3.640 ( -0.630 6.131 -2.624) 6.699 3.713 ( -6.944 11.658 0.210) 13.571 4.035 ( 0.489 0.374 0.427) 0.749 4.237 ( 1.987 1.224 3.555) 4.253 4.396 ( -2.670 2.383 -1.700) 3.962 4.738 ( 6.394 -3.907 5.178) 9.108 4.916 ( -1.665 -1.030 0.735) 2.091 5.428 ( 5.621 4.158 -0.427) 7.005 5.532 ( -1.248 5.000 -0.175) 5.156 6.259 ( 1.182 8.485 -0.342) 8.574 6.458 ( 10.681 -10.114 0.108) 14.710 6.790 ( 1.931 -0.501 1.642) 2.584 6.954 ( -7.092 -5.907 -0.937) 9.278 7.326 ( 7.732 26.221 -0.795) 27.349 7.793 ( -11.937 -2.458 0.200) 12.189 8.368 ( 5.531 -5.763 1.175) 8.074 9.178 ( -4.197 -3.905 -2.509) 6.258 9.462 ( -1.988 -7.733 5.422) 9.651 9.574 ( 1.847 -8.217 -4.170) 9.398 10.148 ( 0.099 -8.322 -0.724) 8.354 10.382 ( -2.206 2.651 -0.691) 3.517 11.699 ( 2.358 10.021 2.501) 10.594 12.075 ( 2.086 19.752 -3.033) 20.092 14.724 ( -2.183 3.237 -1.260) 4.102 14.989 ( -3.380 2.634 1.550) 4.557 16.073 ( -2.569 1.208 0.095) 2.840 16.406 ( -1.314 -1.098 0.184) 1.722 21.264 ( -0.160 11.645 0.807) 11.674 21.576 ( 0.873 1.619 -1.864) 2.619======================= Grid point 537 (255/322) =======================q-point: (-0.15 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.707 ( -1.165 -1.859 5.640) 6.051 1.959 ( -2.436 18.375 3.544) 18.872 2.524 ( -2.733 16.765 -2.857) 17.224 2.916 ( -1.079 6.354 -1.063) 6.532 3.078 ( 2.035 12.010 0.146) 12.182 3.153 ( -5.339 7.481 -3.740) 9.923 3.356 ( 0.051 12.951 0.487) 12.961 3.436 ( -3.601 8.000 0.877) 8.816 3.621 ( 1.354 -2.166 -1.513) 2.968 3.942 ( -0.174 9.202 -0.039) 9.204 4.272 ( 1.889 -2.934 2.513) 4.300 4.321 ( -1.028 3.893 0.011) 4.027 4.768 ( 0.764 4.600 2.318) 5.207 4.981 ( 1.245 -4.595 0.827) 4.832 5.355 ( 4.604 4.646 0.363) 6.552 5.430 ( -0.540 5.242 -0.633) 5.308 5.824 ( -1.087 31.787 -1.326) 31.834 6.443 ( -0.746 18.226 -1.589) 18.310 6.899 ( 6.402 7.734 3.059) 10.496 7.078 ( 4.442 -14.076 -0.973) 14.792 7.164 ( -2.976 -19.897 0.281) 20.120 7.831 ( -5.802 -6.906 0.765) 9.052 8.546 ( 4.860 -7.985 0.633) 9.369 9.190 ( -3.063 0.643 -2.175) 3.812 9.624 ( -3.057 -8.776 4.215) 10.204 9.753 ( 0.985 -10.380 -4.512) 11.361 10.269 ( -1.316 2.822 1.351) 3.394 10.362 ( -0.664 -7.515 -3.442) 8.292 11.569 ( 3.466 7.009 4.304) 8.926 11.671 ( -0.071 18.087 -1.917) 18.188 14.667 ( 0.297 1.614 0.426) 1.696 14.920 ( -4.402 1.984 0.271) 4.836 16.068 ( -1.440 -1.840 0.216) 2.347 16.435 ( -0.909 -2.569 0.095) 2.727 20.978 ( -0.401 17.712 2.558) 17.900 21.472 ( 1.563 10.304 -5.730) 11.893======================= Grid point 538 (256/322) =======================q-point: (-0.08 0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.578 ( 2.073 19.397 4.266) 19.968 1.716 ( 0.453 2.809 10.905) 11.270 2.064 ( -0.144 26.504 -5.965) 27.167 2.760 ( -5.487 11.920 -0.554) 13.134 2.786 ( 5.475 15.681 -1.731) 16.700 3.011 ( -1.475 3.006 -0.648) 3.411 3.138 ( -0.244 8.085 0.560) 8.108 3.284 ( -1.383 6.917 1.357) 7.183 3.695 ( -0.837 -2.978 0.393) 3.118 3.719 ( -0.703 11.266 -1.164) 11.348 4.231 ( -0.955 4.667 1.131) 4.896 4.341 ( 1.387 -1.377 0.118) 1.959 4.559 ( 0.054 16.966 -0.010) 16.966 4.929 ( -0.948 25.703 0.909) 25.737 5.161 ( 1.037 8.202 -1.149) 8.346 5.371 ( 5.794 -2.804 1.437) 6.596 5.423 ( -3.676 1.905 -2.149) 4.665 5.949 ( -1.241 23.488 -1.706) 23.583 6.922 ( -2.237 -4.917 5.084) 7.418 7.382 ( -0.616 -14.447 -0.167) 14.461 7.628 ( -0.147 -24.936 -0.190) 24.937 8.001 ( -0.301 -11.677 1.495) 11.776 8.706 ( 3.853 -5.158 -0.586) 6.465 9.096 ( -0.492 7.716 -1.969) 7.978 9.742 ( -3.745 -4.140 2.783) 6.238 9.928 ( 0.527 -3.496 -3.644) 5.077 10.230 ( -0.456 -5.358 -0.115) 5.379 10.469 ( -0.140 -1.201 -1.404) 1.853 11.336 ( -0.394 8.096 0.887) 8.154 11.578 ( 1.087 0.225 2.845) 3.054 14.680 ( 4.234 -1.790 1.551) 4.852 14.874 ( -2.534 0.089 -0.557) 2.596 16.121 ( 0.122 -3.700 0.314) 3.716 16.493 ( 0.037 -3.430 -0.047) 3.431 20.576 ( -0.757 23.004 3.645) 23.303 21.127 ( 1.173 25.208 -9.615) 27.005======================= Grid point 541 (257/322) =======================q-point: ( 0.15 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.234 ( 16.807 0.000 1.105) 16.843 1.619 ( 33.478 0.000 -0.286) 33.479 1.720 ( -5.305 -0.000 0.236) 5.310 2.199 ( 4.332 0.000 -2.270) 4.891 2.802 ( 7.230 0.000 -3.157) 7.889 2.918 ( -5.205 -0.000 -1.744) 5.490 2.923 ( -3.620 -0.000 3.050) 4.734 3.183 ( 6.170 0.000 3.665) 7.176 3.530 ( -1.357 -0.000 2.987) 3.281 3.552 ( 5.827 0.000 6.911) 9.039 3.721 ( 1.804 0.000 -2.798) 3.329 4.065 ( -3.419 -0.000 2.132) 4.029 4.160 ( -0.350 -0.000 0.795) 0.868 4.449 ( -2.887 -0.000 -2.397) 3.752 5.010 ( -10.843 -0.000 0.740) 10.869 5.339 ( -2.771 -0.000 -4.151) 4.991 5.504 ( -7.568 -0.000 -3.257) 8.239 5.615 ( -1.669 -0.000 1.736) 2.408 7.027 ( -3.438 -0.000 10.654) 11.195 7.562 ( -9.932 -0.000 0.718) 9.958 8.212 ( -4.681 -0.000 8.226) 9.465 8.499 ( -1.020 -0.000 1.638) 1.929 8.664 ( 7.341 0.000 -0.169) 7.343 8.905 ( 4.110 0.000 -9.493) 10.344 9.720 ( 0.322 0.000 -0.369) 0.490 9.931 ( 6.622 0.000 6.553) 9.316 10.497 ( 5.597 0.000 0.116) 5.599 10.629 ( -0.316 -0.000 0.019) 0.316 10.994 ( -18.327 -0.000 2.931) 18.560 11.680 ( -3.615 -0.000 -0.564) 3.658 14.697 ( 9.181 0.000 -1.482) 9.299 15.449 ( 16.652 0.000 -9.239) 19.044 16.495 ( 20.142 0.000 -7.326) 21.433 16.660 ( 6.383 0.000 -0.149) 6.384 19.878 ( -0.118 -0.000 0.049) 0.128 20.109 ( -0.051 -0.000 -0.046) 0.068======================= Grid point 542 (258/322) =======================q-point: ( 0.23 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.564 ( 15.500 -17.674 -0.544) 23.514 1.722 ( -0.946 -2.979 -0.545) 3.172 1.949 ( 30.804 -13.494 0.385) 33.633 2.390 ( 2.912 -14.236 -1.018) 14.566 2.788 ( -3.209 0.103 -1.072) 3.385 2.949 ( -5.623 -6.236 -0.029) 8.397 3.006 ( -2.505 -7.970 1.168) 8.436 3.254 ( 12.278 -2.674 0.941) 12.601 3.619 ( 10.629 -4.561 6.523) 13.279 3.627 ( -2.831 -5.618 2.210) 6.668 4.036 ( 1.678 -20.100 -0.502) 20.176 4.100 ( -2.255 -6.339 2.432) 7.155 4.308 ( 0.761 -16.087 0.568) 16.115 4.467 ( -3.890 -8.050 -3.408) 9.568 4.937 ( -12.245 0.751 0.935) 12.304 5.285 ( -6.606 2.225 -4.784) 8.454 5.428 ( -4.986 2.481 -1.083) 5.673 5.629 ( -5.332 -4.686 0.385) 7.109 6.953 ( -3.273 7.774 11.887) 14.575 7.417 ( -10.823 8.722 1.111) 13.944 8.004 ( -0.656 17.416 3.530) 17.783 8.344 ( 1.199 9.266 2.267) 9.614 8.804 ( 1.188 1.317 -6.460) 6.699 8.958 ( 4.494 -9.513 -3.276) 11.019 9.764 ( 1.081 -1.555 1.904) 2.686 10.007 ( 6.500 -3.269 5.099) 8.884 10.431 ( -2.627 13.719 0.417) 13.975 10.547 ( 6.131 -0.674 0.956) 6.242 11.016 ( -11.554 -8.267 1.912) 14.335 11.570 ( -8.538 5.802 -3.822) 11.008 14.760 ( 13.721 1.010 1.305) 13.820 15.412 ( 13.665 9.381 -6.372) 17.758 16.451 ( 15.668 11.696 -4.055) 19.968 16.663 ( 6.626 3.381 -0.350) 7.447 20.103 ( -1.433 -20.284 1.138) 20.366 20.465 ( -1.119 -30.119 -2.880) 30.277======================= Grid point 543 (259/322) =======================q-point: ( 0.31 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.796 ( 4.527 -4.318 0.459) 6.273 1.994 ( 15.114 -15.193 -1.895) 21.513 2.410 ( 17.460 -15.025 2.753) 23.199 2.688 ( 0.211 -14.339 -0.040) 14.340 2.822 ( -1.739 -6.472 1.064) 6.786 3.074 ( -3.269 -8.576 0.996) 9.231 3.168 ( -2.233 -9.390 1.739) 9.807 3.438 ( 8.684 -7.943 0.502) 11.780 3.618 ( -1.689 2.455 0.386) 3.004 3.856 ( 12.552 -9.596 2.416) 15.983 4.183 ( -0.421 -5.447 3.070) 6.267 4.284 ( -0.008 -2.953 -3.064) 4.255 4.690 ( 5.887 -14.537 1.910) 15.800 4.773 ( -13.482 -6.249 -2.578) 15.081 5.002 ( -5.599 -25.499 -2.560) 26.232 5.222 ( -8.195 -7.880 -1.027) 11.415 5.378 ( -1.912 0.166 -0.465) 1.975 5.811 ( -10.495 -20.970 -0.179) 23.451 6.699 ( -8.706 16.571 10.262) 21.347 7.116 ( -10.004 14.338 0.664) 17.496 7.682 ( 7.001 15.523 -0.329) 17.032 8.196 ( 3.054 6.775 2.431) 7.819 8.662 ( -3.184 9.106 -9.660) 13.652 9.194 ( 5.294 -8.883 1.071) 10.396 9.734 ( 1.311 5.703 5.576) 8.083 10.000 ( 0.433 12.291 0.843) 12.327 10.305 ( 4.199 -5.362 0.582) 6.835 10.547 ( 3.442 5.214 1.190) 6.360 11.188 ( -5.092 -14.778 0.494) 15.639 11.411 ( -10.950 2.161 -3.961) 11.843 14.811 ( 12.626 1.804 2.393) 12.976 15.297 ( 11.767 7.947 -3.224) 14.561 16.303 ( 9.000 9.083 -0.795) 12.812 16.615 ( 5.624 4.675 -0.758) 7.352 20.541 ( -2.370 -23.127 2.263) 23.358 21.030 ( -2.221 -25.795 -3.501) 26.126======================= Grid point 544 (260/322) =======================q-point: ( 0.38 0.15 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.897 ( 8.826 -0.722 2.427) 9.181 2.337 ( 12.931 -11.349 -1.177) 17.245 2.651 ( 1.430 -5.061 3.347) 6.234 2.950 ( -2.592 -12.648 -0.071) 12.911 3.052 ( 7.254 -12.461 4.869) 15.218 3.234 ( -0.716 -8.301 0.323) 8.338 3.341 ( 0.700 -8.202 1.589) 8.383 3.458 ( -4.733 3.249 1.525) 5.940 3.751 ( 8.123 -11.099 -0.040) 13.754 4.096 ( 8.289 -7.683 -2.516) 11.579 4.261 ( 3.950 0.866 -2.217) 4.612 4.343 ( 0.907 -5.246 3.743) 6.508 4.612 ( -12.175 4.508 -2.840) 13.290 4.926 ( 0.288 -1.610 -1.923) 2.525 5.128 ( -11.698 -6.900 -4.432) 14.287 5.394 ( -2.919 -4.097 0.875) 5.106 5.819 ( 0.494 -33.414 1.079) 33.435 6.240 ( -8.191 8.886 5.449) 13.257 6.379 ( -15.849 -26.779 -0.464) 31.121 6.815 ( -5.384 10.323 0.109) 11.643 7.479 ( 12.380 11.568 1.537) 17.012 8.148 ( 5.559 0.679 1.492) 5.796 8.413 ( -5.877 11.545 -7.858) 15.152 9.323 ( 5.603 0.179 2.893) 6.308 9.601 ( 0.302 8.640 6.362) 10.734 9.729 ( -1.516 11.953 -1.286) 12.117 10.383 ( 1.960 9.672 -2.035) 10.076 10.452 ( 3.857 -1.110 0.876) 4.109 11.394 ( -7.627 -9.988 -2.459) 12.805 11.533 ( -4.257 -19.434 1.152) 19.928 14.853 ( 10.492 1.037 3.095) 10.988 15.239 ( 8.846 3.986 -2.689) 10.068 16.218 ( 5.749 3.787 0.099) 6.885 16.554 ( 3.954 4.103 -1.226) 5.829 20.946 ( -1.645 -18.569 1.936) 18.742 21.398 ( -1.435 -13.527 -2.543) 13.838======================= Grid point 545 (261/322) =======================q-point: ( 0.46 0.15 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.887 ( 10.181 9.003 4.564) 14.336 2.567 ( 7.403 -5.319 0.936) 9.164 2.718 ( 0.782 -1.784 2.362) 3.062 3.140 ( -1.826 -7.670 -1.077) 7.958 3.239 ( -1.921 -2.625 5.912) 6.748 3.406 ( 6.299 -9.311 -0.876) 11.275 3.473 ( -4.789 -7.863 1.811) 9.383 3.505 ( 3.656 -6.833 1.327) 7.862 4.000 ( 7.151 -8.476 2.001) 11.269 4.205 ( -1.449 2.391 -2.338) 3.645 4.252 ( 5.960 -2.951 -0.540) 6.672 4.404 ( -6.444 1.875 -0.521) 6.732 4.510 ( -1.734 -1.225 -3.210) 3.849 4.898 ( -3.307 0.136 -3.839) 5.068 5.212 ( -8.250 -7.433 -2.904) 11.478 5.491 ( -1.872 -6.485 1.170) 6.850 5.859 ( -13.068 11.411 1.101) 17.384 6.264 ( -0.463 -5.800 0.358) 5.830 6.725 ( -1.800 -7.213 -0.198) 7.437 6.988 ( -5.778 -26.298 -0.251) 26.926 7.388 ( 13.807 3.640 3.347) 14.665 8.134 ( -5.649 10.669 -4.256) 12.800 8.245 ( 5.328 -5.857 0.204) 7.920 9.251 ( 2.142 9.009 4.475) 10.285 9.433 ( -0.899 8.964 4.807) 10.211 9.554 ( -0.324 5.851 -3.073) 6.617 10.182 ( 1.496 9.648 -1.293) 9.849 10.447 ( -0.714 1.154 -0.320) 1.395 11.651 ( -0.372 -16.813 -1.305) 16.868 11.889 ( -5.349 -18.596 0.643) 19.360 14.905 ( 8.549 -0.000 3.504) 9.239 15.216 ( 5.459 2.705 -2.905) 6.750 16.220 ( 4.530 -0.662 0.059) 4.578 16.497 ( 1.911 3.262 -1.532) 4.080 21.247 ( -0.537 -12.497 1.086) 12.556 21.557 ( -0.282 -4.229 -1.568) 4.519======================= Grid point 546 (262/322) =======================q-point: ( 0.54 0.15 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.670 ( 6.592 17.850 4.707) 19.601 2.625 ( 0.886 1.015 3.285) 3.550 2.751 ( 1.777 0.479 0.564) 1.925 3.223 ( 6.403 -1.376 -1.412) 6.700 3.312 ( -6.998 -6.454 4.479) 10.521 3.566 ( -1.514 -5.070 -0.097) 5.292 3.643 ( 4.669 -7.760 0.984) 9.110 3.664 ( 2.939 -6.803 1.192) 7.506 4.088 ( 0.340 3.465 0.178) 3.486 4.187 ( 0.635 -3.837 0.522) 3.924 4.276 ( -9.029 2.564 -3.151) 9.901 4.365 ( 4.750 -2.728 1.333) 5.638 4.496 ( -0.643 2.410 -1.323) 2.823 4.913 ( -2.891 -3.396 -4.593) 6.402 5.306 ( -2.555 -5.690 -2.396) 6.681 5.605 ( -3.231 -5.792 0.497) 6.651 5.673 ( -8.260 0.828 0.194) 8.304 6.233 ( -0.300 3.792 -0.510) 3.838 6.879 ( -0.656 -5.438 -0.038) 5.477 7.167 ( 9.182 3.456 1.203) 9.884 7.621 ( 3.511 -14.969 1.500) 15.449 7.904 ( -7.369 7.357 -1.822) 10.571 8.468 ( 5.596 -12.728 1.085) 13.946 9.053 ( -1.625 11.683 3.255) 12.236 9.266 ( -2.044 7.614 3.351) 8.566 9.424 ( 0.177 7.164 -3.019) 7.776 10.054 ( 1.062 3.684 -1.250) 4.033 10.464 ( -1.506 -3.823 0.276) 4.118 11.953 ( 2.654 -11.558 -0.979) 11.899 12.192 ( -4.570 -15.366 -0.544) 16.040 14.953 ( 6.037 0.373 3.240) 6.862 15.180 ( 2.541 2.803 -2.624) 4.604 16.276 ( 3.705 -1.855 -0.310) 4.155 16.439 ( -0.381 2.936 -1.417) 3.282 21.435 ( 0.160 -6.803 0.181) 6.807 21.584 ( 0.089 0.601 -0.534) 0.809======================= Grid point 547 (263/322) =======================q-point: ( 0.62 0.15 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.359 ( 1.043 14.046 3.197) 14.443 2.601 ( -0.426 1.137 3.446) 3.654 2.707 ( -1.341 3.638 -0.061) 3.878 3.283 ( 5.892 -0.456 1.442) 6.083 3.392 ( -2.710 -3.607 1.678) 4.813 3.612 ( -3.088 -0.951 -0.723) 3.311 3.772 ( 5.121 -2.519 -2.869) 6.387 3.799 ( 2.817 -4.192 2.955) 5.851 4.022 ( -3.331 1.710 0.538) 3.783 4.143 ( -8.101 3.992 -4.611) 10.140 