----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 17:38:03]------------------------- Compiled with OpenMP support (max 32 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 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: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.059344490004908 -4.984078169999999 0.000000000000000 b 3.059344490004908 4.984078169999999 0.000000000000000 c -0.148020203067836 0.000000000000000 6.278876035148802 Atomic positions (fractional): *1 Sr 0.81017979525795 0.18982020474205 0.50000000000000 87.620 2 Sr 0.18982020474205 0.81017979525795 0.50000000000000 87.620 *3 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 *4 Li 0.18378076978013 0.54110136294319 0.11979045123572 6.941 5 Li 0.81621923021987 0.45889863705681 0.88020954876428 6.941 6 Li 0.45889863705681 0.81621923021987 0.88020954876428 6.941 7 Li 0.54110136294319 0.18378076978013 0.11979045123572 6.941 *8 Ge 0.61299435160687 0.61299435160687 0.32070738554275 72.640 9 Ge 0.38700564839313 0.38700564839313 0.67929261445725 72.640 *10 N 0.45145819213681 0.13860977033588 0.80174471883834 14.007 11 N 0.54854180786319 0.86139022966412 0.19825528116166 14.007 *12 N 0.29951212497830 0.29951212497830 0.36766558163825 14.007 13 N 0.70048787502170 0.70048787502170 0.63233441836175 14.007 14 N 0.13860977033588 0.45145819213681 0.80174471883834 14.007 15 N 0.86139022966412 0.54854180786319 0.19825528116166 14.007 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.118688980009815 0.000000000000000 0.000000000000000 b 0.000000000000000 9.968156339999998 0.000000000000000 c -0.148020203067836 0.000000000000000 6.278876035148802 Atomic positions (fractional): *1 Sr 0.50000000000000 0.68982020474205 0.50000000000000 87.620 > 1 2 Sr 0.50000000000000 0.31017979525795 0.50000000000000 87.620 > 2 *3 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 > 3 4 Sr 0.00000000000000 0.18982020474205 0.50000000000000 87.620 > 1 5 Sr 0.00000000000000 0.81017979525795 0.50000000000000 87.620 > 2 6 Sr 0.50000000000000 0.50000000000000 0.00000000000000 87.620 > 3 *7 Li 0.36244106636166 0.17866029658153 0.11979045123572 6.941 > 4 8 Li 0.63755893363834 0.82133970341847 0.88020954876428 6.941 > 5 9 Li 0.63755893363834 0.17866029658153 0.88020954876428 6.941 > 6 10 Li 0.36244106636166 0.82133970341847 0.11979045123572 6.941 > 7 11 Li 0.86244106636166 0.67866029658153 0.11979045123572 6.941 > 4 12 Li 0.13755893363834 0.32133970341847 0.88020954876428 6.941 > 5 13 Li 0.13755893363834 0.67866029658153 0.88020954876428 6.941 > 6 14 Li 0.86244106636166 0.32133970341847 0.11979045123572 6.941 > 7 *15 Ge 0.61299435160687 0.00000000000000 0.32070738554275 72.640 > 8 16 Ge 0.38700564839313 0.00000000000000 0.67929261445725 72.640 > 9 17 Ge 0.11299435160687 0.50000000000000 0.32070738554275 72.640 > 8 18 Ge 0.88700564839313 0.50000000000000 0.67929261445725 72.640 > 9 *19 N 0.29503398123635 0.84357578909953 0.80174471883834 14.007 > 10 20 N 0.70496601876365 0.15642421090047 0.19825528116166 14.007 > 11 *21 N 0.29951212497830 0.00000000000000 0.36766558163825 14.007 > 12 22 N 0.70048787502170 0.00000000000000 0.63233441836175 14.007 > 13 23 N 0.29503398123635 0.15642421090047 0.80174471883834 14.007 > 14 24 N 0.70496601876365 0.84357578909953 0.19825528116166 14.007 > 15 25 N 0.79503398123635 0.34357578909953 0.80174471883834 14.007 > 10 26 N 0.20496601876365 0.65642421090047 0.19825528116166 14.007 > 11 27 N 0.79951212497830 0.50000000000000 0.36766558163825 14.007 > 12 28 N 0.20048787502170 0.50000000000000 0.63233441836175 14.007 > 13 29 N 0.79503398123635 0.65642421090047 0.80174471883834 14.007 > 14 30 N 0.20496601876365 0.34357578909953 0.19825528116166 14.007 > 15 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.237377960019630 0.000000000000000 0.000000000000000 b 0.000000000000000 9.968156339999998 0.000000000000000 c -0.296040406135672 0.000000000000000 12.557752070297605 Atomic positions (fractional): *1 Sr 0.25000000000000 0.68982020474205 0.25000000000000 87.620 > 1 2 Sr 0.75000000000000 0.68982020474205 0.25000000000000 87.620 > 1 3 Sr 0.25000000000000 0.68982020474205 0.75000000000000 87.620 > 1 4 Sr 0.75000000000000 0.68982020474205 0.75000000000000 87.620 > 1 5 Sr 0.25000000000000 0.31017979525795 0.25000000000000 87.620 > 2 6 Sr 0.75000000000000 0.31017979525795 0.25000000000000 87.620 > 2 7 Sr 0.25000000000000 0.31017979525795 0.75000000000000 87.620 > 2 8 Sr 0.75000000000000 0.31017979525795 0.75000000000000 87.620 > 2 *9 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 > 3 10 Sr 0.50000000000000 0.00000000000000 0.00000000000000 87.620 > 3 11 Sr 0.00000000000000 0.00000000000000 0.50000000000000 87.620 > 3 12 Sr 0.50000000000000 0.00000000000000 0.50000000000000 87.620 > 3 13 Sr 0.00000000000000 0.18982020474205 0.25000000000000 87.620 > 1 14 Sr 0.50000000000000 0.18982020474205 0.25000000000000 87.620 > 1 15 Sr 0.00000000000000 0.18982020474205 0.75000000000000 87.620 > 1 16 Sr 0.50000000000000 0.18982020474205 0.75000000000000 87.620 > 1 17 Sr 0.00000000000000 0.81017979525795 0.25000000000000 87.620 > 2 18 Sr 0.50000000000000 0.81017979525795 0.25000000000000 87.620 > 2 19 Sr 0.00000000000000 0.81017979525795 0.75000000000000 87.620 > 2 20 Sr 0.50000000000000 0.81017979525795 0.75000000000000 87.620 > 2 21 Sr 0.25000000000000 0.50000000000000 0.00000000000000 87.620 > 3 22 Sr 0.75000000000000 0.50000000000000 0.00000000000000 87.620 > 3 23 Sr 0.25000000000000 0.50000000000000 0.50000000000000 87.620 > 3 24 Sr 0.75000000000000 0.50000000000000 0.50000000000000 87.620 > 3 *25 Li 0.18122053318083 0.17866029658153 0.05989522561786 6.941 > 4 26 Li 0.68122053318083 0.17866029658153 0.05989522561786 6.941 > 4 27 Li 0.18122053318083 0.17866029658153 0.55989522561786 6.941 > 4 28 Li 0.68122053318083 0.17866029658153 0.55989522561786 6.941 > 4 29 Li 0.31877946681917 0.82133970341847 0.44010477438214 6.941 > 5 30 Li 0.81877946681917 0.82133970341847 0.44010477438214 6.941 > 5 31 Li 0.31877946681917 0.82133970341847 0.94010477438214 6.941 > 5 32 Li 0.81877946681917 0.82133970341847 0.94010477438214 6.941 > 5 33 Li 0.31877946681917 0.17866029658153 0.44010477438214 6.941 > 6 34 Li 0.81877946681917 0.17866029658153 0.44010477438214 6.941 > 6 35 Li 0.31877946681917 0.17866029658153 0.94010477438214 6.941 > 6 36 Li 0.81877946681917 0.17866029658153 0.94010477438214 6.941 > 6 37 Li 0.18122053318083 0.82133970341847 0.05989522561786 6.941 > 7 38 Li 0.68122053318083 0.82133970341847 0.05989522561786 6.941 > 7 39 Li 0.18122053318083 0.82133970341847 0.55989522561786 6.941 > 7 40 Li 0.68122053318083 0.82133970341847 0.55989522561786 6.941 > 7 41 Li 0.43122053318083 0.67866029658153 0.05989522561786 6.941 > 4 42 Li 0.93122053318083 0.67866029658153 0.05989522561786 6.941 > 4 43 Li 0.43122053318083 0.67866029658153 0.55989522561786 6.941 > 4 44 Li 0.93122053318083 0.67866029658153 0.55989522561786 6.941 > 4 45 Li 0.06877946681917 0.32133970341847 0.44010477438214 6.941 > 5 46 Li 0.56877946681917 0.32133970341847 0.44010477438214 6.941 > 5 47 Li 0.06877946681917 0.32133970341847 0.94010477438214 6.941 > 5 48 Li 0.56877946681917 0.32133970341847 0.94010477438214 6.941 > 5 49 Li 0.06877946681917 0.67866029658153 0.44010477438214 6.941 > 6 50 Li 0.56877946681917 0.67866029658153 0.44010477438214 6.941 > 6 51 Li 0.06877946681917 0.67866029658153 0.94010477438214 6.941 > 6 52 Li 0.56877946681917 0.67866029658153 0.94010477438214 6.941 > 6 53 Li 0.43122053318083 0.32133970341847 0.05989522561786 6.941 > 7 54 Li 0.93122053318083 0.32133970341847 0.05989522561786 6.941 > 7 55 Li 0.43122053318083 0.32133970341847 0.55989522561786 6.941 > 7 56 Li 0.93122053318083 0.32133970341847 0.55989522561786 6.941 > 7 *57 Ge 0.30649717580343 0.00000000000000 0.16035369277138 72.640 > 8 58 Ge 0.80649717580343 0.00000000000000 0.16035369277138 72.640 > 8 59 Ge 0.30649717580343 0.00000000000000 0.66035369277138 72.640 > 8 60 Ge 0.80649717580343 0.00000000000000 0.66035369277138 72.640 > 8 61 Ge 0.19350282419657 0.00000000000000 0.33964630722862 72.640 > 9 62 Ge 0.69350282419657 0.00000000000000 0.33964630722862 72.640 > 9 63 Ge 0.19350282419657 0.00000000000000 0.83964630722862 72.640 > 9 64 Ge 0.69350282419657 0.00000000000000 0.83964630722862 72.640 > 9 65 Ge 0.05649717580343 0.50000000000000 0.16035369277138 72.640 > 8 66 Ge 0.55649717580343 0.50000000000000 0.16035369277138 72.640 > 8 67 Ge 0.05649717580343 0.50000000000000 0.66035369277138 72.640 > 8 68 Ge 0.55649717580343 0.50000000000000 0.66035369277138 72.640 > 8 69 Ge 0.44350282419657 0.50000000000000 0.33964630722862 72.640 > 9 70 Ge 0.94350282419657 0.50000000000000 0.33964630722862 72.640 > 9 71 Ge 0.44350282419657 0.50000000000000 0.83964630722862 72.640 > 9 72 Ge 0.94350282419657 0.50000000000000 0.83964630722862 72.640 > 9 *73 N 0.14751699061817 0.84357578909953 0.40087235941917 14.007 > 10 74 N 0.64751699061817 0.84357578909953 0.40087235941917 14.007 > 10 75 N 0.14751699061817 0.84357578909953 0.90087235941917 14.007 > 10 76 N 0.64751699061817 0.84357578909953 0.90087235941917 14.007 > 10 77 N 0.35248300938183 0.15642421090047 0.09912764058083 14.007 > 11 78 N 0.85248300938183 0.15642421090047 0.09912764058083 14.007 > 11 79 N 0.35248300938183 0.15642421090047 0.59912764058083 14.007 > 11 80 N 0.85248300938183 0.15642421090047 0.59912764058083 14.007 > 11 *81 N 0.14975606248915 0.00000000000000 0.18383279081913 14.007 > 12 82 N 0.64975606248915 0.00000000000000 0.18383279081913 14.007 > 12 83 N 0.14975606248915 0.00000000000000 0.68383279081913 14.007 > 12 84 N 0.64975606248915 0.00000000000000 0.68383279081913 14.007 > 12 85 N 0.35024393751085 0.00000000000000 0.31616720918087 14.007 > 13 86 N 0.85024393751085 0.00000000000000 0.31616720918087 14.007 > 13 87 N 0.35024393751085 0.00000000000000 0.81616720918087 14.007 > 13 88 N 0.85024393751085 0.00000000000000 0.81616720918087 14.007 > 13 89 N 0.14751699061817 0.15642421090047 0.40087235941917 14.007 > 14 90 N 0.64751699061817 0.15642421090047 0.40087235941917 14.007 > 14 91 N 0.14751699061817 0.15642421090047 0.90087235941917 14.007 > 14 92 N 0.64751699061817 0.15642421090047 0.90087235941917 14.007 > 14 93 N 0.35248300938183 0.84357578909953 0.09912764058083 14.007 > 15 94 N 0.85248300938183 0.84357578909953 0.09912764058083 14.007 > 15 95 N 0.35248300938183 0.84357578909953 0.59912764058083 14.007 > 15 96 N 0.85248300938183 0.84357578909953 0.59912764058083 14.007 > 15 97 N 0.39751699061817 0.34357578909953 0.40087235941917 14.007 > 10 98 N 0.89751699061817 0.34357578909953 0.40087235941917 14.007 > 10 99 N 0.39751699061817 0.34357578909953 0.90087235941917 14.007 > 10 100 N 0.89751699061817 0.34357578909953 0.90087235941917 14.007 > 10 101 N 0.10248300938183 0.65642421090047 0.09912764058083 14.007 > 11 102 N 0.60248300938183 0.65642421090047 0.09912764058083 14.007 > 11 103 N 0.10248300938183 0.65642421090047 0.59912764058083 14.007 > 11 104 N 0.60248300938183 0.65642421090047 0.59912764058083 14.007 > 11 105 N 0.39975606248915 0.50000000000000 0.18383279081913 14.007 > 12 106 N 0.89975606248915 0.50000000000000 0.18383279081913 14.007 > 12 107 N 0.39975606248915 0.50000000000000 0.68383279081913 14.007 > 12 108 N 0.89975606248915 0.50000000000000 0.68383279081913 14.007 > 12 109 N 0.10024393751085 0.50000000000000 0.31616720918087 14.007 > 13 110 N 0.60024393751085 0.50000000000000 0.31616720918087 14.007 > 13 111 N 0.10024393751085 0.50000000000000 0.81616720918087 14.007 > 13 112 N 0.60024393751085 0.50000000000000 0.81616720918087 14.007 > 13 113 N 0.39751699061817 0.65642421090047 0.40087235941917 14.007 > 14 114 N 0.89751699061817 0.65642421090047 0.40087235941917 14.007 > 14 115 N 0.39751699061817 0.65642421090047 0.90087235941917 14.007 > 14 116 N 0.89751699061817 0.65642421090047 0.90087235941917 14.007 > 14 117 N 0.10248300938183 0.34357578909953 0.09912764058083 14.007 > 15 118 N 0.60248300938183 0.34357578909953 0.09912764058083 14.007 > 15 119 N 0.10248300938183 0.34357578909953 0.59912764058083 14.007 > 15 120 N 0.60248300938183 0.34357578909953 0.59912764058083 14.007 > 15 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5697284 0.0000000 -0.2299930 0.0000000 5.6871579 0.0000000 -0.2383265 0.0000000 5.3521081 -------------------------- Born effective charges -------------------------- 1 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 2 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 3 Sr 3.0001100 0.0000000 -0.1389249 0.0000000 2.5350498 0.0000000 -0.3927143 0.0000000 2.9722465 4 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 5 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 6 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 7 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 8 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 9 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 10 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 11 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 12 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 13 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 14 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 15 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 9450/9450 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2192 Number of blocks in projector: 2192 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 506 Use submatrix version of eigh solver. (1) Block: 506 / 506 (2) Block: 250 / 506 (2) 239 eigenvectors found. (2) Block: 506 / 506 (2) 249 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 495 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: 396 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 396 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 298 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 298 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 298 Use standard eigh solver. Tree of FC basis block matrices: - (2192, 2155), data: False |-- (298, 292), data: True |-- (298, 292), data: True |-- (298, 292), data: True |-- (396, 392), data: True |-- (396, 392), data: True |-- (506, 495), data: False |-- (506, 495), data: False |-- (506, 7), data: (506, 18) @ (18, 7) |-- (256, 249), data: True |-- (250, 239), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.005 Solver_block: 100 / 480 - Time: 0.610 Solver_block: 200 / 480 - Time: 0.575 Solver_block: 300 / 480 - Time: 0.576 Solver_block: 400 / 480 - Time: 0.575 Solver_block: 480 / 480 - Time: 0.527 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 2.918 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 360/360 Permutation basis: 9450/9450 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2192 Number of blocks in projector: 2192 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 506 Use submatrix version of eigh solver. (1) Block: 506 / 506 (2) Block: 250 / 506 (2) 239 eigenvectors found. (2) Block: 506 / 506 (2) 249 eigenvectors found. (2) Complementary block size: 18 (2) Compute compressed projector. (2) Use standard solver. (2) 7 eigenvectors found. (1) 495 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: 396 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 396 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 298 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 298 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 298 Use standard eigh solver. Tree of FC basis block matrices: - (2192, 2155), data: False |-- (298, 292), data: True |-- (298, 292), data: True |-- (298, 292), data: True |-- (396, 392), data: True |-- (396, 392), data: True |-- (506, 495), data: False |-- (506, 495), data: False |-- (506, 7), data: (506, 18) @ (18, 7) |-- (256, 249), data: True |-- (250, 239), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 17:38:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:38:31]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 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 3.059344490004908 -4.984078169999999 0.000000000000000 b 3.059344490004908 4.984078169999999 0.000000000000000 c -0.148020203067836 0.000000000000000 6.278876035148802 Atomic positions (fractional): 1 Sr 0.81017979525795 0.18982020474205 0.50000000000000 87.620 2 Sr 0.18982020474205 0.81017979525795 0.50000000000000 87.620 3 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 4 Li 0.18378076978013 0.54110136294319 0.11979045123572 6.941 5 Li 0.81621923021987 0.45889863705681 0.88020954876428 6.941 6 Li 0.45889863705681 0.81621923021987 0.88020954876428 6.941 7 Li 0.54110136294319 0.18378076978013 0.11979045123572 6.941 8 Ge 0.61299435160687 0.61299435160687 0.32070738554275 72.640 9 Ge 0.38700564839313 0.38700564839313 0.67929261445725 72.640 10 N 0.45145819213681 0.13860977033588 0.80174471883834 14.007 11 N 0.54854180786319 0.86139022966412 0.19825528116166 14.007 12 N 0.29951212497830 0.29951212497830 0.36766558163825 14.007 13 N 0.70048787502170 0.70048787502170 0.63233441836175 14.007 14 N 0.13860977033588 0.45145819213681 0.80174471883834 14.007 15 N 0.86139022966412 0.54854180786319 0.19825528116166 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.237377960019630 0.000000000000000 0.000000000000000 b 0.000000000000000 9.968156339999998 0.000000000000000 c -0.296040406135672 0.000000000000000 12.557752070297605 Atomic positions (fractional): 1 Sr 0.25000000000000 0.68982020474205 0.25000000000000 87.620 > 1 2 Sr 0.75000000000000 0.68982020474205 0.25000000000000 87.620 > 1 3 Sr 0.25000000000000 0.68982020474205 0.75000000000000 87.620 > 1 4 Sr 0.75000000000000 0.68982020474205 0.75000000000000 87.620 > 1 5 Sr 0.25000000000000 0.31017979525795 0.25000000000000 87.620 > 5 6 Sr 0.75000000000000 0.31017979525795 0.25000000000000 87.620 > 5 7 Sr 0.25000000000000 0.31017979525795 0.75000000000000 87.620 > 5 8 Sr 0.75000000000000 0.31017979525795 0.75000000000000 87.620 > 5 9 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 > 9 10 Sr 0.50000000000000 0.00000000000000 0.00000000000000 87.620 > 9 11 Sr 0.00000000000000 0.00000000000000 0.50000000000000 87.620 > 9 12 Sr 0.50000000000000 0.00000000000000 0.50000000000000 87.620 > 9 13 Sr 0.00000000000000 0.18982020474205 0.25000000000000 87.620 > 1 14 Sr 0.50000000000000 0.18982020474205 0.25000000000000 87.620 > 1 15 Sr 0.00000000000000 0.18982020474205 0.75000000000000 87.620 > 1 16 Sr 0.50000000000000 0.18982020474205 0.75000000000000 87.620 > 1 17 Sr 0.00000000000000 0.81017979525795 0.25000000000000 87.620 > 5 18 Sr 0.50000000000000 0.81017979525795 0.25000000000000 87.620 > 5 19 Sr 0.00000000000000 0.81017979525795 0.75000000000000 87.620 > 5 20 Sr 0.50000000000000 0.81017979525795 0.75000000000000 87.620 > 5 21 Sr 0.25000000000000 0.50000000000000 0.00000000000000 87.620 > 9 22 Sr 0.75000000000000 0.50000000000000 0.00000000000000 87.620 > 9 23 Sr 0.25000000000000 0.50000000000000 0.50000000000000 87.620 > 9 24 Sr 0.75000000000000 0.50000000000000 0.50000000000000 87.620 > 9 25 Li 0.18122053318083 0.17866029658153 0.05989522561786 6.941 > 25 26 Li 0.68122053318083 0.17866029658153 0.05989522561786 6.941 > 25 27 Li 0.18122053318083 0.17866029658153 0.55989522561786 6.941 > 25 28 Li 0.68122053318083 0.17866029658153 0.55989522561786 6.941 > 25 29 Li 0.31877946681917 0.82133970341847 0.44010477438214 6.941 > 29 30 Li 0.81877946681917 0.82133970341847 0.44010477438214 6.941 > 29 31 Li 0.31877946681917 0.82133970341847 0.94010477438214 6.941 > 29 32 Li 0.81877946681917 0.82133970341847 0.94010477438214 6.941 > 29 33 Li 0.31877946681917 0.17866029658153 0.44010477438214 6.941 > 33 34 Li 0.81877946681917 0.17866029658153 0.44010477438214 6.941 > 33 35 Li 0.31877946681917 0.17866029658153 0.94010477438214 6.941 > 33 36 Li 0.81877946681917 0.17866029658153 0.94010477438214 6.941 > 33 37 Li 0.18122053318083 0.82133970341847 0.05989522561786 6.941 > 37 38 Li 0.68122053318083 0.82133970341847 0.05989522561786 6.941 > 37 39 Li 0.18122053318083 0.82133970341847 0.55989522561786 6.941 > 37 40 Li 0.68122053318083 0.82133970341847 0.55989522561786 6.941 > 37 41 Li 0.43122053318083 0.67866029658153 0.05989522561786 6.941 > 25 42 Li 0.93122053318083 0.67866029658153 0.05989522561786 6.941 > 25 43 Li 0.43122053318083 0.67866029658153 0.55989522561786 6.941 > 25 44 Li 0.93122053318083 0.67866029658153 0.55989522561786 6.941 > 25 45 Li 0.06877946681917 0.32133970341847 0.44010477438214 6.941 > 29 46 Li 0.56877946681917 0.32133970341847 0.44010477438214 6.941 > 29 47 Li 0.06877946681917 0.32133970341847 0.94010477438214 6.941 > 29 48 Li 0.56877946681917 0.32133970341847 0.94010477438214 6.941 > 29 49 Li 0.06877946681917 0.67866029658153 0.44010477438214 6.941 > 33 50 Li 0.56877946681917 0.67866029658153 0.44010477438214 6.941 > 33 51 Li 0.06877946681917 0.67866029658153 0.94010477438214 6.941 > 33 52 Li 0.56877946681917 0.67866029658153 0.94010477438214 6.941 > 33 53 Li 0.43122053318083 0.32133970341847 0.05989522561786 6.941 > 37 54 Li 0.93122053318083 0.32133970341847 0.05989522561786 6.941 > 37 55 Li 0.43122053318083 0.32133970341847 0.55989522561786 6.941 > 37 56 Li 0.93122053318083 0.32133970341847 0.55989522561786 6.941 > 37 57 Ge 0.30649717580343 0.00000000000000 0.16035369277138 72.640 > 57 58 Ge 0.80649717580343 0.00000000000000 0.16035369277138 72.640 > 57 59 Ge 0.30649717580343 0.00000000000000 0.66035369277138 72.640 > 57 60 Ge 0.80649717580343 0.00000000000000 0.66035369277138 72.640 > 57 61 Ge 0.19350282419657 0.00000000000000 0.33964630722862 72.640 > 61 62 Ge 0.69350282419657 0.00000000000000 0.33964630722862 72.640 > 61 63 Ge 0.19350282419657 0.00000000000000 0.83964630722862 72.640 > 61 64 Ge 0.69350282419657 0.00000000000000 0.83964630722862 72.640 > 61 65 Ge 0.05649717580343 0.50000000000000 0.16035369277138 72.640 > 57 66 Ge 0.55649717580343 0.50000000000000 0.16035369277138 72.640 > 57 67 Ge 0.05649717580343 0.50000000000000 0.66035369277138 72.640 > 57 68 Ge 0.55649717580343 0.50000000000000 0.66035369277138 72.640 > 57 69 Ge 0.44350282419657 0.50000000000000 0.33964630722862 72.640 > 61 70 Ge 0.94350282419657 0.50000000000000 0.33964630722862 72.640 > 61 71 Ge 0.44350282419657 0.50000000000000 0.83964630722862 72.640 > 61 72 Ge 0.94350282419657 0.50000000000000 0.83964630722862 72.640 > 61 73 N 0.14751699061817 0.84357578909953 0.40087235941917 14.007 > 73 74 N 0.64751699061817 0.84357578909953 0.40087235941917 14.007 > 73 75 N 0.14751699061817 0.84357578909953 0.90087235941917 14.007 > 73 76 N 0.64751699061817 0.84357578909953 0.90087235941917 14.007 > 73 77 N 0.35248300938183 0.15642421090047 0.09912764058083 14.007 > 77 78 N 0.85248300938183 0.15642421090047 0.09912764058083 14.007 > 77 79 N 0.35248300938183 0.15642421090047 0.59912764058083 14.007 > 77 80 N 0.85248300938183 0.15642421090047 0.59912764058083 14.007 > 77 81 N 0.14975606248915 0.00000000000000 0.18383279081913 14.007 > 81 82 N 0.64975606248915 0.00000000000000 0.18383279081913 14.007 > 81 83 N 0.14975606248915 0.00000000000000 0.68383279081913 14.007 > 81 84 N 0.64975606248915 0.00000000000000 0.68383279081913 14.007 > 81 85 N 0.35024393751085 0.00000000000000 0.31616720918087 14.007 > 85 86 N 0.85024393751085 0.00000000000000 0.31616720918087 14.007 > 85 87 N 0.35024393751085 0.00000000000000 0.81616720918087 14.007 > 85 88 N 0.85024393751085 0.00000000000000 0.81616720918087 14.007 > 85 89 N 0.14751699061817 0.15642421090047 0.40087235941917 14.007 > 89 90 N 0.64751699061817 0.15642421090047 0.40087235941917 14.007 > 89 91 N 0.14751699061817 0.15642421090047 0.90087235941917 14.007 > 89 92 N 0.64751699061817 0.15642421090047 0.90087235941917 14.007 > 89 93 N 0.35248300938183 0.84357578909953 0.09912764058083 14.007 > 93 94 N 0.85248300938183 0.84357578909953 0.09912764058083 14.007 > 93 95 N 0.35248300938183 0.84357578909953 0.59912764058083 14.007 > 93 96 N 0.85248300938183 0.84357578909953 0.59912764058083 14.007 > 93 97 N 0.39751699061817 0.34357578909953 0.40087235941917 14.007 > 73 98 N 0.89751699061817 0.34357578909953 0.40087235941917 14.007 > 73 99 N 0.39751699061817 0.34357578909953 0.90087235941917 14.007 > 73 100 N 0.89751699061817 0.34357578909953 0.90087235941917 14.007 > 73 101 N 0.10248300938183 0.65642421090047 0.09912764058083 14.007 > 77 102 N 0.60248300938183 0.65642421090047 0.09912764058083 14.007 > 77 103 N 0.10248300938183 0.65642421090047 0.59912764058083 14.007 > 77 104 N 0.60248300938183 0.65642421090047 0.59912764058083 14.007 > 77 105 N 0.39975606248915 0.50000000000000 0.18383279081913 14.007 > 81 106 N 0.89975606248915 0.50000000000000 0.18383279081913 14.007 > 81 107 N 0.39975606248915 0.50000000000000 0.68383279081913 14.007 > 81 108 N 0.89975606248915 0.50000000000000 0.68383279081913 14.007 > 81 109 N 0.10024393751085 0.50000000000000 0.31616720918087 14.007 > 85 110 N 0.60024393751085 0.50000000000000 0.31616720918087 14.007 > 85 111 N 0.10024393751085 0.50000000000000 0.81616720918087 14.007 > 85 112 N 0.60024393751085 0.50000000000000 0.81616720918087 14.007 > 85 113 N 0.39751699061817 0.65642421090047 0.40087235941917 14.007 > 89 114 N 0.89751699061817 0.65642421090047 0.40087235941917 14.007 > 89 115 N 0.39751699061817 0.65642421090047 0.90087235941917 14.007 > 89 116 N 0.89751699061817 0.65642421090047 0.90087235941917 14.007 > 89 117 N 0.10248300938183 0.34357578909953 0.09912764058083 14.007 > 93 118 N 0.60248300938183 0.34357578909953 0.09912764058083 14.007 > 93 119 N 0.10248300938183 0.34357578909953 0.59912764058083 14.007 > 93 120 N 0.60248300938183 0.34357578909953 0.59912764058083 14.007 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.5697284 0.0000000 -0.2299930 0.0000000 5.6871579 0.0000000 -0.2383265 0.0000000 5.3521081 -------------------------- Born effective charges -------------------------- 1 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 2 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 3 Sr 3.0001100 0.0000000 -0.1389249 0.0000000 2.5350498 0.0000000 -0.3927143 0.0000000 2.9722465 4 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 5 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 6 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 7 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 8 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 9 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 10 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 11 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 12 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 13 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 14 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 15 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 ---------------------------------------------------------------------------- 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] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] 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] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] 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] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0002 0.0000 0.0100] [ 0.0002 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000008 (xxx) -0.00000008 (xxx) -0.00000008 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 17:38:57]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 17:38:57]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 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 3.059344490004908 -4.984078169999999 0.000000000000000 b 3.059344490004908 4.984078169999999 0.000000000000000 c -0.148020203067836 0.000000000000000 6.278876035148802 Atomic positions (fractional): 1 Sr 0.81017979525795 0.18982020474205 0.50000000000000 87.620 2 Sr 0.18982020474205 0.81017979525795 0.50000000000000 87.620 3 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 4 Li 0.18378076978013 0.54110136294319 0.11979045123572 6.941 5 Li 0.81621923021987 0.45889863705681 0.88020954876428 6.941 6 Li 0.45889863705681 0.81621923021987 0.88020954876428 6.941 7 Li 0.54110136294319 0.18378076978013 0.11979045123572 6.941 8 Ge 0.61299435160687 0.61299435160687 0.32070738554275 72.640 9 Ge 0.38700564839313 0.38700564839313 0.67929261445725 72.640 10 N 0.45145819213681 0.13860977033588 0.80174471883834 14.007 11 N 0.54854180786319 0.86139022966412 0.19825528116166 14.007 12 N 0.29951212497830 0.29951212497830 0.36766558163825 14.007 13 N 0.70048787502170 0.70048787502170 0.63233441836175 14.007 14 N 0.13860977033588 0.45145819213681 0.80174471883834 14.007 15 N 0.86139022966412 0.54854180786319 0.19825528116166 14.007 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.237377960019630 0.000000000000000 0.000000000000000 b 0.000000000000000 9.968156339999998 0.000000000000000 c -0.296040406135672 0.000000000000000 12.557752070297605 Atomic positions (fractional): 1 Sr 0.25000000000000 0.68982020474205 0.25000000000000 87.620 > 1 2 Sr 0.75000000000000 0.68982020474205 0.25000000000000 87.620 > 1 3 Sr 0.25000000000000 0.68982020474205 0.75000000000000 87.620 > 1 4 Sr 0.75000000000000 0.68982020474205 0.75000000000000 87.620 > 1 5 Sr 0.25000000000000 0.31017979525795 0.25000000000000 87.620 > 5 6 Sr 0.75000000000000 0.31017979525795 0.25000000000000 87.620 > 5 7 Sr 0.25000000000000 0.31017979525795 0.75000000000000 87.620 > 5 8 Sr 0.75000000000000 0.31017979525795 0.75000000000000 87.620 > 5 9 Sr 0.00000000000000 0.00000000000000 0.00000000000000 87.620 > 9 10 Sr 0.50000000000000 0.00000000000000 0.00000000000000 87.620 > 9 11 Sr 0.00000000000000 0.00000000000000 0.50000000000000 87.620 > 9 12 Sr 0.50000000000000 0.00000000000000 0.50000000000000 87.620 > 9 13 Sr 0.00000000000000 0.18982020474205 0.25000000000000 87.620 > 1 14 Sr 0.50000000000000 0.18982020474205 0.25000000000000 87.620 > 1 15 Sr 0.00000000000000 0.18982020474205 0.75000000000000 87.620 > 1 16 Sr 0.50000000000000 0.18982020474205 0.75000000000000 87.620 > 1 17 Sr 0.00000000000000 0.81017979525795 0.25000000000000 87.620 > 5 18 Sr 0.50000000000000 0.81017979525795 0.25000000000000 87.620 > 5 19 Sr 0.00000000000000 0.81017979525795 0.75000000000000 87.620 > 5 20 Sr 0.50000000000000 0.81017979525795 0.75000000000000 87.620 > 5 21 Sr 0.25000000000000 0.50000000000000 0.00000000000000 87.620 > 9 22 Sr 0.75000000000000 0.50000000000000 0.00000000000000 87.620 > 9 23 Sr 0.25000000000000 0.50000000000000 0.50000000000000 87.620 > 9 24 Sr 0.75000000000000 0.50000000000000 0.50000000000000 87.620 > 9 25 Li 0.18122053318083 0.17866029658153 0.05989522561786 6.941 > 25 26 Li 0.68122053318083 0.17866029658153 0.05989522561786 6.941 > 25 27 Li 0.18122053318083 0.17866029658153 0.55989522561786 6.941 > 25 28 Li 0.68122053318083 0.17866029658153 0.55989522561786 6.941 > 25 29 Li 0.31877946681917 0.82133970341847 0.44010477438214 6.941 > 29 30 Li 0.81877946681917 0.82133970341847 0.44010477438214 6.941 > 29 31 Li 0.31877946681917 0.82133970341847 0.94010477438214 6.941 > 29 32 Li 0.81877946681917 0.82133970341847 0.94010477438214 6.941 > 29 33 Li 0.31877946681917 0.17866029658153 0.44010477438214 6.941 > 33 34 Li 0.81877946681917 0.17866029658153 0.44010477438214 6.941 > 33 35 Li 0.31877946681917 0.17866029658153 0.94010477438214 6.941 > 33 36 Li 0.81877946681917 0.17866029658153 0.94010477438214 6.941 > 33 37 Li 0.18122053318083 0.82133970341847 0.05989522561786 6.941 > 37 38 Li 0.68122053318083 0.82133970341847 0.05989522561786 6.941 > 37 39 Li 0.18122053318083 0.82133970341847 0.55989522561786 6.941 > 37 40 Li 0.68122053318083 0.82133970341847 0.55989522561786 6.941 > 37 41 Li 0.43122053318083 0.67866029658153 0.05989522561786 6.941 > 25 42 Li 0.93122053318083 0.67866029658153 0.05989522561786 6.941 > 25 43 Li 0.43122053318083 0.67866029658153 0.55989522561786 6.941 > 25 44 Li 0.93122053318083 0.67866029658153 0.55989522561786 6.941 > 25 45 Li 0.06877946681917 0.32133970341847 0.44010477438214 6.941 > 29 46 Li 0.56877946681917 0.32133970341847 0.44010477438214 6.941 > 29 47 Li 0.06877946681917 0.32133970341847 0.94010477438214 6.941 > 29 48 Li 0.56877946681917 0.32133970341847 0.94010477438214 6.941 > 29 49 Li 0.06877946681917 0.67866029658153 0.44010477438214 6.941 > 33 50 Li 0.56877946681917 0.67866029658153 0.44010477438214 6.941 > 33 51 Li 0.06877946681917 0.67866029658153 0.94010477438214 6.941 > 33 52 Li 0.56877946681917 0.67866029658153 0.94010477438214 6.941 > 33 53 Li 0.43122053318083 0.32133970341847 0.05989522561786 6.941 > 37 54 Li 0.93122053318083 0.32133970341847 0.05989522561786 6.941 > 37 55 Li 0.43122053318083 0.32133970341847 0.55989522561786 6.941 > 37 56 Li 0.93122053318083 0.32133970341847 0.55989522561786 6.941 > 37 57 Ge 0.30649717580343 0.00000000000000 0.16035369277138 72.640 > 57 58 Ge 0.80649717580343 0.00000000000000 0.16035369277138 72.640 > 57 59 Ge 0.30649717580343 0.00000000000000 0.66035369277138 72.640 > 57 60 Ge 0.80649717580343 0.00000000000000 0.66035369277138 72.640 > 57 61 Ge 0.19350282419657 0.00000000000000 0.33964630722862 72.640 > 61 62 Ge 0.69350282419657 0.00000000000000 0.33964630722862 72.640 > 61 63 Ge 0.19350282419657 0.00000000000000 0.83964630722862 72.640 > 61 64 Ge 0.69350282419657 0.00000000000000 0.83964630722862 72.640 > 61 65 Ge 0.05649717580343 0.50000000000000 0.16035369277138 72.640 > 57 66 Ge 0.55649717580343 0.50000000000000 0.16035369277138 72.640 > 57 67 Ge 0.05649717580343 0.50000000000000 0.66035369277138 72.640 > 57 68 Ge 0.55649717580343 0.50000000000000 0.66035369277138 72.640 > 57 69 Ge 0.44350282419657 0.50000000000000 0.33964630722862 72.640 > 61 70 Ge 0.94350282419657 0.50000000000000 0.33964630722862 72.640 > 61 71 Ge 0.44350282419657 0.50000000000000 0.83964630722862 72.640 > 61 72 Ge 0.94350282419657 0.50000000000000 0.83964630722862 72.640 > 61 73 N 0.14751699061817 0.84357578909953 0.40087235941917 14.007 > 73 74 N 0.64751699061817 0.84357578909953 0.40087235941917 14.007 > 73 75 N 0.14751699061817 0.84357578909953 0.90087235941917 14.007 > 73 76 N 0.64751699061817 0.84357578909953 0.90087235941917 14.007 > 73 77 N 0.35248300938183 0.15642421090047 0.09912764058083 14.007 > 77 78 N 0.85248300938183 0.15642421090047 0.09912764058083 14.007 > 77 79 N 0.35248300938183 0.15642421090047 0.59912764058083 14.007 > 77 80 N 0.85248300938183 0.15642421090047 0.59912764058083 14.007 > 77 81 N 0.14975606248915 0.00000000000000 0.18383279081913 14.007 > 81 82 N 0.64975606248915 0.00000000000000 0.18383279081913 14.007 > 81 83 N 0.14975606248915 0.00000000000000 0.68383279081913 14.007 > 81 84 N 0.64975606248915 0.00000000000000 0.68383279081913 14.007 > 81 85 N 0.35024393751085 0.00000000000000 0.31616720918087 14.007 > 85 86 N 0.85024393751085 0.00000000000000 0.31616720918087 14.007 > 85 87 N 0.35024393751085 0.00000000000000 0.81616720918087 14.007 > 85 88 N 0.85024393751085 0.00000000000000 0.81616720918087 14.007 > 85 89 N 0.14751699061817 0.15642421090047 0.40087235941917 14.007 > 89 90 N 0.64751699061817 0.15642421090047 0.40087235941917 14.007 > 89 91 N 0.14751699061817 0.15642421090047 0.90087235941917 14.007 > 89 92 N 0.64751699061817 0.15642421090047 0.90087235941917 14.007 > 89 93 N 0.35248300938183 0.84357578909953 0.09912764058083 14.007 > 93 94 N 0.85248300938183 0.84357578909953 0.09912764058083 14.007 > 93 95 N 0.35248300938183 0.84357578909953 0.59912764058083 14.007 > 93 96 N 0.85248300938183 0.84357578909953 0.59912764058083 14.007 > 93 97 N 0.39751699061817 0.34357578909953 0.40087235941917 14.007 > 73 98 N 0.89751699061817 0.34357578909953 0.40087235941917 14.007 > 73 99 N 0.39751699061817 0.34357578909953 0.90087235941917 14.007 > 73 100 N 0.89751699061817 0.34357578909953 0.90087235941917 14.007 > 73 101 N 0.10248300938183 0.65642421090047 0.09912764058083 14.007 > 77 102 N 0.60248300938183 0.65642421090047 0.09912764058083 14.007 > 77 103 N 0.10248300938183 0.65642421090047 0.59912764058083 14.007 > 77 104 N 0.60248300938183 0.65642421090047 0.59912764058083 14.007 > 77 105 N 0.39975606248915 0.50000000000000 0.18383279081913 14.007 > 81 106 N 0.89975606248915 0.50000000000000 0.18383279081913 14.007 > 81 107 N 0.39975606248915 0.50000000000000 0.68383279081913 14.007 > 81 108 N 0.89975606248915 0.50000000000000 0.68383279081913 14.007 > 81 109 N 0.10024393751085 0.50000000000000 0.31616720918087 14.007 > 85 110 N 0.60024393751085 0.50000000000000 0.31616720918087 14.007 > 85 111 N 0.10024393751085 0.50000000000000 0.81616720918087 14.007 > 85 112 N 0.60024393751085 0.50000000000000 0.81616720918087 14.007 > 85 113 N 0.39751699061817 0.65642421090047 0.40087235941917 14.007 > 89 114 N 0.89751699061817 0.65642421090047 0.40087235941917 14.007 > 89 115 N 0.39751699061817 0.65642421090047 0.90087235941917 14.007 > 89 116 N 0.89751699061817 0.65642421090047 0.90087235941917 14.007 > 89 117 N 0.10248300938183 0.34357578909953 0.09912764058083 14.007 > 93 118 N 0.60248300938183 0.34357578909953 0.09912764058083 14.007 > 93 119 N 0.10248300938183 0.34357578909953 0.59912764058083 14.007 > 93 120 N 0.60248300938183 0.34357578909953 0.59912764058083 14.007 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.5697284 0.0000000 -0.2299930 0.0000000 5.6871579 0.0000000 -0.2383265 0.0000000 5.3521081 -------------------------- Born effective charges -------------------------- 1 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 2 Sr 2.7247497 0.0000000 0.0613510 0.0000000 2.6031986 0.0000000 0.1128911 0.0000000 1.9072287 3 Sr 3.0001100 0.0000000 -0.1389249 0.0000000 2.5350498 0.0000000 -0.3927143 0.0000000 2.9722465 4 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 5 Li 0.7817943 -0.1809777 0.0657935 -0.2368307 0.9438706 0.0391839 0.0310522 -0.0669085 1.0563531 6 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 7 Li 0.7817943 0.1809777 0.0657935 0.2368307 0.9438706 -0.0391839 0.0310522 0.0669085 1.0563531 8 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 9 Ge 2.3912193 0.0000000 -0.6782597 0.0000000 2.5975774 0.0000000 -0.5816269 0.0000000 2.5922359 10 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 11 N -2.4634939 -0.2905927 0.2691745 -0.3541667 -3.0269119 0.3487821 0.2802539 0.2426468 -2.6170495 12 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 13 N -3.2526249 0.0000000 0.0164353 0.0000000 -2.3022183 0.0000000 0.0424807 0.0000000 -2.8641952 14 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 15 N -2.4634939 0.2905927 0.2691745 0.3541667 -3.0269119 -0.3487821 0.2802539 -0.2426468 -2.6170495 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000008 (xxx) -0.00000008 (xxx) -0.00000008 (xxx) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 8 ] 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: 0.72, Number of G-points: 305, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/227) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.401 ( 0.000 0.000 0.000) 0.000 2.746 ( 0.000 0.000 0.000) 0.000 3.084 ( 0.000 0.000 0.000) 0.000 3.392 ( 0.000 0.000 0.000) 0.000 3.452 ( 0.000 0.000 0.000) 0.000 3.583 ( 0.000 0.000 0.000) 0.000 4.491 ( 0.000 0.000 0.000) 0.000 4.686 ( 0.000 0.000 0.000) 0.000 5.270 ( 0.000 0.000 0.000) 0.000 5.361 ( 0.000 0.000 0.000) 0.000 5.502 ( 0.000 0.000 0.000) 0.000 5.801 ( 0.000 0.000 0.000) 0.000 6.675 ( 0.000 0.000 0.000) 0.000 7.468 ( 0.000 0.000 0.000) 0.000 8.224 ( 0.000 0.000 0.000) 0.000 8.758 ( 0.000 0.000 0.000) 0.000 9.633 ( 0.000 0.000 0.000) 0.000 9.839 ( 0.000 0.000 0.000) 0.000 10.425 ( 0.000 0.000 0.000) 0.000 10.464 ( 0.000 0.000 0.000) 0.000 10.696 ( 0.000 0.000 0.000) 0.000 10.812 ( 0.000 0.000 0.000) 0.000 11.232 ( 0.000 0.000 0.000) 0.000 11.235 ( 0.000 0.000 0.000) 0.000 11.918 ( 0.000 0.000 0.000) 0.000 12.657 ( 0.000 0.000 0.000) 0.000 12.738 ( 0.000 0.000 0.000) 0.000 13.640 ( 0.000 0.000 0.000) 0.000 13.893 ( 0.000 0.000 0.000) 0.000 14.212 ( 0.000 0.000 0.000) 0.000 14.488 ( 0.000 0.000 0.000) 0.000 14.683 ( 0.000 0.000 0.000) 0.000 14.906 ( 0.000 0.000 0.000) 0.000 15.558 ( 0.000 0.000 0.000) 0.000 15.724 ( 0.000 0.000 0.000) 0.000 15.784 ( 0.000 0.000 0.000) 0.000 16.275 ( 0.000 0.000 0.000) 0.000 16.518 ( 0.000 0.000 0.000) 0.000 20.545 ( 0.000 0.000 0.000) 0.000 21.171 ( 0.000 0.000 0.000) 0.000 21.325 ( 0.000 0.000 0.000) 0.000 22.208 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/227) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.611 ( 32.147 -4.404 -1.682) 32.491 0.709 ( 31.176 -15.661 -8.026) 35.800 1.186 ( 48.832 -35.643 -2.902) 60.526 1.585 ( 16.172 2.396 13.027) 20.904 2.763 ( -7.471 -6.037 3.404) 10.191 3.181 ( -12.444 -8.472 -1.435) 15.122 3.419 ( 3.931 1.961 -3.231) 5.453 3.519 ( -7.279 -20.865 4.447) 22.542 4.057 ( -3.663 -10.550 15.536) 19.133 4.535 ( 2.167 -3.559 2.280) 4.750 4.881 ( -2.582 -0.567 -25.942) 26.076 5.234 ( -3.305 1.426 -2.605) 4.444 5.465 ( -3.337 1.553 -2.445) 4.419 5.698 ( -0.212 8.594 -1.374) 8.706 5.965 ( 5.338 -3.257 -9.822) 11.643 6.680 ( -0.392 2.964 -0.946) 3.136 7.659 ( 0.563 13.113 24.951) 28.192 8.193 ( -2.338 2.174 0.979) 3.340 8.691 ( -6.869 1.733 2.677) 7.573 9.648 ( 0.600 -1.840 2.878) 3.468 9.977 ( 6.585 6.920 -15.291) 18.030 10.434 ( -3.318 0.191 3.736) 5.000 10.545 ( -12.279 -11.687 0.371) 16.956 10.719 ( 2.436 6.305 -13.016) 14.667 10.884 ( 4.596 -5.262 -10.433) 12.556 11.142 ( -5.917 0.445 -3.647) 6.965 11.371 ( -6.597 -16.147 -2.467) 17.616 12.558 ( -8.268 -3.925 15.864) 18.315 12.684 ( -3.381 5.835 -1.759) 6.969 12.866 ( 12.588 3.444 13.009) 18.427 13.629 ( 0.524 2.777 2.597) 3.838 14.084 ( 2.957 1.511 24.497) 24.721 14.187 ( -2.089 1.058 -2.881) 3.713 14.452 ( -4.473 -0.483 2.734) 5.264 14.846 ( -5.381 -0.771 -16.487) 17.360 15.000 ( 7.795 4.434 -10.775) 14.019 15.721 ( 0.020 1.278 0.360) 1.328 15.792 ( 1.631 0.745 -0.597) 1.889 16.269 ( -0.439 0.104 -0.207) 0.496 16.495 ( 1.379 5.894 2.461) 6.534 17.314 ( 76.476 115.875 11.733) 139.332 21.094 ( -19.299 -29.827 19.477) 40.514 21.212 ( 0.228 -6.934 4.515) 8.278 22.136 ( -38.091 -62.467 -56.947) 92.714 22.204 ( -1.518 -1.694 1.349) 2.644 ======================= Grid point 2 (3/227) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( 21.574 1.628 0.245) 21.637 1.295 ( 23.994 -12.067 -8.048) 28.037 1.976 ( 28.198 -5.639 7.572) 29.736 2.268 ( 42.253 -28.898 -2.908) 51.273 2.711 ( -5.549 -6.465 4.750) 9.754 3.073 ( -4.440 1.402 -3.280) 5.696 3.464 ( 4.519 3.235 -4.346) 7.054 3.607 ( -5.713 -18.215 6.728) 20.241 4.143 ( 5.744 -2.232 2.115) 6.515 4.588 ( -0.365 -1.362 1.461) 2.030 4.820 ( -5.067 -1.763 -11.967) 13.115 5.148 ( -4.855 1.124 -3.098) 5.868 5.366 ( -5.561 3.039 -3.297) 7.143 5.650 ( -1.595 -1.529 5.061) 5.522 6.037 ( -1.254 -4.562 -2.461) 5.333 6.646 ( 2.561 6.956 0.156) 7.414 7.533 ( -4.507 4.557 14.313) 15.682 8.113 ( -3.618 3.321 0.418) 4.929 8.519 ( -11.278 2.338 5.022) 12.565 9.691 ( 1.518 -2.554 5.216) 6.003 9.982 ( -0.535 3.531 0.252) 3.580 10.372 ( -3.689 -0.055 -2.850) 4.662 10.471 ( -6.027 -3.516 -0.452) 6.992 10.624 ( 0.468 13.409 -12.323) 18.218 10.966 ( 0.173 1.624 -14.902) 14.991 11.159 ( 8.125 -4.000 13.295) 16.086 11.394 ( -5.283 -8.216 -1.536) 9.888 12.463 ( -11.241 -2.862 2.598) 11.887 12.547 ( -2.661 5.375 2.639) 6.552 13.053 ( 13.415 3.298 6.516) 15.274 13.616 ( 1.857 3.444 3.071) 4.974 14.085 ( -3.548 2.248 1.477) 4.452 14.168 ( 1.933 -0.464 2.576) 3.254 14.366 ( -5.715 0.092 3.106) 6.506 14.745 ( -6.913 -0.834 -12.558) 14.359 15.086 ( 6.597 1.549 -5.976) 9.035 15.691 ( -1.233 2.734 -0.313) 3.015 15.819 ( 1.911 0.167 -0.554) 1.997 16.257 ( -0.339 0.999 -0.475) 1.157 16.471 ( 2.470 4.296 2.901) 5.742 17.421 ( 35.495 47.020 6.530) 59.274 21.089 ( -7.797 -12.099 7.858) 16.400 21.308 ( 3.253 -5.666 4.086) 7.706 22.110 ( -17.754 -26.425 -25.417) 40.737 22.195 ( -2.850 -3.687 1.321) 4.843 ======================= Grid point 3 (4/227) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( 10.603 5.635 0.111) 12.008 1.742 ( 18.276 -8.437 -4.189) 20.560 2.481 ( 17.212 -7.258 3.179) 18.948 2.786 ( 9.000 -9.718 3.910) 13.810 2.963 ( 4.409 -3.084 -0.897) 5.455 3.114 ( 21.455 -8.581 -3.508) 23.372 3.499 ( 3.715 1.238 -2.445) 4.616 3.736 ( 3.705 -11.062 4.737) 12.591 4.281 ( 7.678 -2.754 -0.887) 8.205 4.522 ( -6.878 2.558 -2.003) 7.606 4.767 ( -3.525 -4.246 -8.125) 9.822 5.074 ( -4.683 -2.901 -0.640) 5.546 5.231 ( -5.401 4.596 -2.446) 7.502 5.660 ( -2.282 -4.676 6.290) 8.163 6.028 ( -2.452 -1.170 -0.127) 2.720 6.615 ( 0.695 5.564 1.957) 5.938 7.476 ( -1.466 -3.455 8.786) 9.554 8.020 ( -2.967 3.994 -1.753) 5.275 8.300 ( -12.573 1.884 6.532) 14.294 9.731 ( -0.211 0.719 9.957) 9.985 9.881 ( -3.586 5.898 2.840) 7.464 10.293 ( -5.469 2.196 -12.557) 13.872 10.415 ( -4.119 -2.466 2.988) 5.654 10.545 ( 3.793 6.548 -8.298) 11.230 10.921 ( -0.414 3.118 -11.290) 11.720 11.333 ( -3.166 -5.817 1.306) 6.750 11.422 ( 11.694 1.150 16.494) 20.252 12.250 ( -9.658 6.650 -9.785) 15.273 12.501 ( -5.772 -5.912 5.000) 9.658 13.233 ( 12.012 2.970 5.176) 13.413 13.630 ( 3.630 3.023 2.424) 5.310 13.976 ( -5.352 2.967 -3.989) 7.305 14.163 ( -5.970 -1.379 5.824) 8.453 14.323 ( 2.773 1.305 -1.066) 3.245 14.638 ( -6.595 -1.162 -8.286) 10.653 15.174 ( 5.523 0.569 -3.913) 6.793 15.628 ( -3.200 2.423 -0.759) 4.085 15.842 ( 1.047 0.152 -0.463) 1.155 16.239 ( 0.159 2.099 -0.578) 2.183 16.495 ( 3.016 0.751 1.851) 3.618 17.521 ( 19.559 23.549 4.603) 30.957 21.087 ( -3.976 -6.250 3.958) 8.399 21.425 ( 4.569 -3.872 3.299) 6.837 22.068 ( -10.165 -12.380 -12.984) 20.620 22.188 ( -3.095 -4.513 0.544) 5.500 ======================= Grid point 4 (5/227) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( 3.971 4.521 -0.062) 6.017 2.047 ( 10.433 -5.009 -1.183) 11.634 2.655 ( 2.334 -6.587 2.680) 7.485 2.880 ( -2.846 3.438 -0.335) 4.476 3.214 ( 13.555 -6.941 -8.253) 17.322 3.426 ( 15.262 0.179 5.948) 16.381 3.628 ( 7.255 -7.758 3.956) 11.334 3.879 ( 5.142 1.918 0.898) 5.560 4.282 ( -14.545 1.484 -6.304) 15.922 4.466 ( 6.414 -1.077 -0.447) 6.519 4.794 ( 0.765 -4.147 -6.388) 7.655 5.006 ( -6.832 1.049 1.159) 7.009 5.195 ( 3.755 -5.072 0.278) 6.317 5.650 ( -3.128 -1.636 3.202) 4.766 6.007 ( -0.717 -0.416 1.201) 1.459 6.550 ( -2.690 3.783 2.250) 5.158 7.558 ( 2.752 -8.446 5.220) 10.303 7.939 ( -0.671 6.145 -6.601) 9.043 8.098 ( -10.432 -0.083 7.941) 13.111 9.612 ( -4.940 8.341 7.969) 12.549 9.857 ( 1.491 -0.311 1.585) 2.198 10.163 ( -5.407 2.571 -9.597) 11.312 10.405 ( -1.592 -4.015 4.500) 6.237 10.556 ( 3.200 4.665 -7.128) 9.100 10.916 ( 1.962 -0.841 -6.420) 6.766 11.273 ( -5.603 -1.172 0.353) 5.735 11.620 ( 11.170 4.698 19.928) 23.322 12.067 ( -4.869 2.595 -14.024) 15.071 12.454 ( -6.893 -5.258 1.446) 8.790 13.387 ( 8.924 1.258 4.199) 9.942 13.657 ( 2.027 2.643 1.051) 3.493 13.881 ( -1.614 2.165 -5.214) 5.871 14.050 ( -8.287 -1.321 5.587) 10.081 14.381 ( 4.689 1.612 -2.206) 5.427 14.554 ( -4.860 -1.581 -3.648) 6.279 15.248 ( 4.040 0.260 -1.877) 4.462 15.547 ( -3.810 1.328 -0.536) 4.070 15.852 ( 0.420 0.113 -0.329) 0.546 16.223 ( 0.224 1.524 -0.450) 1.605 16.539 ( 2.097 -0.406 0.759) 2.267 17.587 ( 9.033 10.369 2.542) 13.985 21.087 ( -1.769 -2.786 1.719) 3.721 21.525 ( 3.532 -1.975 2.072) 4.546 22.022 ( -5.313 -4.918 -5.806) 9.280 22.185 ( -1.935 -3.016 0.120) 3.585 ======================= Grid point 5 (6/227) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( 0.000 -0.000 0.000) 0.000 2.161 ( 0.000 -0.000 0.000) 0.000 2.766 ( -0.000 0.000 -0.000) 0.000 2.773 ( 0.000 -0.000 0.000) 0.000 3.305 ( 0.000 -0.000 0.000) 0.000 3.700 ( 0.000 -0.000 -0.000) 0.000 3.712 ( -0.000 0.000 0.000) 0.000 3.986 ( -0.000 0.000 -0.000) 0.000 3.988 ( 0.000 -0.000 0.000) 0.000 4.537 ( 0.000 -0.000 -0.000) 0.000 4.832 ( 0.000 0.000 0.000) 0.000 4.913 ( 0.000 -0.000 -0.000) 0.000 5.302 ( 0.000 0.000 0.000) 0.000 5.619 ( 0.000 -0.000 0.000) 0.000 6.009 ( 0.000 -0.000 0.000) 0.000 6.495 ( 0.000 -0.000 -0.000) 0.000 7.660 ( 0.000 -0.000 -0.000) 0.000 7.879 ( 0.000 -0.000 0.000) 0.000 8.008 ( 0.000 -0.000 -0.000) 0.000 9.520 ( 0.000 -0.000 0.000) 0.000 9.875 ( 0.000 -0.000 -0.000) 0.000 10.097 ( 0.000 -0.000 0.000) 0.000 10.421 ( 0.000 -0.000 0.000) 0.000 10.550 ( 0.000 -0.000 0.000) 0.000 10.954 ( 0.000 -0.000 -0.000) 0.000 11.219 ( 0.000 0.000 0.000) 0.000 11.681 ( 0.000 -0.000 0.000) 0.000 12.029 ( -0.000 -0.000 -0.000) 0.000 12.414 ( 0.000 -0.000 0.000) 0.000 13.470 ( 0.000 0.000 0.000) 0.000 13.643 ( 0.000 -0.000 0.000) 0.000 13.878 ( 0.000 -0.000 -0.000) 0.000 13.969 ( -0.000 -0.000 0.000) 0.000 14.416 ( -0.000 -0.000 0.000) 0.000 14.518 ( 0.000 0.000 -0.000) 0.000 15.285 ( 0.000 -0.000 0.000) 0.000 15.502 ( 0.000 -0.000 0.000) 0.000 15.855 ( 0.000 0.000 -0.000) 0.000 16.217 ( 0.000 -0.000 0.000) 0.000 16.560 ( 0.000 -0.000 -0.000) 0.000 17.609 ( 0.000 -0.000 0.000) 0.000 21.086 ( 0.000 -0.000 0.000) 0.000 21.567 ( 0.000 -0.000 -0.000) 0.000 22.000 ( 0.000 -0.000 0.000) 0.000 22.184 ( 0.000 -0.000 -0.000) 0.000 ======================= Grid point 12 (7/227) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.133 ( 25.787 0.000 -2.098) 25.872 1.214 ( 32.049 0.000 -2.261) 32.128 1.861 ( 46.917 0.000 -13.426) 48.800 1.959 ( 33.629 0.000 17.782) 38.041 2.624 ( -5.225 -0.000 4.959) 7.203 3.126 ( 4.158 0.000 -4.032) 5.792 3.315 ( -4.417 -0.000 3.267) 5.494 3.503 ( 4.536 0.000 -4.124) 6.130 4.128 ( 7.764 0.000 0.128) 7.765 4.575 ( 3.723 0.000 3.168) 4.888 4.794 ( -6.395 -0.000 -12.747) 14.261 5.157 ( -6.742 -0.000 -5.564) 8.742 5.394 ( -5.759 -0.000 -5.276) 7.810 5.662 ( -6.388 -0.000 4.601) 7.872 5.970 ( 1.930 0.000 -0.882) 2.122 6.719 ( 0.677 0.000 -0.490) 0.836 7.607 ( -10.185 -0.000 20.808) 23.167 8.152 ( -4.117 -0.000 2.521) 4.828 8.533 ( -12.272 -0.000 2.532) 12.530 9.663 ( 2.442 0.000 4.241) 4.894 10.019 ( -2.074 -0.000 -5.196) 5.595 10.369 ( -4.201 -0.000 2.040) 4.670 10.403 ( -1.550 -0.000 -4.846) 5.088 10.880 ( 3.907 0.000 5.925) 7.097 10.903 ( 4.424 0.000 -30.637) 30.954 11.176 ( -2.921 -0.000 -0.515) 2.966 11.227 ( 5.215 0.000 5.893) 7.869 12.391 ( -9.640 -0.000 14.518) 17.427 12.648 ( -5.219 -0.000 -2.329) 5.715 13.089 ( 12.733 0.000 7.416) 14.735 13.644 ( 0.326 0.000 0.367) 0.491 14.129 ( 1.028 0.000 13.493) 13.532 14.144 ( -3.457 -0.000 -4.967) 6.052 14.366 ( -5.131 -0.000 2.572) 5.740 14.735 ( -6.633 -0.000 -15.931) 17.256 15.105 ( 5.225 0.000 -4.347) 6.797 15.714 ( -1.770 -0.000 -0.193) 1.781 15.823 ( 1.723 0.000 -1.251) 2.129 16.264 ( -0.082 -0.000 -0.495) 0.502 16.498 ( -1.089 -0.000 3.285) 3.460 18.361 ( -2.106 -0.000 19.863) 19.975 20.554 ( 0.618 0.000 0.504) 0.797 21.307 ( 7.968 0.000 0.706) 8.000 21.788 ( 2.241 0.000 -34.673) 34.746 22.170 ( -2.081 -0.000 4.325) 4.800 ======================= Grid point 13 (8/227) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 15.880 5.564 3.302) 17.147 1.646 ( 22.067 0.021 -4.047) 22.436 2.408 ( 25.859 -0.667 -2.734) 26.012 2.600 ( 1.792 -7.374 4.255) 8.700 2.750 ( 36.237 -9.747 5.009) 37.858 3.155 ( 9.816 9.298 -4.366) 14.208 3.445 ( 9.457 -15.670 1.011) 18.331 3.550 ( 2.511 1.999 -3.531) 4.772 4.249 ( 6.274 -0.928 -2.623) 6.863 4.591 ( -2.110 3.805 -0.459) 4.375 4.685 ( -6.932 -3.422 -7.531) 10.792 5.029 ( -8.957 -1.711 -5.243) 10.519 5.285 ( -6.281 1.070 -6.249) 8.924 5.587 ( -3.065 -1.919 7.322) 8.166 6.007 ( 1.094 -0.722 3.989) 4.199 6.692 ( -2.672 1.803 0.321) 3.240 7.451 ( -7.627 0.274 16.409) 18.096 8.075 ( -3.772 1.482 0.482) 4.081 8.317 ( -13.814 0.047 5.017) 14.697 9.722 ( 3.876 -0.336 3.814) 5.448 9.964 ( -3.925 1.537 7.067) 8.229 10.313 ( -2.698 0.222 -3.814) 4.677 10.371 ( -3.687 -1.656 -2.993) 5.029 10.759 ( -1.826 13.281 -10.669) 17.133 10.981 ( 0.424 -0.248 -22.944) 22.949 11.171 ( -2.676 -7.919 -2.209) 8.646 11.425 ( 15.484 -0.491 20.223) 25.475 12.242 ( -11.523 -2.777 8.695) 14.700 12.527 ( -6.142 3.589 -2.781) 7.638 13.287 ( 12.010 1.849 6.111) 13.602 13.656 ( 1.588 0.039 1.045) 1.901 14.046 ( -5.099 3.875 -1.573) 6.594 14.120 ( -6.148 -2.894 5.446) 8.708 14.324 ( 0.207 -0.668 1.344) 1.516 14.628 ( -5.374 -0.027 -14.162) 15.147 15.187 ( 5.229 0.464 -3.400) 6.254 15.659 ( -4.415 0.765 -0.240) 4.487 15.845 ( 1.039 0.055 -1.852) 2.124 16.264 ( 0.271 0.680 -2.124) 2.247 16.486 ( -0.680 -0.955 3.029) 3.248 18.148 ( 2.609 29.150 10.226) 31.002 20.700 ( -4.094 -22.880 3.337) 23.482 21.447 ( 10.540 2.695 0.680) 10.901 21.850 ( 0.863 -6.494 -20.569) 21.587 22.144 ( -1.565 -0.853 4.760) 5.083 ======================= Grid point 14 (9/227) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 7.803 12.463 3.102) 15.028 1.951 ( 12.899 -4.322 -2.052) 13.757 2.562 ( 2.773 -2.379 3.417) 5.003 2.873 ( 4.878 -4.886 0.413) 6.917 3.147 ( 21.533 0.732 -5.112) 22.144 3.437 ( 22.480 0.405 3.195) 22.710 3.541 ( 0.213 0.544 -0.779) 0.974 3.855 ( 18.664 -5.212 -1.701) 19.453 4.301 ( -5.809 -0.344 -2.883) 6.494 4.485 ( 0.182 3.257 -3.670) 4.910 4.652 ( -2.236 -7.683 -8.436) 11.627 4.915 ( -8.902 -5.946 -2.134) 10.915 5.187 ( -2.799 0.742 -4.916) 5.706 5.601 ( 0.416 -2.809 7.931) 8.424 6.017 ( 0.536 1.166 4.105) 4.301 6.600 ( -6.502 1.251 2.456) 7.062 7.409 ( -0.793 -5.362 11.713) 12.907 8.016 ( -0.990 1.956 -2.675) 3.458 8.099 ( -12.591 0.071 7.136) 14.473 9.754 ( -0.757 4.396 7.579) 8.795 9.889 ( -0.397 2.351 2.456) 3.423 10.236 ( -4.701 3.960 -8.331) 10.353 10.326 ( -3.086 -2.749 2.617) 4.892 10.655 ( 1.563 5.506 -7.439) 9.386 10.940 ( -1.261 2.748 -18.979) 19.218 11.196 ( -2.993 -6.243 -4.918) 8.492 11.694 ( 14.492 2.009 24.616) 28.636 12.062 ( -12.820 -2.037 -0.409) 12.988 12.414 ( -3.737 0.923 -1.426) 4.105 13.440 ( 9.429 3.391 4.926) 11.166 13.696 ( 2.393 0.514 2.430) 3.449 13.920 ( -4.873 1.940 -3.301) 6.198 14.007 ( -9.925 -2.053 3.562) 10.743 14.355 ( -0.384 -3.294 1.765) 3.756 14.564 ( -0.555 1.637 -11.007) 11.142 15.260 ( 4.291 0.672 -2.306) 4.918 15.567 ( -5.355 0.713 -0.323) 5.412 15.854 ( 0.253 -0.034 -1.612) 1.632 16.249 ( -0.708 1.333 -4.137) 4.404 16.502 ( -0.106 -2.835 1.682) 3.298 17.931 ( 0.714 20.848 6.100) 21.734 20.832 ( -5.013 -18.301 3.599) 19.314 21.583 ( 10.507 5.428 -0.451) 11.835 21.910 ( -0.121 -5.542 -9.017) 10.584 22.150 ( 1.383 -0.740 2.009) 2.549 ======================= Grid point 15 (10/227) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 3.052 12.801 2.337) 13.366 2.135 ( 4.427 -2.784 -0.432) 5.247 2.655 ( 4.310 -4.668 2.974) 7.016 2.878 ( -1.025 3.634 -0.081) 3.777 3.369 ( 4.476 5.860 -2.187) 7.691 3.609 ( 10.005 -4.078 -3.090) 11.238 3.764 ( 7.552 1.777 3.890) 8.679 4.005 ( 6.128 2.818 5.550) 8.735 4.078 ( -9.768 6.407 -10.850) 15.943 4.514 ( -0.044 -2.824 -2.755) 3.946 4.726 ( -1.913 -6.907 -8.926) 11.447 4.876 ( -3.286 -4.961 -2.499) 6.454 5.254 ( 8.429 -4.519 0.498) 9.577 5.633 ( 1.842 0.737 5.538) 5.882 6.019 ( 1.375 1.181 2.905) 3.424 6.478 ( -7.438 -1.472 2.623) 8.023 7.530 ( 5.180 -9.165 7.842) 13.127 7.905 ( -9.961 1.018 6.728) 12.063 8.022 ( 2.872 0.813 -5.111) 5.919 9.622 ( -4.445 8.404 2.904) 9.940 9.902 ( 2.249 2.005 -3.375) 4.524 10.130 ( -1.704 3.100 -2.142) 4.135 10.337 ( -0.899 -4.851 6.584) 8.227 10.628 ( -0.268 4.435 -6.200) 7.627 10.920 ( 0.153 -2.298 -13.779) 13.970 11.207 ( 0.308 -1.809 -2.768) 3.321 11.725 ( -7.620 4.002 0.061) 8.607 11.977 ( -1.593 -3.866 13.880) 14.496 12.418 ( 5.286 -0.302 1.439) 5.487 13.518 ( 3.148 4.386 1.795) 5.689 13.667 ( -3.237 1.992 2.213) 4.398 13.865 ( -8.200 -1.850 1.528) 8.544 13.921 ( 3.261 -3.386 -2.322) 5.243 14.356 ( -4.053 -4.211 2.472) 6.346 14.568 ( 3.788 3.048 -6.382) 8.023 15.296 ( 0.599 1.048 -0.663) 1.377 15.495 ( -2.293 -0.606 -0.181) 2.379 15.856 ( 0.077 0.012 -0.975) 0.978 16.217 ( -1.794 0.329 -5.588) 5.878 16.526 ( -1.128 -3.100 0.454) 3.330 17.740 ( -4.818 11.526 3.552) 12.988 20.916 ( -4.353 -13.716 2.860) 14.672 21.657 ( 5.406 6.662 -2.293) 8.881 21.973 ( 3.828 -2.575 -0.274) 4.622 22.201 ( 4.879 1.454 -0.564) 5.122 ======================= Grid point 16 (11/227) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( 0.905 10.376 2.239) 10.653 2.133 ( -4.775 2.852 -0.105) 5.563 2.767 ( 1.509 -1.426 2.261) 3.069 2.830 ( 3.922 4.381 -2.418) 6.358 3.324 ( -3.383 2.606 8.994) 9.956 3.497 ( -22.046 7.226 -2.963) 23.389 3.772 ( 1.702 5.143 -4.290) 6.911 3.855 ( -4.007 2.270 -9.124) 10.221 4.271 ( 16.546 0.458 6.978) 17.963 4.489 ( -4.648 0.192 -1.568) 4.910 4.785 ( 1.030 -6.830 -4.056) 8.010 4.884 ( 1.011 -4.787 -5.462) 7.332 5.351 ( 0.918 6.262 1.271) 6.455 5.674 ( 4.595 1.289 2.556) 5.414 6.029 ( 0.920 1.560 1.664) 2.459 6.443 ( -1.709 -6.958 1.095) 7.248 7.688 ( 1.242 1.983 -0.544) 2.402 7.781 ( -2.513 -7.194 10.698) 13.134 8.098 ( 6.975 -0.333 -7.697) 10.392 9.524 ( -0.160 0.947 -5.302) 5.389 9.898 ( 0.734 3.060 -4.726) 5.678 10.139 ( 4.287 0.159 6.441) 7.739 10.383 ( -0.585 -5.346 7.934) 9.585 10.556 ( -2.250 4.047 -5.767) 7.396 10.931 ( -1.534 -0.901 -6.393) 6.635 11.270 ( 6.372 -0.507 -1.229) 6.509 11.543 ( -11.350 -2.050 -14.331) 18.396 11.981 ( -2.844 -4.777 15.886) 16.831 12.557 ( 10.916 2.899 5.692) 12.647 13.413 ( -8.673 4.328 -3.724) 10.384 13.607 ( -5.722 -2.503 1.452) 6.412 13.827 ( 1.064 -3.007 4.312) 5.364 14.042 ( 7.234 -2.031 -4.171) 8.594 14.319 ( -5.110 -3.510 3.579) 7.159 14.607 ( 4.737 2.795 -2.365) 5.987 15.255 ( -3.626 1.030 1.455) 4.041 15.509 ( 1.143 -2.509 0.731) 2.853 15.856 ( 0.156 0.486 -0.690) 0.858 16.186 ( -2.425 -1.776 -6.166) 6.860 16.519 ( -3.054 -2.162 0.115) 3.744 17.534 ( -11.342 3.767 1.119) 12.003 20.973 ( -3.562 -10.540 1.953) 11.296 21.631 ( -0.024 6.014 -2.460) 6.497 22.088 ( 9.084 1.719 0.693) 9.271 22.272 ( 7.811 5.083 1.310) 9.410 ======================= Grid point 17 (12/227) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.325 ( -0.716 8.810 2.699) 9.242 1.933 ( -11.369 9.564 0.603) 14.869 2.684 ( -6.984 11.555 -3.364) 13.914 2.904 ( 0.894 0.459 0.385) 1.077 3.025 ( -13.449 7.152 -0.433) 15.239 3.234 ( -12.566 0.398 6.708) 14.250 3.570 ( -9.145 7.643 -1.650) 12.032 3.867 ( 1.624 3.340 -4.723) 6.009 4.382 ( -3.064 6.570 -4.215) 8.386 4.483 ( 7.820 -2.318 3.015) 8.695 4.826 ( 3.220 2.441 4.293) 5.895 5.049 ( 6.758 -9.793 -6.005) 13.328 5.230 ( -2.263 9.110 0.474) 9.399 5.734 ( 4.266 2.260 -2.593) 5.480 6.042 ( 2.218 -0.082 3.494) 4.139 6.492 ( -2.729 -6.436 0.581) 7.014 7.575 ( -4.019 5.319 -0.969) 6.737 7.914 ( 4.116 -6.457 3.406) 8.381 8.247 ( 9.148 -3.056 -6.868) 11.841 9.605 ( 4.516 -8.467 -10.392) 14.144 9.870 ( 0.647 3.672 -3.146) 4.879 10.245 ( 5.873 -2.081 12.161) 13.664 10.420 ( -1.514 -4.681 7.166) 8.692 10.489 ( -1.257 2.337 -5.528) 6.132 10.906 ( 0.343 1.131 1.264) 1.730 11.381 ( -8.579 -2.519 -12.956) 15.742 11.398 ( 6.590 1.352 -4.986) 8.374 12.047 ( 1.382 -10.811 12.954) 16.929 12.673 ( 8.694 7.202 4.135) 12.023 13.199 ( -13.324 0.793 -4.902) 14.219 13.541 ( -6.757 -5.531 -1.769) 8.910 13.920 ( 5.429 -2.691 5.052) 7.889 14.171 ( 5.553 -0.626 -4.775) 7.350 14.276 ( -2.671 -2.863 2.479) 4.634 14.669 ( 5.624 1.569 1.334) 5.989 15.173 ( -5.431 0.671 4.644) 7.177 15.558 ( -0.019 -4.483 1.691) 4.792 15.848 ( -0.223 0.955 -1.146) 1.508 16.171 ( -2.681 -4.058 -6.242) 7.913 16.470 ( -4.966 -1.163 0.898) 5.179 17.288 ( -17.865 -2.086 -1.164) 18.024 21.014 ( -3.010 -8.431 1.040) 9.012 21.553 ( -1.574 6.067 -2.657) 6.807 22.204 ( 7.391 3.643 -3.945) 9.136 22.375 ( 14.998 10.201 8.346) 19.967 ======================= Grid point 18 (13/227) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( -1.465 12.451 3.356) 12.978 1.594 ( -13.700 16.301 2.473) 21.436 2.203 ( -26.295 16.870 -6.341) 31.879 2.771 ( -22.556 13.903 5.130) 26.989 2.872 ( -1.857 12.136 -3.878) 12.875 3.051 ( 5.759 -1.637 1.698) 6.223 3.417 ( -5.341 0.242 4.651) 7.086 3.823 ( -2.467 3.230 -3.051) 5.082 4.287 ( 5.594 12.406 -9.831) 16.789 4.600 ( 3.907 -1.884 0.765) 4.404 4.863 ( 3.663 3.267 8.003) 9.388 5.141 ( 2.274 2.078 -1.272) 3.333 5.265 ( 5.653 -6.723 -0.569) 8.802 5.745 ( 1.879 6.104 -5.008) 8.117 6.098 ( 3.058 0.451 5.866) 6.631 6.475 ( -6.864 -8.402 0.500) 10.861 7.495 ( -1.605 0.853 -4.622) 4.966 8.031 ( 3.462 -4.730 0.928) 5.934 8.434 ( 8.016 -5.579 -5.941) 11.432 9.724 ( 0.099 -2.613 -9.472) 9.826 9.889 ( 3.532 -2.572 -2.769) 5.173 10.343 ( 1.747 -3.207 16.902) 17.292 10.439 ( -1.348 -4.871 2.270) 5.540 10.485 ( 2.259 -1.133 -6.689) 7.151 10.945 ( 3.847 0.042 9.443) 10.196 11.255 ( -1.556 4.287 -12.868) 13.653 11.506 ( 7.669 3.321 -0.456) 8.370 12.238 ( 4.007 -15.499 7.817) 17.815 12.702 ( 6.177 10.217 0.367) 11.945 12.976 ( -15.078 -3.351 -5.414) 16.368 13.500 ( -6.206 -7.605 -5.196) 11.107 14.040 ( 5.424 -2.454 3.457) 6.883 14.164 ( -4.184 -0.554 -1.094) 4.360 14.356 ( 7.023 -1.032 -3.502) 7.915 14.759 ( 6.311 0.351 4.543) 7.784 15.064 ( -8.053 -0.120 9.590) 12.523 15.593 ( -2.439 -6.531 1.177) 7.070 15.825 ( -1.365 0.921 -1.665) 2.342 16.168 ( -4.969 -7.159 -6.937) 11.138 16.381 ( -7.300 -0.913 3.134) 7.996 16.990 ( -21.916 -3.886 -2.702) 22.421 21.045 ( -2.659 -7.061 0.255) 7.549 21.467 ( -0.806 6.354 -3.423) 7.262 22.249 ( 3.616 4.027 -4.508) 7.043 22.576 ( 24.488 14.996 12.083) 31.154 ======================= Grid point 19 (14/227) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( 0.648 25.165 3.234) 25.380 1.165 ( -12.488 26.379 3.292) 29.371 1.664 ( -17.993 11.467 -7.515) 22.621 1.983 ( -32.925 37.327 4.136) 49.944 2.868 ( 5.351 6.323 -3.237) 8.893 3.197 ( 8.720 -2.953 -0.039) 9.206 3.363 ( -2.785 -2.840 4.883) 6.298 3.719 ( -7.283 1.137 -0.009) 7.372 4.371 ( 22.634 13.416 -18.853) 32.368 4.636 ( 1.451 4.074 -1.248) 4.501 4.871 ( -1.501 -0.710 15.368) 15.457 5.207 ( 6.798 0.840 -0.856) 6.903 5.398 ( 3.171 -4.996 0.591) 5.947 5.673 ( -2.994 6.459 1.250) 7.228 6.042 ( -8.632 4.098 2.995) 10.014 6.525 ( 1.222 -12.330 1.740) 12.512 7.481 ( -3.226 -4.142 -7.509) 9.162 8.126 ( 2.494 -4.274 0.465) 4.971 8.597 ( 4.190 -6.827 -4.024) 8.964 9.695 ( -1.825 1.946 -3.059) 4.058 9.929 ( -1.785 -0.108 -0.618) 1.892 10.414 ( 2.680 -3.304 3.065) 5.244 10.479 ( -1.148 -6.759 1.680) 7.059 10.576 ( 2.732 -8.439 -0.318) 8.876 10.954 ( -2.321 1.670 5.408) 6.118 11.315 ( 16.488 10.580 4.010) 19.996 11.607 ( 14.157 6.667 -0.482) 15.656 12.439 ( -0.972 -15.265 1.372) 15.358 12.712 ( 5.359 6.645 0.225) 8.540 12.775 ( -11.259 -3.229 -8.293) 14.351 13.481 ( -7.473 -10.959 -8.769) 15.901 14.077 ( -4.121 0.963 -8.038) 9.084 14.148 ( 2.285 -2.659 3.580) 5.011 14.462 ( 5.005 0.227 -2.869) 5.773 14.858 ( 3.918 -0.851 0.090) 4.010 14.913 ( -11.627 -0.992 22.370) 25.231 15.605 ( -6.622 -9.132 -1.702) 11.408 15.789 ( -1.847 0.470 -1.462) 2.402 16.053 ( -24.717 -10.796 -4.905) 27.414 16.282 ( -1.984 1.287 2.775) 3.646 16.696 ( -12.343 2.199 -2.350) 12.755 21.072 ( -1.943 -6.053 -0.183) 6.360 21.405 ( 0.839 5.660 -3.804) 6.871 22.251 ( 1.597 3.575 -2.444) 4.616 22.896 ( 32.844 14.686 12.471) 38.078 ======================= Grid point 20 (15/227) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.678 ( -0.000 32.609 0.000) 32.609 0.786 ( -0.000 37.861 0.000) 37.861 1.133 ( -0.000 53.050 0.000) 53.050 1.443 ( -0.000 4.812 0.000) 4.812 2.867 ( -0.000 3.777 0.000) 3.777 3.320 ( 0.000 -5.818 -0.000) 5.818 3.421 ( 0.000 -3.162 -0.000) 3.162 3.608 ( -0.000 1.478 0.000) 1.478 4.574 ( -0.000 6.545 0.000) 6.545 4.739 ( -0.000 4.221 0.000) 4.221 4.799 ( 0.000 -9.084 -0.000) 9.084 5.326 ( 0.000 -1.035 -0.000) 1.035 5.450 ( -0.000 12.804 0.000) 12.804 5.467 ( 0.000 -3.499 -0.000) 3.499 5.863 ( -0.000 5.237 0.000) 5.237 6.689 ( 0.000 -10.468 -0.000) 10.468 7.448 ( 0.000 -1.611 -0.000) 1.611 8.188 ( 0.000 -3.364 -0.000) 3.364 8.695 ( 0.000 -5.883 -0.000) 5.883 9.654 ( -0.000 1.862 0.000) 1.862 9.877 ( -0.000 3.181 0.000) 3.181 10.458 ( 0.000 -0.483 -0.000) 0.483 10.553 ( 0.000 -9.691 -0.000) 9.691 10.716 ( 0.000 -11.909 -0.000) 11.909 10.897 ( -0.000 4.288 0.000) 4.288 11.367 ( -0.000 9.361 0.000) 9.361 11.923 ( -0.000 0.466 0.000) 0.466 12.434 ( 0.000 -8.584 -0.000) 8.584 12.646 ( 0.000 -2.615 -0.000) 2.615 12.818 ( -0.000 1.146 0.000) 1.146 13.483 ( 0.000 -12.048 -0.000) 12.048 13.977 ( -0.000 5.039 0.000) 5.039 14.192 ( 0.000 -1.788 -0.000) 1.788 14.500 ( -0.000 0.825 0.000) 0.825 14.708 ( -0.000 2.422 0.000) 2.422 14.916 ( -0.000 0.841 0.000) 0.841 15.515 ( 0.000 -3.138 -0.000) 3.138 15.775 ( 0.000 -0.787 -0.000) 0.787 15.785 ( -0.000 4.954 0.000) 4.954 16.273 ( 0.000 -0.176 -0.000) 0.176 16.570 ( -0.000 4.347 0.000) 4.347 21.110 ( 0.000 -5.012 -0.000) 5.012 21.372 ( -0.000 3.708 0.000) 3.708 22.232 ( -0.000 2.469 0.000) 2.469 23.249 ( 0.000 -1.555 -0.000) 1.555 ======================= Grid point 23 (16/227) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( 12.127 0.000 3.581) 12.645 1.889 ( 8.781 0.000 -0.768) 8.815 2.548 ( 0.912 0.000 4.771) 4.858 2.790 ( 13.021 0.000 -3.952) 13.608 3.160 ( 24.639 0.000 2.053) 24.724 3.479 ( 16.980 0.000 -4.742) 17.629 3.573 ( -0.001 -0.000 -2.578) 2.578 3.741 ( 33.580 0.000 -0.815) 33.589 4.286 ( -2.788 -0.000 -0.290) 2.803 4.540 ( -2.199 -0.000 -6.249) 6.625 4.570 ( -6.351 -0.000 -5.070) 8.127 4.840 ( -11.658 -0.000 -5.293) 12.803 5.192 ( -4.872 -0.000 -7.477) 8.924 5.567 ( 1.977 0.000 9.597) 9.799 6.033 ( 1.459 0.000 5.523) 5.713 6.609 ( -7.943 -0.000 1.015) 8.007 7.356 ( -3.359 -0.000 15.353) 15.716 8.034 ( -1.715 -0.000 -1.075) 2.024 8.099 ( -12.736 -0.000 6.593) 14.342 9.799 ( 4.794 0.000 -0.424) 4.813 9.908 ( -4.045 -0.000 12.701) 13.329 10.289 ( -5.049 -0.000 -5.219) 7.262 10.291 ( -0.697 -0.000 -1.363) 1.531 10.752 ( -5.779 -0.000 -8.092) 9.944 10.966 ( -0.947 -0.000 -28.510) 28.526 11.104 ( 0.304 0.000 -4.570) 4.580 11.707 ( 16.123 0.000 27.222) 31.639 12.036 ( -12.698 -0.000 6.880) 14.442 12.434 ( -6.016 -0.000 -4.058) 7.257 13.486 ( 10.496 0.000 6.121) 12.150 13.688 ( 2.619 0.000 1.376) 2.959 13.942 ( -11.545 -0.000 7.111) 13.559 13.993 ( -5.614 -0.000 -6.796) 8.815 14.309 ( -1.895 -0.000 2.861) 3.431 14.584 ( 0.539 0.000 -12.711) 12.722 15.268 ( 4.398 0.000 -2.514) 5.065 15.574 ( -5.928 -0.000 -0.071) 5.928 15.852 ( 0.061 0.000 -3.064) 3.064 16.269 ( -0.392 -0.000 -3.900) 3.920 16.463 ( -1.090 -0.000 1.460) 1.822 18.200 ( -9.358 -0.000 8.714) 12.787 20.590 ( 1.595 0.000 1.110) 1.943 21.659 ( 12.875 0.000 1.089) 12.921 21.838 ( 0.419 0.000 -10.347) 10.356 22.144 ( 2.468 0.000 2.039) 3.201 ======================= Grid point 24 (17/227) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 5.114 13.164 3.194) 14.479 2.036 ( 4.903 -7.162 -0.567) 8.698 2.592 ( 3.447 -1.566 4.336) 5.756 2.906 ( 3.642 -0.151 -0.504) 3.680 3.487 ( -2.405 3.738 0.136) 4.447 3.575 ( 19.596 0.596 -6.141) 20.544 3.797 ( 17.830 1.517 -1.518) 17.959 4.057 ( -1.907 1.410 3.142) 3.937 4.193 ( -0.953 3.473 -6.202) 7.172 4.431 ( -8.598 -3.068 -8.217) 12.283 4.640 ( -3.217 -2.139 -6.001) 7.137 4.750 ( 11.305 -5.146 -0.751) 12.444 5.158 ( 1.439 -3.539 -6.317) 7.382 5.636 ( 4.814 -0.172 8.779) 10.014 6.049 ( 1.214 1.189 4.419) 4.735 6.450 ( -11.549 -0.906 3.557) 12.118 7.387 ( 4.243 -4.013 11.501) 12.899 7.914 ( -10.062 0.105 7.534) 12.570 8.030 ( 1.551 0.078 -3.093) 3.461 9.788 ( -2.751 7.303 3.241) 8.450 9.900 ( 0.526 -3.185 1.334) 3.492 10.201 ( -2.528 2.852 -5.132) 6.393 10.283 ( -0.759 -0.617 3.764) 3.889 10.679 ( -1.275 0.750 -4.912) 5.130 10.899 ( -4.628 0.120 -24.147) 24.587 11.157 ( 4.047 -2.114 -6.680) 8.091 11.805 ( -12.382 2.799 3.044) 13.055 11.915 ( 2.625 -1.933 21.620) 21.864 12.398 ( 3.487 -1.012 1.726) 4.020 13.616 ( 6.670 4.159 5.063) 9.350 13.704 ( -5.732 1.708 3.671) 7.018 13.778 ( -7.264 -5.159 3.282) 9.495 13.904 ( -1.364 0.694 -6.521) 6.698 14.280 ( -3.138 -2.613 2.588) 4.835 14.611 ( 3.278 1.124 -8.326) 9.018 15.318 ( 1.806 0.827 -0.942) 2.198 15.482 ( -4.963 -0.549 -0.148) 4.996 15.853 ( 0.330 -0.195 -3.986) 4.004 16.237 ( -2.450 1.267 -6.005) 6.608 16.460 ( -1.092 -2.546 -0.204) 2.777 17.968 ( -12.653 7.966 6.283) 16.218 20.664 ( 0.651 -8.365 1.723) 8.566 21.782 ( 2.092 5.225 -1.523) 5.830 21.905 ( 8.902 -3.813 0.444) 9.694 22.228 ( 7.746 0.851 -1.808) 8.000 ======================= Grid point 25 (18/227) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( 2.654 15.438 2.156) 15.812 2.134 ( -0.330 -3.300 -0.706) 3.391 2.693 ( 5.124 -3.424 4.036) 7.366 2.945 ( 4.024 4.190 -2.888) 6.488 3.353 ( -9.030 1.080 6.585) 11.229 3.645 ( -15.272 6.572 0.134) 16.627 3.874 ( 9.887 6.744 -3.117) 12.367 3.966 ( -8.013 6.581 -11.374) 15.391 4.263 ( 9.666 -2.780 2.068) 10.269 4.416 ( -1.546 -8.488 -5.880) 10.441 4.598 ( 0.645 -6.586 -6.624) 9.363 4.922 ( 7.704 7.467 -4.981) 11.828 5.357 ( 10.236 -6.109 -0.708) 11.941 5.709 ( 4.495 1.766 5.865) 7.597 6.063 ( 1.398 1.610 3.658) 4.234 6.296 ( -9.149 -6.343 5.109) 12.249 7.564 ( 8.686 -7.261 7.750) 13.720 7.773 ( -6.960 1.029 6.497) 9.576 8.082 ( 4.351 -1.036 -5.273) 6.915 9.632 ( -4.916 8.304 -5.170) 10.948 9.925 ( -0.338 -1.880 -0.110) 1.913 10.175 ( 3.194 3.465 -0.214) 4.717 10.294 ( -0.229 -2.743 7.147) 7.659 10.637 ( -2.316 3.739 -6.619) 7.947 10.862 ( -1.108 -5.178 -16.675) 17.495 11.263 ( 7.886 -0.326 -3.768) 8.746 11.553 ( -13.724 2.368 -4.189) 14.543 11.904 ( -5.463 -2.677 13.112) 14.455 12.550 ( 9.691 -2.540 10.273) 14.349 13.538 ( -11.393 1.939 1.159) 11.615 13.548 ( -8.522 1.597 0.917) 8.719 13.783 ( 3.785 -1.013 3.865) 5.504 13.989 ( 7.492 -2.646 -2.799) 8.424 14.256 ( -3.470 -2.676 2.922) 5.266 14.650 ( 3.373 1.434 -4.966) 6.172 15.290 ( -2.931 2.329 1.178) 3.925 15.448 ( -1.890 -3.353 0.585) 3.893 15.867 ( 1.581 0.480 -4.574) 4.863 16.170 ( -4.034 0.279 -7.956) 8.924 16.465 ( -1.973 -2.842 -0.789) 3.548 17.661 ( -15.605 6.900 4.377) 17.615 20.757 ( -0.472 -9.332 1.945) 9.544 21.727 ( -2.439 3.353 0.719) 4.208 22.103 ( 11.911 0.094 0.442) 11.920 22.361 ( 10.941 3.332 -1.717) 11.565 ======================= Grid point 26 (19/227) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 2.501 15.011 2.169) 15.372 2.084 ( -4.723 4.475 -2.034) 6.817 2.800 ( 3.914 -1.074 2.558) 4.798 2.966 ( 5.380 5.967 -4.604) 9.260 3.188 ( -13.895 -0.662 14.099) 19.807 3.220 ( -20.949 10.094 -4.560) 23.697 3.721 ( -9.847 6.679 -5.627) 13.162 3.931 ( 0.337 3.512 -2.289) 4.205 4.372 ( -0.889 -9.270 -0.897) 9.355 4.474 ( 4.491 0.476 -4.415) 6.316 4.828 ( 11.381 -9.314 -9.028) 17.257 4.954 ( 10.250 11.114 -1.552) 15.198 5.425 ( -0.682 7.509 -0.739) 7.576 5.760 ( 3.747 1.001 2.615) 4.678 6.026 ( -3.712 -1.115 4.864) 6.219 6.341 ( 0.965 -8.933 4.473) 10.036 7.654 ( -5.505 2.157 5.732) 8.235 7.782 ( 7.671 -5.968 2.629) 10.069 8.185 ( 5.969 -2.942 -6.224) 9.112 9.521 ( -1.313 0.773 -10.092) 10.207 9.932 ( 0.338 0.740 1.794) 1.969 10.225 ( 4.839 0.485 2.135) 5.311 10.321 ( -1.269 -3.830 7.455) 8.477 10.550 ( -2.512 3.399 -8.889) 9.843 10.912 ( 2.368 -1.772 -7.473) 8.037 11.343 ( -9.065 -0.727 -5.315) 10.533 11.416 ( 10.325 0.964 -3.840) 11.058 11.866 ( -4.127 -6.821 10.401) 13.105 12.709 ( 4.883 -2.949 8.424) 10.174 13.286 ( -13.141 5.685 -0.582) 14.330 13.426 ( -8.705 -4.588 -0.282) 9.844 13.878 ( 5.751 -1.149 4.751) 7.547 14.143 ( 7.339 -1.827 -3.039) 8.150 14.224 ( -2.400 -2.155 2.851) 4.305 14.694 ( 3.780 0.877 -2.894) 4.841 15.202 ( -4.884 2.206 4.396) 6.931 15.459 ( -2.524 -5.053 1.629) 5.879 15.880 ( 1.382 2.071 -4.504) 5.147 16.107 ( -4.079 -2.131 -9.512) 10.567 16.445 ( -3.087 -1.437 0.258) 3.415 17.331 ( -17.866 4.367 2.523) 18.564 20.834 ( -1.150 -8.536 1.668) 8.773 21.648 ( -2.876 3.507 1.069) 4.660 22.268 ( 9.220 2.687 -2.200) 9.852 22.526 ( 14.846 4.930 1.834) 15.750 ======================= Grid point 27 (20/227) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( 2.770 13.797 2.667) 14.323 1.909 ( -4.166 14.050 -2.634) 14.890 2.610 ( -19.734 21.714 -3.926) 29.603 2.896 ( -5.565 2.837 4.081) 7.462 2.985 ( -7.431 -2.490 3.609) 8.628 3.033 ( 1.040 0.354 -0.834) 1.379 3.512 ( -6.952 7.226 0.566) 10.044 3.848 ( -6.524 1.098 -0.513) 6.635 4.467 ( -0.042 -11.057 -0.625) 11.074 4.539 ( 9.082 9.065 -6.804) 14.524 4.948 ( 2.757 2.485 -6.290) 7.303 5.145 ( 15.308 1.204 -0.233) 15.357 5.286 ( -0.985 10.002 -1.326) 10.137 5.823 ( 4.540 0.720 -2.550) 5.257 6.019 ( -2.265 -6.992 7.732) 10.667 6.375 ( -5.252 -2.148 3.829) 6.845 7.544 ( -4.195 3.400 1.923) 5.732 7.933 ( 4.364 -4.773 0.799) 6.517 8.320 ( 5.338 -5.255 -5.389) 9.228 9.571 ( 1.864 -8.167 -10.594) 13.506 9.928 ( 1.840 2.705 1.929) 3.798 10.294 ( 1.410 -1.378 8.442) 8.669 10.332 ( -2.544 -5.224 1.319) 5.958 10.494 ( -0.687 1.799 -7.923) 8.153 10.958 ( 2.622 0.942 0.989) 2.956 11.292 ( 3.181 -1.351 -9.087) 9.722 11.561 ( 9.222 3.024 -0.201) 9.707 11.945 ( 1.452 -12.436 8.943) 15.386 12.753 ( -5.462 -5.195 2.119) 7.831 13.033 ( -7.970 7.800 1.110) 11.207 13.343 ( -8.760 -6.767 -3.430) 11.589 13.990 ( 5.375 -2.250 4.590) 7.417 14.152 ( -3.683 -0.623 -0.003) 3.736 14.327 ( 8.318 -1.644 -2.038) 8.721 14.760 ( 4.816 -0.190 -1.811) 5.148 15.086 ( -7.247 2.080 10.208) 12.691 15.463 ( -3.668 -5.922 0.501) 6.984 15.857 ( -1.315 2.198 -4.196) 4.916 16.071 ( -3.461 -2.632 -9.900) 10.812 16.392 ( -3.933 0.716 3.179) 5.107 17.006 ( -16.580 3.092 0.401) 16.871 20.893 ( -1.502 -7.528 1.101) 7.755 21.568 ( -2.197 3.964 0.330) 4.544 22.343 ( 5.129 5.036 -3.276) 7.899 22.754 ( 18.164 4.168 4.413) 19.152 ======================= Grid point 28 (21/227) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( 1.058 12.745 2.611) 13.053 1.701 ( 3.685 25.003 -1.952) 25.349 2.051 ( -16.315 25.376 -3.767) 30.403 2.530 ( -22.026 15.331 5.480) 27.390 3.005 ( 5.147 4.023 -3.051) 7.210 3.115 ( 3.977 -4.226 -0.823) 5.861 3.357 ( -4.075 4.467 4.464) 7.516 3.721 ( -7.463 0.408 0.004) 