4.257 ( 1.620 -1.181 1.708) 2.634 4.427 ( 1.779 0.973 -0.548) 2.101 4.467 ( 0.997 -2.287 3.358) 4.183 4.945 ( -3.452 -2.003 -3.860) 5.553 5.393 ( 3.348 -3.279 -1.632) 4.963 5.673 ( -4.357 -3.292 0.271) 5.468 5.710 ( -2.505 -6.822 0.507) 7.285 6.179 ( -0.001 1.064 -0.951) 1.427 6.932 ( 0.328 -1.397 -0.099) 1.439 7.128 ( 10.072 6.119 1.514) 11.882 7.724 ( -5.008 3.152 -1.065) 6.012 7.889 ( 0.787 -6.547 1.775) 6.829 8.724 ( -5.120 1.378 1.409) 5.486 8.843 ( 5.558 -2.719 1.002) 6.269 9.132 ( -3.553 4.400 2.206) 6.070 9.299 ( 0.784 4.395 -1.620) 4.749 10.030 ( 0.745 0.010 -1.299) 1.497 10.538 ( -1.089 -3.000 0.129) 3.194 12.097 ( 1.114 -2.190 -0.143) 2.462 12.425 ( -0.658 -9.287 -2.310) 9.593 14.954 ( 2.390 2.658 1.567) 3.902 15.135 ( 1.086 2.410 -1.205) 2.905 16.298 ( 1.692 2.398 -0.351) 2.956 16.390 ( -1.333 0.383 -0.963) 1.688 21.521 ( 0.130 -1.890 -0.245) 1.910 21.560 ( 0.036 1.149 0.138) 1.158======================= Grid point 548 (264/322) =======================q-point: (-0.31 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.231 ( -3.228 -2.301 1.631) 4.287 2.605 ( -0.405 1.654 1.489) 2.263 2.618 ( -2.423 1.053 1.254) 2.925 3.299 ( 1.968 1.645 3.352) 4.221 3.405 ( -0.079 1.980 -0.804) 2.139 3.561 ( -4.771 3.552 -1.023) 6.036 3.788 ( 4.831 3.583 -3.096) 6.765 3.859 ( 4.382 0.700 -0.158) 4.441 3.978 ( -4.886 1.411 0.551) 5.116 4.012 ( -5.944 3.382 -1.878) 7.091 4.279 ( 1.663 -0.024 2.135) 2.706 4.415 ( -1.857 -0.452 -3.367) 3.871 4.554 ( 4.697 -3.679 6.579) 8.882 4.937 ( -3.440 0.125 -2.807) 4.442 5.468 ( 7.515 -1.254 -0.751) 7.656 5.663 ( -5.130 0.954 1.059) 5.324 5.910 ( 1.479 -12.992 0.284) 13.079 6.191 ( -0.163 -2.431 -1.030) 2.645 6.960 ( 1.639 -0.493 -0.111) 1.715 7.042 ( 6.421 7.872 1.338) 10.247 7.659 ( -6.712 -0.326 0.221) 6.724 7.951 ( 2.099 1.974 0.746) 2.976 8.477 ( -3.082 11.100 -0.253) 11.523 9.052 ( 0.249 -0.514 -1.696) 1.790 9.138 ( -1.590 -12.553 5.809) 13.923 9.280 ( 1.378 -2.413 -2.004) 3.426 10.029 ( 0.585 0.393 -1.499) 1.656 10.535 ( -0.899 2.827 -0.023) 2.967 12.066 ( 0.672 5.451 0.288) 5.500 12.511 ( 1.167 0.675 -3.193) 3.466 14.885 ( -0.571 4.559 -0.437) 4.615 15.094 ( 0.358 2.328 0.519) 2.412 16.215 ( -1.090 5.026 -0.117) 5.144 16.392 ( -0.343 -0.385 -0.467) 0.695 21.515 ( 0.086 1.972 0.141) 1.979 21.555 ( -0.187 -0.297 -0.081) 0.360======================= Grid point 549 (265/322) =======================q-point: (-0.23 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.379 ( -3.436 -12.248 1.489) 12.808 2.481 ( -1.242 7.858 0.565) 7.975 2.676 ( -0.914 -3.656 1.962) 4.248 3.250 ( -3.787 4.559 5.265) 7.928 3.310 ( 3.529 6.866 -2.938) 8.260 3.437 ( -4.224 5.446 -2.470) 7.321 3.698 ( 4.835 7.278 -1.921) 8.947 3.769 ( -3.412 7.595 -2.739) 8.766 3.873 ( -1.664 6.905 0.045) 7.103 4.004 ( -0.032 -2.530 0.267) 2.544 4.285 ( 2.066 1.082 2.876) 3.702 4.401 ( -2.566 0.291 -2.710) 3.743 4.687 ( 5.852 -5.498 5.550) 9.760 4.901 ( -3.215 0.898 -1.708) 3.749 5.517 ( 7.548 1.261 -0.368) 7.661 5.595 ( -5.019 2.829 0.546) 5.787 6.218 ( 3.787 -16.279 0.454) 16.720 6.262 ( -0.215 -4.445 -0.416) 4.469 6.893 ( 1.921 8.442 1.765) 8.836 6.950 ( -0.713 3.191 -0.864) 3.382 7.650 ( -1.938 -1.049 0.072) 2.205 7.807 ( -1.317 13.462 -0.287) 13.530 8.342 ( 1.698 1.436 -0.003) 2.224 9.073 ( -3.113 -3.484 -0.861) 4.750 9.320 ( -2.374 -6.707 5.984) 9.297 9.421 ( 2.797 -8.767 -3.440) 9.824 10.040 ( 0.457 -2.438 -1.460) 2.879 10.444 ( -0.768 4.757 -0.089) 4.819 11.914 ( 1.113 9.947 0.768) 10.038 12.392 ( 0.771 11.482 -3.134) 11.927 14.787 ( -1.204 4.405 -0.952) 4.665 15.042 ( -0.261 3.141 1.026) 3.315 16.115 ( -1.182 4.050 0.060) 4.219 16.393 ( -0.178 -0.042 -0.178) 0.255 21.437 ( -0.029 6.252 -0.067) 6.252 21.572 ( 0.076 -1.261 -0.085) 1.266======================= Grid point 550 (266/322) =======================q-point: (-0.15 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.595 ( -1.147 -9.381 2.734) 9.839 2.274 ( 0.267 13.276 1.470) 13.359 2.701 ( -0.860 2.509 0.807) 2.773 3.069 ( -1.550 10.043 1.195) 10.232 3.230 ( 1.527 4.499 0.065) 4.751 3.289 ( -1.933 7.669 -2.764) 8.378 3.570 ( -6.621 8.501 0.253) 10.778 3.583 ( 5.005 7.148 -2.221) 9.004 3.693 ( 0.647 9.812 -0.511) 9.847 4.044 ( 0.839 0.332 -0.397) 0.986 4.267 ( 1.363 1.539 2.684) 3.380 4.366 ( -1.557 1.606 -1.148) 2.514 4.823 ( 5.586 -1.079 3.893) 6.894 4.881 ( -3.532 -3.684 -0.947) 5.190 5.479 ( -0.064 5.020 -0.222) 5.026 5.512 ( 0.850 3.941 -0.586) 4.074 6.260 ( -0.429 9.555 -0.112) 9.565 6.527 ( -0.135 -8.396 0.325) 8.404 6.813 ( 0.177 -5.279 2.125) 5.693 6.895 ( -1.455 -2.257 -0.890) 2.829 7.383 ( 0.631 26.169 -0.786) 26.189 7.711 ( -0.068 -3.934 0.062) 3.935 8.417 ( 2.432 -6.601 -0.640) 7.064 9.133 ( -2.434 -3.764 -0.415) 4.501 9.453 ( -2.473 -7.553 5.978) 9.944 9.579 ( 1.375 -7.421 -4.150) 8.613 10.149 ( 0.495 -8.350 -0.958) 8.419 10.366 ( 0.147 3.184 -0.716) 3.267 11.726 ( 0.912 9.067 1.676) 9.266 12.074 ( -0.629 19.865 -2.258) 20.003 14.708 ( -0.348 2.839 -0.542) 2.911 14.974 ( 0.413 3.777 0.751) 3.873 16.057 ( -0.154 1.236 0.177) 1.258 16.400 ( 0.385 -0.895 -0.124) 0.982 21.264 ( -0.429 11.542 0.986) 11.592 21.579 ( 0.596 1.603 -1.972) 2.610======================= Grid point 551 (267/322) =======================q-point: (-0.08 0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.721 ( 0.664 -3.062 4.485) 5.471 1.979 ( 4.272 17.742 1.715) 18.329 2.508 ( 1.251 17.092 -1.512) 17.205 2.906 ( -0.130 6.858 -0.434) 6.873 3.079 ( -2.927 11.266 -0.273) 11.643 3.127 ( 3.438 7.729 -0.604) 8.481 3.348 ( -1.705 11.292 1.181) 11.481 3.438 ( 3.430 9.747 0.593) 10.350 3.615 ( -1.782 -2.400 -0.938) 3.133 3.942 ( 0.291 9.948 0.036) 9.952 4.285 ( -0.908 -1.271 1.182) 1.959 4.318 ( 0.578 1.906 0.309) 2.016 4.779 ( -0.003 5.709 1.154) 5.824 4.988 ( -0.016 -4.627 0.312) 4.638 5.372 ( -2.078 3.600 -1.234) 4.336 5.433 ( 1.649 4.836 -0.873) 5.183 5.812 ( -0.551 32.494 -0.172) 32.499 6.418 ( -3.182 18.142 0.849) 18.439 6.910 ( -6.416 9.949 2.025) 12.011 7.068 ( -4.547 -14.930 -0.116) 15.607 7.168 ( 2.935 -20.387 -0.251) 20.599 7.831 ( 5.334 -6.940 0.843) 8.793 8.583 ( 1.834 -8.427 -2.844) 9.081 9.167 ( -0.092 0.218 -0.109) 0.260 9.601 ( -3.345 -7.789 5.749) 10.243 9.752 ( 0.939 -10.561 -3.685) 11.225 10.276 ( 2.177 3.955 0.910) 4.605 10.353 ( 0.694 -8.174 -2.861) 8.688 11.602 ( -0.163 4.585 3.022) 5.494 11.648 ( -2.499 19.891 -1.637) 20.114 14.675 ( 0.489 0.451 -0.340) 0.747 14.917 ( 4.168 2.787 0.559) 5.045 16.068 ( 1.252 -1.933 0.249) 2.317 16.438 ( 1.379 -2.464 -0.154) 2.828 20.978 ( -0.989 17.569 2.589) 17.786 21.466 ( 0.323 10.799 -5.165) 11.975======================= Grid point 555 (268/322) =======================q-point: ( 0.23 0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.452 ( 19.994 0.000 -0.974) 20.018 1.684 ( 0.125 0.000 -1.632) 1.637 2.027 ( 35.123 0.000 1.523) 35.156 2.253 ( 5.639 0.000 -1.129) 5.751 2.774 ( -7.744 -0.000 -1.761) 7.942 2.831 ( -8.530 -0.000 -0.638) 8.554 2.889 ( -3.992 -0.000 2.158) 4.538 3.317 ( 12.521 0.000 -2.213) 12.715 3.523 ( -1.417 -0.000 3.506) 3.781 3.709 ( 15.616 0.000 11.029) 19.118 3.733 ( 1.793 0.000 -3.345) 3.795 4.041 ( -1.684 -0.000 3.978) 4.320 4.169 ( 0.438 0.000 1.054) 1.141 4.378 ( -5.470 -0.000 -5.563) 7.802 4.877 ( -12.381 -0.000 1.470) 12.468 5.254 ( -10.300 -0.000 -5.353) 11.608 5.418 ( -5.667 -0.000 -2.678) 6.268 5.566 ( -6.715 -0.000 1.931) 6.987 7.048 ( 0.689 0.000 14.164) 14.181 7.445 ( -10.249 -0.000 0.871) 10.286 8.192 ( -3.521 -0.000 8.826) 9.503 8.487 ( -1.616 -0.000 0.928) 1.863 8.749 ( 7.098 0.000 -0.198) 7.101 8.906 ( 1.602 0.000 -11.076) 11.191 9.723 ( 0.376 0.000 -0.633) 0.736 10.035 ( 7.145 0.000 6.413) 9.601 10.561 ( 4.533 0.000 0.745) 4.594 10.625 ( -0.333 -0.000 0.192) 0.384 10.810 ( -14.471 -0.000 3.476) 14.883 11.571 ( -12.152 -0.000 -5.438) 13.313 14.886 ( 20.170 0.000 5.936) 21.025 15.562 ( 8.218 0.000 -8.204) 11.612 16.714 ( 20.866 0.000 -9.959) 23.121 16.742 ( 7.959 0.000 -0.345) 7.966 19.876 ( -0.139 -0.000 0.051) 0.148 20.108 ( -0.067 -0.000 -0.053) 0.086======================= Grid point 556 (269/322) =======================q-point: ( 0.31 0.23 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.729 ( 6.189 -5.014 -0.506) 7.981 1.764 ( 15.795 -15.125 -2.425) 22.003 2.310 ( 27.304 -8.068 3.557) 28.692 2.428 ( 3.930 -12.143 -0.649) 12.779 2.724 ( -5.310 -1.765 -0.116) 5.597 2.872 ( -7.583 -8.372 0.812) 11.325 2.965 ( -4.434 -8.441 1.494) 9.651 3.377 ( 8.828 -2.302 -2.524) 9.466 3.600 ( -2.905 -4.146 2.564) 5.674 3.802 ( 15.525 -5.121 1.741) 16.440 4.079 ( 1.728 -19.379 0.456) 19.461 4.096 ( 3.731 -5.481 6.324) 9.162 4.310 ( -0.700 -15.586 -0.155) 15.602 4.407 ( -2.884 -10.769 -4.877) 12.169 4.795 ( -12.068 1.101 2.092) 12.297 5.151 ( -13.096 2.084 -3.796) 13.794 5.368 ( -6.825 0.347 -3.431) 7.647 5.543 ( -7.797 -2.554 1.375) 8.319 6.976 ( -0.029 10.765 14.819) 18.317 7.297 ( -10.077 9.067 1.319) 13.620 8.022 ( 1.916 14.767 3.000) 15.190 8.349 ( -1.430 8.047 1.889) 8.388 8.778 ( -1.247 5.205 -9.475) 10.882 9.009 ( 5.090 -11.448 -1.113) 12.578 9.786 ( 1.660 -2.976 1.550) 3.744 10.098 ( 6.055 -1.797 4.784) 7.923 10.396 ( -3.472 12.534 0.549) 13.018 10.619 ( 5.085 0.083 2.076) 5.493 10.904 ( -8.490 -10.940 1.506) 13.929 11.424 ( -12.441 5.337 -7.062) 15.268 14.972 ( 18.900 4.052 6.704) 20.459 15.513 ( 7.469 7.176 -6.190) 12.066 16.624 ( 15.673 15.317 -5.187) 22.520 16.742 ( 7.187 4.245 -0.890) 8.394 20.090 ( -1.361 -19.517 0.897) 19.585 20.444 ( -1.161 -28.677 -1.599) 28.745======================= Grid point 557 (270/322) =======================q-point: ( 0.38 0.23 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.874 ( 8.494 -5.904 0.524) 10.358 2.164 ( 14.874 -14.376 -1.999) 20.782 2.556 ( 2.641 -5.931 4.228) 7.747 2.681 ( -2.425 -12.633 0.251) 12.866 2.875 ( 12.790 -11.286 2.544) 17.246 3.033 ( -4.261 -10.347 1.534) 11.295 3.145 ( -2.260 -11.102 1.532) 11.432 3.498 ( 0.857 -1.614 1.681) 2.483 3.617 ( 3.146 -3.658 -1.527) 5.061 4.002 ( 9.245 -6.434 -1.965) 11.434 4.225 ( 6.690 -6.060 4.164) 9.941 4.295 ( 3.512 -2.266 -3.113) 5.211 4.591 ( -15.348 -3.793 -3.574) 16.209 4.768 ( 4.183 -13.231 4.257) 14.515 4.925 ( -4.399 -18.795 -5.332) 20.026 5.099 ( -11.620 -16.512 2.719) 20.373 5.354 ( -2.772 -4.735 -2.525) 6.040 5.669 ( -12.631 -20.392 0.183) 23.988 6.643 ( -6.652 22.624 11.032) 26.034 7.018 ( -7.079 12.734 0.560) 14.581 7.778 ( 9.353 12.417 -0.142) 15.546 8.218 ( -0.654 4.471 2.357) 5.097 8.588 ( -4.077 10.196 -9.182) 14.314 9.260 ( 5.271 -9.434 1.192) 10.872 9.772 ( 2.364 5.955 4.474) 7.815 9.998 ( -1.254 14.758 1.230) 14.862 10.357 ( 4.578 -7.458 -0.020) 8.751 10.585 ( 1.740 6.257 2.405) 6.925 11.137 ( -3.710 -15.628 -0.392) 16.067 11.262 ( -11.472 0.349 -4.669) 12.391 14.987 ( 14.522 4.674 5.225) 16.126 15.398 ( 7.521 7.267 -4.032) 11.209 16.407 ( 8.936 11.926 -1.185) 14.950 16.675 ( 4.916 5.616 -1.331) 7.581 20.521 ( -2.105 -23.211 1.835) 23.378 20.996 ( -1.876 -25.721 -2.285) 25.891======================= Grid point 558 (271/322) =======================q-point: ( 0.46 0.23 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.022 ( 10.955 -1.815 2.757) 11.442 2.474 ( 10.415 -9.499 -0.462) 14.103 2.656 ( -2.186 -4.705 3.173) 6.082 2.905 ( -4.639 -12.176 1.299) 13.095 3.179 ( 8.322 -8.522 4.036) 12.577 3.227 ( 2.103 -11.815 0.556) 12.014 3.348 ( -0.654 -8.465 1.203) 8.575 3.415 ( -3.022 2.896 1.636) 4.494 3.845 ( 8.224 -11.411 0.265) 14.068 4.145 ( 2.820 -5.162 -2.599) 6.431 4.312 ( 3.332 2.155 -1.005) 4.093 4.379 ( -0.485 -2.664 1.434) 3.064 4.467 ( -5.987 1.187 -4.116) 7.362 4.908 ( -7.258 2.544 -5.274) 9.325 4.983 ( -5.574 -9.332 0.777) 10.898 5.358 ( -3.550 -6.167 0.462) 7.131 5.831 ( 1.208 -32.512 0.332) 32.536 6.141 ( -11.682 19.042 4.334) 22.756 6.244 ( -6.623 -37.021 0.868) 37.619 6.760 ( -4.019 9.106 -0.219) 9.956 7.631 ( 12.135 9.674 2.187) 15.673 8.193 ( 1.454 -1.636 1.232) 2.512 8.324 ( -5.197 12.257 -6.579) 14.850 9.395 ( 5.089 0.532 2.967) 5.915 9.629 ( 1.323 9.711 4.921) 10.967 9.702 ( -2.299 12.079 -1.418) 12.377 10.400 ( 1.758 9.927 -1.598) 10.207 10.482 ( 1.016 1.602 0.432) 1.945 11.303 ( -6.413 -14.430 -1.992) 15.916 11.495 ( -2.670 -18.822 0.782) 19.027 14.993 ( 10.894 2.814 4.590) 12.152 15.315 ( 5.623 4.731 -3.435) 8.112 16.281 ( 4.875 4.830 -0.233) 6.867 16.589 ( 2.721 4.975 -1.450) 5.853 20.934 ( -1.342 -19.065 1.682) 19.186 21.377 ( -0.991 -14.195 -2.090) 14.382======================= Grid point 559 (272/322) =======================q-point: ( 0.54 0.23 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.017 ( 8.934 10.265 4.476) 14.326 2.632 ( 2.739 -2.461 2.874) 4.671 2.738 ( 1.099 -3.153 0.944) 3.469 3.106 ( -3.372 -10.376 1.448) 11.006 3.259 ( 3.412 0.822 0.303) 3.523 3.414 ( -4.952 -7.471 1.500) 9.087 3.495 ( 7.223 -10.479 1.640) 12.832 3.545 ( 2.463 -7.727 0.966) 8.168 4.084 ( 4.312 -7.815 1.116) 8.995 4.184 ( -1.283 5.469 0.394) 5.631 4.252 ( -4.864 -0.620 -0.493) 4.928 4.332 ( -0.784 -1.117 -2.593) 2.930 4.523 ( 1.987 -0.841 -1.613) 2.694 4.826 ( -7.708 -0.960 -6.170) 9.920 5.141 ( -0.787 -8.779 -0.412) 8.824 5.462 ( -3.607 -6.484 0.441) 7.433 5.742 ( -7.683 11.632 1.190) 13.991 6.260 ( -0.267 -5.170 -0.233) 5.182 6.706 ( -1.274 -8.439 -0.229) 8.538 6.934 ( -3.310 -30.143 -0.036) 30.325 7.553 ( 11.874 4.641 3.597) 13.247 8.048 ( -5.523 11.305 -3.799) 13.143 8.297 ( 2.514 -7.440 0.680) 7.883 9.280 ( 0.691 11.268 3.542) 11.832 9.441 ( -0.016 10.120 3.553) 10.726 9.542 ( -0.121 5.156 -2.616) 5.783 10.195 ( 1.292 9.833 -1.043) 9.972 10.428 ( -2.013 1.595 -0.345) 2.591 11.653 ( 1.028 -20.032 -0.796) 20.074 11.834 ( -4.179 -17.223 0.255) 17.725 15.016 ( 8.076 1.424 4.326) 9.272 15.254 ( 2.636 3.684 -3.366) 5.644 16.266 ( 3.110 -0.469 -0.352) 3.165 16.508 ( 0.806 4.177 -1.411) 4.482 21.246 ( -0.334 -12.852 0.955) 12.892 21.550 ( -0.172 -4.716 -1.408) 4.925======================= Grid point 560 (273/322) =======================q-point: ( 0.62 0.23 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.743 ( 3.450 20.241 4.000) 20.919 2.647 ( 1.111 1.921 3.924) 4.508 2.757 ( -0.672 1.495 0.090) 1.642 3.258 ( -4.206 -5.975 4.634) 8.652 3.311 ( 8.490 -3.154 -2.563) 9.413 3.524 ( -4.599 -5.498 -0.013) 7.168 3.696 ( 1.593 -6.289 1.031) 6.569 3.713 ( 5.966 -7.384 0.730) 9.521 4.052 ( -5.499 3.735 1.546) 6.825 4.157 ( -5.024 1.506 -5.163) 7.360 4.246 ( 4.181 -1.291 1.303) 4.566 4.415 ( 2.584 -4.367 3.600) 6.222 4.479 ( -1.088 3.754 -1.592) 4.220 4.844 ( -6.038 -4.643 -6.047) 9.726 5.305 ( 3.231 -7.106 -0.940) 7.863 5.551 ( -3.651 -4.595 -0.685) 5.909 5.617 ( -4.038 -1.568 1.131) 4.477 6.226 ( -0.479 3.598 -0.751) 3.707 6.871 ( -0.507 -5.613 -0.040) 5.636 7.254 ( 4.860 -2.018 0.566) 5.293 7.688 ( 5.933 -11.542 2.284) 13.177 7.819 ( -5.499 8.037 -1.446) 9.845 8.510 ( 1.124 -12.540 1.165) 12.644 9.042 ( -1.478 12.713 1.735) 12.916 9.256 ( -0.805 8.657 2.327) 9.000 9.418 ( -0.040 6.904 -1.649) 7.098 10.062 ( 0.919 3.900 -1.159) 4.171 10.447 ( -1.328 -4.248 0.201) 4.455 11.987 ( 3.411 -10.614 -0.201) 11.151 12.140 ( -3.814 -17.133 -1.339) 17.604 15.029 ( 4.897 2.302 3.545) 6.469 15.190 ( 0.422 3.068 -2.830) 4.195 16.311 ( 2.448 -1.976 -0.624) 3.207 16.426 ( -0.969 4.041 -1.106) 4.300 21.438 ( 0.182 -6.847 0.135) 6.851 21.583 ( -0.048 0.434 -0.448) 0.626======================= Grid point 561 (274/322) =======================q-point: (-0.31 -0.77 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.371 ( -0.565 16.299 2.921) 16.569 2.609 ( -0.282 1.900 3.526) 4.015 2.692 ( -0.910 4.052 -0.029) 4.153 3.320 ( -1.010 -1.256 5.695) 5.919 3.409 ( 4.393 -2.041 -3.505) 5.979 3.564 ( -3.427 -0.980 -0.422) 3.589 3.802 ( 0.176 -3.413 0.347) 3.435 3.853 ( 4.838 -3.515 -0.350) 5.991 3.979 ( -3.389 1.743 1.864) 4.243 4.059 ( -3.892 3.959 -4.098) 6.900 4.291 ( 2.924 -0.369 1.980) 3.550 4.401 ( -2.749 1.437 -3.059) 4.356 4.521 ( 3.882 -3.403 4.889) 7.110 4.884 ( -3.736 -2.875 -4.808) 6.733 5.452 ( 5.654 -5.141 -0.488) 7.657 5.616 ( -4.576 -2.439 -0.047) 5.186 5.691 ( -0.918 -8.445 0.393) 8.504 6.173 ( -0.392 0.999 -0.827) 1.355 6.931 ( -0.229 -1.940 -0.040) 1.954 7.230 ( 4.595 5.842 1.735) 7.633 7.667 ( -2.426 4.326 -1.254) 5.116 7.916 ( 2.347 -6.846 1.355) 7.363 8.668 ( -3.898 5.803 0.802) 7.037 8.892 ( 0.856 -7.211 2.317) 7.622 9.110 ( -0.413 5.731 0.643) 5.782 9.301 ( 0.028 3.990 -0.717) 4.054 10.034 ( 0.616 0.133 -1.329) 1.471 10.529 ( -0.507 -3.089 0.079) 3.131 12.113 ( 1.430 -1.503 -0.161) 2.080 12.410 ( -0.513 -10.508 -2.381) 10.787 14.980 ( 1.035 4.750 1.325) 5.038 15.139 ( 0.270 2.028 -0.933) 2.249 16.314 ( 1.142 4.828 -0.578) 4.995 16.372 ( -0.986 -1.261 -0.689) 1.743 21.522 ( 0.014 -1.707 -0.155) 1.714 21.561 ( 0.026 1.044 0.079) 1.047======================= Grid point 562 (275/322) =======================q-point: (-0.23 0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.207 ( -1.782 -1.185 2.464) 3.264 2.598 ( -0.851 4.482 0.602) 4.602 2.611 ( -0.214 -1.426 2.456) 2.848 3.309 ( -2.052 2.352 5.733) 6.528 3.419 ( 2.056 2.150 -4.054) 5.028 3.519 ( -0.533 4.261 -0.099) 4.295 3.815 ( -0.460 2.209 -0.245) 2.270 3.864 ( -4.203 4.461 -1.633) 6.343 3.953 ( 3.113 -0.122 0.891) 3.240 3.979 ( 0.271 2.109 -1.761) 2.761 4.309 ( 2.239 0.092 2.558) 3.401 4.378 ( -2.451 -0.510 -3.175) 4.043 4.624 ( 3.729 -4.354 3.900) 6.933 4.894 ( -1.000 -0.299 -3.263) 3.426 5.546 ( -0.657 -1.701 0.196) 1.834 5.605 ( 1.048 0.770 0.026) 1.300 5.921 ( 0.297 -14.301 0.095) 14.304 6.183 ( -0.580 -2.430 -0.542) 2.556 6.963 ( -0.195 -1.125 -0.156) 1.152 7.093 ( -1.177 9.353 2.088) 9.656 7.620 ( 1.846 0.173 -1.043) 2.128 7.973 ( 1.124 2.531 0.172) 2.775 8.452 ( -1.156 9.397 0.150) 9.469 9.023 ( -4.360 -0.193 2.537) 5.048 9.154 ( 1.217 -10.812 3.075) 11.307 9.288 ( 1.274 -3.451 -2.543) 4.472 10.030 ( 0.417 0.460 -1.513) 1.635 10.529 ( -0.056 2.918 0.017) 2.918 12.078 ( 1.230 5.474 -0.428) 5.626 12.507 ( -0.321 0.374 -2.523) 2.571 14.878 ( -0.560 5.370 0.068) 5.400 15.099 ( 0.353 2.359 0.130) 2.389 16.209 ( 0.159 5.517 -0.231) 5.524 16.390 ( 0.243 -0.499 -0.525) 0.764 21.517 ( 0.129 1.942 0.025) 1.946 21.553 ( -0.095 -0.250 -0.003) 0.267======================= Grid point 563 (276/322) =======================q-point: (-0.15 0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.366 ( 0.028 -12.457 2.761) 12.759 2.480 ( 0.723 7.563 0.695) 7.630 2.673 ( -0.598 -3.450 2.205) 4.138 3.226 ( -2.928 5.502 5.169) 8.097 3.344 ( 3.359 5.942 -3.847) 7.835 3.414 ( 1.691 6.115 -0.054) 6.345 3.690 ( -7.531 7.734 -1.495) 10.898 3.733 ( 0.945 6.418 0.812) 6.537 3.891 ( 3.936 7.337 -1.482) 8.456 4.013 ( 1.597 -2.588 -0.655) 3.111 4.315 ( 1.402 1.257 1.857) 2.645 4.369 ( -1.368 -0.088 -1.497) 2.029 4.747 ( 1.048 -6.005 0.714) 6.137 4.879 ( 1.906 1.421 -0.477) 2.425 5.508 ( -8.089 1.239 0.418) 8.194 5.608 ( 6.194 2.909 -0.707) 6.880 6.225 ( -2.748 -15.775 -0.191) 16.013 6.258 ( -0.311 -5.370 -0.003) 5.379 6.886 ( -3.975 8.618 2.355) 9.779 6.945 ( 0.007 3.460 -0.378) 3.481 7.660 ( 3.258 -0.797 -0.816) 3.452 7.812 ( 2.723 14.034 -0.570) 14.307 8.348 ( -0.728 0.273 -0.646) 1.011 9.044 ( -1.978 -3.485 1.893) 4.432 9.309 ( -2.533 -6.630 5.709) 9.108 9.440 ( 2.235 -8.213 -3.839) 9.337 10.041 ( 0.448 -2.527 -1.548) 2.997 10.443 ( 0.614 4.741 0.015) 4.781 11.927 ( 0.802 9.913 -0.349) 9.952 12.379 ( -1.527 11.545 -1.971) 11.811 14.777 ( -0.112 4.408 -0.044) 4.410 15.051 ( 1.409 3.045 0.180) 3.360 16.114 ( 1.121 4.131 0.071) 4.281 16.397 ( 0.964 -0.121 -0.512) 1.098 21.436 ( -0.133 6.368 0.028) 6.370 21.574 ( 0.303 -1.349 -0.246) 1.404======================= Grid point 564 (277/322) =======================q-point: (-0.08 0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.610 ( 2.189 -9.693 3.222) 10.447 2.301 ( 3.848 12.140 0.729) 12.756 2.697 ( -0.430 2.374 1.578) 2.883 3.075 ( 1.429 9.391 2.407) 9.799 3.247 ( 1.775 5.438 -1.339) 5.875 3.289 ( 2.339 8.405 0.209) 8.727 3.489 ( -6.363 7.357 0.490) 9.739 3.616 ( -0.695 4.755 -0.260) 4.813 3.724 ( 6.166 12.080 -0.764) 13.584 4.053 ( 1.431 0.550 -1.304) 2.013 4.279 ( -0.336 1.913 0.265) 1.960 4.359 ( 0.509 1.194 0.996) 1.636 4.815 ( -4.979 -1.051 -2.498) 5.668 4.908 ( 5.014 -2.887 2.006) 6.124 5.425 ( -5.941 3.057 -0.253) 6.686 5.543 ( 2.039 5.617 -1.154) 6.086 6.250 ( -1.415 9.100 0.394) 9.217 6.454 ( -11.542 -7.486 0.539) 13.768 6.799 ( -2.469 -2.244 0.735) 3.416 6.927 ( 5.959 -6.165 1.399) 8.688 7.331 ( -7.435 26.288 -1.201) 27.346 7.794 ( 12.212 -2.128 0.224) 12.398 8.414 ( -1.909 -7.300 -3.325) 8.245 9.124 ( 0.433 -4.185 2.509) 4.899 9.443 ( -2.476 -7.471 6.170) 10.001 9.580 ( 0.898 -6.803 -3.684) 7.789 10.153 ( 0.804 -8.575 -1.230) 8.700 10.381 ( 2.500 2.755 -0.604) 3.769 11.727 ( -1.220 9.455 0.073) 9.534 12.049 ( -2.754 19.820 -0.824) 20.028 14.710 ( 1.067 2.634 0.072) 2.843 15.005 ( 4.517 3.038 -0.000) 5.444 16.070 ( 2.296 1.231 0.304) 2.623 16.414 ( 2.041 -1.044 -0.553) 2.358 21.261 ( -0.643 11.592 1.123) 11.664 21.577 ( 0.277 1.996 -1.978) 2.823======================= Grid point 569 (278/322) =======================q-point: ( 0.31 0.31 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.686 ( 20.758 0.000 -2.287) 20.884 1.718 ( 6.292 0.000 -0.957) 6.364 2.318 ( 5.563 0.000 -0.229) 5.568 2.399 ( 20.455 0.000 4.128) 20.868 2.685 ( -0.218 -0.000 -0.079) 0.232 2.718 ( -10.405 -0.000 0.412) 10.414 2.843 ( -4.679 -0.000 1.155) 4.820 3.437 ( 10.027 0.000 -3.551) 10.638 3.519 ( -1.356 -0.000 4.043) 4.264 3.742 ( 1.531 0.000 -3.712) 4.015 3.901 ( 8.598 0.000 2.535) 8.964 4.070 ( 3.017 0.000 7.271) 7.872 4.179 ( 3.564 0.000 2.514) 4.361 4.322 ( -0.441 -0.000 -6.433) 6.448 4.739 ( -11.885 -0.000 2.106) 12.070 5.090 ( -14.011 -0.000 -2.428) 14.220 5.298 ( -13.239 -0.000 -5.973) 14.524 5.511 ( -3.660 -0.000 2.688) 4.541 7.126 ( 3.846 0.000 17.203) 17.628 7.336 ( -8.572 -0.000 0.915) 8.620 8.179 ( -3.409 -0.000 8.125) 8.811 8.473 ( -0.746 -0.000 0.088) 0.751 8.823 ( 5.518 0.000 -0.220) 5.522 8.874 ( -0.964 -0.000 -12.074) 12.112 9.725 ( 0.394 0.000 -0.706) 0.808 10.131 ( 6.265 0.000 4.768) 7.873 10.581 ( -3.154 -0.000 0.422) 3.183 10.623 ( -0.267 -0.000 0.259) 0.372 10.698 ( -5.289 -0.000 4.288) 6.809 11.398 ( -12.478 -0.000 -8.187) 14.924 15.156 ( 19.919 0.000 10.739) 22.630 15.607 ( 3.938 0.000 -6.490) 7.591 16.818 ( 6.767 0.000 -3.496) 7.617 16.925 ( 18.356 0.000 -6.540) 19.486 19.875 ( -0.131 -0.000 0.052) 0.141 20.107 ( -0.066 -0.000 -0.057) 0.087======================= Grid point 570 (279/322) =======================q-point: ( 0.38 0.31 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.811 ( 9.359 -4.800 -0.218) 10.521 1.964 ( 18.079 -13.850 -2.523) 22.913 2.451 ( 0.742 -8.796 0.864) 8.869 2.471 ( -6.874 -3.231 3.174) 8.232 2.779 ( -1.679 -9.249 2.358) 9.691 2.812 ( 15.507 -7.561 2.019) 17.370 2.920 ( -3.128 -9.045 0.861) 9.609 3.458 ( 6.313 -1.244 -2.223) 6.808 3.580 ( -1.495 -3.495 2.729) 4.679 3.939 ( 8.602 -5.568 -3.734) 10.906 4.073 ( -0.807 -19.154 -1.720) 19.248 4.194 ( 3.886 -8.867 6.038) 11.409 4.315 ( 3.498 -6.528 -2.960) 7.976 4.379 ( 0.210 -14.958 -1.508) 15.036 4.681 ( -9.511 -0.952 3.632) 10.226 4.993 ( -10.597 1.201 0.549) 10.679 5.214 ( -15.142 -1.632 -6.288) 16.477 5.484 ( -4.241 0.235 1.289) 4.439 7.035 ( 1.184 14.802 16.720) 22.362 7.198 ( -7.111 8.903 0.986) 11.437 8.063 ( 3.346 10.666 2.455) 11.445 8.326 ( -2.965 8.519 1.053) 9.081 8.723 ( -2.722 6.947 -10.110) 12.566 9.063 ( 4.363 -12.439 -0.298) 13.186 9.811 ( 1.816 -4.642 1.145) 5.114 10.175 ( 4.860 0.116 3.632) 6.068 10.357 ( -3.376 10.170 0.439) 10.725 10.668 ( 1.413 1.362 2.881) 3.486 10.830 ( -4.388 -12.808 0.720) 13.558 11.262 ( -10.441 4.930 -7.870) 13.974 15.208 ( 16.074 6.468 9.153) 19.596 15.559 ( 3.806 5.480 -5.164) 8.437 16.764 ( 9.952 13.161 -4.610) 17.132 16.828 ( 8.650 9.695 -1.763) 13.112 20.078 ( -1.057 -18.806 0.741) 18.850 20.429 ( -0.755 -27.580 -0.989) 27.608======================= Grid point 571 (280/322) =======================q-point: ( 0.46 0.31 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.993 ( 11.130 -6.688 1.120) 13.033 2.323 ( 12.832 -12.315 -1.539) 17.852 2.517 ( -8.823 -6.468 3.155) 11.386 2.641 ( -4.433 -11.750 1.475) 12.645 2.988 ( -3.233 -11.699 1.726) 12.259 3.086 ( 16.479 -8.890 3.703) 19.086 3.129 ( -0.396 -12.169 0.867) 12.206 3.482 ( -3.450 2.811 2.085) 4.915 3.690 ( 9.432 -8.354 -0.927) 12.634 4.058 ( 3.352 -5.033 -1.789) 6.306 4.321 ( 4.227 -3.901 1.986) 6.085 4.339 ( 3.634 -0.651 -6.479) 7.457 4.418 ( -8.852 -5.858 -3.094) 11.057 4.710 ( -13.316 -7.675 0.639) 15.383 4.964 ( 11.538 -13.065 -0.996) 17.459 4.996 ( -8.031 -21.151 5.544) 23.293 5.283 ( -6.998 -17.857 -4.326) 19.661 5.541 ( -9.192 -16.259 0.792) 18.694 6.612 ( -4.412 26.903 10.732) 29.298 6.955 ( -3.880 11.909 -0.087) 12.525 7.891 ( 9.563 10.273 0.512) 14.045 8.196 ( -4.228 2.487 2.315) 5.424 8.517 ( -3.174 10.584 -8.117) 13.711 9.320 ( 4.217 -10.004 1.134) 10.915 9.813 ( 2.588 6.006 2.912) 7.159 9.983 ( -1.708 16.063 1.321) 16.207 10.410 ( 4.595 -8.004 -0.629) 9.251 10.595 ( -1.612 6.183 2.976) 7.049 11.086 ( -4.831 -6.543 -4.701) 9.394 11.145 ( -5.378 -10.207 -0.399) 11.544 15.162 ( 11.571 6.708 6.388) 14.822 15.451 ( 3.720 6.461 -3.981) 8.451 16.497 ( 6.857 14.349 -1.241) 15.952 16.716 ( 2.940 6.393 -1.814) 7.267 20.505 ( -1.537 -23.257 1.582) 23.361 20.974 ( -0.810 -25.594 -1.915) 25.678======================= Grid point 572 (281/322) =======================q-point: ( 0.54 0.31 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.156 ( 9.390 -1.696 3.029) 10.011 2.558 ( 2.449 -6.956 2.315) 7.729 2.632 ( -2.034 -7.534 1.249) 7.903 2.865 ( -2.254 -12.443 1.177) 12.700 3.188 ( -1.739 -9.961 0.572) 10.127 3.334 ( -1.333 -3.361 -0.107) 3.618 3.349 ( 10.528 -9.120 3.272) 14.308 3.402 ( -0.388 -2.972 1.491) 3.347 3.939 ( 7.065 -9.693 0.883) 12.028 4.182 ( 5.181 -5.353 -0.116) 7.450 4.264 ( -11.579 3.658 -0.330) 12.148 4.341 ( 2.410 2.854 -1.114) 3.898 4.470 ( -0.075 -4.334 -5.726) 7.181 4.735 ( -13.803 -2.202 -4.444) 14.667 5.022 ( 6.572 -3.882 3.250) 8.296 5.313 ( -4.148 -6.774 -0.935) 7.998 5.848 ( 1.543 -32.442 -0.458) 32.482 6.027 ( -8.448 7.273 2.982) 11.540 6.206 ( -1.599 -25.756 2.164) 25.896 6.721 ( -2.352 8.651 -0.678) 8.990 7.760 ( 7.676 8.738 3.252) 12.077 8.194 ( -1.450 -3.561 0.876) 3.944 8.259 ( -2.325 12.553 -5.604) 13.942 9.458 ( 4.070 0.771 3.265) 5.274 9.659 ( 1.470 10.692 2.073) 10.990 9.668 ( -2.490 12.251 -0.817) 12.528 10.411 ( 0.370 10.116 -0.270) 10.127 10.484 ( -0.008 3.846 -0.922) 3.955 11.239 ( -3.700 -18.514 -1.110) 18.913 11.476 ( -0.994 -18.075 0.431) 18.108 15.122 ( 8.009 3.952 5.121) 10.295 15.347 ( 1.730 5.136 -3.636) 6.527 16.325 ( 2.690 5.787 -0.446) 6.398 16.607 ( 1.220 5.546 -1.428) 5.855 20.926 ( -0.873 -19.443 1.497) 19.520 21.364 ( -0.109 -14.494 -2.013) 14.634======================= Grid point 573 (282/322) =======================q-point: (-0.38 -0.69 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.106 ( 3.457 12.031 4.058) 13.160 2.664 ( 1.505 -2.395 4.083) 4.967 2.737 ( -1.670 -3.244 0.258) 3.657 3.083 ( -1.231 -10.044 1.722) 10.264 3.309 ( 4.063 -0.541 -1.594) 4.398 3.362 ( -3.395 -8.186 0.819) 8.900 3.562 ( 0.617 -8.236 2.339) 8.584 3.586 ( 5.808 -8.843 -0.387) 10.587 4.076 ( -3.824 -0.498 0.391) 3.876 4.137 ( -3.446 1.260 0.116) 3.671 4.281 ( 3.839 2.506 -1.446) 4.807 4.341 ( 4.578 -5.550 2.873) 7.747 4.529 ( 0.456 0.028 -2.165) 2.213 4.683 ( -11.507 -4.253 -6.730) 13.992 5.185 ( 5.707 -7.072 0.544) 9.103 5.415 ( -3.733 -6.739 -0.326) 7.710 5.684 ( -2.917 11.264 1.167) 11.694 6.257 ( -0.142 -4.389 -0.471) 4.416 6.695 ( -0.453 -9.176 -0.222) 9.190 6.910 ( -0.852 -31.704 -0.017) 31.716 7.662 ( 3.347 4.231 4.687) 7.147 7.999 ( 0.020 11.702 -4.740) 12.625 8.310 ( -0.342 -8.260 0.999) 8.327 9.291 ( -0.287 13.258 3.170) 13.635 9.455 ( 1.100 10.812 1.503) 10.972 9.532 ( -0.644 4.524 -1.500) 4.810 10.204 ( 0.540 9.792 -0.777) 9.838 10.407 ( -1.054 1.541 -0.346) 1.899 11.664 ( 0.976 -23.209 -0.518) 23.235 11.798 ( -1.618 -15.045 -0.131) 15.132 15.110 ( 5.232 2.326 4.610) 7.351 15.253 ( -1.058 4.164 -3.639) 5.630 16.288 ( 0.830 -0.399 -0.438) 1.020 16.510 ( 0.255 4.726 -1.170) 4.875 21.246 ( -0.133 -13.082 0.801) 13.107 21.545 ( 0.089 -4.876 -1.285) 5.043======================= Grid point 574 (283/322) =======================q-point: (-0.31 -0.69 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.772 ( -0.598 21.452 3.485) 21.741 2.670 ( 0.327 2.754 3.816) 4.717 2.744 ( -1.086 1.236 0.157) 1.652 3.243 ( -0.903 -6.406 3.707) 7.456 3.372 ( 1.059 -3.291 -2.505) 4.269 3.488 ( 0.602 -5.225 -0.302) 5.269 3.701 ( -1.728 -5.951 1.871) 6.473 3.769 ( 2.810 -7.046 -1.259) 7.689 4.013 ( -1.218 2.394 3.430) 4.357 4.099 ( -1.599 2.713 -4.246) 5.287 4.287 ( 1.070 -1.433 0.315) 1.816 4.449 ( 1.084 3.221 0.451) 3.428 4.477 ( 1.570 -2.647 1.397) 3.380 4.763 ( -2.796 -6.766 -5.206) 8.983 5.339 ( 1.111 -6.880 -0.929) 7.031 5.527 ( -1.598 -5.262 0.329) 5.509 5.589 ( 1.022 -1.485 0.169) 1.810 6.219 ( -0.344 3.587 -0.441) 3.630 6.868 ( -0.018 -5.569 -0.019) 5.569 7.278 ( -1.214 -4.648 1.145) 4.939 7.710 ( -4.469 -6.697 4.495) 9.220 7.819 ( 7.262 4.929 -5.368) 10.289 8.511 ( -1.206 -12.068 1.710) 12.248 9.030 ( -1.418 13.080 2.195) 13.338 9.265 ( 1.409 9.213 0.580) 9.339 9.410 ( -0.976 6.670 -0.396) 6.753 10.067 ( 0.439 3.950 -1.207) 4.154 10.439 ( 0.000 -4.483 0.148) 4.486 12.022 ( 1.597 -8.576 -0.476) 8.737 12.103 ( -0.677 -19.443 -1.400) 19.505 15.081 ( 1.852 4.158 3.309) 5.627 15.172 ( -1.852 2.115 -2.682) 3.886 16.323 ( -0.327 -2.490 -0.463) 2.554 16.417 ( 0.279 4.784 -0.948) 4.885 21.440 ( 0.103 -6.812 0.037) 6.813 21.581 ( -0.102 0.340 -0.286) 0.456======================= Grid point 575 (284/322) =======================q-point: (-0.23 -0.69 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.367 ( -1.604 16.792 3.247) 17.178 2.614 ( -0.730 2.243 3.162) 3.945 2.688 ( 0.173 3.910 0.310) 3.926 3.319 ( -2.947 -1.242 5.352) 6.235 3.418 ( 0.407 -1.853 -4.028) 4.453 3.563 ( 3.266 -0.931 -0.186) 3.401 3.775 ( -5.547 -3.051 2.131) 6.680 3.873 ( -0.770 -2.287 -1.644) 2.920 3.988 ( 3.507 1.476 2.738) 4.687 4.031 ( 1.007 2.683 -3.091) 4.215 4.323 ( 0.395 -1.449 0.616) 1.623 4.368 ( -0.156 2.812 -1.619) 3.249 4.567 ( 1.517 -3.743 1.355) 4.260 4.858 ( 2.462 -3.428 -3.186) 5.288 5.454 ( -5.936 -4.881 -0.637) 7.711 5.606 ( 3.211 -3.914 0.823) 5.129 5.702 ( 2.910 -7.418 -0.583) 7.989 6.166 ( -0.463 1.096 -0.172) 1.203 6.929 ( -0.110 -1.884 0.145) 1.892 7.219 ( -7.065 5.645 2.585) 9.405 7.680 ( 4.757 3.311 -2.246) 6.216 7.940 ( 1.358 -5.855 -0.867) 6.073 8.654 ( 1.110 6.134 2.035) 6.558 8.871 ( -5.641 -5.996 4.086) 9.191 9.130 ( 3.455 4.931 -0.929) 6.092 9.295 ( -0.905 3.611 -0.172) 3.727 10.035 ( 0.322 0.184 -1.436) 1.484 10.529 ( 0.515 -3.052 0.060) 3.096 12.125 ( 0.923 -1.500 -1.309) 2.194 12.401 ( 0.196 -10.411 -1.573) 10.531 14.984 ( -0.891 5.590 0.971) 5.743 15.134 ( -0.729 1.295 -0.526) 1.576 16.314 ( -0.826 4.620 -0.566) 4.728 16.371 ( 1.121 -1.259 -0.592) 1.786 21.521 ( -0.131 -1.639 -0.056) 1.645 21.561 ( 0.038 0.934 0.025) 0.935======================= Grid point 576 (285/322) =======================q-point: (-0.15 0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.208 ( 0.293 -1.659 3.785) 4.143 2.596 ( -0.270 2.814 1.920) 3.417 2.621 ( 1.044 0.143 1.424) 1.771 3.285 ( -4.865 2.299 4.028) 6.721 3.432 ( 3.485 1.529 -2.791) 4.719 3.550 ( 4.476 4.477 0.484) 6.349 3.745 ( -9.140 2.332 0.481) 9.446 3.835 ( -1.889 3.944 1.705) 4.694 4.000 ( 3.785 0.122 -0.581) 3.831 4.005 ( 5.043 2.200 -1.900) 5.820 4.336 ( -0.626 0.453 -2.386) 2.508 4.350 ( 0.960 -0.853 1.998) 2.375 4.647 ( -0.725 -4.232 -1.540) 4.562 4.913 ( 5.103 -0.288 -1.205) 5.251 5.456 ( -9.131 -1.041 0.371) 9.198 5.680 ( 6.510 0.427 -0.611) 6.552 5.916 ( -1.116 -13.280 -0.304) 13.331 6.177 ( -0.462 -2.496 0.303) 2.557 6.955 ( -2.164 -0.410 0.474) 2.253 7.033 ( -7.360 7.805 1.890) 10.893 7.686 ( 8.041 -0.040 -2.145) 8.322 7.976 ( -0.101 2.489 -1.460) 2.887 8.455 ( 1.493 10.369 1.666) 10.608 8.978 ( -5.260 -3.373 5.169) 8.109 9.176 ( 0.958 -6.565 2.408) 7.058 9.293 ( 1.118 -4.866 -3.348) 6.012 10.029 ( 0.216 0.461 -1.540) 1.622 10.534 ( 0.793 2.914 0.094) 3.021 12.089 ( 1.108 5.446 -1.772) 5.834 12.491 ( -1.275 0.916 -1.325) 2.054 14.873 ( -0.409 5.199 0.686) 5.260 15.103 ( 0.310 1.691 -0.315) 1.748 16.217 ( 1.320 5.074 -0.298) 5.251 16.395 ( 0.838 -0.678 -0.688) 1.279 21.518 ( 0.123 2.006 -0.133) 2.014 21.553 ( 0.039 -0.413 0.109) 0.429======================= Grid point 577 (286/322) =======================q-point: (-0.08 0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.398 ( 3.543 -12.941 4.141) 14.042 2.504 ( 2.959 6.674 0.863) 7.352 2.676 ( -0.191 -3.010 2.371) 3.836 3.208 ( -2.681 3.661 3.557) 5.765 3.380 ( 5.292 5.998 -2.694) 8.440 3.463 ( 5.106 6.886 1.776) 8.754 3.592 ( -8.742 7.039 0.115) 11.224 3.724 ( -2.719 6.216 1.659) 6.984 3.953 ( 6.907 6.894 -0.747) 9.788 4.035 ( 3.097 -1.821 -1.700) 3.975 4.313 ( -1.162 1.344 -2.607) 3.155 4.375 ( 1.662 -0.366 2.823) 3.297 4.713 ( -4.702 -4.195 -4.444) 7.711 4.934 ( 5.152 0.816 0.403) 5.232 5.416 ( -6.935 0.263 0.968) 7.007 5.655 ( 2.066 4.450 -1.422) 5.108 6.157 ( -9.274 -12.865 -1.015) 15.892 6.245 ( -1.550 -3.885 0.559) 4.220 6.851 ( -1.874 3.936 2.534) 5.043 6.948 ( 0.628 3.073 0.350) 3.155 7.670 ( -1.848 9.892 -0.872) 10.101 7.892 ( 10.769 3.826 -1.895) 11.585 8.324 ( -2.439 2.033 -0.648) 3.240 9.039 ( -0.723 -4.596 4.571) 6.523 9.298 ( -2.273 -6.569 5.183) 8.671 9.448 ( 1.356 -7.835 -4.077) 8.936 10.041 ( 0.465 -2.751 -1.608) 3.220 10.456 ( 1.398 4.330 0.161) 4.553 11.930 ( 0.352 10.458 -1.663) 10.596 12.347 ( -3.253 11.947 -0.609) 12.397 14.785 ( 1.359 4.000 0.881) 4.316 15.076 ( 2.876 1.807 -0.665) 3.461 16.139 ( 3.004 3.850 0.106) 4.885 16.411 ( 1.762 -0.534 -0.923) 2.060 21.435 ( -0.169 6.485 0.103) 6.488 21.577 ( 0.437 -1.271 -0.386) 1.399======================= Grid point 583 (287/322) =======================q-point: ( 0.38 0.38 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.822 ( 11.470 0.000 0.128) 11.471 1.915 ( 19.430 0.000 -2.891) 19.643 2.361 ( 0.042 0.000 0.519) 0.521 2.378 ( -15.271 -0.000 3.075) 15.577 2.609 ( -7.025 -0.000 1.245) 7.135 2.789 ( -4.906 -0.000 0.016) 4.906 2.912 ( 26.733 0.000 4.812) 27.162 3.517 ( -1.224 -0.000 4.478) 4.642 3.529 ( 6.553 0.000 -2.175) 6.904 3.745 ( 1.098 0.000 -3.832) 3.986 3.944 ( 2.803 0.000 -2.665) 3.867 4.079 ( -1.510 -0.000 1.769) 2.325 4.295 ( 2.702 0.000 0.206) 2.710 4.316 ( 6.442 0.000 -2.629) 6.958 4.605 ( -12.794 -0.000 3.142) 13.174 4.956 ( -7.793 -0.000 2.732) 8.258 5.116 ( -11.400 -0.000 -6.157) 12.957 5.474 ( -4.217 -0.000 0.366) 4.233 7.234 ( 4.622 0.000 18.887) 19.444 7.255 ( -5.600 -0.000 0.843) 5.664 8.159 ( -3.919 -0.000 5.963) 7.136 8.476 ( 1.320 0.000 0.267) 1.347 8.812 ( -2.809 -0.000 -12.661) 12.969 8.875 ( 3.370 0.000 -0.217) 3.377 9.727 ( 0.270 0.000 -0.596) 0.655 10.208 ( 4.943 0.000 2.696) 5.630 10.512 ( -6.671 -0.000 1.241) 6.785 10.621 ( -0.117 -0.000 0.210) 0.240 10.690 ( -0.420 -0.000 3.301) 3.328 11.251 ( -7.882 -0.000 -7.780) 11.075 15.388 ( 13.027 0.000 11.051) 17.082 15.623 ( 2.257 0.000 -4.905) 5.400 16.871 ( 4.148 0.000 -3.591) 5.487 17.096 ( 13.732 0.000 -5.148) 14.666 19.874 ( -0.095 -0.000 0.051) 0.108 20.107 ( -0.047 -0.000 -0.055) 0.072======================= Grid point 584 (288/322) =======================q-point: ( 0.46 0.38 -0.57)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.942 ( 12.275 -4.699 0.685) 13.161 2.158 ( 15.645 -11.713 -2.622) 19.719 2.334 ( -14.345 -4.966 3.094) 15.492 2.416 ( -7.800 -7.211 1.678) 10.754 2.743 ( -0.668 -12.081 2.157) 12.290 2.863 ( -3.608 -10.512 -0.865) 11.148 3.095 ( 19.561 -2.950 5.133) 20.438 3.492 ( -0.395 1.165 -0.315) 1.270 3.607 ( 5.641 -6.529 2.195) 8.903 3.978 ( -1.925 -5.974 -2.861) 6.898 4.074 ( 4.537 -19.082 -2.437) 19.765 4.224 ( 1.965 -12.609 0.574) 12.774 4.313 ( -0.441 -3.128 -6.846) 7.540 4.388 ( -6.587 -9.391 -0.087) 11.471 4.583 ( -5.127 -4.329 6.165) 9.112 4.935 ( -6.081 -3.721 1.354) 7.256 5.059 ( -1.927 0.907 -2.628) 3.382 5.429 ( -5.440 1.106 -1.093) 5.658 7.091 ( -1.682 17.888 15.304) 23.601 7.151 ( -0.420 9.489 1.698) 9.649 8.106 ( 2.203 4.569 2.441) 5.630 8.293 ( -2.634 12.262 0.278) 12.544 8.661 ( -2.326 6.953 -9.469) 11.976 9.104 ( 2.585 -13.200 -0.107) 13.451 9.834 ( 1.561 -6.274 0.575) 6.490 10.232 ( 3.259 3.595 2.695) 5.551 10.323 ( -2.325 5.853 -0.052) 6.298 10.665 ( -2.671 2.269 2.787) 4.478 10.810 ( 0.033 -13.348 0.338) 13.352 11.145 ( -5.619 5.192 -6.539) 10.065 15.385 ( 8.994 7.328 8.615) 14.451 15.577 ( 1.927 4.886 -4.188) 6.718 16.827 ( 3.579 6.600 -2.733) 7.990 16.921 ( 7.397 18.532 -3.315) 20.227 20.070 ( -0.633 -18.313 0.658) 18.336 20.421 ( 0.061 -27.031 -1.017) 27.050======================= Grid point 585 (289/322) =======================q-point: (-0.46 -0.62 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.119 ( 7.461 -6.064 1.777) 9.777 2.388 ( -5.863 -9.621 3.084) 11.681 2.463 ( 2.673 -8.535 0.151) 8.945 2.594 ( -2.405 -14.160 0.566) 14.374 2.966 ( -1.058 -11.163 1.506) 11.313 3.117 ( -0.077 -13.965 -0.288) 13.969 3.268 ( 9.891 -5.606 2.837) 11.718 3.447 ( -2.646 2.961 0.948) 4.083 3.816 ( 10.713 -8.363 1.830) 13.713 4.092 ( 2.330 -6.638 -1.626) 7.220 4.224 ( -10.310 -1.180 -1.062) 10.431 4.324 ( -8.228 -3.877 -4.898) 10.330 4.416 ( 3.533 -0.608 -1.393) 3.846 4.597 ( -3.056 -7.103 0.202) 7.735 4.947 ( -2.283 -20.936 3.986) 21.434 5.095 ( 7.615 -9.254 -1.773) 12.115 5.206 ( -2.076 -26.739 -0.974) 26.838 5.456 ( -5.140 -15.244 -0.675) 16.102 6.609 ( -1.549 29.107 9.735) 30.731 6.925 ( -0.826 12.151 -1.154) 12.234 7.989 ( 5.387 10.565 1.839) 12.001 8.141 ( -5.412 -0.041 2.305) 5.882 8.471 ( -0.516 10.307 -7.148) 12.554 9.361 ( 2.069 -10.651 0.691) 10.872 9.848 ( 2.270 5.990 1.067) 6.494 9.970 ( -1.158 16.946 1.419) 17.044 10.455 ( 2.664 -8.259 -0.925) 8.727 10.575 ( -2.213 5.459 2.750) 6.501 11.015 ( -3.744 0.562 -4.137) 5.608 11.120 ( -0.327 -17.357 0.485) 17.367 15.284 ( 5.802 7.442 5.941) 11.151 15.461 ( 0.165 6.312 -3.726) 7.332 16.552 ( 2.878 16.129 -1.089) 16.420 16.731 ( 0.605 6.526 -1.823) 6.803 20.496 ( -0.832 -23.276 1.490) 23.339 20.967 ( 0.803 -25.434 -2.323) 25.552======================= Grid point 586 (290/322) =======================q-point: (-0.38 -0.62 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.224 ( -1.181 -1.139 3.250) 3.641 2.567 ( 0.742 -8.553 3.678) 9.340 2.616 ( -2.863 -7.272 1.164) 7.902 2.865 ( 1.644 -12.333 -0.384) 12.448 3.173 ( -1.200 -9.830 1.375) 9.998 3.332 ( 1.743 -2.347 -1.770) 3.418 3.396 ( -1.542 -6.159 2.543) 6.840 3.450 ( 4.921 -7.060 -0.889) 8.652 4.005 ( 3.022 -5.552 0.234) 6.325 4.155 ( -5.505 1.587 1.513) 5.925 4.263 ( 6.045 -5.814 3.637) 9.142 4.360 ( -10.405 -5.285 -4.052) 12.354 4.384 ( 2.327 0.436 -4.007) 4.654 4.630 ( -1.811 0.996 -1.418) 2.506 5.109 ( 4.650 -4.173 0.761) 6.294 5.265 ( -1.881 -6.284 -1.093) 6.650 5.856 ( -0.253 -33.115 -0.490) 33.120 5.983 ( 0.005 4.339 2.452) 4.984 6.211 ( 1.242 -22.022 1.256) 22.092 6.703 ( -0.122 8.635 -0.780) 8.671 7.809 ( -1.832 8.804 4.595) 10.099 8.176 ( -1.675 -3.727 0.356) 4.102 8.242 ( 2.412 11.282 -5.022) 12.583 9.506 ( 2.087 -0.887 2.648) 3.486 9.630 ( -2.487 14.788 -1.020) 15.030 9.686 ( 1.707 10.730 0.792) 10.894 10.402 ( -2.048 8.953 1.457) 9.299 10.490 ( 1.963 6.076 -2.388) 6.817 11.210 ( -0.919 -20.614 -0.107) 20.634 11.473 ( 0.442 -17.750 -0.006) 17.756 15.202 ( 2.769 4.193 4.367) 6.657 15.332 ( -2.397 5.536 -3.284) 6.868 16.338 ( -0.263 6.266 -0.275) 6.278 16.610 ( -0.036 5.629 -1.154) 5.746 20.924 ( -0.342 -19.636 1.405) 19.689 21.362 ( 1.029 -14.350 -2.302) 14.569======================= Grid point 587 (291/322) =======================q-point: (-0.31 -0.62 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.112 ( -4.517 11.864 3.519) 13.173 2.688 ( -0.945 -2.173 2.543) 3.475 2.714 ( -0.918 -3.756 1.724) 4.233 3.086 ( 0.565 -9.529 1.350) 9.641 3.291 ( -3.336 -3.570 0.124) 4.888 3.393 ( 5.932 -5.454 -2.058) 8.317 3.557 ( -2.498 -7.832 1.649) 8.384 3.618 ( -0.073 -8.491 -2.249) 8.784 4.053 ( -0.235 0.604 2.572) 2.652 4.139 ( 3.854 0.728 -0.288) 3.932 4.274 ( -3.062 1.760 -0.224) 3.539 4.395 ( -2.527 -5.042 -1.218) 5.770 4.524 ( 0.118 -2.623 -2.378) 3.542 4.602 ( 3.980 -3.414 0.528) 5.270 5.210 ( -2.302 -5.847 -2.077) 6.618 5.409 ( 3.609 -7.059 0.354) 7.936 5.683 ( 2.186 11.321 1.273) 11.600 6.255 ( 0.154 -3.998 -0.340) 4.016 6.694 ( 0.428 -9.355 -0.168) 9.366 6.913 ( 1.245 -31.217 -0.221) 31.243 7.652 ( -7.040 4.462 5.328) 9.893 8.017 ( 5.102 10.514 -6.190) 13.225 8.304 ( -1.371 -8.158 1.658) 8.437 9.298 ( 0.016 14.452 3.020) 14.764 9.473 ( 1.726 10.439 -0.955) 10.624 9.516 ( -1.788 4.471 0.283) 4.824 10.202 ( -0.458 9.477 -0.614) 9.508 10.406 ( 1.108 1.571 -0.260) 1.940 11.664 ( -0.842 -23.649 -0.483) 23.668 11.802 ( 2.431 -14.801 -0.472) 15.007 15.160 ( 0.740 2.030 3.791) 4.363 15.207 ( -4.659 4.582 -3.219) 7.284 16.283 ( -1.418 -0.363 0.000) 1.464 16.508 ( -0.073 4.635 -0.975) 4.737 21.247 ( 0.038 -13.115 0.651) 13.131 21.544 ( 0.432 -4.694 -1.216) 4.868======================= Grid point 588 (292/322) =======================q-point: (-0.23 -0.62 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.752 ( -4.359 20.736 3.108) 21.416 2.668 ( -2.127 2.584 2.172) 3.990 2.743 ( 0.257 0.935 1.279) 1.605 3.235 ( -4.262 -5.508 3.883) 7.974 3.354 ( 1.443 -4.246 -3.542) 5.714 3.528 ( 4.487 -4.520 -0.488) 6.388 3.667 ( -4.932 -5.182 2.342) 7.527 3.765 ( -1.696 -7.134 -2.820) 7.857 4.043 ( 3.154 1.537 4.295) 5.546 4.103 ( 3.580 4.022 -1.899) 5.710 4.272 ( -2.761 -2.517 -1.028) 3.875 4.455 ( 0.796 3.097 -0.471) 3.232 4.488 ( -1.101 -3.264 -1.294) 3.680 4.776 ( 5.842 -6.917 -0.487) 9.067 5.310 ( -4.298 -6.191 -1.425) 7.670 5.531 ( 3.107 -3.348 1.271) 4.741 5.636 ( 5.189 -3.005 -0.688) 6.036 6.217 ( 0.120 3.763 0.120) 3.767 6.870 ( 0.406 -5.453 0.062) 5.468 7.237 ( -6.357 -1.656 2.096) 6.896 7.667 ( -4.146 -8.624 2.574) 9.909 7.889 ( 7.042 4.026 -6.364) 10.310 8.496 ( -2.854 -12.313 2.463) 12.877 9.031 ( 0.572 13.793 3.127) 14.155 9.289 ( 2.684 8.951 -1.009) 9.399 9.392 ( -2.135 6.384 0.763) 6.775 10.064 ( -0.110 3.787 -1.342) 4.019 10.448 ( 1.329 -4.312 0.130) 4.514 12.004 ( -2.983 -11.207 -1.797) 11.736 12.132 ( 5.065 -16.526 -0.585) 17.295 15.081 ( -3.354 5.064 0.132) 6.075 15.141 ( -2.062 0.531 0.268) 2.146 16.304 ( -2.506 -2.122 0.056) 3.284 16.424 ( 1.076 3.915 -0.937) 4.167 21.441 ( -0.009 -6.684 -0.090) 6.684 21.579 ( -0.110 0.319 -0.086) 0.348======================= Grid point 589 (293/322) =======================q-point: (-0.15 -0.62 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.355 ( -2.365 15.379 3.566) 15.964 2.611 ( -1.092 1.759 2.617) 3.337 2.699 ( 1.222 3.572 0.667) 3.833 3.265 ( -7.305 -1.275 2.633) 7.869 3.445 ( 5.594 -2.444 -2.641) 6.652 3.605 ( 2.608 -1.104 -0.198) 2.840 3.704 ( -6.592 -1.319 3.611) 7.631 3.848 ( -2.351 -2.150 -1.655) 3.590 4.036 ( 2.143 1.309 0.149) 2.516 4.067 ( 6.200 1.911 1.409) 6.639 4.302 ( -1.673 -1.813 -2.214) 3.315 4.392 ( 2.597 2.961 1.067) 4.081 4.556 ( -2.985 -4.095 -3.057) 5.918 4.911 ( 6.221 -3.322 -1.086) 7.135 5.372 ( -5.707 -3.049 0.362) 6.481 5.660 ( 5.092 -6.516 1.031) 8.334 5.737 ( 2.649 -4.440 -1.653) 5.428 6.164 ( -0.037 1.297 0.498) 1.390 6.926 ( -0.941 -1.235 0.573) 1.655 7.118 ( -9.778 5.728 2.129) 11.530 7.732 ( 4.215 0.769 -1.623) 4.582 7.944 ( 0.731 -4.272 -3.503) 5.573 8.701 ( 4.040 1.203 3.500) 5.479 8.807 ( -6.154 0.100 4.300) 7.508 9.171 ( 3.651 3.988 -0.972) 5.494 9.279 ( -1.709 3.133 0.044) 3.569 10.033 ( 0.093 0.142 -1.550) 1.559 10.539 ( 1.095 -2.892 0.059) 3.093 12.122 ( -0.462 -2.494 -2.474) 3.543 12.408 ( 1.743 -8.695 -0.783) 8.902 14.967 ( -2.228 4.738 0.477) 5.257 15.120 ( -1.444 0.573 -0.019) 1.554 16.298 ( -1.524 2.036 -0.327) 2.564 16.386 ( 1.596 0.222 -0.669) 1.745 21.519 ( -0.222 -1.719 0.038) 1.734 21.562 ( 0.019 0.862 -0.019) 0.862======================= Grid point 590 (294/322) =======================q-point: (-0.08 0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.236 ( 2.051 -3.645 4.700) 6.291 2.599 ( -0.562 0.744 2.720) 2.876 2.649 ( 3.211 1.523 0.813) 3.645 3.231 ( -5.214 0.911 1.694) 5.557 3.487 ( 6.486 1.563 -1.529) 6.844 3.599 ( 0.993 2.700 -0.584) 2.935 3.646 ( -6.003 4.047 4.351) 8.447 3.812 ( -2.552 3.720 0.696) 4.565 4.030 ( 1.935 0.297 -1.074) 2.233 4.082 ( 7.977 1.843 0.822) 8.228 4.311 ( -0.918 -0.273 -3.220) 3.359 4.381 ( 1.672 -0.032 2.451) 2.967 4.600 ( -5.361 -3.606 -4.929) 8.126 4.973 ( 4.481 -0.060 -1.602) 4.759 5.379 ( -3.636 -0.745 1.608) 4.045 5.726 ( 1.614 1.566 -1.537) 2.724 5.892 ( -2.947 -9.833 -0.529) 10.279 6.173 ( -0.496 -2.187 0.754) 2.365 6.899 ( -5.761 2.495 1.743) 6.516 6.995 ( -0.575 2.306 0.662) 2.467 7.753 ( 3.804 -0.015 -1.731) 4.179 7.966 ( -0.316 1.076 -3.251) 3.439 8.503 ( 5.594 13.199 2.876) 14.621 8.933 ( -5.533 -6.903 6.096) 10.744 9.190 ( -0.100 -3.549 2.773) 4.505 9.293 ( 0.939 -5.949 -4.057) 7.262 10.026 ( 0.172 0.397 -1.532) 1.591 10.545 ( 0.898 2.852 0.171) 2.995 12.092 ( 0.659 5.139 -2.690) 5.838 12.471 ( -1.499 2.381 -0.449) 2.849 14.875 ( 0.340 4.124 1.227) 4.316 15.106 ( 0.573 0.448 -0.751) 1.046 16.235 ( 1.915 3.808 -0.274) 4.271 16.403 ( 0.946 -0.896 -0.901) 1.584 21.519 ( 0.125 2.118 -0.261) 2.138 21.555 ( 0.130 -0.718 0.193) 0.754======================= Grid point 597 (295/322) =======================q-point: (-0.54 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.972 ( 12.128 0.000 1.076) 12.175 2.103 ( 11.618 0.000 -2.245) 11.833 2.192 ( -15.932 -0.000 3.602) 16.335 2.299 ( -8.175 -0.000 1.488) 8.309 2.595 ( 3.115 0.000 0.468) 3.150 2.734 ( -3.823 -0.000 -0.841) 3.915 3.200 ( 17.664 0.000 6.128) 18.696 3.518 ( -1.065 -0.000 4.701) 4.820 3.549 ( -2.231 -0.000 -2.324) 3.222 3.743 ( 0.593 0.000 -3.672) 3.720 4.007 ( 8.775 0.000 -1.519) 8.906 4.069 ( -2.725 -0.000 1.993) 3.377 4.249 ( -8.338 -0.000 -2.878) 8.821 4.285 ( -8.798 -0.000 -3.901) 9.624 4.568 ( 6.470 0.000 6.272) 9.011 4.859 ( -9.017 -0.000 -4.611) 10.128 5.088 ( 6.045 0.000 1.722) 6.286 5.416 ( -4.629 -0.000 -1.731) 4.942 7.213 ( -1.887 -0.000 0.667) 2.002 7.339 ( 2.880 0.000 18.071) 18.299 8.130 ( -2.998 -0.000 3.742) 4.795 8.504 ( 2.644 0.000 1.465) 3.023 8.736 ( -3.131 -0.000 -12.627) 13.009 8.900 ( 1.081 0.000 -0.164) 1.094 9.727 ( -0.039 -0.000 -0.356) 0.358 10.262 ( 3.208 0.000 0.553) 3.255 10.456 ( -3.545 -0.000 2.064) 4.102 10.621 ( 0.094 0.000 0.061) 0.112 10.694 ( -0.245 -0.000 2.380) 2.392 11.168 ( -3.062 -0.000 -5.783) 6.543 15.514 ( 3.163 0.000 8.380) 8.957 15.640 ( 3.080 0.000 -3.477) 4.645 16.892 ( 1.146 0.000 -2.823) 3.047 17.204 ( 7.064 0.000 -5.500) 8.953 19.873 ( -0.041 -0.000 0.050) 0.064 20.106 ( -0.016 -0.000 -0.049) 0.051======================= Grid point 598 (296/322) =======================q-point: (-0.46 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.040 ( -4.179 -3.544 2.397) 5.981 2.193 ( -0.013 -6.982 2.546) 7.431 2.285 ( -10.935 -11.345 2.496) 15.953 2.349 ( 10.807 -7.412 -1.702) 13.215 2.772 ( 3.615 -9.440 1.904) 10.286 2.823 ( -1.756 -13.341 -2.424) 13.672 3.261 ( 5.020 0.195 2.685) 5.696 3.471 ( -1.649 1.147 0.124) 2.013 3.691 ( 4.402 -10.713 2.418) 11.831 3.902 ( -6.471 -9.655 -3.999) 12.292 4.124 ( -3.542 -5.606 7.371) 9.915 4.201 ( -14.969 -10.566 0.633) 18.333 4.279 ( 9.017 -12.505 -3.997) 15.927 4.291 ( 0.154 -9.090 -4.288) 10.052 4.653 ( 9.416 -4.065 5.358) 11.571 4.826 ( -5.450 -3.670 -6.247) 9.066 5.131 ( 5.886 -0.772 1.227) 6.061 5.367 ( -1.946 1.840 -1.919) 3.294 7.095 ( -1.478 13.257 7.045) 15.085 7.190 ( 2.586 16.357 6.665) 17.852 8.118 ( -1.751 0.335 3.102) 3.578 8.276 ( -0.227 16.347 -0.052) 16.348 8.618 ( -0.082 5.887 -7.849) 9.812 9.120 ( 0.189 -13.752 -0.202) 13.755 9.849 ( 0.910 -7.632 -0.283) 7.691 10.268 ( 1.447 11.201 2.406) 11.547 10.303 ( -0.861 -1.926 -0.892) 2.291 10.650 ( -0.543 2.440 2.757) 3.721 10.816 ( 0.410 -13.002 0.076) 13.009 11.089 ( -1.339 5.457 -4.436) 7.159 15.467 ( 1.171 6.441 6.964) 9.558 15.579 ( 0.354 6.126 -4.185) 7.428 16.840 ( 0.041 4.824 -1.804) 5.151 16.962 ( 1.148 21.499 -3.982) 21.895 20.068 ( -0.179 -18.106 0.635) 18.118 20.424 ( 1.161 -27.178 -1.602) 27.250======================= Grid point 599 (297/322) =======================q-point: (-0.38 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.100 ( -11.418 -6.825 3.551) 13.768 2.391 ( -1.289 -10.725 2.363) 11.058 2.429 ( -1.197 -8.961 3.310) 9.627 2.631 ( 6.558 -12.882 -2.496) 14.669 2.974 ( 1.720 -10.409 0.953) 10.593 3.122 ( 1.365 -14.304 -0.935) 14.400 3.300 ( -5.274 -4.023 -0.165) 6.635 3.459 ( 4.614 1.370 -0.180) 4.816 3.873 ( -7.325 -8.163 -2.829) 11.327 4.038 ( -4.642 -8.856 1.732) 10.147 4.193 ( -5.390 -0.183 2.666) 6.016 4.218 ( 2.194 -4.785 4.294) 6.793 4.442 ( 1.166 -1.679 -2.726) 3.407 4.614 ( 5.640 -4.962 -1.333) 7.630 4.985 ( 7.353 -17.012 0.861) 18.553 5.085 ( -4.996 -21.295 -2.327) 21.996 5.220 ( 0.379 -14.714 -1.452) 14.790 5.456 ( 6.674 -18.322 -0.862) 19.518 6.635 ( 1.204 29.694 7.894) 30.749 6.929 ( 2.346 12.836 -2.035) 13.206 7.980 ( -8.124 10.122 3.125) 13.350 8.131 ( 2.483 0.363 2.552) 3.579 8.462 ( 2.353 9.563 -6.083) 11.576 9.369 ( -0.870 -11.055 -0.123) 11.090 9.870 ( 1.459 5.836 -1.134) 6.122 9.968 ( 0.125 17.504 1.695) 17.586 10.444 ( -3.734 -5.829 0.107) 6.923 10.596 ( 4.486 3.117 1.178) 5.588 10.978 ( -1.269 -0.433 -1.039) 1.697 11.129 ( 1.668 -16.744 -0.359) 16.831 15.330 ( -0.840 7.594 3.905) 8.581 15.430 ( -3.624 6.660 -3.015) 8.160 16.551 ( -2.538 16.486 -1.027) 16.711 16.723 ( -1.044 6.169 -1.100) 6.352 20.495 ( -0.132 -23.291 1.549) 23.343 20.978 ( 2.656 -25.234 -3.393) 25.599======================= Grid point 600 (298/322) =======================q-point: (-0.31 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.149 ( -11.705 -2.956 3.647) 12.612 2.552 ( -8.408 -9.022 2.124) 12.514 2.624 ( 5.422 -6.704 2.734) 9.045 2.893 ( 3.521 -11.174 -1.546) 11.817 3.174 ( 0.740 -7.958 1.824) 8.198 3.350 ( -0.850 -4.072 -1.491) 4.419 3.372 ( -1.589 -9.941 0.077) 10.068 3.471 ( 1.161 -2.381 -3.690) 4.542 3.981 ( -5.606 -7.806 -3.057) 10.085 4.166 ( 2.952 -0.860 6.677) 7.350 4.187 ( -12.372 -7.799 -1.592) 14.711 4.327 ( 3.422 0.181 4.046) 5.303 4.436 ( 4.138 -1.525 -3.341) 5.533 4.675 ( 8.890 1.545 1.578) 9.160 5.088 ( -5.226 -3.317 -3.637) 7.179 5.301 ( 6.441 -7.115 0.330) 9.603 5.846 ( -0.622 -31.397 -0.247) 31.404 6.037 ( 7.409 4.143 1.984) 8.717 6.239 ( 3.373 -21.955 -0.615) 22.221 6.714 ( 2.377 8.970 -0.446) 9.290 7.751 ( -9.867 8.718 4.432) 13.892 8.163 ( -0.857 -1.850 1.388) 2.467 8.272 ( 4.475 9.484 -4.659) 11.475 9.507 ( -2.685 -3.389 -0.913) 4.419 9.619 ( 0.561 17.475 2.550) 17.669 9.704 ( 1.661 10.684 -1.412) 10.904 10.379 ( -2.599 7.418 2.019) 8.115 10.510 ( 2.556 7.415 -2.654) 8.280 11.216 ( 1.658 -20.445 1.022) 20.538 11.486 ( 1.797 -18.001 -0.488) 18.097 15.199 ( -5.090 3.932 -0.423) 6.446 15.283 ( -4.347 5.579 0.678) 7.105 16.319 ( -2.946 5.865 0.157) 6.565 16.600 ( -1.234 5.359 -0.719) 5.547 20.927 ( 0.147 -19.620 1.420) 19.672 21.373 ( 2.185 -13.762 -2.901) 14.233======================= Grid point 601 (299/322) =======================q-point: (-0.23 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.033 ( -10.134 9.576 2.957) 14.253 2.646 ( -5.985 -4.113 0.964) 7.326 2.729 ( 0.635 -2.096 2.444) 3.281 3.096 ( 0.424 -7.486 1.816) 7.715 3.277 ( 1.637 -3.702 -1.172) 4.214 3.448 ( 3.188 -5.719 -1.389) 6.693 3.516 ( -3.757 -7.312 -0.274) 8.225 3.588 ( -2.648 -8.535 -3.240) 9.506 4.077 ( 2.146 -2.124 2.728) 4.069 4.189 ( -7.370 -2.722 -0.165) 7.859 4.226 ( 6.840 4.315 0.009) 8.088 4.334 ( -4.352 -6.010 -1.481) 7.566 4.519 ( -0.194 -1.447 -1.565) 2.140 4.714 ( 9.497 -1.698 4.463) 10.630 5.162 ( -2.110 -6.499 -2.395) 7.240 5.471 ( 5.614 -6.347 -0.396) 8.483 5.742 ( 7.200 11.840 1.218) 13.911 6.260 ( 0.771 -4.040 -0.191) 4.117 6.703 ( 1.130 -9.018 -0.016) 9.088 6.938 ( 3.312 -28.680 -0.359) 28.873 7.552 ( -11.867 3.990 3.714) 13.059 8.064 ( 5.749 9.104 -5.241) 11.975 8.283 ( -3.531 -7.058 2.004) 8.143 9.311 ( 0.790 13.965 1.870) 14.111 9.478 ( -0.990 5.721 -0.951) 5.883 9.505 ( 0.460 8.847 0.556) 8.876 10.191 ( -1.056 9.138 -0.616) 9.220 10.426 ( 2.053 1.614 -0.100) 2.613 11.647 ( -1.488 -20.918 -0.295) 20.973 11.846 ( 5.266 -16.935 -0.952) 17.760 15.106 ( -8.162 1.766 -4.433) 9.454 15.173 ( -2.743 3.593 4.553) 6.416 16.257 ( -3.036 -0.424 0.440) 3.097 16.500 ( -0.832 4.034 -0.679) 4.174 21.250 ( 0.170 -12.941 0.534) 12.953 21.548 ( 0.764 -4.210 -1.223) 4.450======================= Grid point 602 (300/322) =======================q-point: (-0.15 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.693 ( -7.194 18.480 2.505) 19.988 2.645 ( -2.684 1.198 1.317) 3.220 2.743 ( -1.347 0.457 1.431) 2.018 3.181 ( -4.712 -3.077 2.513) 6.163 3.396 ( 6.384 -5.402 -3.514) 9.071 3.556 ( -1.688 -3.948 0.923) 4.392 3.625 ( -1.171 -5.019 1.558) 5.384 3.726 ( -2.921 -7.430 -3.594) 8.756 4.081 ( 0.192 2.459 2.091) 3.233 4.153 ( 3.809 1.737 1.877) 4.588 4.255 ( 2.808 -1.573 -0.826) 3.322 4.425 ( -6.847 -5.965 -3.692) 9.803 4.479 ( 1.409 3.750 0.195) 4.010 4.852 ( 5.402 -5.664 1.050) 7.897 5.277 ( 0.410 -5.038 0.357) 5.067 5.601 ( 6.980 -3.655 0.741) 7.914 5.687 ( 4.966 -1.127 -1.102) 5.210 6.223 ( 0.728 4.007 0.445) 4.096 6.876 ( 0.289 -5.064 0.323) 5.083 7.154 ( -8.515 2.620 2.163) 9.168 7.633 ( -2.378 -12.881 0.298) 13.102 7.943 ( 5.419 5.038 -5.283) 9.091 8.451 ( -6.341 -12.562 2.653) 14.319 9.067 ( 3.770 13.235 2.689) 14.022 9.317 ( 2.808 8.417 -2.030) 9.102 9.367 ( -2.940 6.237 2.190) 7.234 10.057 ( -0.393 3.467 -1.450) 3.778 10.466 ( 1.501 -3.936 0.108) 4.214 11.960 ( -3.356 -12.456 -1.636) 13.003 12.199 ( 6.566 -14.431 -1.172) 15.897 15.016 ( -6.182 2.372 -2.609) 7.117 15.121 ( -2.624 1.042 2.811) 3.984 16.270 ( -3.399 -2.028 0.280) 3.968 16.431 ( 0.377 2.754 -0.662) 2.857 21.440 ( -0.063 -6.493 -0.197) 6.496 21.577 ( -0.133 0.378 0.084) 0.410======================= Grid point 603 (301/322) =======================q-point: (-0.08 -0.54 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.334 ( -3.093 12.372 3.307) 13.175 2.607 ( -0.958 1.209 2.413) 2.864 2.712 ( 0.155 1.993 0.598) 2.087 3.198 ( -4.101 -1.205 1.096) 4.412 3.513 ( 6.815 -2.581 -2.888) 7.839 3.581 ( -6.346 -0.912 2.214) 6.782 3.691 ( 1.824 -0.719 2.940) 3.534 3.812 ( -2.531 -2.702 -2.516) 4.476 4.045 ( -0.214 0.827 -0.387) 0.938 4.161 ( 7.426 1.587 4.206) 8.681 4.290 ( 1.223 -0.997 -1.762) 2.365 4.407 ( -2.531 1.609 -0.702) 3.080 4.490 ( -4.411 -3.372 -3.196) 6.406 4.964 ( 2.995 -2.968 -1.621) 4.517 5.350 ( 1.276 -1.908 1.912) 2.987 5.718 ( 2.106 -3.158 -0.439) 3.821 5.757 ( 4.015 -3.796 -0.656) 5.564 6.168 ( 0.501 1.602 0.532) 1.761 6.902 ( -3.716 0.847 1.461) 4.082 7.036 ( -4.354 2.895 0.629) 5.266 7.759 ( 1.128 -0.968 -0.645) 1.621 7.941 ( 0.768 -2.178 -3.886) 4.520 8.684 ( -7.894 -13.815 3.868) 16.375 8.834 ( 7.488 14.416 2.943) 16.509 9.202 ( 1.491 3.994 0.418) 4.283 9.258 ( -1.382 2.394 -0.576) 2.824 10.029 ( 0.107 0.024 -1.601) 1.604 10.551 ( 0.747 -2.715 0.049) 2.816 12.102 ( -1.551 -3.893 -2.354) 4.806 12.435 ( 3.150 -6.080 -1.074) 6.932 14.939 ( -2.436 2.537 -0.089) 3.518 15.103 ( -1.448 -0.144 0.477) 1.531 16.278 ( -1.755 -0.126 -0.153) 1.766 16.400 ( 0.935 0.638 -0.657) 1.309 21.516 ( -0.219 -1.873 0.117) 1.889 21.561 ( -0.049 0.788 -0.058) 0.792======================= Grid point 611 (302/322) =======================q-point: (-0.46 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.937 ( -16.907 -0.000 4.360) 17.460 2.047 ( -16.994 -0.000 2.970) 17.251 2.208 ( 14.698 0.000 2.069) 14.843 2.331 ( 9.397 0.000 -1.574) 9.528 2.633 ( 2.440 0.000 -2.895) 3.786 2.719 ( 2.637 0.000 0.526) 2.689 3.292 ( -7.645 -0.000 -1.346) 7.762 3.504 ( -2.866 -0.000 0.503) 2.909 3.521 ( -0.893 -0.000 4.642) 4.727 3.737 ( 0.111 0.000 -3.246) 3.248 3.922 ( -16.868 -0.000 4.605) 17.485 4.078 ( 1.375 0.000 5.000) 5.185 4.222 ( -3.185 -0.000 -1.890) 3.704 4.259 ( 11.123 0.000 -1.490) 11.223 4.682 ( 6.236 0.000 -0.689) 6.273 4.795 ( 5.546 0.000 -3.044) 6.327 5.138 ( -0.995 -0.000 -2.101) 2.325 5.401 ( 4.639 0.000 -0.534) 4.670 7.216 ( 2.047 0.000 0.417) 2.089 7.398 ( -1.871 -0.000 13.559) 13.687 8.128 ( 1.224 0.000 3.778) 3.971 8.534 ( 0.937 0.000 1.422) 1.703 8.673 ( -0.731 -0.000 -10.372) 10.398 8.899 ( -1.195 -0.000 -0.066) 1.196 9.724 ( -0.423 -0.000 -0.041) 0.425 10.283 ( 0.601 0.000 -1.622) 1.730 10.450 ( 1.429 0.000 2.938) 3.267 10.624 ( 0.311 0.000 -0.152) 0.346 10.705 ( 1.241 0.000 1.782) 2.171 11.137 ( 0.002 0.000 -3.392) 3.392 15.532 ( -2.637 -0.000 6.306) 6.835 15.654 ( 0.211 0.000 -4.338) 4.343 16.881 ( -1.782 -0.000 -1.696) 2.460 17.219 ( -1.295 -0.000 -7.356) 7.469 19.873 ( 0.020 0.000 0.047) 0.051 20.106 ( 0.022 0.000 -0.039) 0.045======================= Grid point 612 (303/322) =======================q-point: (-0.38 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.894 ( -16.631 -5.200 5.196) 18.183 2.087 ( -17.790 -12.299 3.809) 21.960 2.347 ( 13.598 -4.641 1.959) 14.501 2.460 ( 7.448 -8.055 -2.371) 11.224 2.799 ( 1.752 -9.907 -2.363) 10.335 2.844 ( 5.310 -12.360 0.271) 13.454 3.199 ( -15.465 -0.878 -4.488) 16.127 3.460 ( -3.197 -1.816 2.098) 4.234 3.636 ( -9.567 -7.201 0.091) 11.974 3.898 ( 2.498 -6.002 4.919) 8.152 4.004 ( -7.038 -17.318 2.641) 18.880 4.165 ( -2.222 -2.724 7.261) 8.067 4.277 ( 0.071 -11.395 -2.873) 11.752 4.392 ( 7.864 -11.203 -1.069) 13.729 4.727 ( 3.950 -3.494 -6.253) 8.180 4.882 ( 15.425 -3.630 2.462) 16.037 5.113 ( -5.664 -0.137 -4.774) 7.409 5.418 ( 9.073 1.323 -0.247) 9.172 7.113 ( 0.799 13.157 6.001) 14.483 7.231 ( 2.027 15.708 2.486) 16.033 8.095 ( -3.270 6.018 3.291) 7.599 8.283 ( 1.054 13.166 0.821) 13.234 8.611 ( 2.135 5.009 -5.314) 7.608 9.107 ( -2.347 -13.927 -0.365) 14.128 9.852 ( -0.040 -8.331 -1.260) 8.426 10.268 ( -1.728 7.052 -0.449) 7.274 10.313 ( 2.558 3.578 0.815) 4.473 10.679 ( 3.880 1.858 2.834) 5.151 10.815 ( -0.393 -12.315 -0.488) 12.331 11.083 ( 1.962 4.771 -1.609) 5.404 15.469 ( -3.759 5.641 5.925) 9.003 15.543 ( -4.434 7.857 -6.050) 10.863 16.817 ( -3.333 4.769 -1.434) 5.992 16.921 ( -5.879 21.185 -3.918) 22.332 20.070 ( 0.240 -18.188 0.680) 18.203 20.438 ( 2.320 -28.055 -2.679) 28.278======================= Grid point 613 (304/322) =======================q-point: (-0.31 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.950 ( -14.876 -8.175 5.152) 17.739 2.263 ( -14.981 -13.580 3.827) 20.579 2.537 ( 9.825 -6.619 1.655) 11.962 2.688 ( 4.478 -11.398 -3.087) 12.629 3.008 ( 3.403 -10.004 0.237) 10.569 3.140 ( 1.881 -13.596 -1.300) 13.787 3.173 ( -14.673 -6.405 -3.752) 16.443 3.514 ( 3.956 -0.465 -0.797) 4.062 3.696 ( -14.407 -9.405 -1.757) 17.294 4.006 ( -4.803 -6.093 3.306) 8.433 4.177 ( -1.916 -0.369 8.157) 8.387 4.276 ( 3.328 -7.543 4.284) 9.291 4.448 ( 3.336 -3.659 -3.475) 6.049 4.717 ( 11.246 -5.227 0.284) 12.405 4.983 ( -10.519 -12.799 -2.987) 16.835 5.097 ( 10.701 -15.901 -3.353) 19.458 5.231 ( 3.859 -20.199 0.094) 20.565 5.566 ( 11.222 -17.368 -1.699) 20.747 6.682 ( 3.094 28.526 5.455) 29.208 6.968 ( 5.575 13.695 -2.441) 14.987 7.870 ( -11.198 9.498 2.912) 14.969 8.172 ( 2.090 3.069 3.818) 5.326 8.481 ( 3.435 8.843 -4.449) 10.478 9.341 ( -3.520 -10.991 -0.894) 11.575 9.873 ( 0.229 5.639 -3.067) 6.423 9.983 ( 1.506 17.294 1.530) 17.426 10.394 ( -4.472 -4.599 0.774) 6.461 10.654 ( 4.259 4.372 -1.648) 6.322 10.986 ( 2.641 -4.348 3.342) 6.087 11.156 ( 3.224 -14.681 -0.723) 15.048 15.274 ( -9.489 8.436 -2.881) 13.020 15.372 ( -5.424 6.126 2.115) 8.451 16.491 ( -6.992 14.557 -0.679) 16.163 16.700 ( -2.607 5.950 -0.290) 6.503 20.502 ( 0.458 -23.311 1.769) 23.383 21.007 ( 4.340 -24.998 -4.993) 25.859======================= Grid point 614 (305/322) =======================q-point: (-0.23 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 2.008 ( -13.581 -3.998 4.094) 14.737 2.434 ( -12.714 -11.312 2.941) 17.270 2.687 ( 3.596 -3.944 0.798) 5.396 2.934 ( 4.162 -10.910 -1.805) 11.816 3.199 ( 1.819 -6.846 2.001) 7.361 3.263 ( -9.586 -10.053 -2.651) 14.141 3.379 ( 0.486 -10.059 -1.623) 10.200 3.484 ( 3.681 2.552 -4.523) 6.366 3.878 ( -9.259 -14.294 -3.293) 17.347 4.091 ( -5.110 -4.749 2.357) 7.364 4.199 ( -2.513 -1.882 7.945) 8.543 4.386 ( 3.298 -0.789 3.722) 5.035 4.463 ( 5.216 1.011 -4.551) 6.996 4.803 ( 8.645 2.431 4.308) 9.960 5.030 ( -0.317 -5.889 -3.471) 6.843 5.375 ( 5.902 -6.261 -1.145) 8.680 5.844 ( 0.420 -31.542 -0.862) 31.556 6.160 ( 12.221 10.101 2.236) 16.012 6.285 ( 5.432 -25.926 -2.337) 26.592 6.754 ( 4.509 9.629 -0.133) 10.633 7.625 ( -13.089 8.910 3.155) 16.145 8.160 ( -1.453 -1.001 3.115) 3.580 8.306 ( 3.620 9.896 -3.856) 11.221 9.452 ( -5.057 -2.066 -2.424) 5.977 9.644 ( 1.290 15.332 3.627) 15.807 9.718 ( 2.013 10.702 -3.194) 11.349 10.356 ( -2.513 6.260 2.148) 7.080 10.523 ( 0.764 7.149 -2.974) 7.780 11.256 ( 4.316 -17.851 2.429) 18.526 11.513 ( 3.287 -18.832 -0.890) 19.137 15.087 ( -11.520 3.412 -4.369) 12.784 15.236 ( -5.558 4.700 4.053) 8.331 16.274 ( -4.723 4.750 0.437) 6.713 16.576 ( -2.561 4.878 -0.256) 5.516 20.935 ( 0.499 -19.406 1.552) 19.475 21.394 ( 3.105 -12.836 -3.718) 13.720======================= Grid point 615 (306/322) =======================q-point: (-0.15 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.910 ( -11.725 7.611 2.452) 14.192 2.558 ( -9.583 -7.327 1.503) 12.156 2.737 ( -0.050 -0.353 1.024) 1.084 3.114 ( 1.893 -4.346 1.499) 4.972 3.310 ( 3.633 -5.251 -1.292) 6.515 3.411 ( -6.407 -8.977 -0.391) 11.035 3.525 ( 4.180 -4.818 -3.198) 7.136 3.545 ( -2.723 -8.109 -2.973) 9.056 4.064 ( -6.845 -8.361 -4.255) 11.614 4.127 ( 0.877 0.002 4.701) 4.782 4.242 ( -9.404 -5.457 1.035) 10.922 4.362 ( 11.018 5.130 2.478) 12.403 4.506 ( -1.237 -1.853 -1.902) 2.930 4.811 ( 4.781 -0.653 4.207) 6.401 5.184 ( 6.507 -6.491 -0.104) 9.191 5.520 ( 3.053 -6.216 -1.691) 7.129 5.860 ( 12.426 12.409 1.062) 17.593 6.272 ( 1.379 -4.154 -0.353) 4.391 6.719 ( 1.473 -8.154 0.315) 8.291 6.989 ( 5.459 -23.969 -0.214) 24.584 7.411 ( -13.031 1.613 1.257) 13.190 8.119 ( 5.635 9.177 -3.130) 11.215 8.226 ( -7.125 -6.188 2.166) 9.682 9.318 ( -0.355 10.611 -0.940) 10.658 9.462 ( -1.566 5.753 3.066) 6.705 9.520 ( 2.138 10.036 -1.962) 10.447 10.175 ( -1.168 8.904 -0.643) 9.003 10.445 ( 0.894 1.198 -0.063) 1.496 11.634 ( -0.647 -17.804 0.330) 17.818 11.913 ( 6.589 -18.568 -1.620) 19.769 14.985 ( -9.687 0.423 -4.433) 10.662 15.142 ( -4.854 2.440 4.386) 6.982 16.216 ( -4.159 -0.631 0.473) 4.233 16.483 ( -1.854 3.205 -0.237) 3.710 21.254 ( 0.243 -12.614 0.483) 12.626 21.554 ( 1.002 -3.510 -1.314) 3.879======================= Grid point 616 (307/322) =======================q-point: (-0.08 -0.46 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.606 ( -8.410 15.816 1.689) 17.992 2.610 ( -4.094 -2.003 0.985) 4.663 2.720 ( -2.869 0.913 1.265) 3.266 3.164 ( 0.789 -1.176 1.286) 1.913 3.454 ( 2.422 -6.049 -1.804) 6.761 3.510 ( -3.064 -4.009 1.290) 5.208 3.643 ( 1.168 -5.176 -1.012) 5.402 3.685 ( -0.759 -7.363 -3.372) 8.134 4.061 ( -3.136 1.406 0.335) 3.453 4.189 ( 2.056 -2.605 1.082) 3.491 4.292 ( -12.294 -5.337 -2.403) 13.616 4.345 ( 9.042 3.232 2.553) 9.936 4.492 ( 0.375 1.697 -0.094) 1.741 4.899 ( 2.640 -4.395 1.074) 5.238 5.321 ( 5.479 -3.391 1.522) 6.621 5.642 ( 0.471 -5.102 -1.362) 5.302 5.797 ( 13.807 3.076 0.734) 14.165 6.234 ( 0.902 4.205 0.240) 4.307 6.875 ( -0.952 -3.799 0.984) 4.039 7.064 ( -7.191 3.803 0.798) 8.174 7.619 ( 0.406 -14.853 -0.855) 14.883 7.977 ( 2.036 6.111 -2.797) 7.022 8.373 ( -7.562 -12.324 2.124) 14.614 9.121 ( 3.761 10.583 0.324) 11.236 9.339 ( -0.141 6.083 -0.501) 6.105 9.344 ( -0.015 8.704 2.165) 8.969 10.048 ( -0.292 3.089 -1.467) 3.432 10.479 ( 0.425 -3.738 0.046) 3.763 11.921 ( -2.478 -12.249 -0.770) 12.521 12.272 ( 6.688 -13.279 -2.178) 15.027 14.933 ( -6.085 -0.307 -2.969) 6.778 15.096 ( -3.163 0.537 3.069) 4.440 16.227 ( -3.919 -2.427 0.242) 4.616 16.427 ( -0.648 1.741 -0.295) 1.880 21.438 ( -0.029 -6.304 -0.246) 6.308 21.576 ( -0.182 0.530 0.172) 0.586======================= Grid point 625 (308/322) =======================q-point: (-0.38 -0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.751 ( -16.703 -0.000 6.686) 17.991 1.829 ( -21.384 -0.000 4.914) 21.941 2.393 ( 1.213 0.000 -2.229) 2.538 2.399 ( 15.634 0.000 1.443) 15.701 2.664 ( 6.298 0.000 -4.015) 7.469 2.781 ( 6.318 0.000 0.771) 6.365 3.027 ( -31.662 -0.000 -6.564) 32.336 3.438 ( -10.251 -0.000 6.231) 11.996 3.526 ( -0.715 -0.000 4.292) 4.351 3.726 ( -0.259 -0.000 -2.627) 2.639 3.864 ( 2.610 0.000 4.902) 5.554 4.104 ( 1.582 0.000 3.473) 3.816 4.185 ( -2.863 -0.000 1.905) 3.439 4.344 ( 1.094 0.000 -0.843) 1.381 4.725 ( 7.536 0.000 -7.472) 10.612 4.959 ( 16.884 0.000 2.961) 17.142 5.085 ( -2.558 -0.000 -3.841) 4.615 5.492 ( 9.339 0.000 -1.407) 9.444 7.263 ( 5.691 0.000 0.148) 5.693 7.374 ( -7.465 -0.000 7.273) 10.422 8.188 ( 6.445 0.000 4.521) 7.873 8.522 ( -1.927 -0.000 -3.168) 3.708 8.666 ( 2.339 0.000 -2.690) 3.564 8.872 ( -3.432 -0.000 0.039) 3.432 9.718 ( -0.677 -0.000 0.304) 0.742 10.270 ( -1.232 -0.000 -3.433) 3.647 10.503 ( 5.780 0.000 2.755) 6.403 10.627 ( 0.465 0.000 -0.383) 0.603 10.734 ( 2.851 0.000 0.604) 2.914 11.148 ( 3.133 0.000 0.425) 3.162 15.507 ( -5.094 -0.000 6.591) 8.330 15.598 ( -6.729 -0.000 -8.857) 11.124 16.841 ( -4.426 -0.000 -0.730) 4.485 17.125 ( -10.479 -0.000 -8.770) 13.665 19.874 ( 0.073 0.000 0.044) 0.086 20.106 ( 0.056 0.000 -0.029) 0.063======================= Grid point 626 (309/322) =======================q-point: (-0.31 -0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.727 ( -14.812 -5.746 7.536) 17.584 1.880 ( -19.553 -14.493 5.050) 24.857 2.474 ( 3.215 -7.103 -0.812) 7.839 2.526 ( 8.731 -4.914 -1.740) 10.169 2.831 ( 2.413 -9.472 -2.588) 10.111 2.875 ( -16.579 -8.877 -3.597) 19.146 2.934 ( -5.524 -8.787 -1.299) 10.460 3.391 ( -8.083 -3.586 4.079) 9.739 3.594 ( 0.102 -3.736 1.878) 4.183 3.863 ( -6.965 -6.586 3.049) 10.059 4.044 ( 6.523 -15.864 1.402) 17.210 4.169 ( -1.081 -1.686 8.648) 8.877 4.278 ( 1.803 -12.364 -2.188) 12.685 4.413 ( -3.113 -13.034 -2.286) 13.594 4.779 ( 7.325 -1.966 -6.202) 9.797 5.048 ( 2.454 -0.393 -4.471) 5.115 5.103 ( 15.981 -2.097 4.488) 16.732 5.523 ( 8.959 0.836 -2.624) 9.373 7.133 ( -1.611 14.809 5.900) 16.022 7.264 ( 4.687 9.991 -2.349) 11.283 8.072 ( -1.765 15.748 1.675) 15.935 8.305 ( 1.710 8.499 2.849) 9.125 8.628 ( 2.505 4.710 -2.377) 5.840 9.065 ( -4.455 -13.856 -0.417) 14.560 9.841 ( -0.925 -8.125 -1.888) 8.392 10.239 ( -2.374 2.819 -2.579) 4.498 10.354 ( 3.676 9.764 0.957) 10.477 10.731 ( 1.799 1.608 -1.617) 2.905 10.822 ( 3.656 -11.873 1.844) 12.559 11.130 ( 6.052 3.749 3.115) 7.771 15.392 ( -12.562 9.471 -5.437) 16.645 15.456 ( -6.551 5.257 1.913) 8.614 16.741 ( -9.693 10.422 -2.343) 14.425 16.820 ( -8.167 12.837 -1.561) 15.294 20.077 ( 0.572 -18.531 0.810) 18.557 20.460 ( 3.249 -29.520 -4.156) 29.988======================= Grid point 627 (310/322) =======================q-point: (-0.23 -0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.804 ( -12.821 -8.221 6.855) 16.702 2.090 ( -16.671 -15.330 4.718) 23.135 2.623 ( 2.735 -4.678 -0.924) 5.497 2.717 ( 2.372 -12.223 -3.485) 12.930 2.932 ( -18.467 -13.362 -3.164) 23.013 3.064 ( 3.424 -9.358 -1.232) 10.040 3.167 ( 2.493 -11.603 -0.702) 11.889 3.510 ( -5.584 -10.413 0.782) 11.842 3.609 ( 0.469 1.381 -0.646) 1.595 3.949 ( -6.624 -6.250 2.694) 9.497 4.168 ( -2.581 -1.407 7.301) 7.870 4.292 ( -1.943 -5.536 -0.275) 5.873 4.537 ( 12.245 -5.961 1.205) 13.672 4.815 ( -5.427 -12.975 3.076) 14.397 4.882 ( 5.506 -7.383 -4.930) 10.446 5.186 ( 7.078 -21.893 -5.016) 23.549 5.310 ( 7.499 -7.512 1.487) 10.718 5.697 ( 12.353 -19.187 -2.404) 22.946 6.737 ( 3.777 24.858 3.375) 25.369 7.043 ( 8.523 14.911 -2.654) 17.378 7.752 ( -10.095 11.794 2.491) 15.723 8.197 ( -0.150 4.894 4.240) 6.477 8.510 ( 3.168 8.419 -2.027) 9.221 9.287 ( -4.944 -10.729 -1.339) 11.889 9.859 ( -0.733 5.221 -4.026) 6.634 10.007 ( 1.683 16.432 0.476) 16.524 10.348 ( -3.801 -3.921 0.723) 5.508 10.663 ( -1.049 5.990 -4.788) 7.739 11.067 ( 7.943 -8.059 6.612) 13.106 11.204 ( 5.424 -11.146 0.499) 12.405 15.104 ( -16.270 7.459 -6.013) 18.881 15.311 ( -7.305 5.994 4.409) 10.428 16.394 ( -8.950 11.343 -0.004) 14.448 16.660 ( -4.194 5.508 0.072) 6.924 20.516 ( 0.848 -23.320 2.156) 23.435 21.046 ( 5.436 -24.770 -6.915) 26.285======================= Grid point 628 (311/322) =======================q-point: (-0.15 -0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.872 ( -11.647 -3.693 4.703) 13.092 2.284 ( -14.349 -13.080 3.603) 19.748 2.705 ( -0.593 -3.368 -1.264) 3.646 2.971 ( 2.867 -11.438 -2.068) 11.972 3.125 ( -9.847 -13.827 -1.749) 17.065 3.240 ( 2.632 -6.459 -0.376) 6.985 3.370 ( -0.819 -8.532 -1.395) 8.684 3.521 ( 4.630 2.832 -4.265) 6.903 3.766 ( -8.699 -14.885 -1.689) 17.323 4.039 ( -6.290 -6.346 2.569) 9.298 4.180 ( -2.418 0.203 5.934) 6.411 4.386 ( -2.364 -5.842 -0.081) 6.303 4.571 ( 11.919 6.312 0.539) 13.498 4.858 ( -0.076 0.843 4.133) 4.219 5.091 ( 10.017 -7.885 -0.639) 12.763 5.425 ( 3.214 -4.556 -2.078) 5.950 5.847 ( 0.743 -32.035 -1.631) 32.085 6.311 ( 10.119 18.804 -0.109) 21.354 6.372 ( 12.846 -33.649 -0.642) 36.024 6.816 ( 5.950 10.777 -0.248) 12.313 7.477 ( -13.097 10.097 1.986) 16.656 8.133 ( -5.259 0.350 3.026) 6.078 8.341 ( 4.273 10.200 -1.348) 11.140 9.382 ( -5.424 -1.737 -2.661) 6.286 9.661 ( -0.154 12.887 2.435) 13.116 9.734 ( 2.591 11.332 -3.752) 12.214 10.334 ( -2.452 5.191 2.257) 6.169 10.504 ( -2.272 5.716 -3.677) 7.167 11.329 ( 6.207 -13.457 3.761) 15.289 11.557 ( 4.716 -19.854 -1.106) 20.437 14.927 ( -12.939 1.407 -4.127) 13.654 15.173 ( -7.467 3.852 3.877) 9.254 16.215 ( -5.528 3.509 0.423) 6.561 16.539 ( -3.601 4.238 0.094) 5.562 20.947 ( 0.636 -19.032 1.787) 19.126 21.421 ( 3.562 -11.777 -4.610) 13.139======================= Grid point 629 (312/322) =======================q-point: (-0.08 -0.38 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.785 ( -10.490 6.911 2.159) 12.746 2.445 ( -10.052 -9.956 1.868) 14.271 2.735 ( -0.636 0.118 0.184) 0.672 3.145 ( 2.454 -3.787 0.144) 4.515 3.292 ( -7.565 -8.410 2.188) 11.522 3.388 ( 4.544 -8.390 -4.346) 10.484 3.494 ( -3.725 -6.501 -2.941) 8.049 3.573 ( 4.766 -5.178 -3.023) 7.659 3.968 ( -7.790 -10.214 -3.846) 13.409 4.112 ( -10.611 -3.617 1.518) 11.313 4.164 ( 1.884 -0.423 4.014) 4.455 4.473 ( -1.980 -3.333 0.161) 3.881 4.510 ( 10.378 6.070 2.546) 12.289 4.867 ( 3.210 -0.747 3.946) 5.142 5.280 ( 8.333 -5.361 0.687) 9.932 5.535 ( 0.841 -5.610 -1.979) 6.008 6.032 ( 15.943 10.535 0.913) 19.131 6.289 ( 2.065 -3.457 -0.785) 4.103 6.739 ( 1.663 -6.279 0.796) 6.544 7.056 ( 4.823 -13.313 0.380) 14.165 7.272 ( -9.449 -7.177 -1.104) 11.917 8.097 ( -10.571 2.171 0.165) 10.793 8.210 ( 5.551 2.366 0.867) 6.096 9.292 ( -2.928 6.514 -2.951) 7.728 9.462 ( -0.876 7.592 4.628) 8.934 9.541 ( 2.674 9.738 -2.953) 10.522 10.161 ( -0.892 8.683 -0.617) 8.751 10.442 ( -1.355 0.112 -0.242) 1.381 11.638 ( 0.921 -14.749 1.326) 14.837 11.984 ( 6.481 -19.365 -2.363) 20.557 14.864 ( -8.462 -1.474 -3.586) 9.308 15.092 ( -5.734 1.087 3.643) 6.879 16.165 ( -4.674 -0.899 0.270) 4.767 16.457 ( -2.545 2.350 0.141) 3.467 21.259 ( 0.220 -12.231 0.517) 12.244 21.562 ( 1.101 -2.726 -1.479) 3.291======================= Grid point 639 (313/322) =======================q-point: (-0.31 -0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.589 ( -22.374 -0.000 6.428) 23.279 1.601 ( -13.173 -0.000 9.573) 16.284 2.362 ( -3.822 -0.000 -3.757) 5.360 2.514 ( -15.158 -0.000 -5.678) 16.187 2.639 ( -12.185 -0.000 3.861) 12.782 2.745 ( 8.243 0.000 -2.320) 8.563 2.857 ( 6.326 0.000 -0.162) 6.328 3.336 ( -9.840 -0.000 5.567) 11.305 3.531 ( -0.546 -0.000 3.724) 3.764 3.715 ( -0.447 -0.000 -1.945) 1.996 3.916 ( 1.852 0.000 1.078) 2.142 4.151 ( 4.163 0.000 3.791) 5.630 4.165 ( -1.475 -0.000 2.750) 3.120 4.288 ( -6.812 -0.000 -5.311) 8.638 4.804 ( 8.730 0.000 -4.691) 9.911 5.077 ( 6.143 0.000 -1.563) 6.339 5.186 ( 15.243 0.000 4.967) 16.032 5.587 ( 8.316 0.000 -4.524) 9.467 7.284 ( -10.030 -0.000 3.296) 10.558 7.347 ( 8.542 0.000 -0.084) 8.542 8.289 ( 8.393 0.000 1.573) 8.539 8.490 ( -1.158 -0.000 -3.808) 3.980 8.691 ( 1.543 0.000 2.559) 2.988 8.820 ( -5.519 -0.000 0.110) 5.520 9.711 ( -0.665 -0.000 0.628) 0.914 10.235 ( -2.257 -0.000 -5.501) 5.946 10.583 ( 5.440 0.000 0.827) 5.502 10.632 ( 0.508 0.000 -0.586) 0.776 10.776 ( 5.482 0.000 -1.733) 5.750 11.227 ( 9.100 0.000 6.736) 11.322 15.408 ( -16.517 -0.000 -10.457) 19.549 15.478 ( -7.366 -0.000 3.337) 8.087 16.771 ( -7.645 -0.000 -0.363) 7.654 16.932 ( -16.939 -0.000 -7.053) 18.349 19.875 ( 0.107 0.000 0.042) 0.115 20.107 ( 0.080 0.000 -0.020) 0.082======================= Grid point 640 (314/322) =======================q-point: (-0.23 -0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.603 ( -11.066 -5.813 10.452) 16.293 1.670 ( -19.258 -16.461 6.189) 26.080 2.420 ( -31.986 -9.698 -5.607) 33.890 2.461 ( -2.295 -11.419 -3.002) 12.028 2.688 ( 4.768 -3.277 2.727) 6.396 2.899 ( 5.745 -9.132 -1.720) 10.925 2.982 ( 5.034 -8.413 -0.310) 9.809 3.314 ( -7.327 -4.072 3.578) 9.114 3.611 ( 1.181 -4.642 1.961) 5.176 3.791 ( -6.305 -5.677 0.769) 8.519 4.095 ( 1.516 -11.005 -0.259) 11.112 4.177 ( -2.314 -3.729 3.806) 5.810 4.305 ( 1.574 -12.812 -3.908) 13.487 4.355 ( -0.737 -16.347 0.444) 16.369 4.850 ( 8.555 0.003 -3.512) 9.248 5.107 ( 7.845 0.402 -0.071) 7.856 5.293 ( 12.409 -1.956 3.686) 13.092 5.610 ( 8.023 -0.008 -4.709) 9.303 7.104 ( -5.253 12.180 3.377) 13.688 7.339 ( 8.865 7.528 -2.230) 11.843 8.065 ( 0.268 22.563 -1.094) 22.591 8.336 ( 1.374 7.349 3.819) 8.395 8.651 ( 1.907 4.431 0.687) 4.873 9.004 ( -5.582 -13.939 -0.313) 15.018 9.821 ( -1.390 -7.219 -1.952) 7.606 10.195 ( -3.158 1.720 -4.785) 5.986 10.400 ( 3.597 12.136 0.389) 12.664 10.692 ( -5.105 -0.247 -4.938) 7.107 10.919 ( 10.106 -9.085 1.335) 13.655 11.250 ( 11.220 4.217 8.843) 14.895 15.155 ( -22.289 9.338 -11.188) 26.631 15.388 ( -8.223 5.092 6.000) 11.382 16.580 ( -15.340 13.000 -1.253) 20.147 16.735 ( -6.545 5.209 -0.191) 8.367 20.088 ( 0.760 -19.085 1.030) 19.128 20.486 ( 3.683 -31.257 -5.823) 32.007======================= Grid point 641 (315/322) =======================q-point: (-0.15 -0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.701 ( -8.972 -7.564 8.795) 14.665 1.909 ( -16.862 -16.254 5.842) 24.138 2.514 ( -17.867 -13.970 -6.305) 23.540 2.725 ( 0.948 -15.107 -2.745) 15.383 2.814 ( -0.916 -8.490 1.228) 8.627 3.098 ( 2.486 -8.637 -1.049) 9.049 3.192 ( 1.954 -9.716 -0.812) 9.944 3.432 ( -8.074 -11.366 1.297) 14.002 3.633 ( 2.645 3.281 -0.929) 4.316 3.870 ( -7.206 -6.681 0.274) 9.831 4.182 ( 1.497 -1.048 6.264) 6.525 4.254 ( -2.642 -5.266 -2.579) 6.431 4.698 ( 4.457 -16.244 0.811) 16.864 4.721 ( 1.501 -5.558 2.691) 6.355 4.980 ( 8.219 -12.725 -0.925) 15.177 5.237 ( 3.283 -17.006 -1.993) 17.434 5.387 ( 5.672 -1.902 -1.531) 6.175 5.834 ( 11.647 -21.117 -2.388) 24.234 6.789 ( 3.727 18.783 2.504) 19.313 7.148 ( 10.683 16.126 -2.667) 19.527 7.658 ( -6.840 15.780 1.900) 17.303 8.189 ( -3.604 7.091 3.475) 8.680 8.545 ( 3.365 7.829 0.817) 8.560 9.223 ( -5.019 -10.473 -1.584) 11.720 9.834 ( -1.294 4.644 -4.055) 6.299 10.019 ( 0.218 14.709 -0.982) 14.744 10.309 ( -3.272 -2.431 0.158) 4.079 10.612 ( -4.426 5.156 -5.247) 8.585 11.178 ( 7.210 -11.230 2.936) 13.665 11.299 ( 9.497 -4.652 5.666) 11.997 14.882 ( -17.607 3.804 -4.679) 18.611 15.225 ( -9.625 5.962 3.910) 11.978 16.290 ( -8.715 8.071 0.466) 11.888 16.606 ( -4.932 4.858 0.115) 6.924 20.534 ( 0.952 -23.291 2.668) 23.463 21.087 ( 5.620 -24.627 -8.808) 26.752======================= Grid point 642 (316/322) =======================q-point: (-0.08 -0.31 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.772 ( -8.075 -2.387 5.413) 10.010 2.133 ( -13.162 -14.981 4.203) 20.380 2.664 ( -5.047 -7.638 -3.066) 9.655 2.971 ( -2.091 -11.026 -2.496) 11.497 3.051 ( -1.434 -14.024 -0.261) 14.100 3.256 ( 0.203 -6.739 -1.788) 6.975 3.358 ( -0.447 -6.851 -1.269) 6.981 3.560 ( 3.873 1.575 -3.467) 5.431 3.650 ( -10.891 -13.357 -0.653) 17.247 3.973 ( -4.621 -6.802 1.217) 8.312 4.194 ( 1.488 1.285 4.876) 5.257 4.357 ( -2.114 -6.153 -0.594) 6.533 4.697 ( 7.271 5.888 2.533) 9.693 4.878 ( 2.797 -2.014 3.476) 4.896 5.206 ( 8.603 -6.975 0.538) 11.088 5.439 ( 0.565 -4.201 -1.840) 4.621 5.849 ( 0.314 -31.828 -2.037) 31.895 6.393 ( 6.266 -5.576 -3.100) 8.942 6.566 ( 17.548 -11.402 2.310) 21.054 6.891 ( 7.390 12.894 -0.640) 14.875 7.340 ( -11.004 12.303 1.247) 16.553 8.053 ( -9.551 3.059 1.902) 10.208 8.400 ( 5.664 9.189 1.305) 10.873 9.311 ( -5.226 -1.629 -2.843) 6.169 9.658 ( -1.264 10.994 1.614) 11.183 9.750 ( 2.033 11.484 -3.965) 12.318 10.312 ( -2.503 3.532 2.398) 4.949 10.452 ( -4.077 4.682 -4.308) 7.556 11.417 ( 6.454 -9.576 4.460) 12.379 11.612 ( 5.023 -20.048 -1.198) 20.703 14.778 ( -10.096 -1.109 -2.435) 10.445 15.089 ( -8.520 2.589 2.698) 9.304 16.152 ( -5.250 2.557 0.294) 5.847 16.496 ( -3.778 3.550 0.257) 5.191 20.960 ( 0.515 -18.558 2.085) 18.681 21.446 ( 3.421 -10.852 -5.376) 12.585======================= Grid point 653 (317/322) =======================q-point: (-0.23 -0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.355 ( -21.294 -0.000 7.757) 22.663 1.504 ( -10.063 -0.000 13.165) 16.571 2.088 ( -37.800 -0.000 -0.928) 37.811 2.298 ( -4.376 -0.000 -4.800) 6.495 2.715 ( 6.446 0.000 2.797) 7.026 2.828 ( 6.387 0.000 -0.493) 6.406 2.924 ( 5.449 0.000 -1.200) 5.579 3.246 ( -8.240 -0.000 4.280) 9.285 3.536 ( -0.434 -0.000 3.094) 3.124 3.705 ( -0.401 -0.000 -1.378) 1.435 3.875 ( -8.235 -0.000 -5.065) 9.668 4.127 ( -4.392 -0.000 1.578) 4.667 4.189 ( -0.535 -0.000 -4.701) 4.732 4.282 ( 9.394 0.000 2.720) 9.780 4.910 ( 11.261 0.000 -1.815) 11.407 5.159 ( 6.208 0.000 2.874) 6.841 5.350 ( 10.165 0.000 3.579) 10.777 5.659 ( 6.841 0.000 -6.388) 9.359 7.179 ( -8.780 -0.000 2.355) 9.090 7.456 ( 10.066 0.000 -0.230) 10.069 8.371 ( 6.001 0.000 -5.997) 8.484 8.481 ( 0.717 0.000 0.206) 0.746 8.714 ( 0.369 0.000 5.551) 5.563 8.746 ( -7.063 -0.000 0.137) 7.065 9.707 ( -0.425 -0.000 0.858) 0.958 10.181 ( -3.761 -0.000 -7.884) 8.735 10.597 ( -2.870 -0.000 -2.538) 3.831 10.635 ( 0.437 0.000 -0.717) 0.840 10.878 ( 13.214 0.000 -2.557) 13.460 11.404 ( 15.588 0.000 10.856) 18.996 15.096 ( -27.987 -0.000 -15.569) 32.025 15.404 ( -9.391 -0.000 7.330) 11.913 16.623 ( -18.031 -0.000 -1.105) 18.065 16.752 ( -9.490 -0.000 -1.607) 9.625 19.876 ( 0.114 0.000 0.041) 0.121 20.108 ( 0.087 0.000 -0.014) 0.088======================= Grid point 654 (318/322) =======================q-point: (-0.15 -0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.476 ( -17.330 -17.475 7.364) 25.689 1.531 ( -8.224 -6.826 13.742) 17.409 2.026 ( -29.752 -14.786 -2.213) 33.297 2.422 ( -2.388 -13.684 -3.457) 14.315 2.752 ( 3.083 -1.456 1.394) 3.683 2.952 ( 3.700 -7.414 -0.372) 8.294 3.028 ( 2.690 -7.222 -1.063) 7.779 3.238 ( -6.943 -3.990 2.318) 8.337 3.629 ( 0.695 -5.344 2.196) 5.819 3.717 ( -5.723 -4.028 -3.404) 7.782 4.070 ( -4.208 -15.726 -1.946) 16.395 4.156 ( 0.202 -5.171 -2.364) 5.689 4.290 ( -0.608 -12.828 0.904) 12.874 4.422 ( 7.513 -12.387 0.714) 14.505 4.965 ( 11.561 1.024 -1.494) 11.702 5.190 ( 4.674 0.268 3.531) 5.864 5.410 ( 7.128 -0.023 0.973) 7.194 5.680 ( 5.733 -1.942 -4.493) 7.539 7.053 ( -4.353 8.398 2.840) 9.877 7.445 ( 9.800 7.457 -1.328) 12.386 8.070 ( 1.696 24.831 -2.940) 25.062 8.348 ( -1.449 9.072 2.496) 9.520 8.679 ( 1.939 3.905 3.269) 5.449 8.939 ( -5.148 -14.465 -0.222) 15.356 9.799 ( -1.414 -5.963 -1.575) 6.328 10.131 ( -4.914 1.045 -6.972) 8.594 10.436 ( 2.376 12.776 -0.040) 12.995 10.601 ( -7.325 -0.024 -4.572) 8.635 11.048 ( 11.844 -6.758 -0.803) 13.660 11.427 ( 12.524 6.350 10.451) 17.504 14.841 ( -23.993 4.538 -7.419) 25.521 15.292 ( -11.548 5.673 5.608) 14.035 16.403 ( -14.099 8.862 0.632) 16.665 16.661 ( -5.948 3.682 -0.179) 6.998 20.101 ( 0.739 -19.769 1.316) 19.827 20.508 ( 3.474 -32.820 -7.296) 33.800======================= Grid point 655 (319/322) =======================q-point: (-0.08 -0.23 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.648 ( -5.718 -7.798 10.340) 14.157 1.744 ( -13.703 -15.776 7.230) 22.112 2.285 ( -15.820 -22.490 -6.037) 28.152 2.728 ( 1.107 -16.947 -2.175) 17.122 2.826 ( 0.643 -4.912 0.817) 5.021 3.111 ( 0.033 -7.372 -1.065) 7.449 3.191 ( -2.757 -9.003 -1.173) 9.489 3.336 ( -7.124 -9.685 0.655) 12.041 3.657 ( 1.989 2.876 -0.635) 3.554 3.798 ( -4.269 -7.666 -2.236) 9.055 4.225 ( 0.035 -5.760 2.116) 6.136 4.242 ( 4.073 -0.136 1.175) 4.241 4.628 ( -5.676 -15.622 0.136) 16.621 4.869 ( 10.047 -12.528 2.855) 16.311 5.061 ( 6.520 -13.671 -0.962) 15.176 5.251 ( 0.516 -7.494 0.546) 7.532 5.438 ( 3.992 -2.156 -2.296) 5.084 5.934 ( 6.399 -22.128 -2.932) 23.220 6.843 ( 4.117 12.163 3.047) 13.197 7.267 ( 10.405 15.995 -2.123) 19.199 7.608 ( -2.452 20.555 0.969) 20.724 8.134 ( -7.143 9.483 2.400) 12.112 8.594 ( 4.099 6.824 2.599) 8.374 9.164 ( -4.019 -9.970 -1.868) 10.911 9.805 ( -1.664 4.188 -2.980) 5.403 10.001 ( -2.302 11.283 -2.540) 11.793 10.273 ( -2.761 0.514 -0.471) 2.847 10.542 ( -4.544 3.415 -3.960) 6.928 11.255 ( 5.623 -10.767 0.542) 12.159 11.435 ( 8.901 -0.982 7.263) 11.530 14.697 ( -11.387 -0.562 -0.949) 11.441 15.110 ( -11.563 5.206 2.140) 12.860 16.200 ( -6.768 5.522 0.585) 8.755 16.550 ( -4.374 4.213 0.042) 6.073 20.553 ( 0.701 -23.211 3.198) 23.441 21.119 ( 4.788 -24.647 -10.175) 27.092======================= Grid point 667 (320/322) =======================q-point: (-0.15 -0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.151 ( -17.454 -0.000 8.650) 19.480 1.399 ( -19.436 -0.000 14.799) 24.429 1.741 ( -17.497 -0.000 4.830) 18.151 2.236 ( -3.439 -0.000 -5.236) 6.265 2.748 ( -2.579 -0.000 0.877) 2.724 2.889 ( 3.944 0.000 1.009) 4.071 2.975 ( 3.944 0.000 -1.987) 4.416 3.180 ( -4.217 -0.000 3.268) 5.335 3.540 ( -0.441 -0.000 2.587) 2.624 3.698 ( -0.101 -0.000 -1.092) 1.097 3.728 ( -10.924 -0.000 -9.044) 14.182 4.100 ( -0.949 -0.000 0.338) 1.007 4.184 ( 1.760 0.000 -2.187) 2.807 4.409 ( 9.101 0.000 0.931) 9.149 5.036 ( 9.790 0.000 -1.844) 9.962 5.227 ( 4.008 0.000 5.995) 7.211 5.455 ( 6.898 0.000 1.923) 7.161 5.697 ( 2.584 0.000 -6.180) 6.698 7.106 ( -4.889 -0.000 3.402) 5.956 7.573 ( 9.574 0.000 -0.251) 9.578 8.394 ( 2.768 0.000 -9.381) 9.781 8.494 ( -0.119 -0.000 2.123) 2.126 8.661 ( -7.274 -0.000 0.127) 7.275 8.738 ( 0.904 0.000 5.963) 6.031 9.706 ( -0.117 -0.000 0.920) 0.927 10.093 ( -6.724 -0.000 -9.537) 11.669 10.526 ( -6.548 -0.000 -2.852) 7.142 10.637 ( 0.284 0.000 -0.744) 0.796 11.050 ( 16.785 0.000 -2.467) 16.965 11.613 ( 12.549 0.000 6.788) 14.267 14.729 ( -24.329 -0.000 -6.220) 25.112 15.292 ( -13.847 -0.000 6.602) 15.340 16.412 ( -16.205 -0.000 1.248) 16.253 16.664 ( -5.978 -0.000 -0.530) 6.001 19.878 ( 0.092 0.000 0.041) 0.100 20.109 ( 0.076 0.000 -0.013) 0.078======================= Grid point 668 (321/322) =======================q-point: (-0.08 -0.15 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.318 ( -13.641 -16.270 8.624) 22.916 1.465 ( -11.674 -16.401 13.494) 24.236 1.777 ( -10.366 -11.564 1.440) 15.597 2.391 ( -1.052 -15.771 -3.022) 16.092 2.748 ( -4.600 -2.962 -0.811) 5.531 2.977 ( 0.343 -5.777 0.621) 5.820 3.032 ( -0.273 -4.219 -1.714) 4.562 3.190 ( -1.823 -3.213 1.532) 3.999 3.622 ( -3.760 -3.784 -3.205) 6.223 3.659 ( -0.630 -6.542 -0.659) 6.605 4.036 ( 0.002 -20.563 -1.383) 20.609 4.159 ( 0.563 -6.994 -1.412) 7.157 4.298 ( 1.637 -10.725 0.964) 10.892 4.490 ( 2.707 -8.467 -1.279) 8.980 5.077 ( 7.406 0.568 -1.508) 7.579 5.257 ( 5.833 0.750 5.292) 7.912 5.481 ( 5.073 2.134 0.073) 5.504 5.699 ( -0.440 -3.990 -3.969) 5.645 7.029 ( -1.614 5.952 4.039) 7.372 7.547 ( 7.716 7.845 -0.689) 11.025 8.086 ( 2.667 24.404 -2.888) 24.719 8.312 ( -5.481 10.673 0.985) 12.039 8.716 ( 2.248 3.350 4.003) 5.683 8.890 ( -2.657 -15.094 -0.748) 15.345 9.779 ( -1.234 -4.607 -0.865) 4.847 10.035 ( -7.407 -0.057 -7.580) 10.598 10.452 ( 0.121 10.736 0.078) 10.737 10.511 ( -5.173 1.775 -3.062) 6.268 11.187 ( 12.140 -2.856 -0.950) 12.507 11.564 ( 4.731 7.210 6.723) 10.934 14.622 ( -9.093 -0.696 1.229) 9.202 15.150 ( -15.229 5.512 3.285) 16.526 16.268 ( -9.198 5.199 1.200) 10.634 16.599 ( -4.388 3.050 -0.279) 5.351 20.113 ( 0.461 -20.448 1.588) 20.515 20.520 ( 2.658 -33.766 -8.084) 34.821======================= Grid point 681 (322/322) =======================q-point: (-0.08 -0.08 0.43)Boundary mean free path (millimeter): 1000.000Mass variance parameters: 1.64e-04 1.64e-04 2.32e-04 2.32e-04 3.09e-04 3.09e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322Calculating Gamma of ph-isotope with tetrahedron methodFrequency group velocity (x, y, z) |gv| 1.014 ( -9.931 -0.000 8.508) 13.077 1.171 ( -20.205 -0.000 11.304) 23.152 1.709 ( 2.226 0.000 12.360) 12.559 2.189 ( -1.778 -0.000 -5.107) 5.407 2.664 ( -9.424 -0.000 -3.438) 10.031 2.927 ( 1.723 0.000 2.071) 2.694 3.002 ( 1.918 0.000 -2.362) 3.043 3.175 ( 0.862 0.000 3.242) 3.355 3.541 ( -0.597 -0.000 2.331) 2.407 3.598 ( -6.650 -0.000 -6.985) 9.644 3.696 ( 0.413 0.000 -1.173) 1.244 4.092 ( -0.911 -0.000 0.752) 1.181 4.222 ( 5.866 0.000 -1.908) 6.169 4.458 ( -1.502 -0.000 -1.922) 2.439 5.115 ( 5.392 0.000 0.223) 5.396 5.311 ( 6.686 0.000 3.867) 7.724 5.526 ( 4.033 0.000 1.475) 4.295 5.678 ( -2.088 -0.000 -5.237) 5.638 7.083 ( -1.881 -0.000 4.935) 5.281 7.667 ( 6.127 0.000 -0.121) 6.128 8.381 ( -1.177 -0.000 -6.281) 6.390 8.486 ( -1.584 -0.000 2.205) 2.715 8.587 ( -4.986 -0.000 0.076) 4.987 8.774 ( 2.963 0.000 2.701) 4.010 9.709 ( 0.120 0.000 0.775) 0.784 9.969 ( -9.122 -0.000 -7.533) 11.831 10.451 ( -4.384 -0.000 -1.618) 4.673 10.637 ( 0.095 0.000 -0.655) 0.662 11.244 ( 16.826 0.000 -1.092) 16.862 11.671 ( -5.357 -0.000 -0.117) 5.359 14.601 ( 5.015 0.000 5.010) 7.088 15.118 ( -18.273 -0.000 3.388) 18.585 16.272 ( -8.135 -0.000 1.689) 8.309 16.607 ( -3.526 -0.000 -0.437) 3.553 19.879 ( 0.046 0.000 0.042) 0.062 20.110 ( 0.051 0.000 -0.018) 0.054=================== 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 3/42588 10.0 1284.194 520.526 442.006 0.000 101.056 0.000 3/42588 20.0 354.239 204.526 120.484 0.000 18.496 0.000 3/42588 30.0 120.916 78.960 36.969 0.000 5.570 0.000 3/42588 40.0 60.917 42.130 17.169 0.000 2.442 0.000 3/42588 50.0 38.338 27.525 10.257 0.000 1.450 0.000 3/42588 60.0 27.363 20.202 7.091 0.000 1.025 0.000 3/42588 70.0 21.078 15.901 5.356 0.000 0.799 0.000 3/42588 80.0 17.069 13.098 4.285 0.000 0.659 0.000 3/42588 90.0 14.313 11.135 3.565 0.000 0.563 0.000 3/42588 100.0 12.314 9.691 3.052 0.000 0.493 0.000 3/42588 110.0 10.805 8.588 2.670 0.000 0.440 0.000 3/42588 120.0 9.629 7.723 2.375 0.000 0.397 0.000 3/42588 130.0 8.689 7.028 2.141 0.000 0.363 0.000 3/42588 140.0 7.921 6.461 1.952 0.000 0.334 0.000 3/42588 150.0 7.284 5.991 1.796 0.000 0.310 0.000 3/42588 160.0 6.746 5.596 1.664 0.000 0.289 0.000 3/42588 170.0 6.286 5.260 1.553 0.000 0.271 0.000 3/42588 180.0 5.889 4.971 1.457 0.000 0.255 0.000 3/42588 190.0 5.541 4.721 1.373 0.000 0.241 0.000 3/42588 200.0 5.235 4.501 1.300 0.000 0.229 0.000 3/42588 210.0 4.963 4.307 1.235 0.000 0.218 0.000 3/42588 220.0 4.719 4.133 1.177 0.000 0.207 0.000 3/42588 230.0 4.500 3.977 1.125 0.000 0.198 0.000 3/42588 240.0 4.301 3.836 1.078 0.000 0.190 0.000 3/42588 250.0 4.120 3.707 1.035 0.000 0.182 0.000 3/42588 260.0 3.955 3.589 0.996 0.000 0.175 0.000 3/42588 270.0 3.803 3.480 0.960 0.000 0.168 0.000 3/42588 280.0 3.662 3.379 0.926 0.000 0.162 0.000 3/42588 290.0 3.532 3.285 0.896 0.000 0.156 0.000 3/42588 300.0 3.412 3.197 0.867 0.000 0.151 0.000 3/42588 310.0 3.299 3.114 0.840 0.000 0.146 0.000 3/42588 320.0 3.194 3.037 0.815 0.000 0.141 0.000 3/42588 330.0 3.096 2.963 0.792 0.000 0.137 0.000 3/42588 340.0 3.004 2.893 0.770 0.000 0.133 0.000 3/42588 350.0 2.917 2.827 0.749 0.000 0.129 0.000 3/42588 360.0 2.836 2.764 0.729 0.000 0.125 0.000 3/42588 370.0 2.758 2.704 0.711 0.000 0.122 0.000 3/42588 380.0 2.685 2.647 0.693 0.000 0.118 0.000 3/42588 390.0 2.616 2.592 0.676 0.000 0.115 0.000 3/42588 400.0 2.551 2.539 0.660 0.000 0.112 0.000 3/42588 410.0 2.488 2.489 0.645 0.000 0.110 0.000 3/42588 420.0 2.429 2.440 0.631 0.000 0.107 0.000 3/42588 430.0 2.373 2.394 0.617 0.000 0.104 0.000 3/42588 440.0 2.319 2.349 0.604 0.000 0.102 0.000 3/42588 450.0 2.267 2.306 0.591 0.000 0.100 0.000 3/42588 460.0 2.218 2.264 0.579 0.000 0.097 0.000 3/42588 470.0 2.171 2.224 0.567 0.000 0.095 0.000 3/42588 480.0 2.126 2.185 0.556 0.000 0.093 0.000 3/42588 490.0 2.083 2.148 0.545 0.000 0.091 0.000 3/42588 500.0 2.041 2.112 0.535 0.000 0.089 0.000 3/42588 510.0 2.001 2.076 0.525 0.000 0.088 0.000 3/42588 520.0 1.963 2.043 0.516 0.000 0.086 0.000 3/42588 530.0 1.926 2.010 0.506 0.000 0.084 0.000 3/42588 540.0 1.891 1.978 0.497 0.000 0.083 0.000 3/42588 550.0 1.856 1.947 0.489 0.000 0.081 0.000 3/42588 560.0 1.823 1.917 0.481 0.000 0.080 0.000 3/42588 570.0 1.792 1.888 0.473 0.000 0.078 0.000 3/42588 580.0 1.761 1.859 0.465 0.000 0.077 0.000 3/42588 590.0 1.731 1.832 0.457 0.000 0.076 0.000 3/42588 600.0 1.702 1.805 0.450 0.000 0.074 0.000 3/42588 610.0 1.675 1.779 0.443 0.000 0.073 0.000 3/42588 620.0 1.648 1.754 0.436 0.000 0.072 0.000 3/42588 630.0 1.622 1.730 0.430 0.000 0.071 0.000 3/42588 640.0 1.597 1.706 0.423 0.000 0.070 0.000 3/42588 650.0 1.572 1.682 0.417 0.000 0.068 0.000 3/42588 660.0 1.549 1.660 0.411 0.000 0.067 0.000 3/42588 670.0 1.526 1.638 0.405 0.000 0.066 0.000 3/42588 680.0 1.503 1.616 0.399 0.000 0.065 0.000 3/42588 690.0 1.482 1.595 0.394 0.000 0.064 0.000 3/42588 700.0 1.461 1.575 0.388 0.000 0.063 0.000 3/42588 710.0 1.440 1.555 0.383 0.000 0.063 0.000 3/42588 720.0 1.420 1.535 0.378 0.000 0.062 0.000 3/42588 730.0 1.401 1.516 0.373 0.000 0.061 0.000 3/42588 740.0 1.382 1.498 0.368 0.000 0.060 0.000 3/42588 750.0 1.364 1.480 0.363 0.000 0.059 0.000 3/42588 760.0 1.346 1.462 0.359 0.000 0.058 0.000 3/42588 770.0 1.328 1.445 0.354 0.000 0.058 0.000 3/42588 780.0 1.311 1.428 0.350 0.000 0.057 0.000 3/42588 790.0 1.295 1.411 0.346 0.000 0.056 0.000 3/42588 800.0 1.279 1.395 0.341 0.000 0.055 0.000 3/42588 810.0 1.263 1.379 0.337 0.000 0.055 0.000 3/42588 820.0 1.248 1.364 0.333 0.000 0.054 0.000 3/42588 830.0 1.233 1.349 0.329 0.000 0.053 0.000 3/42588 840.0 1.218 1.334 0.326 0.000 0.053 0.000 3/42588 850.0 1.204 1.319 0.322 0.000 0.052 0.000 3/42588 860.0 1.190 1.305 0.318 0.000 0.051 0.000 3/42588 870.0 1.176 1.291 0.315 0.000 0.051 0.000 3/42588 880.0 1.163 1.278 0.311 0.000 0.050 0.000 3/42588 890.0 1.150 1.264 0.308 0.000 0.050 0.000 3/42588 900.0 1.137 1.251 0.305 0.000 0.049 0.000 3/42588 910.0 1.125 1.239 0.301 0.000 0.049 0.000 3/42588 920.0 1.113 1.226 0.298 0.000 0.048 0.000 3/42588 930.0 1.101 1.214 0.295 0.000 0.048 0.000 3/42588 940.0 1.089 1.202 0.292 0.000 0.047 0.000 3/42588 950.0 1.078 1.190 0.289 0.000 0.047 0.000 3/42588 960.0 1.067 1.178 0.286 0.000 0.046 0.000 3/42588 970.0 1.056 1.167 0.283 0.000 0.046 0.000 3/42588 980.0 1.045 1.156 0.280 0.000 0.045 0.000 3/42588 990.0 1.035 1.145 0.278 0.000 0.045 0.000 3/42588 1000.0 1.024 1.134 0.275 0.000 0.044 0.000 3/42588Thermal conductivity related properties were written into "kappa-m13137.hdf5".Summary of calculation was written in "phono3py.yaml".-------------------------[time 2026-01-08 14:33:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|