7.474 4.567 ( 3.027 -3.570 2.328) 5.227 4.608 ( 9.359 5.085 -11.717) 15.835 4.897 ( -4.931 2.757 1.680) 5.894 5.259 ( 3.472 -2.652 -0.956) 4.473 5.375 ( 17.319 9.864 -2.615) 20.101 5.838 ( 0.617 7.379 -0.717) 7.439 6.082 ( -2.947 -5.037 5.607) 8.093 6.257 ( -8.911 -8.251 2.337) 12.367 7.461 ( -2.694 1.705 -0.819) 3.292 8.033 ( 2.354 -4.620 0.427) 5.203 8.450 ( 2.777 -7.252 -3.522) 8.527 9.659 ( -1.185 -6.408 -6.038) 8.883 9.955 ( 3.752 2.641 -0.845) 4.665 10.307 ( -0.928 -3.651 13.991) 14.489 10.363 ( -2.252 -8.322 -6.288) 10.671 10.481 ( 0.412 0.335 -4.848) 4.877 10.966 ( -0.906 -0.099 1.642) 1.877 11.464 ( 15.005 2.780 0.275) 15.263 11.682 ( 11.932 2.170 -2.762) 12.438 12.117 ( -0.294 -14.568 5.738) 15.660 12.633 ( -14.196 -6.975 -2.190) 15.968 12.920 ( 4.076 8.790 3.604) 10.337 13.259 ( -11.445 -9.594 -7.549) 16.734 14.089 ( 0.676 -2.373 4.522) 5.152 14.095 ( -0.697 -0.122 -3.232) 3.309 14.457 ( 5.638 -0.644 -1.957) 6.002 14.839 ( 2.708 -0.337 -7.205) 7.704 14.941 ( -6.591 2.345 20.461) 21.623 15.458 ( -4.106 -5.565 -2.491) 7.351 15.801 ( -3.061 0.841 -3.480) 4.710 16.003 ( -5.879 1.451 -5.604) 8.251 16.319 ( -2.469 2.030 3.922) 5.060 16.761 ( -8.546 3.338 -1.215) 9.254 20.941 ( -1.272 -6.719 0.463) 6.854 21.501 ( -0.976 4.162 -0.446) 4.298 22.345 ( 2.192 5.682 -2.078) 6.435 23.020 ( 16.384 0.907 4.221) 16.944 ======================= Grid point 29 (22/227) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( -0.000 19.604 0.000) 19.604 1.491 ( -0.000 31.619 0.000) 31.619 1.664 ( -0.000 20.125 0.000) 20.125 2.033 ( -0.000 33.790 0.000) 33.790 2.995 ( -0.000 8.388 0.000) 8.388 3.196 ( 0.000 -6.006 -0.000) 6.006 3.338 ( 0.000 -3.746 -0.000) 3.746 3.633 ( -0.000 1.272 0.000) 1.272 4.647 ( 0.000 -2.735 -0.000) 2.735 4.697 ( -0.000 0.838 0.000) 0.838 4.790 ( -0.000 1.383 0.000) 1.383 5.345 ( 0.000 -5.148 -0.000) 5.148 5.464 ( -0.000 12.452 0.000) 12.452 5.697 ( -0.000 10.877 0.000) 10.877 5.971 ( -0.000 4.889 0.000) 4.889 6.387 ( 0.000 -18.838 -0.000) 18.838 7.426 ( -0.000 0.065 0.000) 0.065 8.102 ( 0.000 -4.803 -0.000) 4.803 8.549 ( 0.000 -7.968 -0.000) 7.968 9.675 ( 0.000 -1.201 -0.000) 1.201 9.949 ( -0.000 4.005 0.000) 4.005 10.370 ( 0.000 -7.562 -0.000) 7.562 10.425 ( 0.000 -6.381 -0.000) 6.381 10.500 ( 0.000 -5.336 -0.000) 5.336 10.950 ( -0.000 1.106 0.000) 1.106 11.536 ( -0.000 6.611 0.000) 6.611 11.936 ( -0.000 0.873 0.000) 0.873 12.166 ( 0.000 -16.658 -0.000) 16.658 12.555 ( 0.000 -5.645 -0.000) 5.645 12.920 ( -0.000 7.991 0.000) 7.991 13.225 ( 0.000 -13.042 -0.000) 13.042 14.047 ( -0.000 1.945 0.000) 1.945 14.147 ( 0.000 -2.537 -0.000) 2.537 14.508 ( 0.000 -0.031 -0.000) 0.031 14.776 ( -0.000 4.163 0.000) 4.163 14.928 ( -0.000 0.070 0.000) 0.070 15.451 ( 0.000 -3.260 -0.000) 3.260 15.763 ( 0.000 -0.134 -0.000) 0.134 15.895 ( -0.000 5.716 0.000) 5.716 16.286 ( -0.000 1.383 0.000) 1.383 16.659 ( -0.000 3.968 0.000) 3.968 20.994 ( 0.000 -6.295 -0.000) 6.295 21.452 ( -0.000 4.084 0.000) 4.084 22.307 ( -0.000 4.967 0.000) 4.967 23.201 ( 0.000 -3.157 -0.000) 3.157 ======================= Grid point 34 (23/227) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 0.975 0.000 4.883) 4.980 2.021 ( 2.590 0.000 -3.922) 4.700 2.655 ( 5.294 0.000 4.934) 7.236 2.984 ( 5.022 0.000 -2.464) 5.594 3.369 ( -10.827 -0.000 2.980) 11.230 3.722 ( -9.693 -0.000 0.806) 9.726 4.010 ( 4.514 0.000 -0.989) 4.621 4.035 ( 2.836 0.000 -3.602) 4.584 4.203 ( -5.448 -0.000 -7.536) 9.299 4.262 ( -1.326 -0.000 -12.438) 12.508 4.545 ( 3.093 0.000 -1.834) 3.596 5.119 ( 23.457 0.000 0.020) 23.457 5.171 ( 5.344 0.000 -7.314) 9.058 5.728 ( 5.103 0.000 7.023) 8.681 6.082 ( 2.176 0.000 4.482) 4.982 6.229 ( -14.191 -0.000 6.745) 15.712 7.486 ( 9.483 0.000 8.164) 12.513 7.782 ( -6.525 -0.000 7.116) 9.655 8.069 ( 3.417 0.000 -3.804) 5.114 9.776 ( -7.724 -0.000 -15.684) 17.483 9.846 ( 0.065 0.000 12.592) 12.593 10.234 ( 3.770 0.000 -0.229) 3.777 10.262 ( -1.587 -0.000 4.673) 4.935 10.692 ( 3.548 0.000 -4.271) 5.553 10.783 ( -7.275 -0.000 -23.196) 24.310 11.259 ( 9.273 0.000 -5.726) 10.898 11.587 ( -14.416 -0.000 1.150) 14.462 11.877 ( -6.360 -0.000 10.678) 12.428 12.513 ( 8.861 0.000 11.634) 14.624 13.498 ( -14.270 -0.000 1.671) 14.368 13.631 ( -9.453 -0.000 2.189) 9.703 13.775 ( 6.519 0.000 4.867) 8.135 13.958 ( 7.487 0.000 -2.665) 7.947 14.225 ( -2.373 -0.000 2.376) 3.359 14.664 ( 2.827 0.000 -5.813) 6.464 15.328 ( -1.562 -0.000 1.812) 2.392 15.399 ( -4.168 -0.000 -0.474) 4.195 15.872 ( 2.462 0.000 -7.238) 7.645 16.179 ( -5.088 -0.000 -7.169) 8.791 16.430 ( -0.984 -0.000 -1.424) 1.731 17.742 ( -18.520 -0.000 5.713) 19.381 20.654 ( 2.053 0.000 1.572) 2.586 21.761 ( -3.759 -0.000 2.091) 4.302 22.103 ( 13.446 0.000 0.839) 13.472 22.396 ( 11.545 0.000 -3.260) 11.997 ======================= Grid point 35 (24/227) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -1.264 10.285 2.574) 10.677 2.091 ( 0.994 -3.011 -3.950) 5.065 2.765 ( 6.555 -1.310 4.684) 8.163 3.033 ( 1.012 1.045 -3.969) 4.227 3.159 ( -14.435 -0.150 5.900) 15.595 3.474 ( -12.222 9.826 1.956) 15.804 3.846 ( -12.132 6.352 -8.201) 15.963 3.999 ( -3.423 2.536 1.089) 4.397 4.136 ( -8.502 -12.186 -6.126) 16.072 4.398 ( 7.545 -4.714 -7.616) 11.712 4.740 ( 16.285 -0.805 -4.793) 16.994 5.217 ( 12.297 12.406 -4.506) 18.040 5.462 ( 9.129 -3.671 -2.088) 10.059 5.788 ( 2.191 1.184 4.935) 5.528 6.014 ( -9.958 -0.063 6.527) 11.907 6.170 ( 4.284 -6.011 6.175) 9.624 7.661 ( 6.251 -0.950 6.741) 9.242 7.707 ( -0.554 -1.136 4.458) 4.634 8.139 ( 4.400 -1.385 -4.976) 6.786 9.596 ( -7.731 4.560 -14.709) 17.231 9.885 ( 0.386 -3.675 10.221) 10.869 10.234 ( -1.279 -0.254 0.412) 1.367 10.298 ( 3.397 0.814 3.360) 4.846 10.634 ( -3.878 4.619 -15.771) 16.884 10.828 ( 6.638 -5.255 -7.808) 11.517 11.350 ( -12.632 0.719 -3.286) 13.072 11.440 ( 12.609 0.987 1.873) 12.786 11.776 ( -6.282 -2.173 5.994) 8.951 12.633 ( 2.276 -2.815 8.994) 9.696 13.279 ( -14.241 -2.731 -1.252) 14.554 13.455 ( -8.597 3.353 5.576) 10.782 13.871 ( 5.309 0.114 4.295) 6.830 14.114 ( 9.946 -0.853 -0.439) 9.992 14.191 ( -2.536 -1.002 2.053) 3.414 14.704 ( 2.669 0.203 -4.656) 5.370 15.257 ( -4.544 2.909 4.048) 6.745 15.365 ( -3.087 -3.858 0.167) 4.944 15.919 ( 3.772 1.326 -8.933) 9.787 16.080 ( -6.277 -0.690 -8.250) 10.390 16.418 ( -1.372 -0.965 -0.769) 1.845 17.409 ( -19.954 2.479 4.886) 20.693 20.705 ( 1.390 -3.622 1.579) 4.189 21.695 ( -3.477 1.209 2.941) 4.712 22.306 ( 11.471 1.013 0.187) 11.517 22.586 ( 12.705 1.376 -2.353) 12.995 ======================= Grid point 36 (25/227) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( -2.533 9.501 2.058) 10.046 2.107 ( 2.856 4.861 -5.607) 7.952 2.863 ( 1.893 1.255 2.673) 3.507 2.915 ( -16.057 -1.284 9.594) 18.749 2.974 ( -8.069 0.534 -2.938) 8.604 3.174 ( -2.109 18.939 -3.686) 19.409 3.625 ( -7.990 3.839 -3.474) 9.521 3.885 ( -6.772 2.223 1.471) 7.278 4.178 ( -4.453 -17.043 -3.360) 17.933 4.554 ( 5.851 -5.098 -5.344) 9.422 4.978 ( 12.419 2.537 -7.970) 14.973 5.314 ( 12.753 9.626 -0.815) 15.999 5.499 ( 1.042 9.087 -2.947) 9.610 5.781 ( -1.199 -1.763 5.592) 5.984 5.930 ( -1.948 -1.495 3.282) 4.099 6.309 ( 2.015 -5.277 5.382) 7.802 7.614 ( -3.027 3.282 4.836) 6.581 7.844 ( 5.678 -3.892 2.073) 7.189 8.233 ( 4.094 -3.318 -5.049) 7.299 9.476 ( -3.449 -1.312 -11.860) 12.421 9.927 ( 0.553 -2.471 10.477) 10.779 10.217 ( -3.561 -4.009 -5.946) 8.006 10.330 ( 1.885 2.318 4.166) 5.126 10.552 ( -0.178 3.825 -10.925) 11.577 10.969 ( 4.308 -0.226 -3.651) 5.651 11.211 ( -2.995 -5.132 -2.132) 6.313 11.632 ( 11.059 3.569 1.685) 11.742 11.767 ( 2.414 -5.451 6.204) 8.604 12.625 ( -9.097 -5.898 1.534) 10.950 13.084 ( -12.631 -3.158 -2.878) 13.334 13.318 ( -4.152 3.958 7.408) 9.370 13.958 ( 4.570 -0.993 3.982) 6.143 14.141 ( -3.210 -0.334 0.472) 3.262 14.298 ( 9.740 -1.135 0.497) 9.819 14.754 ( 3.716 -0.372 -4.386) 5.761 15.140 ( -6.310 3.150 7.719) 10.456 15.358 ( -2.994 -4.564 -0.410) 5.474 15.911 ( -2.532 2.977 -6.341) 7.449 16.033 ( 0.029 -1.771 -10.792) 10.937 16.396 ( -2.222 -0.219 1.823) 2.882 17.072 ( -17.350 2.855 3.411) 17.911 20.764 ( 0.408 -4.864 1.259) 5.041 21.629 ( -2.586 2.121 2.216) 4.012 22.438 ( 7.405 4.010 -1.160) 8.501 22.787 ( 12.830 -0.004 -0.019) 12.830 ======================= Grid point 37 (26/227) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -2.466 8.176 1.239) 8.629 2.102 ( 8.353 13.799 -5.638) 17.087 2.568 ( -11.646 22.791 -0.598) 25.601 2.660 ( -16.760 0.179 6.771) 18.076 2.993 ( 4.016 -1.646 -0.143) 4.342 3.085 ( 1.306 3.105 -1.896) 3.865 3.489 ( -3.597 5.373 0.239) 6.470 3.754 ( -5.716 2.721 0.514) 6.351 4.306 ( -1.352 -16.999 -0.997) 17.082 4.685 ( 4.244 -4.797 -2.100) 6.740 5.059 ( 5.453 12.920 -9.237) 16.792 5.285 ( -2.654 7.940 2.372) 8.702 5.554 ( 14.411 1.588 -4.186) 15.090 5.851 ( 3.566 -6.003 4.988) 8.581 5.927 ( 0.220 1.026 1.099) 1.519 6.270 ( -9.024 2.760 4.091) 10.285 7.531 ( -2.148 4.572 2.016) 5.439 7.948 ( 2.494 -3.804 0.505) 4.577 8.324 ( 2.071 -5.002 -3.112) 6.244 9.497 ( -0.348 -7.836 -6.864) 10.422 9.978 ( 3.248 -1.363 8.490) 9.191 10.196 ( -5.201 -7.241 -9.387) 12.946 10.309 ( -0.786 3.058 5.268) 6.142 10.526 ( 1.293 3.786 -5.097) 6.480 10.964 ( -1.486 0.095 -0.623) 1.614 11.369 ( 7.860 -11.146 -1.198) 13.691 11.739 ( 9.306 3.285 -0.639) 9.889 11.935 ( 7.493 -3.233 6.728) 10.576 12.484 ( -14.171 -7.548 -0.895) 16.081 12.954 ( -7.978 -5.971 -3.120) 10.442 13.218 ( -2.990 5.842 3.402) 7.392 14.039 ( 2.989 -2.131 3.715) 5.222 14.094 ( -2.616 -0.261 -1.461) 3.007 14.444 ( 6.439 -0.529 -0.106) 6.462 14.830 ( 4.775 -0.822 -6.236) 7.898 14.999 ( -6.853 3.481 12.561) 14.726 15.360 ( -2.285 -4.533 -1.872) 5.410 15.825 ( -3.897 1.477 -3.988) 5.768 16.046 ( 0.945 2.187 -8.099) 8.442 16.351 ( -2.642 0.916 4.146) 5.001 16.820 ( -9.376 2.479 0.876) 9.738 20.816 ( -0.215 -5.324 0.661) 5.370 21.572 ( -1.340 2.893 0.936) 3.322 22.469 ( 3.211 6.358 -1.284) 7.238 22.993 ( 9.703 -2.898 1.150) 10.191 ======================= Grid point 38 (27/227) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -0.000 8.805 0.000) 8.805 2.032 ( -0.000 21.712 0.000) 21.712 2.196 ( -0.000 28.676 0.000) 28.676 2.437 ( -0.000 7.984 0.000) 7.984 3.059 ( 0.000 -2.739 -0.000) 2.739 3.100 ( 0.000 -2.792 -0.000) 2.792 3.390 ( -0.000 7.787 0.000) 7.787 3.671 ( -0.000 2.759 0.000) 2.759 4.456 ( 0.000 -14.312 -0.000) 14.312 4.780 ( 0.000 -4.310 -0.000) 4.310 4.892 ( -0.000 18.625 0.000) 18.625 5.254 ( 0.000 -1.574 -0.000) 1.574 5.781 ( -0.000 14.721 0.000) 14.721 5.807 ( 0.000 -6.448 -0.000) 6.448 6.033 ( 0.000 -9.027 -0.000) 9.027 6.054 ( -0.000 4.240 0.000) 4.240 7.467 ( -0.000 4.009 0.000) 4.009 8.009 ( 0.000 -4.276 -0.000) 4.276 8.399 ( 0.000 -6.581 -0.000) 6.581 9.576 ( 0.000 -7.946 -0.000) 7.946 10.024 ( -0.000 2.078 0.000) 2.078 10.224 ( 0.000 -10.188 -0.000) 10.188 10.284 ( 0.000 -0.309 -0.000) 0.309 10.503 ( -0.000 2.650 0.000) 2.650 10.954 ( 0.000 -0.414 -0.000) 0.414 11.559 ( 0.000 -8.136 -0.000) 8.136 11.894 ( 0.000 -5.146 -0.000) 5.146 11.956 ( -0.000 0.984 0.000) 0.984 12.424 ( 0.000 -7.430 -0.000) 7.430 12.976 ( 0.000 -11.408 -0.000) 11.408 13.104 ( -0.000 9.595 0.000) 9.595 14.065 ( -0.000 0.177 0.000) 0.177 14.095 ( 0.000 -2.595 -0.000) 2.595 14.503 ( 0.000 -0.353 -0.000) 0.353 14.869 ( -0.000 4.981 0.000) 4.981 14.912 ( 0.000 -1.600 -0.000) 1.600 15.380 ( 0.000 -3.927 -0.000) 3.927 15.774 ( -0.000 1.128 0.000) 1.128 16.006 ( -0.000 5.194 0.000) 5.194 16.316 ( -0.000 1.264 0.000) 1.264 16.722 ( -0.000 2.434 0.000) 2.434 20.869 ( 0.000 -5.830 -0.000) 5.830 21.529 ( -0.000 3.472 0.000) 3.472 22.427 ( -0.000 6.717 0.000) 6.717 23.123 ( 0.000 -4.547 -0.000) 4.547 ======================= Grid point 45 (28/227) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( -6.382 -0.000 2.366) 6.806 2.138 ( 5.468 0.000 -6.013) 8.127 2.854 ( -1.816 -0.000 9.410) 9.583 2.927 ( -7.566 -0.000 -0.428) 7.578 2.963 ( -8.071 -0.000 -0.863) 8.117 3.462 ( 0.835 0.000 -0.891) 1.221 3.689 ( -11.052 -0.000 -6.749) 12.950 3.890 ( -8.558 -0.000 -2.932) 9.047 3.922 ( -6.731 -0.000 0.113) 6.732 4.484 ( 5.436 0.000 -6.853) 8.747 5.010 ( 15.630 0.000 -3.770) 16.078 5.403 ( 1.724 0.000 1.691) 2.415 5.591 ( 6.736 0.000 -3.861) 7.764 5.805 ( 1.405 0.000 2.892) 3.215 5.923 ( -0.846 -0.000 2.360) 2.507 6.222 ( 4.773 0.000 6.300) 7.903 7.656 ( -2.428 -0.000 4.791) 5.371 7.797 ( 6.795 0.000 4.284) 8.033 8.197 ( 3.829 0.000 -5.006) 6.302 9.476 ( -7.562 -0.000 -14.234) 16.118 9.887 ( 1.125 0.000 14.123) 14.168 10.174 ( -4.874 -0.000 -6.996) 8.527 10.358 ( 2.570 0.000 2.900) 3.875 10.607 ( -0.136 -0.000 -14.505) 14.506 10.956 ( 9.751 0.000 -3.465) 10.348 11.152 ( -11.080 -0.000 1.172) 11.142 11.685 ( 15.803 0.000 4.913) 16.549 11.703 ( -0.282 -0.000 1.990) 2.010 12.559 ( -9.525 -0.000 1.713) 9.678 13.036 ( -13.659 -0.000 -4.458) 14.368 13.372 ( -3.618 -0.000 10.927) 11.510 13.948 ( 3.986 0.000 3.406) 5.243 14.138 ( -3.206 -0.000 0.701) 3.281 14.286 ( 10.592 0.000 1.882) 10.758 14.749 ( 3.207 0.000 -5.070) 5.999 15.187 ( -6.332 -0.000 6.922) 9.381 15.299 ( -2.344 -0.000 -1.407) 2.734 15.956 ( -7.034 -0.000 -6.835) 9.808 16.001 ( 5.187 0.000 -11.426) 12.548 16.392 ( -1.560 -0.000 1.351) 2.063 17.103 ( -18.109 -0.000 4.552) 18.672 20.713 ( 1.304 0.000 1.259) 1.813 21.651 ( -2.674 -0.000 2.790) 3.865 22.482 ( 8.890 0.000 0.331) 8.896 22.782 ( 10.441 0.000 -2.091) 10.648 ======================= Grid point 47 (29/227) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( -4.768 3.329 0.927) 5.888 2.242 ( 8.690 1.594 -6.277) 10.838 2.640 ( -15.335 -0.496 7.208) 16.952 2.820 ( -6.586 3.463 0.332) 7.448 2.982 ( 4.023 -0.016 0.400) 4.042 3.350 ( -0.995 20.290 -3.367) 20.591 3.549 ( -3.596 0.891 -1.690) 4.072 3.806 ( -4.684 1.459 0.999) 5.007 3.918 ( -3.764 -19.602 -2.003) 20.060 4.570 ( 2.809 -3.959 -4.098) 6.353 5.207 ( 9.875 2.839 -2.714) 10.627 5.389 ( -2.729 -4.232 3.673) 6.233 5.601 ( -0.486 10.573 -1.795) 10.735 5.874 ( 8.951 1.547 -0.768) 9.117 5.928 ( 0.621 -0.113 0.546) 0.835 6.288 ( -0.165 -0.577 4.022) 4.067 7.611 ( -1.578 2.521 2.813) 4.094 7.888 ( 3.018 -1.793 2.228) 4.158 8.255 ( 2.129 -1.781 -3.311) 4.321 9.388 ( -3.429 -2.721 -7.719) 8.874 9.929 ( 2.297 -2.076 14.277) 14.609 10.090 ( -6.097 -2.887 -12.377) 14.096 10.378 ( 0.983 2.404 1.923) 3.231 10.613 ( 2.572 3.673 -8.198) 9.344 10.982 ( -4.048 2.155 0.835) 4.662 11.133 ( 2.428 -9.719 0.361) 10.024 11.783 ( 10.362 0.948 -0.369) 10.412 11.934 ( 13.270 1.332 6.434) 14.808 12.357 ( -15.884 -4.038 -0.689) 16.404 12.840 ( -11.477 -3.560 -5.691) 13.296 13.329 ( -0.635 3.424 7.612) 8.371 14.008 ( 2.670 -0.866 2.788) 3.956 14.089 ( -2.596 -0.111 -0.704) 2.692 14.439 ( 7.168 -0.058 1.690) 7.365 14.810 ( 4.077 -0.747 -5.089) 6.563 15.069 ( -6.159 2.737 7.312) 9.944 15.279 ( -1.983 -2.944 -1.330) 3.790 15.851 ( -4.446 0.862 -4.126) 6.127 16.077 ( 4.339 0.801 -9.915) 10.853 16.359 ( -2.593 0.073 4.133) 4.880 16.857 ( -10.532 1.018 2.479) 10.867 20.740 ( 0.556 -2.047 0.709) 2.237 21.613 ( -1.421 1.053 1.520) 2.332 22.577 ( 4.493 3.527 -0.141) 5.714 22.932 ( 6.519 -2.345 -0.712) 6.964 ======================= Grid point 48 (30/227) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -0.000 5.211 0.000) 5.211 2.346 ( -0.000 9.683 0.000) 9.683 2.449 ( 0.000 -3.968 -0.000) 3.968 2.673 ( -0.000 14.586 0.000) 14.586 3.019 ( 0.000 -0.448 -0.000) 0.448 3.163 ( -0.000 12.487 0.000) 12.487 3.503 ( -0.000 3.120 0.000) 3.120 3.738 ( -0.000 3.336 0.000) 3.336 4.101 ( 0.000 -20.713 -0.000) 20.713 4.647 ( 0.000 -6.722 -0.000) 6.722 5.276 ( -0.000 2.304 0.000) 2.304 5.333 ( -0.000 18.316 0.000) 18.316 5.523 ( 0.000 -9.520 -0.000) 9.520 5.931 ( -0.000 1.222 0.000) 1.222 6.003 ( 0.000 -1.738 -0.000) 1.738 6.202 ( -0.000 8.895 0.000) 8.895 7.562 ( -0.000 4.415 0.000) 4.415 7.936 ( 0.000 -2.829 -0.000) 2.829 8.297 ( 0.000 -3.388 -0.000) 3.388 9.413 ( 0.000 -6.926 -0.000) 6.926 10.007 ( 0.000 -2.497 -0.000) 2.497 10.051 ( 0.000 -6.464 -0.000) 6.464 10.346 ( -0.000 4.623 0.000) 4.623 10.586 ( -0.000 5.290 0.000) 5.290 10.944 ( 0.000 -0.427 -0.000) 0.427 11.280 ( 0.000 -14.632 -0.000) 14.632 11.942 ( -0.000 6.159 0.000) 6.159 11.973 ( -0.000 0.658 0.000) 0.658 12.261 ( 0.000 -8.579 -0.000) 8.579 12.783 ( 0.000 -7.335 -0.000) 7.335 13.275 ( -0.000 6.679 0.000) 6.679 14.049 ( 0.000 -1.839 -0.000) 1.839 14.065 ( 0.000 -0.095 -0.000) 0.095 14.500 ( -0.000 0.109 0.000) 0.109 14.872 ( 0.000 -2.035 -0.000) 2.035 14.968 ( -0.000 4.526 0.000) 4.526 15.296 ( 0.000 -4.097 -0.000) 4.097 15.801 ( -0.000 1.330 0.000) 1.330 16.094 ( -0.000 3.239 0.000) 3.239 16.330 ( -0.000 0.136 0.000) 0.136 16.760 ( -0.000 1.296 0.000) 1.296 20.772 ( 0.000 -3.556 -0.000) 3.556 21.586 ( -0.000 2.012 0.000) 2.012 22.562 ( -0.000 6.161 0.000) 6.161 23.027 ( 0.000 -4.664 -0.000) 4.664 ======================= Grid point 58 (31/227) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 126 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 0.000 -0.000 -0.000) 0.000 2.391 ( 0.000 -0.000 -0.000) 0.000 2.439 ( 0.000 -0.000 -0.000) 0.000 2.783 ( 0.000 -0.000 -0.000) 0.000 3.019 ( 0.000 -0.000 -0.000) 0.000 3.485 ( 0.000 -0.000 -0.000) 0.000 3.532 ( 0.000 -0.000 -0.000) 0.000 3.729 ( 0.000 -0.000 -0.000) 0.000 3.780 ( 0.000 -0.000 -0.000) 0.000 4.572 ( 0.000 -0.000 -0.000) 0.000 5.304 ( 0.000 -0.000 -0.000) 0.000 5.325 ( 0.000 -0.000 -0.000) 0.000 5.682 ( -0.000 0.000 0.000) 0.000 5.932 ( 0.000 -0.000 -0.000) 0.000 5.932 ( 0.000 -0.000 -0.000) 0.000 6.303 ( 0.000 -0.000 -0.000) 0.000 7.611 ( 0.000 -0.000 -0.000) 0.000 7.905 ( 0.000 -0.000 -0.000) 0.000 8.264 ( 0.000 -0.000 -0.000) 0.000 9.338 ( 0.000 -0.000 -0.000) 0.000 9.975 ( 0.000 -0.000 -0.000) 0.000 9.983 ( 0.000 -0.000 -0.000) 0.000 10.402 ( 0.000 -0.000 -0.000) 0.000 10.663 ( 0.000 -0.000 -0.000) 0.000 10.939 ( 0.000 -0.000 -0.000) 0.000 11.103 ( 0.000 -0.000 -0.000) 0.000 11.980 ( 0.000 -0.000 -0.000) 0.000 12.081 ( 0.000 -0.000 -0.000) 0.000 12.098 ( -0.000 0.000 0.000) 0.000 12.705 ( 0.000 -0.000 -0.000) 0.000 13.346 ( 0.000 -0.000 -0.000) 0.000 14.029 ( 0.000 -0.000 -0.000) 0.000 14.064 ( 0.000 -0.000 -0.000) 0.000 14.503 ( 0.000 -0.000 -0.000) 0.000 14.848 ( 0.000 -0.000 -0.000) 0.000 15.023 ( 0.000 -0.000 -0.000) 0.000 15.245 ( 0.000 -0.000 -0.000) 0.000 15.816 ( 0.000 -0.000 -0.000) 0.000 16.127 ( 0.000 -0.000 -0.000) 0.000 16.329 ( 0.000 -0.000 -0.000) 0.000 16.773 ( 0.000 -0.000 -0.000) 0.000 20.735 ( 0.000 -0.000 -0.000) 0.000 21.606 ( 0.000 -0.000 -0.000) 0.000 22.635 ( 0.000 -0.000 -0.000) 0.000 22.969 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 105 (32/227) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( -4.306 -0.000 33.020) 33.300 0.748 ( 6.942 0.000 35.944) 36.608 1.204 ( -14.165 -0.000 56.383) 58.135 1.674 ( 20.243 0.000 6.337) 21.212 2.715 ( 3.842 0.000 -3.212) 5.008 3.104 ( -2.723 -0.000 2.458) 3.668 3.429 ( -3.448 -0.000 3.329) 4.793 3.438 ( -1.930 -0.000 -1.266) 2.308 3.590 ( -2.068 -0.000 0.557) 2.142 4.460 ( 2.994 0.000 -3.547) 4.641 5.051 ( -13.899 -0.000 -11.766) 18.211 5.358 ( 8.411 0.000 -0.595) 8.432 5.376 ( -19.216 -0.000 3.703) 19.569 5.428 ( -1.655 -0.000 -6.982) 7.175 5.905 ( 1.223 0.000 11.458) 11.523 6.824 ( -0.804 -0.000 13.425) 13.449 7.440 ( 20.902 0.000 -14.087) 25.206 8.279 ( -1.793 -0.000 4.460) 4.807 8.726 ( 0.609 0.000 -3.684) 3.734 9.530 ( 3.815 0.000 -10.137) 10.831 9.824 ( -0.234 -0.000 -13.285) 13.287 10.343 ( -1.592 -0.000 -5.794) 6.009 10.680 ( -6.052 -0.000 16.489) 17.565 10.757 ( 7.950 0.000 4.241) 9.010 11.194 ( -4.180 -0.000 -3.576) 5.501 11.225 ( -1.979 -0.000 -0.952) 2.196 11.735 ( -32.151 -0.000 2.313) 32.234 12.639 ( 6.431 0.000 -1.742) 6.663 12.728 ( -1.378 -0.000 -0.816) 1.602 12.994 ( 16.446 0.000 1.235) 16.492 13.627 ( 0.202 0.000 -1.217) 1.234 14.009 ( 24.407 0.000 -17.155) 29.833 14.193 ( -3.281 -0.000 -1.842) 3.763 14.478 ( 6.782 0.000 -1.337) 6.912 15.011 ( 0.747 0.000 8.503) 8.536 15.660 ( -16.602 -0.000 8.754) 18.769 15.754 ( -0.107 -0.000 2.851) 2.853 15.832 ( 1.008 0.000 5.988) 6.072 16.284 ( 0.160 0.000 0.846) 0.861 16.502 ( 3.158 0.000 -1.357) 3.437 17.095 ( 22.119 0.000 -0.745) 22.131 20.542 ( 0.272 0.000 -0.262) 0.378 21.173 ( 0.393 0.000 0.237) 0.459 22.173 ( -36.778 -0.000 -1.037) 36.793 22.204 ( -11.038 -0.000 -0.297) 11.042 ======================= Grid point 106 (33/227) ======================= q-point: ( 0.10 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.818 ( 8.408 -8.227 26.274) 28.787 0.936 ( 15.457 -11.599 23.453) 30.389 1.542 ( 25.309 -15.487 24.224) 38.304 1.903 ( 22.027 3.671 19.873) 29.893 2.774 ( -2.092 -4.382 -2.429) 5.430 3.177 ( -13.488 -9.747 1.278) 16.690 3.368 ( 1.889 -17.514 -11.674) 21.133 3.393 ( 0.621 -0.832 -0.232) 1.064 3.887 ( 15.356 -4.029 -16.040) 22.568 4.534 ( 2.866 -2.982 -3.103) 5.170 4.799 ( -9.669 -0.110 8.610) 12.948 5.156 ( -8.882 -2.880 -1.368) 9.437 5.377 ( -4.626 -0.254 -6.243) 7.774 5.606 ( 16.029 3.803 -4.959) 17.204 5.937 ( -0.704 -5.942 10.408) 12.005 6.797 ( -1.082 4.118 11.521) 12.283 7.718 ( 13.993 10.039 -14.943) 22.801 8.203 ( -4.779 1.551 3.738) 6.263 8.689 ( -5.025 -1.395 -3.912) 6.519 9.600 ( 3.501 -2.095 -7.843) 8.841 9.811 ( 0.774 0.331 -4.928) 4.999 10.345 ( 0.632 -0.519 -5.091) 5.156 10.550 ( -9.751 -1.162 11.688) 15.266 10.787 ( -3.674 8.591 1.844) 9.524 11.043 ( -16.583 -3.132 5.718) 17.818 11.179 ( 5.829 2.102 4.584) 7.707 11.392 ( -10.388 -11.668 3.959) 16.116 12.644 ( -4.499 7.445 -2.096) 8.948 12.746 ( 3.539 0.674 4.565) 5.815 13.043 ( 4.067 6.309 1.707) 7.698 13.637 ( 0.648 -0.793 -1.295) 1.651 14.105 ( -3.910 3.061 -7.357) 8.876 14.194 ( -0.619 -1.479 -20.286) 20.349 14.526 ( -2.140 0.247 -0.176) 2.161 14.838 ( -20.321 1.625 23.142) 30.840 15.199 ( -6.464 7.982 20.265) 22.719 15.760 ( -1.705 -0.873 3.359) 3.866 15.790 ( 0.727 1.590 0.897) 1.965 16.273 ( -0.447 1.752 0.635) 1.916 16.538 ( 3.025 3.518 2.198) 5.134 17.409 ( 58.867 82.220 -2.674) 101.156 21.052 ( 4.310 -57.562 -30.906) 65.476 21.193 ( 3.406 3.500 0.643) 4.926 21.566 ( -37.529 -30.723 15.254) 50.842 22.244 ( 1.731 -1.159 1.482) 2.556 ======================= Grid point 107 (34/227) ======================= q-point: ( 0.20 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( 20.678 0.965 8.402) 22.341 1.303 ( 15.040 -10.591 10.324) 21.094 2.027 ( 22.026 -11.188 1.633) 24.759 2.518 ( 33.453 -14.847 18.982) 41.229 2.772 ( -2.163 -6.095 1.225) 6.583 3.052 ( -5.301 0.359 1.730) 5.587 3.397 ( 3.557 2.788 -1.588) 4.790 3.612 ( 1.108 -20.055 -4.472) 20.578 4.086 ( 6.477 -6.468 -10.259) 13.749 4.557 ( -2.701 0.483 -4.874) 5.593 4.695 ( -5.934 -0.557 2.516) 6.469 5.071 ( -5.887 -4.808 -2.331) 7.950 5.285 ( -5.934 0.398 -5.149) 7.867 5.787 ( 9.077 0.276 4.603) 10.181 5.984 ( -1.421 -4.142 3.778) 5.784 6.728 ( -0.255 6.840 7.540) 10.183 7.700 ( 0.834 11.261 -0.697) 11.313 8.123 ( -3.401 2.109 1.468) 4.263 8.582 ( -9.458 -0.666 -0.805) 9.515 9.680 ( 2.718 -4.304 -6.277) 8.082 9.858 ( 4.149 -1.893 -6.708) 8.112 10.280 ( -6.640 9.485 -8.558) 14.398 10.418 ( -5.175 1.859 0.081) 5.500 10.588 ( -8.901 0.981 7.340) 11.579 10.897 ( -6.453 -2.402 1.327) 7.012 11.276 ( -3.088 -8.613 -1.984) 9.363 11.482 ( 13.064 -1.544 9.558) 16.261 12.416 ( -9.497 14.240 -3.410) 17.453 12.713 ( -5.322 0.056 8.950) 10.413 13.140 ( 12.585 4.947 1.238) 13.579 13.654 ( 1.051 -0.108 -0.015) 1.056 14.004 ( -4.349 2.830 -6.271) 8.139 14.158 ( -1.272 -0.146 -12.455) 12.521 14.434 ( -7.402 0.239 5.023) 8.948 14.640 ( -6.464 -0.541 10.829) 12.623 15.155 ( 2.584 2.504 8.048) 8.816 15.706 ( -2.415 3.352 1.631) 4.442 15.821 ( 1.006 -2.337 0.677) 2.633 16.238 ( -1.108 2.402 -0.959) 2.814 16.546 ( 3.584 4.987 4.694) 7.729 17.516 ( 32.569 43.512 1.886) 54.384 21.187 ( -0.035 3.483 2.332) 4.192 21.433 ( 0.970 -4.996 3.901) 6.412 21.511 ( -15.838 -48.762 -23.855) 56.548 22.275 ( 0.098 -1.891 3.796) 4.242 ======================= Grid point 108 (35/227) ======================= q-point: ( 0.30 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 11.067 9.551 4.896) 15.417 1.700 ( 17.158 -11.420 1.744) 20.685 2.472 ( 15.196 -9.302 -3.122) 18.089 2.792 ( 4.217 -5.311 -3.374) 7.574 2.964 ( -0.563 -1.157 2.957) 3.225 3.199 ( 22.798 -5.000 6.710) 24.285 3.473 ( 7.740 -3.661 1.147) 8.639 3.799 ( 2.619 -10.262 -0.029) 10.591 4.286 ( 7.085 -10.512 0.574) 12.690 4.430 ( -8.773 3.160 -6.914) 11.608 4.611 ( -5.012 -2.416 -4.249) 7.001 5.056 ( -4.179 -6.806 -0.206) 7.989 5.190 ( -4.301 -0.726 -2.140) 4.858 5.874 ( -2.337 -1.468 15.405) 15.650 5.988 ( 3.050 1.385 -3.731) 5.014 6.668 ( 0.052 5.833 3.275) 6.690 7.610 ( -0.014 5.353 2.685) 5.988 8.032 ( -4.970 3.336 2.996) 6.694 8.408 ( -10.757 0.662 3.017) 11.191 9.762 ( 1.108 -5.432 -6.526) 8.562 9.955 ( -4.780 9.336 1.040) 10.540 9.981 ( -1.247 3.335 -13.631) 14.088 10.335 ( -2.369 3.496 -9.484) 10.382 10.494 ( -5.296 -2.618 5.457) 8.042 10.862 ( -2.638 -5.313 1.463) 6.109 11.272 ( -6.127 -7.732 -4.144) 10.700 11.770 ( 20.467 3.068 12.317) 24.083 12.080 ( -11.841 15.877 -5.626) 20.590 12.612 ( -7.977 -1.388 6.473) 10.366 13.298 ( 11.650 4.232 0.749) 12.418 13.687 ( 3.833 1.306 2.131) 4.576 13.892 ( -5.539 2.935 -3.861) 7.362 14.179 ( 4.365 0.740 -9.827) 10.778 14.299 ( -9.584 -0.792 4.555) 10.641 14.573 ( -4.673 -2.793 4.520) 7.076 15.204 ( 4.400 0.488 4.696) 6.454 15.626 ( -3.262 2.987 0.586) 4.462 15.855 ( 0.002 -2.565 1.527) 2.985 16.196 ( -1.506 1.031 -3.075) 3.576 16.566 ( 3.435 3.099 5.304) 7.038 17.599 ( 17.868 22.785 2.339) 29.050 21.145 ( -1.580 1.620 1.934) 2.977 21.501 ( -0.854 -8.875 3.993) 9.769 21.685 ( -4.299 -19.604 -19.878) 28.248 22.290 ( -0.942 -2.228 5.591) 6.092 ======================= Grid point 109 (36/227) ======================= q-point: ( 0.40 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 4.984 7.369 3.181) 9.447 2.028 ( 10.733 -6.418 -0.023) 12.506 2.649 ( 2.614 -4.462 -3.667) 6.339 2.854 ( -2.035 3.069 -2.697) 4.565 3.072 ( 10.122 -4.175 -3.859) 11.610 3.492 ( 14.392 -0.914 1.354) 14.485 3.746 ( 10.893 -9.847 6.183) 15.933 3.880 ( 0.485 -1.635 -4.123) 4.462 4.168 ( -14.174 3.340 -3.634) 15.009 4.485 ( 2.575 -3.848 3.322) 5.698 4.643 ( 2.224 -8.661 -6.753) 11.205 5.009 ( -7.277 -3.885 -1.061) 8.317 5.235 ( 4.206 -6.691 3.613) 8.690 5.789 ( -3.846 4.633 9.855) 11.548 6.030 ( 1.446 0.988 1.784) 2.500 6.599 ( -2.020 5.082 2.248) 5.912 7.624 ( 4.851 -0.354 -0.523) 4.892 7.878 ( -7.381 7.534 1.877) 10.713 8.259 ( -7.415 -0.975 7.171) 10.362 9.611 ( -12.012 11.121 -8.255) 18.333 9.806 ( -1.578 -4.533 -6.710) 8.250 10.125 ( 9.140 -1.394 3.184) 9.779 10.259 ( -1.400 4.435 -13.686) 14.454 10.463 ( -2.778 -4.704 -0.931) 5.542 10.915 ( 0.236 -8.377 2.698) 8.804 11.238 ( -5.574 -5.107 -3.288) 8.244 11.738 ( -11.124 12.746 -7.948) 18.692 12.061 ( 20.067 7.137 11.814) 24.356 12.492 ( -8.444 -1.789 3.924) 9.482 13.422 ( 6.542 2.150 -0.782) 6.931 13.730 ( 1.897 3.769 5.050) 6.581 13.793 ( -0.538 1.620 -3.245) 3.667 14.148 ( -10.009 -1.302 3.706) 10.752 14.259 ( 6.407 1.248 -8.081) 10.388 14.545 ( -3.267 -4.421 3.125) 6.323 15.279 ( 4.428 -0.272 3.860) 5.880 15.549 ( -3.125 1.267 0.749) 3.454 15.873 ( -0.159 -1.177 2.289) 2.579 16.173 ( -2.074 -2.741 -4.274) 5.484 16.591 ( 1.951 1.656 4.640) 5.299 17.637 ( 7.572 11.340 1.809) 13.755 21.108 ( -0.444 2.667 0.528) 2.755 21.562 ( -2.392 -7.311 1.188) 7.784 21.776 ( 1.048 -6.416 -13.750) 15.209 22.298 ( -0.819 -2.019 6.930) 7.264 ======================= Grid point 110 (37/227) ======================= q-point: (-0.50 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 1.555 2.628 2.590) 4.004 2.153 ( 0.214 -0.434 -0.551) 0.733 2.690 ( -0.682 5.299 -6.134) 8.135 2.792 ( -0.065 -3.225 0.657) 3.292 3.248 ( 8.230 -1.917 -3.565) 9.172 3.666 ( -8.394 2.857 -6.530) 11.012 3.777 ( -10.270 -0.833 -0.151) 10.305 3.816 ( 1.309 -1.748 1.160) 2.473 4.162 ( 12.416 -3.814 6.123) 14.359 4.538 ( -0.701 -2.679 0.266) 2.782 4.739 ( 0.340 -7.319 -5.606) 9.226 4.960 ( -3.549 -5.938 1.954) 7.188 5.316 ( -0.896 3.120 1.440) 3.551 5.719 ( 1.365 4.912 10.160) 11.367 6.009 ( -0.893 2.879 0.130) 3.017 6.526 ( -1.208 2.257 2.756) 3.761 7.663 ( -5.119 13.001 -3.133) 14.319 7.758 ( 8.745 -2.495 -2.688) 9.483 8.174 ( -5.422 -1.269 9.888) 11.348 9.395 ( -5.471 0.713 -10.309) 11.692 9.801 ( -3.061 -2.985 -6.198) 7.530 10.193 ( -0.326 4.112 -14.466) 15.043 10.282 ( 7.657 -0.366 11.910) 14.163 10.508 ( 1.362 -7.053 -7.470) 10.363 11.019 ( 0.108 -9.771 2.718) 10.143 11.200 ( -2.929 -2.450 -2.129) 4.371 11.479 ( -8.332 5.804 -7.475) 12.610 12.269 ( 14.838 10.300 11.847) 21.601 12.399 ( -4.174 -1.573 0.603) 4.501 13.424 ( -4.848 0.244 -2.981) 5.697 13.711 ( 0.935 1.778 4.633) 5.049 13.837 ( 6.183 2.164 -2.066) 6.869 14.019 ( -6.471 -0.931 3.335) 7.339 14.334 ( 4.008 1.426 -6.807) 8.027 14.565 ( -0.287 -5.573 4.266) 7.024 15.343 ( 2.060 -0.765 5.047) 5.505 15.517 ( 0.347 -0.299 1.427) 1.498 15.878 ( 0.225 0.332 2.087) 2.126 16.179 ( -2.946 -6.656 -3.630) 8.134 16.591 ( -0.507 1.223 3.475) 3.719 17.620 ( -1.096 2.733 0.554) 2.996 21.076 ( 1.136 4.967 -0.908) 5.176 21.558 ( -5.524 -4.822 -1.138) 7.421 21.853 ( 5.367 0.409 -9.657) 11.056 22.314 ( 0.913 -0.573 8.240) 8.311 ======================= Grid point 111 (38/227) ======================= q-point: (-0.40 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( -1.589 -1.303 2.807) 3.479 2.059 ( -8.838 3.620 0.143) 9.552 2.579 ( -2.652 7.324 -4.547) 9.020 2.859 ( 1.555 -1.266 -1.579) 2.552 3.226 ( -25.755 6.542 -8.772) 27.984 3.390 ( 4.646 -1.834 3.691) 6.211 3.624 ( -7.328 5.374 4.382) 10.089 3.911 ( -3.628 -5.722 2.672) 7.283 4.376 ( 8.970 0.690 2.431) 9.319 4.483 ( -6.431 -1.170 1.626) 6.736 4.826 ( 1.829 -4.363 -3.487) 5.877 4.996 ( -0.301 -3.003 0.699) 3.098 5.195 ( -1.989 4.231 -0.326) 4.686 5.694 ( 0.670 6.056 8.207) 10.222 5.983 ( 2.614 3.749 -0.784) 4.638 6.533 ( 1.752 -1.535 0.917) 2.503 7.462 ( -2.268 13.954 -4.269) 14.767 7.947 ( 11.761 -1.838 -5.336) 13.045 8.113 ( -2.911 -0.307 8.353) 8.851 9.406 ( 1.285 -7.398 -11.240) 13.518 9.776 ( -2.733 -2.754 -6.286) 7.386 10.155 ( 1.192 2.914 -16.181) 16.484 10.391 ( 4.179 -1.656 9.813) 10.794 10.626 ( 4.714 -5.067 -3.076) 7.574 11.060 ( -4.803 -5.527 0.788) 7.365 11.237 ( 3.797 -3.670 -1.475) 5.483 11.348 ( -5.014 -1.543 0.508) 5.270 12.353 ( 3.669 -0.315 13.136) 13.643 12.398 ( 6.930 9.478 -4.496) 12.573 13.300 ( -10.289 -2.031 -3.474) 11.048 13.680 ( -3.918 0.276 2.695) 4.764 13.936 ( 7.067 3.081 -5.643) 9.554 13.984 ( 1.849 -2.047 4.794) 5.531 14.341 ( -1.236 0.812 -5.061) 5.273 14.653 ( 3.680 -5.504 5.828) 8.821 15.366 ( -0.164 -1.198 8.994) 9.075 15.568 ( 4.240 -1.059 1.414) 4.594 15.876 ( 0.157 0.761 1.489) 1.680 16.201 ( -3.720 -8.521 -2.098) 9.531 16.551 ( -2.815 1.343 2.134) 3.779 17.550 ( -9.236 -6.008 -1.264) 11.091 21.042 ( 2.836 8.266 -2.518) 9.095 21.485 ( -7.188 -2.022 -1.967) 7.721 21.933 ( 6.729 2.807 -7.981) 10.810 22.350 ( 4.379 2.459 9.857) 11.063 ======================= Grid point 112 (39/227) ======================= q-point: (-0.30 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -6.617 -0.889 3.924) 7.744 1.819 ( -14.726 5.281 3.483) 16.027 2.388 ( -19.291 7.569 -3.893) 21.085 2.668 ( -9.430 10.263 -6.244) 15.272 2.970 ( -1.054 3.863 -0.315) 4.017 3.340 ( -12.556 5.046 15.393) 20.495 3.537 ( 0.251 -1.857 1.167) 2.207 3.722 ( -15.773 7.019 4.835) 17.929 4.299 ( -10.104 -0.064 0.223) 10.107 4.528 ( 4.906 1.286 -0.610) 5.108 4.859 ( 4.903 3.441 0.824) 6.047 5.031 ( 3.288 -2.449 -5.319) 6.715 5.260 ( 3.776 -6.455 -0.887) 7.531 5.645 ( 0.366 3.843 5.000) 6.317 6.002 ( 4.994 6.528 -1.209) 8.308 6.600 ( 2.172 -5.529 0.683) 5.979 7.318 ( 0.597 11.131 -6.171) 12.741 8.103 ( 1.118 -1.475 5.969) 6.249 8.179 ( 13.327 -2.467 -5.437) 14.603 9.492 ( 0.711 -4.167 -12.514) 13.209 9.777 ( 0.148 -1.955 -8.181) 8.413 10.191 ( 4.163 -3.820 -13.984) 15.083 10.465 ( 2.434 -1.999 3.880) 4.998 10.725 ( 4.089 0.675 0.590) 4.186 11.017 ( -4.719 -3.329 -2.139) 6.159 11.338 ( 5.578 1.944 -2.006) 6.239 11.359 ( -0.808 -10.927 17.863) 20.956 12.390 ( 6.542 12.930 -4.328) 15.123 12.460 ( 4.310 -6.700 9.030) 12.042 13.135 ( -12.776 -2.979 -3.771) 13.650 13.607 ( -5.511 -2.210 -0.016) 5.937 13.968 ( 2.816 3.564 -6.429) 7.872 14.107 ( 6.890 -2.076 1.669) 7.387 14.295 ( -2.368 0.513 -3.189) 4.005 14.781 ( 4.615 -4.924 6.434) 9.324 15.385 ( 0.882 -1.054 15.046) 15.108 15.654 ( 3.972 -1.568 1.723) 4.604 15.867 ( -0.819 0.321 1.320) 1.586 16.223 ( -3.778 -8.243 -1.233) 9.151 16.483 ( -3.545 1.257 0.505) 3.795 17.442 ( -17.914 -16.906 -3.186) 24.837 20.996 ( 4.757 13.221 -4.704) 14.817 21.374 ( -7.662 -0.844 -1.879) 7.934 22.008 ( 6.481 3.247 -7.049) 10.111 22.418 ( 9.118 6.658 11.330) 15.995 ======================= Grid point 113 (40/227) ======================= q-point: (-0.20 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( -12.894 4.763 8.663) 16.248 1.479 ( -19.041 7.824 9.217) 22.555 1.829 ( -28.880 10.985 -1.842) 30.953 2.577 ( -5.787 10.736 4.807) 13.109 2.645 ( -19.356 14.474 14.599) 28.237 3.170 ( -0.743 -1.697 7.015) 7.256 3.461 ( -2.997 12.865 -3.723) 13.724 3.546 ( -2.698 -2.160 3.769) 5.114 4.129 ( -11.969 -1.413 0.036) 12.052 4.533 ( 0.122 5.356 -3.329) 6.307 4.962 ( 8.736 -0.117 0.639) 8.760 5.115 ( 2.360 -4.045 -5.845) 7.490 5.364 ( 3.031 -2.609 -4.757) 6.214 5.667 ( 3.127 -2.397 5.816) 7.025 5.986 ( 2.302 9.240 -3.947) 10.308 6.711 ( 2.126 -8.452 5.229) 10.163 7.254 ( 2.351 6.333 -11.183) 13.064 8.163 ( 3.508 -1.995 5.275) 6.641 8.427 ( 12.695 -3.701 -4.463) 13.957 9.501 ( -0.415 0.079 -12.194) 12.201 9.795 ( 1.360 0.134 -14.019) 14.085 10.328 ( 2.841 -8.745 -10.176) 13.714 10.524 ( 2.536 -2.153 4.067) 5.254 10.742 ( 4.330 8.447 -0.594) 9.511 11.020 ( -0.978 -8.078 3.315) 8.786 11.380 ( 3.186 5.172 0.183) 6.077 11.516 ( 7.477 -8.445 24.747) 27.196 12.383 ( 6.380 7.533 -0.814) 9.905 12.611 ( 5.038 -6.007 5.667) 9.674 12.938 ( -14.398 -2.300 -4.127) 15.154 13.560 ( -4.590 -5.547 -2.343) 7.571 13.935 ( -1.898 4.456 -9.845) 10.972 14.202 ( 2.025 -1.280 1.841) 3.021 14.298 ( 4.227 0.611 -3.307) 5.402 14.891 ( 3.026 -3.638 6.235) 7.827 15.436 ( 3.663 -0.541 22.475) 22.778 15.717 ( 1.356 -2.027 2.183) 3.273 15.841 ( -2.400 -0.254 1.559) 2.873 16.247 ( -2.133 -6.361 -1.109) 6.800 16.429 ( -1.960 -0.383 -1.513) 2.506 17.303 ( -29.245 -32.513 -4.717) 43.984 20.919 ( 6.821 21.205 -7.841) 23.615 21.264 ( -6.691 -1.346 -1.119) 6.916 22.075 ( 5.693 2.651 -5.652) 8.449 22.521 ( 13.662 11.192 10.512) 20.553 ======================= Grid point 114 (41/227) ======================= q-point: (-0.10 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( -13.239 12.071 22.519) 28.776 1.025 ( -23.182 12.992 20.897) 33.807 1.438 ( -6.649 4.398 5.298) 9.572 1.856 ( -37.455 14.089 43.541) 59.137 2.662 ( 7.663 5.275 -5.853) 10.991 3.225 ( 5.332 7.955 2.976) 10.029 3.324 ( 2.342 7.949 -6.174) 10.334 3.498 ( -4.479 -0.431 4.322) 6.239 3.905 ( -17.637 0.401 -1.101) 17.676 4.465 ( 0.146 5.535 -4.585) 7.188 5.109 ( 3.352 -4.849 -6.132) 8.506 5.179 ( 5.017 -0.490 -1.554) 5.275 5.417 ( 0.863 -2.346 -6.747) 7.196 5.734 ( -5.184 -2.202 -6.303) 8.453 5.891 ( -0.995 6.306 3.704) 7.380 6.811 ( 0.797 -4.105 11.162) 11.919 7.253 ( 4.258 1.913 -14.095) 14.848 8.246 ( 3.256 -1.983 5.309) 6.536 8.638 ( 8.355 -2.900 -3.350) 9.457 9.495 ( 1.743 1.419 -11.444) 11.663 9.813 ( 0.977 -1.112 -17.022) 17.087 10.382 ( -3.241 -3.602 -9.885) 11.009 10.614 ( 4.928 -3.780 4.572) 7.712 10.732 ( 3.807 7.448 9.681) 12.795 11.127 ( 0.846 -10.559 1.866) 10.756 11.328 ( -0.944 8.244 -1.288) 8.397 11.819 ( 19.261 -2.033 15.507) 24.811 12.488 ( 10.950 -3.944 12.376) 16.989 12.709 ( -4.661 -2.533 -2.099) 5.705 12.744 ( -1.091 1.046 4.161) 4.427 13.577 ( -1.297 -8.160 -2.286) 8.573 13.839 ( -0.634 5.901 -8.875) 10.677 14.222 ( -0.630 -0.731 0.431) 1.057 14.378 ( 5.967 0.915 -3.564) 7.010 14.960 ( 2.141 -1.966 7.562) 8.101 15.549 ( 9.818 -0.481 27.576) 29.275 15.744 ( -0.590 -2.255 2.374) 3.327 15.801 ( -2.426 -0.368 0.627) 2.533 16.275 ( 0.097 -1.869 0.273) 1.891 16.440 ( 1.022 -3.632 -2.995) 4.817 17.131 ( -45.412 -55.477 -4.889) 71.860 20.766 ( 7.218 33.235 -10.233) 35.516 21.192 ( -3.758 -1.614 -0.203) 4.095 22.138 ( 4.686 1.488 -3.615) 6.103 22.603 ( 7.594 14.535 -0.669) 16.413 ======================= Grid point 116 (42/227) ======================= q-point: ( 0.10 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( 25.721 0.000 7.446) 26.777 1.309 ( 26.682 0.000 10.890) 28.819 1.864 ( 21.565 0.000 5.790) 22.328 2.374 ( 34.289 0.000 23.372) 41.497 2.697 ( -3.568 -0.000 1.343) 3.812 3.098 ( 3.524 0.000 1.837) 3.974 3.280 ( 2.339 0.000 -5.000) 5.521 3.431 ( 2.716 0.000 -2.334) 3.581 4.043 ( 7.592 0.000 -10.381) 12.861 4.569 ( 1.866 0.000 -3.846) 4.275 4.687 ( -6.126 -0.000 4.459) 7.577 5.009 ( -8.005 -0.000 -6.643) 10.402 5.285 ( -6.187 -0.000 -5.620) 8.359 5.863 ( -2.820 -0.000 15.544) 15.797 5.873 ( 12.205 0.000 -6.159) 13.671 6.797 ( -2.510 -0.000 7.755) 8.151 7.850 ( -3.685 -0.000 0.047) 3.685 8.149 ( -2.549 -0.000 -1.656) 3.040 8.547 ( -9.401 -0.000 -1.926) 9.597 9.634 ( 2.555 0.000 -7.164) 7.606 9.843 ( 3.850 0.000 -4.905) 6.236 10.339 ( -1.793 -0.000 -2.522) 3.094 10.433 ( -3.564 -0.000 -2.323) 4.254 10.703 ( -14.931 -0.000 8.506) 17.184 10.806 ( -5.786 -0.000 -6.852) 8.968 11.185 ( -4.696 -0.000 0.884) 4.778 11.460 ( 18.639 0.000 11.485) 21.894 12.594 ( -6.554 -0.000 -2.596) 7.049 12.691 ( -10.167 -0.000 12.555) 16.155 13.196 ( 11.333 0.000 1.865) 11.485 13.639 ( 0.732 0.000 -0.893) 1.154 14.038 ( -5.276 -0.000 -5.049) 7.303 14.149 ( -0.165 -0.000 -18.039) 18.040 14.437 ( -7.994 -0.000 4.675) 9.261 14.636 ( -8.425 -0.000 15.027) 17.228 15.185 ( -0.029 -0.000 8.122) 8.122 15.732 ( -2.312 -0.000 1.885) 2.983 15.800 ( 0.053 0.000 -0.824) 0.826 16.275 ( -0.609 -0.000 1.481) 1.601 16.574 ( 0.530 0.000 4.701) 4.731 18.368 ( 6.700 0.000 -17.960) 19.169 20.561 ( 1.011 0.000 0.232) 1.037 21.318 ( 8.131 0.000 0.430) 8.143 21.369 ( 4.620 0.000 -3.373) 5.721 22.256 ( 0.298 0.000 3.834) 3.845 ======================= Grid point 117 (43/227) ======================= q-point: ( 0.20 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( 18.127 -3.361 3.797) 18.823 1.626 ( 20.474 11.109 3.548) 23.563 2.295 ( 23.731 -7.759 -5.216) 25.506 2.668 ( -1.384 -4.599 1.701) 5.095 2.929 ( 20.655 -3.023 7.818) 22.291 3.163 ( 15.153 5.155 5.417) 16.897 3.470 ( 2.873 0.795 -3.139) 4.329 3.503 ( 12.243 -15.282 3.408) 19.875 4.167 ( 7.690 -2.088 -6.174) 10.080 4.526 ( -5.768 4.980 -5.701) 9.517 4.579 ( -7.074 -1.080 -0.786) 7.199 4.909 ( -7.042 -6.144 -4.857) 10.533 5.177 ( -6.634 -0.501 -5.133) 8.403 5.842 ( -0.296 -0.828 17.906) 17.928 6.020 ( 5.742 0.980 -2.284) 6.257 6.729 ( -4.804 0.964 3.272) 5.892 7.722 ( -6.454 4.150 8.681) 11.586 8.086 ( -4.013 1.764 -0.076) 4.384 8.393 ( -10.538 -1.396 1.735) 10.771 9.681 ( 2.146 -2.150 -7.440) 8.037 9.942 ( 7.952 -0.713 -7.147) 10.715 10.209 ( -11.322 7.302 -9.568) 16.525 10.380 ( -3.580 0.468 -2.942) 4.658 10.490 ( -5.988 2.780 -2.191) 6.956 10.756 ( -3.953 -5.058 -2.114) 6.759 11.139 ( -3.924 -4.069 -0.445) 5.671 11.807 ( 22.472 0.787 13.967) 26.471 12.368 ( -12.463 11.976 0.471) 17.290 12.545 ( -11.211 -5.700 7.490) 14.638 13.383 ( 12.226 3.186 2.416) 12.863 13.669 ( 2.433 -1.768 0.004) 3.008 13.940 ( -5.678 1.434 -5.652) 8.139 14.185 ( 4.445 -0.145 -14.745) 15.401 14.284 ( -10.762 -0.323 6.696) 12.679 14.529 ( -6.246 -1.323 8.063) 10.285 15.215 ( 3.517 0.400 4.155) 5.459 15.668 ( -4.655 1.258 1.146) 4.957 15.806 ( -0.337 -1.829 -1.835) 2.613 16.249 ( -1.021 2.728 0.727) 3.002 16.576 ( -0.819 -1.105 6.124) 6.277 18.206 ( 2.921 28.757 -5.112) 29.353 20.744 ( -5.362 -28.326 0.255) 28.831 21.430 ( 9.408 4.333 -4.316) 11.221 21.522 ( 8.980 -4.312 -6.688) 11.999 22.258 ( -0.607 -0.853 5.610) 5.707 ======================= Grid point 118 (44/227) ======================= q-point: ( 0.30 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 6.587 13.300 4.541) 15.521 1.916 ( 15.121 -3.722 -0.547) 15.582 2.583 ( 5.747 -1.181 -2.100) 6.232 2.826 ( 7.984 -8.219 -5.335) 12.640 3.072 ( 11.285 6.198 0.601) 12.889 3.494 ( 8.518 0.665 -1.315) 8.644 3.555 ( 15.116 -8.321 4.711) 17.887 3.839 ( 11.293 -3.314 -3.147) 12.183 4.253 ( -9.880 3.981 -1.561) 10.765 4.412 ( 6.150 -2.214 -1.650) 6.742 4.497 ( -2.928 -4.597 -5.505) 7.747 4.879 ( -6.884 -8.659 -1.095) 11.116 5.112 ( -1.709 -4.483 -2.843) 5.577 5.851 ( -0.231 1.297 16.722) 16.774 6.064 ( 2.785 2.454 0.507) 3.747 6.636 ( -6.548 -0.668 0.953) 6.650 7.627 ( -1.256 0.915 8.489) 8.630 7.994 ( -3.754 3.743 0.682) 5.345 8.237 ( -9.604 -0.936 5.931) 11.326 9.719 ( -2.285 -1.819 -7.970) 8.488 9.889 ( -10.391 12.388 -11.955) 20.109 10.101 ( 10.271 -1.011 -2.704) 10.669 10.309 ( -4.781 -1.443 -1.548) 5.228 10.413 ( -2.474 1.267 -13.383) 13.669 10.771 ( -0.968 -5.814 1.973) 6.215 11.125 ( -3.546 -5.056 -1.432) 6.340 12.011 ( -13.931 13.308 0.505) 19.273 12.164 ( 21.401 2.931 12.207) 24.811 12.421 ( -10.747 -5.138 4.612) 12.774 13.507 ( 8.055 5.817 1.037) 9.990 13.758 ( 4.906 -1.740 2.909) 5.963 13.822 ( -5.126 1.786 -4.430) 7.006 14.096 ( -13.129 -2.803 4.028) 14.016 14.277 ( 6.203 0.468 -10.658) 12.340 14.467 ( -4.269 -3.149 4.673) 7.070 15.283 ( 4.658 0.413 3.488) 5.834 15.572 ( -5.118 1.094 0.796) 5.294 15.823 ( -0.696 -3.377 -1.463) 3.746 16.189 ( -2.207 3.555 -1.327) 4.390 16.579 ( -1.473 -2.608 6.076) 6.774 17.982 ( 0.079 20.663 -1.591) 20.725 20.889 ( -6.527 -20.549 1.572) 21.618 21.531 ( 7.905 4.246 -5.546) 10.549 21.707 ( 9.588 -2.211 -6.705) 11.908 22.264 ( -0.110 -1.364 6.616) 6.756 ======================= Grid point 119 (45/227) ======================= q-point: ( 0.40 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( 2.621 12.981 3.299) 13.648 2.121 ( 4.946 -2.859 -0.631) 5.748 2.674 ( 4.787 -2.544 -1.552) 5.639 2.859 ( -1.992 4.484 -2.353) 5.442 3.271 ( 14.237 4.731 -4.378) 15.629 3.603 ( 4.747 -6.744 0.474) 8.261 3.824 ( -7.207 4.506 -9.767) 12.948 3.854 ( -1.567 3.571 1.359) 4.130 4.104 ( 9.370 -1.804 3.081) 10.027 4.442 ( -2.154 -6.696 -3.979) 8.081 4.604 ( -0.234 -4.503 -2.047) 4.952 4.847 ( -4.124 -4.972 -0.997) 6.536 5.258 ( 7.797 -8.470 0.318) 11.517 5.824 ( 1.141 5.005 13.252) 14.211 6.070 ( 0.985 2.937 2.190) 3.794 6.529 ( -7.247 -1.636 2.027) 7.701 7.682 ( 5.126 -3.899 5.745) 8.630 7.886 ( -2.026 8.087 -2.808) 8.798 8.122 ( -6.908 -2.915 9.692) 12.254 9.499 ( -12.131 7.545 -12.579) 19.035 9.796 ( 1.737 2.934 -8.782) 9.421 10.242 ( 0.537 -0.303 6.523) 6.552 10.298 ( 6.381 1.020 -8.633) 10.783 10.373 ( -1.344 -4.639 -12.473) 13.375 10.840 ( 0.686 -7.714 2.697) 8.200 11.122 ( -2.112 -4.105 -3.285) 5.666 11.665 ( -11.976 11.455 -1.578) 16.648 12.297 ( -8.925 -4.799 9.881) 14.153 12.463 ( 17.384 4.856 4.825) 18.684 13.491 ( -3.622 6.391 -3.817) 8.278 13.744 ( 0.072 1.567 3.096) 3.471 13.868 ( 3.370 0.603 3.197) 4.684 13.942 ( -7.989 -6.143 1.688) 10.218 14.346 ( 1.577 -0.464 -7.186) 7.371 14.469 ( 1.028 -3.476 1.472) 3.913 15.343 ( 2.589 0.751 4.524) 5.267 15.507 ( -1.505 -0.600 1.230) 2.035 15.850 ( -0.525 -3.915 0.010) 3.950 16.115 ( -3.535 1.290 -3.757) 5.318 16.576 ( -2.749 -2.813 4.879) 6.267 17.777 ( -5.480 11.989 -0.475) 13.191 20.963 ( -5.082 -13.669 1.635) 14.675 21.585 ( 4.832 5.881 -4.855) 9.028 21.869 ( 9.622 0.924 -6.404) 11.596 22.297 ( 2.657 -1.087 6.830) 7.408 ======================= Grid point 120 (46/227) ======================= q-point: (-0.50 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 1.190 9.769 3.340) 10.392 2.122 ( -4.960 2.044 -0.977) 5.453 2.734 ( -0.589 5.814 -4.135) 7.159 2.821 ( 5.346 -0.488 0.218) 5.372 3.332 ( -10.072 5.057 -6.105) 12.818 3.482 ( -5.265 9.407 -1.466) 10.879 3.749 ( 2.267 1.953 0.870) 3.116 3.760 ( -6.217 -3.483 1.916) 7.379 4.369 ( 12.445 -1.803 2.833) 12.890 4.462 ( -4.832 -2.237 -1.670) 5.580 4.648 ( 2.673 -11.397 -6.388) 13.336 4.863 ( -0.175 -4.744 1.388) 4.946 5.345 ( -1.042 4.889 -1.764) 5.301 5.810 ( 1.551 5.299 11.284) 12.562 6.059 ( 3.074 3.675 1.081) 4.912 6.476 ( -2.411 -4.299 2.214) 5.404 7.710 ( -2.943 9.423 1.833) 10.040 7.892 ( 8.849 -3.610 -3.263) 10.099 8.076 ( -2.895 -2.899 9.098) 9.978 9.313 ( -4.085 -0.399 -13.403) 14.017 9.780 ( 0.703 3.642 -8.323) 9.112 10.224 ( 0.301 2.701 -14.333) 14.589 10.330 ( -1.007 -4.448 0.756) 4.623 10.517 ( 8.143 -5.160 5.362) 11.032 10.925 ( -0.450 -7.361 1.898) 7.615 11.145 ( 0.148 -3.681 -6.631) 7.586 11.421 ( -5.186 7.213 1.220) 8.967 12.231 ( -6.143 -7.111 8.847) 12.907 12.644 ( 12.504 8.723 1.725) 15.344 13.307 ( -10.892 3.733 -5.631) 12.817 13.671 ( -8.905 -1.577 3.943) 9.865 13.919 ( 4.139 -3.418 4.606) 7.073 13.986 ( 5.426 1.046 -1.318) 5.681 14.334 ( -3.122 -1.321 -3.466) 4.849 14.557 ( 4.474 -3.610 0.141) 5.751 15.356 ( 0.238 0.221 7.389) 7.397 15.540 ( 3.054 -1.707 2.092) 4.076 15.879 ( -0.222 -2.485 2.662) 3.648 16.053 ( -4.950 -3.511 -6.398) 8.819 16.545 ( -4.274 -2.102 3.107) 5.687 17.552 ( -11.629 5.258 0.026) 12.762 21.006 ( -3.690 -9.274 1.216) 10.055 21.566 ( 1.627 7.856 -3.803) 8.879 21.997 ( 8.950 3.432 -6.658) 11.671 22.383 ( 7.369 0.679 6.640) 9.942 ======================= Grid point 121 (47/227) ======================= q-point: (-0.40 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 0.209 7.615 4.450) 8.823 1.944 ( -10.564 6.472 0.405) 12.396 2.602 ( -8.086 12.557 -2.859) 15.206 2.857 ( -7.316 7.542 -4.543) 11.447 2.993 ( -3.444 0.426 -1.750) 3.886 3.452 ( -3.924 3.280 11.191) 12.304 3.572 ( -6.844 4.863 2.111) 8.657 3.785 ( -2.325 1.272 -2.225) 3.460 4.336 ( -8.049 3.598 -0.559) 8.835 4.528 ( 5.172 -3.077 1.915) 6.316 4.866 ( 10.399 -3.141 -4.167) 11.635 4.928 ( -0.074 -8.402 -1.505) 8.536 5.222 ( -1.881 6.293 -1.708) 6.787 5.761 ( 0.161 6.391 5.089) 8.171 6.105 ( 5.825 3.159 2.742) 7.172 6.503 ( -1.263 -4.536 0.991) 4.812 7.546 ( -3.487 10.845 -0.874) 11.425 8.046 ( 1.377 -4.534 7.014) 8.465 8.129 ( 8.883 -2.291 -3.795) 9.928 9.360 ( 3.173 -8.278 -12.870) 15.628 9.753 ( 0.935 2.589 -8.719) 9.143 10.199 ( 1.193 2.533 -17.630) 17.851 10.377 ( -0.410 -6.348 1.019) 6.442 10.686 ( 4.696 -4.819 15.010) 16.449 10.980 ( 2.342 -1.811 -4.562) 5.439 11.163 ( -3.101 -6.639 3.467) 8.106 11.388 ( 6.455 3.590 0.518) 7.405 12.257 ( -1.928 -10.234 7.912) 13.079 12.700 ( 8.002 12.792 -2.127) 15.238 13.082 ( -14.165 -0.934 -5.256) 15.137 13.541 ( -10.437 -4.521 1.232) 11.441 14.007 ( 2.753 -0.442 1.353) 3.099 14.085 ( 7.508 0.522 -2.023) 7.793 14.289 ( -2.505 -0.739 -1.239) 2.890 14.675 ( 4.397 -5.015 1.576) 6.853 15.373 ( 1.605 -0.187 12.402) 12.507 15.613 ( 2.355 -2.566 3.413) 4.876 15.881 ( -1.202 0.407 4.263) 4.448 16.025 ( -5.984 -9.281 -7.422) 13.306 16.486 ( -4.741 -1.090 1.240) 5.020 17.289 ( -17.401 0.152 0.510) 17.409 21.032 ( -2.712 -6.436 0.633) 7.013 21.487 ( -0.110 9.442 -3.602) 10.106 22.088 ( 7.547 4.647 -6.587) 11.042 22.528 ( 12.477 3.630 5.708) 14.193 ======================= Grid point 122 (48/227) ======================= q-point: (-0.30 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -0.429 9.476 6.387) 11.436 1.673 ( -11.499 11.025 5.130) 16.735 2.131 ( -23.319 18.891 1.617) 30.054 2.743 ( 3.425 7.153 -6.029) 9.963 2.991 ( -9.201 11.838 7.916) 16.955 3.161 ( -11.956 2.328 12.802) 17.671 3.511 ( -2.715 -0.596 3.869) 4.764 3.702 ( 0.891 9.253 -6.159) 11.151 4.156 ( -6.810 6.367 -2.410) 9.629 4.614 ( 3.012 0.009 1.008) 3.176 4.946 ( 0.511 -1.376 -1.225) 1.912 5.046 ( 6.887 -0.782 -6.131) 9.254 5.260 ( 4.140 -6.352 -1.451) 7.720 5.718 ( 2.725 6.183 2.492) 7.202 6.145 ( 2.501 5.846 -0.509) 6.379 6.532 ( -1.707 -8.618 4.544) 9.891 7.400 ( -2.395 7.911 -3.326) 8.909 8.107 ( 2.139 -3.417 5.873) 7.123 8.331 ( 9.851 -5.350 -4.549) 12.098 9.483 ( 3.165 -3.835 -13.046) 13.961 9.769 ( 2.181 -0.797 -9.385) 9.668 10.221 ( 3.301 -1.619 -15.538) 15.967 10.434 ( -0.722 -6.516 1.388) 6.701 10.760 ( -1.564 -5.381 18.266) 19.106 11.007 ( 2.705 4.641 -10.213) 11.540 11.308 ( 11.104 -10.421 19.591) 24.814 11.470 ( 6.449 4.078 -1.927) 7.870 12.355 ( -0.567 -10.584 2.673) 10.931 12.679 ( 6.822 12.783 -1.969) 14.622 12.868 ( -14.949 -4.602 -3.625) 16.056 13.428 ( -10.315 -7.359 -1.930) 12.817 14.012 ( -0.767 2.699 -6.604) 7.176 14.167 ( 1.384 -1.995 1.518) 2.864 14.314 ( 5.760 0.973 -0.712) 5.885 14.792 ( 2.782 -5.733 3.073) 7.075 15.428 ( 4.336 -0.210 19.593) 20.068 15.652 ( -2.651 -4.624 4.563) 7.016 15.840 ( -3.235 0.223 3.054) 4.455 16.025 ( -7.212 -11.919 -5.788) 15.085 16.422 ( -3.727 -0.209 0.798) 3.817 16.982 ( -21.360 -2.492 1.380) 21.549 21.049 ( -1.925 -4.622 -0.000) 5.006 21.382 ( 0.277 10.742 -4.610) 11.693 22.149 ( 6.010 4.642 -5.481) 9.365 22.715 ( 16.156 6.609 2.048) 17.575 ======================= Grid point 123 (49/227) ======================= q-point: (-0.20 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( -0.538 16.705 11.153) 20.094 1.361 ( -8.454 18.979 14.077) 25.097 1.625 ( -12.137 16.190 5.911) 21.080 2.343 ( -31.066 28.961 29.214) 51.549 2.766 ( 6.484 5.608 -6.448) 10.727 3.214 ( 6.111 -3.582 1.417) 7.224 3.462 ( -4.387 -1.393 3.200) 5.606 3.640 ( 2.705 9.077 -7.337) 11.980 3.994 ( -2.396 11.377 -9.719) 15.153 4.616 ( 1.258 6.241 -0.915) 6.432 4.973 ( -2.293 -6.533 -4.996) 8.538 5.160 ( 7.939 0.768 -2.715) 8.425 5.371 ( 2.038 -3.655 -4.189) 5.921 5.735 ( 3.226 3.402 3.942) 6.126 6.032 ( -7.172 6.883 -1.171) 10.009 6.649 ( 2.085 -11.617 8.778) 14.709 7.314 ( -0.106 3.899 -7.455) 8.413 8.184 ( 1.977 -3.790 4.869) 6.479 8.536 ( 7.468 -6.710 -2.995) 10.477 9.534 ( 3.187 1.515 -11.623) 12.147 9.799 ( 1.078 0.046 -11.009) 11.062 10.302 ( 2.217 -3.848 -10.953) 11.819 10.492 ( -0.353 -7.728 2.881) 8.255 10.796 ( -1.477 -5.337 15.813) 16.755 11.003 ( 1.524 1.444 -1.356) 2.500 11.476 ( 0.807 6.763 -1.258) 6.927 11.722 ( 25.461 -7.474 16.202) 31.091 12.388 ( -6.984 -6.650 -5.147) 10.931 12.646 ( -7.740 -3.131 -3.335) 8.991 12.767 ( 5.708 2.537 5.105) 8.067 13.376 ( -5.269 -10.777 -2.083) 12.176 13.949 ( -0.876 4.169 -7.830) 8.914 14.197 ( -0.162 -1.702 1.308) 2.153 14.406 ( 6.321 1.614 -2.015) 6.828 14.878 ( 0.780 -5.881 6.379) 8.712 15.528 ( 3.329 -2.466 29.813) 30.099 15.614 ( -10.102 -10.010 2.516) 14.442 15.788 ( -2.907 -0.844 1.554) 3.403 15.999 ( -13.028 -13.559 -0.490) 18.810 16.355 ( -5.198 0.707 3.901) 6.537 16.679 ( -13.963 0.902 0.817) 14.016 21.066 ( -0.720 -3.477 -0.607) 3.602 21.288 ( 2.673 12.139 -6.901) 14.217 22.191 ( 4.583 3.776 -3.519) 6.902 22.889 ( 12.478 9.428 -9.548) 18.324 ======================= Grid point 124 (50/227) ======================= q-point: (-0.10 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( -5.207 20.453 18.889) 28.324 1.103 ( 1.675 25.814 24.805) 35.839 1.491 ( 3.191 11.515 14.412) 18.721 1.673 ( -2.933 23.189 36.391) 43.251 2.806 ( 3.424 3.834 -5.733) 7.700 3.347 ( 1.714 -5.483 1.676) 5.984 3.405 ( -5.112 -0.755 -2.291) 5.653 3.614 ( -0.448 1.570 0.530) 1.716 3.796 ( 8.069 33.705 -31.424) 46.782 4.557 ( 1.361 7.713 -2.607) 8.255 4.958 ( -8.960 -6.136 -5.375) 12.117 5.304 ( 6.121 -2.837 -2.988) 7.378 5.394 ( 1.315 2.009 -1.667) 2.923 5.543 ( -17.392 7.699 -1.163) 19.056 5.952 ( 3.768 3.696 10.191) 11.477 6.765 ( -1.671 -7.487 10.804) 13.251 7.383 ( 12.322 -3.500 -9.937) 16.212 8.231 ( -1.559 -3.651 4.345) 5.886 8.687 ( 3.152 -4.633 -2.645) 6.197 9.566 ( 4.038 2.899 -9.429) 10.659 9.803 ( 0.494 0.231 -9.119) 9.135 10.339 ( -0.022 -1.546 -7.869) 8.020 10.588 ( -0.278 -9.811 5.473) 11.238 10.797 ( -1.308 2.615 11.325) 11.696 11.042 ( -0.438 -7.719 4.342) 8.867 11.351 ( -6.606 8.777 -3.217) 11.447 11.849 ( -21.849 7.517 -2.135) 23.204 12.519 ( 10.516 -16.637 0.869) 19.701 12.635 ( 2.979 -3.037 -0.960) 4.361 12.886 ( 5.371 -6.851 3.012) 9.212 13.543 ( 9.717 -9.002 0.407) 13.252 13.986 ( 12.482 -1.012 -11.340) 16.895 14.193 ( -1.202 -0.352 -1.117) 1.679 14.486 ( 5.297 0.681 -0.462) 5.360 14.982 ( 5.083 -5.298 11.555) 13.690 15.366 ( -42.005 -31.991 27.042) 59.323 15.727 ( 4.201 -7.349 11.949) 14.643 15.840 ( -1.449 1.888 5.097) 5.625 15.877 ( 13.962 -12.909 24.176) 30.758 16.279 ( -1.395 0.225 0.725) 1.588 16.577 ( 3.427 3.738 1.282) 5.230 21.102 ( 2.017 -2.006 -1.714) 3.321 21.222 ( 6.302 15.247 -11.469) 20.093 22.222 ( 3.169 2.467 -1.046) 4.150 22.703 ( -24.041 26.874 -29.155) 46.370 ======================= Grid point 127 (51/227) ======================= q-point: ( 0.20 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 13.151 0.000 2.811) 13.448 1.901 ( 7.000 0.000 1.825) 7.234 2.625 ( 0.250 0.000 2.363) 2.376 2.654 ( 21.165 0.000 -9.398) 23.158 3.180 ( 13.302 0.000 1.851) 13.430 3.447 ( 17.350 0.000 2.127) 17.480 3.507 ( 1.563 0.000 -3.767) 4.079 3.784 ( 22.906 0.000 0.337) 22.908 4.281 ( 3.664 0.000 1.820) 4.091 4.423 ( -2.730 -0.000 -5.394) 6.046 4.458 ( -8.986 -0.000 -5.148) 10.356 4.754 ( -5.959 -0.000 -1.794) 6.223 5.067 ( -5.615 -0.000 -5.586) 7.921 5.859 ( 2.049 0.000 19.325) 19.434 6.097 ( 2.548 0.000 0.461) 2.589 6.619 ( -8.089 -0.000 -0.039) 8.089 7.642 ( -4.645 -0.000 11.772) 12.655 8.031 ( -3.249 -0.000 0.554) 3.296 8.226 ( -9.538 -0.000 5.444) 10.982 9.698 ( 0.668 0.000 -8.519) 8.545 10.052 ( -11.565 -0.000 -19.325) 22.521 10.090 ( 10.381 0.000 -5.001) 11.523 10.259 ( -8.441 -0.000 9.994) 13.082 10.447 ( -1.944 -0.000 -22.599) 22.682 10.703 ( -0.244 -0.000 3.863) 3.870 11.070 ( -2.223 -0.000 0.854) 2.382 12.185 ( 21.109 0.000 16.690) 26.910 12.209 ( -17.026 -0.000 9.517) 19.505 12.317 ( -9.249 -0.000 -5.408) 10.714 13.598 ( 11.117 0.000 3.961) 11.802 13.708 ( 3.783 0.000 0.112) 3.785 13.845 ( -6.259 -0.000 -6.589) 9.088 14.065 ( -14.269 -0.000 4.367) 14.923 14.280 ( 5.465 0.000 -10.641) 11.963 14.432 ( -4.354 -0.000 5.007) 6.635 15.288 ( 4.867 0.000 3.438) 5.959 15.586 ( -5.899 -0.000 1.271) 6.034 15.780 ( -1.267 -0.000 -3.667) 3.880 16.244 ( -1.854 -0.000 1.403) 2.325 16.535 ( -2.863 -0.000 5.925) 6.580 18.252 ( -9.659 -0.000 -4.188) 10.528 20.613 ( 2.093 0.000 1.028) 2.332 21.604 ( 7.598 0.000 -9.872) 12.458 21.669 ( 12.611 0.000 -0.107) 12.611 22.249 ( -0.012 -0.000 6.225) 6.225 ======================= Grid point 128 (52/227) ======================= q-point: ( 0.30 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( 2.883 12.396 1.730) 12.844 2.027 ( 4.813 -6.856 -0.160) 8.378 2.651 ( 3.545 0.020 1.250) 3.759 2.884 ( 5.306 -0.938 -3.013) 6.174 3.415 ( 18.203 7.075 -4.615) 20.067 3.504 ( -0.477 -2.553 -1.563) 3.031 3.793 ( 16.955 -3.783 1.264) 17.418 3.992 ( 2.357 5.085 -11.566) 12.852 4.106 ( -9.748 2.615 0.971) 10.139 4.312 ( -9.185 -5.642 -3.476) 11.327 4.546 ( 0.638 -1.688 -3.332) 3.789 4.794 ( 10.084 0.334 3.834) 10.793 5.052 ( 3.374 -8.996 -3.811) 10.336 5.897 ( 2.138 1.956 17.191) 17.434 6.116 ( 1.409 1.413 1.922) 2.770 6.487 ( -8.856 -1.651 0.074) 9.009 7.622 ( 1.552 -1.657 10.601) 10.841 7.989 ( -0.785 2.384 -0.151) 2.515 8.082 ( -8.507 -0.945 8.243) 11.883 9.610 ( -11.028 2.748 -13.623) 17.741 9.910 ( 1.851 6.420 -16.203) 17.526 10.175 ( -4.974 -4.833 8.886) 11.272 10.266 ( 9.896 -1.284 -1.350) 10.070 10.383 ( -3.715 1.702 -24.135) 24.478 10.726 ( 0.668 -3.185 5.581) 6.460 11.062 ( 0.245 -1.582 -1.432) 2.148 11.889 ( -14.565 9.140 5.172) 17.957 12.180 ( -10.809 -5.876 3.070) 12.680 12.510 ( 16.711 0.553 9.394) 19.178 13.642 ( -4.487 6.743 -5.799) 9.961 13.767 ( 4.373 -0.042 2.563) 5.069 13.826 ( -14.791 -3.043 2.765) 15.352 13.856 ( 6.516 -1.985 3.811) 7.805 14.317 ( -1.931 -1.609 -2.324) 3.423 14.431 ( 3.823 -0.656 -4.994) 6.323 15.365 ( 4.193 0.979 4.647) 6.335 15.495 ( -4.516 -0.485 1.498) 4.783 15.768 ( -1.580 -2.734 -4.171) 5.232 16.182 ( -3.539 3.352 0.742) 4.930 16.502 ( -3.547 -3.269 4.651) 6.700 18.011 ( -12.767 8.139 -2.514) 15.348 20.698 ( 0.855 -9.031 1.493) 9.193 21.692 ( 5.616 3.427 -6.366) 9.154 21.881 ( 12.634 0.190 -1.798) 12.762 22.276 ( 3.143 -0.715 4.968) 5.922 ======================= Grid point 129 (53/227) ======================= q-point: ( 0.40 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 0.935 13.335 0.587) 13.380 2.113 ( -1.696 -3.547 -1.559) 4.229 2.734 ( 4.747 -1.741 -0.110) 5.058 2.906 ( 2.374 4.841 -1.077) 5.498 3.426 ( -6.537 1.139 0.277) 6.642 3.630 ( -2.892 2.221 -1.082) 3.803 3.714 ( -3.786 9.602 -11.449) 15.415 3.890 ( 1.318 6.860 3.391) 7.765 4.265 ( 6.795 -8.722 -0.678) 11.077 4.310 ( 0.432 -11.543 -3.745) 12.143 4.519 ( -0.736 -1.582 -2.303) 2.889 4.872 ( 6.545 5.835 -0.689) 8.795 5.314 ( 8.830 -7.744 -2.935) 12.106 5.903 ( 1.500 3.683 13.716) 14.281 6.128 ( 2.524 2.897 2.389) 4.525 6.379 ( -6.718 -4.384 3.047) 8.582 7.735 ( 6.693 -4.778 8.117) 11.555 7.903 ( -5.604 3.835 3.267) 7.536 8.029 ( 0.146 -1.435 3.247) 3.553 9.371 ( -10.028 4.391 -16.608) 19.892 9.904 ( 4.699 7.794 -10.140) 13.625 10.186 ( -1.015 -5.962 3.017) 6.759 10.290 ( -4.154 0.824 -22.647) 23.040 10.430 ( 6.639 -3.647 8.577) 11.443 10.791 ( 1.654 -5.358 4.145) 6.973 11.104 ( 3.149 -0.697 -7.049) 7.752 11.599 ( -8.200 9.597 4.816) 13.510 12.083 ( -9.063 -7.515 5.947) 13.190 12.720 ( 8.770 0.145 5.200) 10.196 13.440 ( -9.777 7.536 -9.228) 15.412 13.603 ( -15.177 -4.677 3.237) 16.208 13.875 ( 6.767 -0.138 4.935) 8.376 14.000 ( 8.414 0.445 3.343) 9.065 14.292 ( -3.307 -2.691 -0.616) 4.308 14.511 ( 4.431 -1.214 -6.147) 7.674 15.376 ( -0.329 1.758 5.932) 6.196 15.496 ( 1.467 -2.872 4.038) 5.168 15.780 ( -1.497 -4.808 -4.405) 6.691 16.078 ( -4.582 3.500 -0.434) 5.782 16.479 ( -4.115 -3.837 2.798) 6.283 17.699 ( -15.370 7.491 -1.141) 17.136 20.796 ( -0.504 -9.478 1.803) 9.661 21.707 ( 1.865 5.320 -2.423) 6.136 22.063 ( 11.429 2.878 -3.684) 12.348 22.379 ( 8.315 -0.824 2.793) 8.811 ======================= Grid point 130 (54/227) ======================= q-point: (-0.50 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( 1.431 12.119 0.596) 12.218 2.042 ( -6.672 2.445 -2.380) 7.494 2.790 ( 1.844 3.527 -2.658) 4.786 2.935 ( 6.138 2.496 1.003) 6.701 3.117 ( -19.690 11.515 -4.675) 23.284 3.444 ( -10.806 -2.655 9.699) 14.761 3.645 ( -5.187 3.047 -2.376) 6.468 3.890 ( 4.862 8.112 -0.549) 9.473 4.352 ( -2.963 -10.354 0.707) 10.792 4.408 ( 2.315 -2.119 -2.990) 4.335 4.669 ( 8.125 -7.865 -5.882) 12.747 4.961 ( 12.671 6.753 1.360) 14.423 5.373 ( -1.546 5.533 -4.122) 7.071 5.876 ( 0.215 4.844 8.730) 9.986 6.134 ( 0.558 0.513 5.556) 5.607 6.395 ( 0.110 -6.433 1.429) 6.591 7.730 ( -5.520 7.208 3.453) 9.713 7.927 ( 4.481 -6.603 8.103) 11.372 8.087 ( 5.116 -1.901 -2.225) 5.894 9.246 ( -1.873 -2.041 -15.247) 15.496 9.880 ( 3.295 8.858 -9.300) 13.260 10.219 ( -4.393 -3.949 -16.223) 17.265 10.253 ( 2.384 -2.346 -2.723) 4.313 10.556 ( 1.451 -6.971 15.465) 17.025 10.901 ( 6.070 -5.307 2.194) 8.356 11.127 ( -0.618 1.645 -7.997) 8.187 11.490 ( 5.047 6.435 4.076) 9.137 12.055 ( -4.803 -9.678 8.735) 13.893 12.798 ( -0.295 -2.020 0.975) 2.262 13.181 ( -10.577 9.108 -9.860) 17.089 13.428 ( -13.256 -6.085 0.668) 14.601 13.980 ( 4.596 -1.175 4.569) 6.586 14.116 ( 6.292 2.108 -0.811) 6.685 14.271 ( -0.592 -1.249 1.757) 2.235 14.595 ( 3.699 -2.852 -4.131) 6.236 15.374 ( 1.359 0.240 9.885) 9.980 15.548 ( -0.362 -3.862 7.148) 8.133 15.809 ( -1.194 -5.437 -4.584) 7.211 15.970 ( -5.014 1.990 -1.592) 5.624 16.445 ( -3.883 -2.623 0.609) 4.725 17.364 ( -17.374 5.588 0.189) 18.251 20.870 ( -1.322 -8.172 1.804) 8.473 21.654 ( -0.617 6.597 -0.373) 6.636 22.189 ( 9.154 5.183 -5.092) 11.687 22.559 ( 12.555 -0.244 1.103) 12.605 ======================= Grid point 131 (55/227) ======================= q-point: (-0.40 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( 0.739 10.288 0.505) 10.327 1.883 ( -4.502 8.860 -0.143) 9.939 2.552 ( -16.416 21.446 0.835) 27.020 2.858 ( 0.743 4.061 -4.719) 6.270 3.029 ( 4.383 -2.222 1.838) 5.247 3.240 ( -17.139 1.000 14.137) 22.239 3.536 ( -4.122 2.813 1.358) 5.172 3.832 ( -2.934 5.255 -0.514) 6.040 4.374 ( 4.555 9.223 -4.776) 11.341 4.497 ( 1.905 -7.962 0.798) 8.226 4.828 ( 0.848 -9.011 -5.046) 10.362 5.130 ( 15.244 7.608 -0.900) 17.061 5.258 ( -0.572 6.824 -2.163) 7.181 5.843 ( 2.163 5.338 4.080) 7.058 6.168 ( 0.802 -4.393 6.554) 7.931 6.413 ( -4.828 -2.548 0.608) 5.493 7.560 ( -5.596 7.768 1.131) 9.641 8.032 ( 2.331 -3.873 7.179) 8.484 8.227 ( 7.116 -4.802 -3.862) 9.413 9.331 ( 4.581 -8.779 -12.265) 15.763 9.847 ( 3.889 7.752 -9.896) 13.158 10.188 ( -3.199 -4.439 -14.832) 15.809 10.319 ( 1.833 -2.837 -1.555) 3.719 10.620 ( -3.314 -7.852 17.312) 19.295 11.079 ( -1.783 0.682 0.657) 2.019 11.134 ( 16.230 -5.117 1.013) 17.047 11.563 ( 8.070 5.082 0.089) 9.537 12.129 ( 0.063 -10.900 8.810) 14.015 12.747 ( -11.977 -6.311 -1.505) 13.622 12.949 ( -2.394 11.407 -9.364) 14.951 13.278 ( -13.183 -6.902 -2.238) 15.048 14.037 ( 0.597 -0.125 -1.611) 1.723 14.138 ( -0.394 -0.572 -0.064) 0.698 14.337 ( 7.273 1.323 2.339) 7.753 14.685 ( 2.768 -4.440 -2.041) 5.616 15.425 ( 4.205 -0.281 16.447) 16.978 15.541 ( -7.587 -5.810 8.742) 12.952 15.832 ( -2.020 -2.100 0.888) 3.046 15.884 ( -3.347 -1.372 -6.936) 7.822 16.412 ( -2.224 -0.911 -0.520) 2.459 17.028 ( -16.839 4.763 1.219) 17.542 20.921 ( -1.779 -6.899 1.527) 7.286 21.567 ( -1.123 7.375 -0.374) 7.469 22.259 ( 6.746 6.161 -4.955) 10.393 22.780 ( 13.861 0.266 -1.654) 13.962 ======================= Grid point 132 (56/227) ======================= q-point: (-0.30 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( -1.887 8.370 -0.314) 8.586 1.748 ( 3.861 17.134 5.851) 18.513 2.070 ( -11.276 25.411 6.883) 28.640 2.762 ( -16.206 9.796 11.452) 22.130 2.939 ( -1.669 9.695 1.796) 10.000 3.134 ( 4.883 -2.952 1.748) 5.968 3.445 ( -5.076 0.882 3.474) 6.214 3.721 ( -5.089 2.447 0.228) 5.652 4.324 ( 8.190 18.735 -12.045) 23.731 4.605 ( 1.668 -6.419 1.772) 6.865 4.869 ( -2.979 -4.562 -3.358) 6.400 5.256 ( 3.986 -3.607 -6.270) 8.259 5.304 ( 13.621 10.139 0.467) 16.987 5.846 ( 4.234 5.922 2.498) 7.697 6.152 ( -7.701 4.236 0.677) 8.815 6.379 ( -3.734 -13.403 8.678) 16.398 7.411 ( -3.678 5.849 -2.276) 7.274 8.105 ( 1.556 -3.803 5.366) 6.759 8.394 ( 6.070 -6.890 -2.422) 9.497 9.494 ( 5.158 -6.260 -9.328) 12.361 9.848 ( 4.399 5.647 -10.126) 12.400 10.201 ( -2.324 -7.840 -10.691) 13.460 10.369 ( 1.593 -2.474 -1.786) 3.442 10.643 ( -3.503 -7.856 17.493) 19.494 11.056 ( 0.210 1.912 3.237) 3.766 11.539 ( 21.289 -9.379 6.796) 24.236 11.607 ( 5.331 5.297 -4.031) 8.527 12.217 ( -5.401 -8.986 3.254) 10.977 12.569 ( -12.627 -5.018 -3.581) 14.052 12.879 ( 3.207 7.754 -7.011) 10.934 13.163 ( -8.316 -10.088 -0.460) 13.082 14.003 ( -2.037 1.473 -6.443) 6.916 14.160 ( 0.545 -1.848 2.467) 3.130 14.436 ( 5.881 1.325 -0.004) 6.029 14.760 ( 0.194 -5.040 0.879) 5.120 15.403 ( -16.594 -5.690 11.905) 21.201 15.534 ( 6.572 -1.307 19.344) 20.472 15.777 ( -3.254 -0.063 1.127) 3.444 15.892 ( 0.350 -1.353 -5.018) 5.209 16.382 ( -2.033 1.210 1.786) 2.964 16.751 ( -9.809 4.667 0.158) 10.864 20.957 ( -1.611 -6.117 1.077) 6.416 21.480 ( -0.098 7.453 -1.532) 7.609 22.288 ( 4.624 5.869 -3.504) 8.253 22.977 ( 9.436 0.437 -7.601) 12.125 ======================= Grid point 133 (57/227) ======================= q-point: (-0.20 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( -3.546 12.126 3.166) 13.025 1.631 ( 3.331 24.798 12.239) 27.854 1.753 ( 3.013 20.626 9.091) 22.741 2.298 ( -7.146 26.797 24.076) 36.726 2.916 ( 3.972 7.458 -5.925) 10.320 3.239 ( 2.163 -4.845 2.485) 5.859 3.359 ( -6.621 -2.022 2.056) 7.222 3.645 ( -0.292 1.742 1.179) 2.123 4.278 ( 8.836 17.998 -22.822) 30.379 4.659 ( 1.118 1.106 0.024) 1.573 4.854 ( -4.248 -4.580 -0.984) 6.324 5.324 ( 1.081 -0.268 -9.920) 9.982 5.421 ( 10.463 6.828 2.136) 12.675 5.718 ( -14.018 9.168 -0.158) 16.750 6.027 ( 3.102 3.335 7.125) 8.457 6.509 ( -2.281 -16.910 10.620) 20.098 7.354 ( 2.595 0.862 -6.191) 6.768 8.154 ( -0.824 -3.842 4.472) 5.953 8.554 ( 4.089 -7.749 -0.749) 8.794 9.607 ( 5.337 -0.161 -6.673) 8.546 9.852 ( 2.672 4.510 -9.488) 10.840 10.235 ( -4.179 -9.483 -7.296) 12.674 10.432 ( 2.008 -3.556 0.419) 4.105 10.697 ( -0.906 -8.980 15.558) 17.986 11.030 ( -1.028 3.128 4.607) 5.663 11.521 ( -4.260 7.411 -2.144) 8.813 11.954 ( -7.368 2.008 0.547) 7.656 12.134 ( 3.814 -19.032 -2.266) 19.542 12.547 ( 3.814 -5.998 -0.744) 7.146 12.815 ( -4.390 0.186 -6.545) 7.884 13.316 ( 11.910 -11.922 4.954) 17.565 13.980 ( 1.606 0.036 -7.938) 8.099 14.175 ( -0.511 -1.272 1.253) 1.857 14.498 ( 2.750 0.380 0.280) 2.790 14.792 ( -3.472 -6.919 8.535) 11.523 15.141 ( -17.364 -0.355 11.228) 20.681 15.628 ( -0.438 -3.478 14.556) 14.972 15.817 ( 9.198 -0.703 7.878) 12.131 15.894 ( 1.989 2.896 -0.316) 3.527 16.309 ( -3.652 2.495 2.150) 4.918 16.657 ( 2.976 3.528 -0.053) 4.616 21.000 ( -0.287 -6.015 0.611) 6.053 21.421 ( 1.827 6.711 -3.052) 7.595 22.294 ( 2.847 4.725 -1.229) 5.651 22.989 ( -7.721 5.332 -17.776) 20.100 ======================= Grid point 134 (58/227) ======================= q-point: (-0.10 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( -0.737 15.416 9.063) 17.898 1.328 ( 0.158 24.964 18.810) 31.258 1.800 ( 18.225 11.750 5.931) 22.481 2.210 ( 25.638 26.237 23.089) 43.346 2.868 ( -1.154 6.214 -3.184) 7.077 3.222 ( -11.731 -0.207 1.559) 11.836 3.313 ( 1.977 -4.261 1.090) 4.823 3.689 ( 5.747 3.735 -2.325) 7.238 4.176 ( 2.611 20.312 -26.549) 33.529 4.621 ( -1.241 5.101 -2.961) 6.027 4.795 ( -6.779 -1.153 3.305) 7.630 5.241 ( -9.621 4.865 1.690) 10.913 5.368 ( -6.618 -1.076 -3.081) 7.379 5.617 ( 12.789 6.327 -2.949) 14.570 6.050 ( 0.727 3.988 7.130) 8.201 6.627 ( -1.233 -12.742 10.876) 16.798 7.497 ( 8.704 -8.844 -7.214) 14.353 8.155 ( -3.227 -2.904 3.755) 5.740 8.652 ( -1.443 -5.318 -0.773) 5.564 9.667 ( 4.527 3.864 -5.643) 8.202 9.843 ( 1.962 3.520 -7.887) 8.857 10.261 ( -4.141 -10.317 -8.307) 13.878 10.471 ( -3.391 -4.684 5.456) 7.950 10.738 ( -6.330 -2.261 9.685) 11.789 10.971 ( -2.967 -0.337 4.410) 5.326 11.343 ( -2.890 9.925 1.948) 10.519 11.599 ( -14.970 8.144 -1.039) 17.073 12.382 ( -4.243 -17.416 -3.221) 18.212 12.721 ( 2.933 -1.679 0.689) 3.449 12.865 ( 10.323 -9.252 0.634) 13.877 13.593 ( 4.970 -6.854 0.628) 8.489 14.027 ( -1.326 -4.024 -9.853) 10.726 14.190 ( -0.659 -2.084 -6.162) 6.538 14.510 ( -2.547 -1.097 3.057) 4.127 14.753 ( -10.706 -5.052 17.648) 21.251 15.038 ( 5.575 -2.935 11.049) 12.719 15.668 ( -0.324 -6.672 4.020) 7.796 15.839 ( 0.281 4.070 3.189) 5.178 16.191 ( 20.702 -11.690 6.599) 24.673 16.259 ( 1.472 -2.621 2.072) 3.651 16.777 ( 17.934 -0.494 6.046) 18.932 21.078 ( 2.172 -6.617 0.396) 6.976 21.406 ( 3.979 5.377 -4.218) 7.908 22.288 ( 1.318 3.366 1.391) 3.873 22.478 ( -32.687 30.326 -22.857) 50.105 ======================= Grid point 138 (59/227) ======================= q-point: ( 0.30 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.946 ( -0.429 -0.000 -3.381) 3.408 1.993 ( 0.198 0.000 0.488) 0.527 2.716 ( 4.681 0.000 1.070) 4.802 2.958 ( 3.406 0.000 -0.661) 3.470 3.406 ( -8.022 -0.000 0.268) 8.027 3.679 ( 2.956 0.000 -4.374) 5.279 3.908 ( -7.920 -0.000 -9.283) 12.203 3.987 ( -1.107 -0.000 -0.390) 1.174 4.099 ( 2.798 0.000 -0.588) 2.859 4.144 ( 4.337 0.000 0.157) 4.340 4.508 ( 1.081 0.000 -2.552) 2.772 5.023 ( 5.144 0.000 -6.995) 8.683 5.137 ( 18.630 0.000 1.535) 18.693 5.943 ( 1.037 0.000 14.391) 14.429 6.161 ( 3.540 0.000 2.865) 4.554 6.331 ( -9.431 -0.000 3.558) 10.080 7.676 ( 6.043 0.000 9.397) 11.172 7.944 ( -7.543 -0.000 8.534) 11.390 8.016 ( 1.858 0.000 -0.865) 2.049 9.425 ( -11.670 -0.000 -18.382) 21.774 10.030 ( 7.856 0.000 -18.190) 19.814 10.086 ( -2.479 -0.000 7.625) 8.017 10.300 ( -5.406 -0.000 -20.967) 21.652 10.385 ( 4.578 0.000 7.259) 8.582 10.734 ( 2.198 0.000 6.194) 6.573 11.100 ( 4.993 0.000 -6.345) 8.074 11.733 ( -9.777 -0.000 10.280) 14.186 11.975 ( -9.959 -0.000 0.338) 9.964 12.712 ( 6.876 0.000 6.575) 9.514 13.528 ( -9.306 -0.000 -11.001) 14.409 13.542 ( -16.938 -0.000 2.706) 17.153 13.886 ( 6.129 0.000 5.568) 8.281 14.006 ( 11.652 0.000 5.919) 13.069 14.255 ( -3.410 -0.000 -0.372) 3.430 14.500 ( 4.197 0.000 -8.181) 9.194 15.419 ( -3.517 -0.000 2.571) 4.356 15.438 ( 2.937 0.000 7.797) 8.332 15.730 ( -0.808 -0.000 -6.558) 6.608 16.124 ( -5.665 -0.000 1.924) 5.983 16.429 ( -3.092 -0.000 1.866) 3.612 17.785 ( -18.069 -0.000 -1.734) 18.152 20.691 ( 2.358 0.000 1.934) 3.050 21.762 ( 1.214 0.000 -1.869) 2.228 22.096 ( 12.803 0.000 -1.496) 12.890 22.367 ( 8.236 0.000 0.504) 8.252 ======================= Grid point 139 (60/227) ======================= q-point: (-0.60 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -0.706 10.785 -2.617) 11.120 2.017 ( -3.321 -5.075 -3.678) 7.093 2.801 ( 4.968 -0.316 -0.596) 5.014 2.986 ( 1.555 1.800 -0.769) 2.500 3.232 ( -14.500 -1.035 0.300) 14.540 3.518 ( -11.375 7.816 2.922) 14.108 3.739 ( -5.094 8.728 -3.713) 10.766 3.988 ( -0.395 -6.122 -0.893) 6.200 4.096 ( -6.128 -5.901 4.126) 9.455 4.321 ( 7.219 -4.738 -0.881) 8.680 4.638 ( 13.611 1.460 -5.867) 14.893 5.120 ( 12.924 7.224 -5.100) 15.659 5.393 ( 7.933 -2.565 -3.795) 9.161 5.945 ( -0.127 1.731 10.165) 10.312 6.156 ( -7.185 1.820 7.864) 10.807 6.268 ( 2.812 -5.003 3.564) 6.756 7.819 ( 8.059 -2.854 7.835) 11.597 7.830 ( -5.558 2.206 6.950) 9.168 8.057 ( 2.872 -0.906 -2.140) 3.694 9.251 ( -6.873 1.076 -17.795) 19.106 10.033 ( -0.816 3.271 -4.775) 5.845 10.145 ( 2.811 0.652 -13.674) 13.975 10.233 ( -0.342 -1.214 -9.508) 9.591 10.438 ( -0.341 -4.146 11.497) 12.227 10.812 ( 5.984 -2.672 3.721) 7.536 11.168 ( 2.424 1.537 -7.879) 8.385 11.632 ( 2.876 6.824 9.007) 11.660 11.874 ( -6.577 -7.669 4.631) 11.114 12.739 ( -4.757 -2.200 2.205) 5.686 13.276 ( -16.268 -1.152 0.200) 16.310 13.377 ( -7.009 2.100 -11.467) 13.602 13.969 ( 4.041 -0.083 4.952) 6.392 14.170 ( 4.855 3.225 1.952) 6.146 14.233 ( 3.330 -2.596 3.541) 5.511 14.559 ( 3.135 -0.838 -7.306) 7.994 15.382 ( -0.079 0.527 6.600) 6.622 15.473 ( -1.518 -2.748 10.463) 10.924 15.740 ( 1.466 -1.479 -8.916) 9.156 16.012 ( -6.691 1.454 1.943) 7.117 16.398 ( -2.023 -1.547 -0.544) 2.604 17.459 ( -19.165 2.902 -0.239) 19.385 20.745 ( 1.401 -3.570 2.220) 4.431 21.744 ( -1.617 2.270 1.740) 3.286 22.277 ( 10.817 2.888 -2.926) 11.572 22.537 ( 11.429 -1.259 -2.413) 11.748 ======================= Grid point 140 (61/227) ======================= q-point: (-0.50 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( -3.259 8.821 -2.498) 9.730 1.997 ( 0.379 2.183 -5.132) 5.590 2.860 ( 1.323 4.557 -1.649) 5.023 2.920 ( -11.569 3.856 -2.464) 12.441 2.998 ( -6.359 -0.723 1.832) 6.657 3.297 ( -4.325 8.754 10.474) 14.319 3.596 ( -4.810 3.769 0.582) 6.138 3.932 ( -5.950 4.173 3.228) 7.952 4.163 ( -1.826 -17.697 3.358) 18.105 4.480 ( 6.619 -5.340 -2.238) 8.794 4.813 ( 12.469 7.570 -8.207) 16.737 5.283 ( 13.369 6.549 -2.545) 15.103 5.432 ( 2.622 8.010 -3.163) 9.002 5.922 ( 0.041 2.558 7.397) 7.827 6.050 ( -6.526 -5.024 9.390) 12.490 6.363 ( 0.709 -3.483 0.413) 3.579 7.701 ( -5.361 5.934 4.348) 9.103 7.963 ( 4.520 -2.681 8.085) 9.643 8.142 ( 4.989 -3.646 -3.647) 7.175 9.203 ( 0.956 -3.601 -14.044) 14.530 9.984 ( -1.653 0.265 -10.834) 10.963 10.110 ( -2.017 3.418 -8.110) 9.029 10.297 ( 4.648 -0.956 -4.421) 6.486 10.475 ( -2.201 -6.144 11.424) 13.157 10.988 ( 9.279 -4.896 3.122) 10.946 11.151 ( 1.206 1.975 -2.603) 3.483 11.666 ( 5.881 4.963 0.875) 7.745 11.938 ( 3.825 -7.906 9.444) 12.896 12.624 ( -13.139 -5.186 -0.978) 14.160 13.050 ( -12.524 -2.268 -0.426) 12.735 13.236 ( -6.718 3.701 -13.185) 15.254 14.024 ( 1.602 -0.727 1.888) 2.581 14.140 ( -2.347 0.418 -0.419) 2.420 14.366 ( 8.369 1.454 4.472) 9.599 14.621 ( 3.010 -2.042 -6.019) 7.033 15.415 ( 3.329 -0.616 14.010) 14.413 15.441 ( -7.010 -3.735 10.280) 12.991 15.794 ( 3.351 -1.108 -8.127) 8.860 15.893 ( -5.955 0.850 0.456) 6.033 16.390 ( -0.595 -1.078 -1.765) 2.152 17.123 ( -17.210 3.893 1.287) 17.691 20.800 ( 0.090 -4.608 2.187) 5.102 21.679 ( -2.433 3.762 2.607) 5.183 22.383 ( 7.699 5.728 -4.112) 10.440 22.748 ( 11.528 -2.727 -3.737) 12.421 ======================= Grid point 141 (62/227) ======================= q-point: (-0.40 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -3.805 7.141 -2.927) 8.605 2.006 ( 7.469 8.330 -3.671) 11.775 2.540 ( -10.865 18.632 1.875) 21.650 2.864 ( -10.983 1.326 7.552) 13.395 2.941 ( 1.236 -3.589 -2.407) 4.495 3.207 ( 2.719 8.448 11.414) 14.458 3.496 ( -3.820 3.073 1.004) 5.004 3.787 ( -5.851 3.983 2.862) 7.635 4.324 ( 0.107 -15.363 3.408) 15.737 4.639 ( 6.897 -3.690 -2.875) 8.334 4.876 ( 8.244 13.996 -7.868) 18.049 5.270 ( -1.493 6.554 -4.085) 7.866 5.512 ( 14.060 7.422 0.345) 15.902 5.926 ( 3.119 1.750 3.613) 5.084 6.052 ( -3.687 -10.000 9.681) 14.398 6.302 ( -9.224 2.484 -0.621) 9.572 7.546 ( -4.895 7.406 1.001) 8.933 8.038 ( 1.611 -2.768 6.674) 7.403 8.271 ( 4.981 -5.264 -2.253) 7.589 9.331 ( 6.491 -8.336 -8.847) 13.780 9.984 ( 1.573 -1.346 -11.681) 11.863 10.034 ( -3.714 1.104 -6.021) 7.160 10.370 ( 4.344 1.044 -5.155) 6.821 10.498 ( -2.878 -6.289 14.044) 15.655 11.075 ( 0.708 0.227 7.709) 7.745 11.334 ( 12.888 -10.064 -1.594) 16.429 11.710 ( 5.834 4.402 -2.140) 7.616 12.073 ( 0.787 -4.818 5.760) 7.550 12.449 ( -13.258 -6.463 -2.229) 14.917 12.954 ( -3.010 -6.076 3.442) 7.604 13.062 ( -8.180 5.332 -16.177) 18.896 14.018 ( -2.246 0.184 -3.927) 4.528 14.129 ( 0.412 -1.084 3.043) 3.257 14.462 ( 4.824 1.265 1.328) 5.161 14.686 ( 2.106 -2.414 -4.686) 5.676 15.326 ( -11.158 -2.499 9.998) 15.189 15.504 ( 4.559 -1.695 20.477) 21.046 15.788 ( -2.452 1.071 -0.062) 2.677 15.882 ( 4.332 -0.104 -7.332) 8.517 16.393 ( -0.077 -0.036 -0.163) 0.184 16.842 ( -11.311 4.111 1.236) 12.098 20.842 ( -0.787 -4.956 1.807) 5.334 21.600 ( -1.921 4.594 1.802) 5.295 22.418 ( 4.651 6.731 -3.724) 8.989 22.940 ( 7.473 -3.422 -6.043) 10.202 ======================= Grid point 142 (63/227) ======================= q-point: (-0.30 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -1.229 7.509 -2.399) 7.978 2.045 ( 9.627 15.466 0.772) 18.234 2.215 ( -3.642 21.456 4.712) 22.267 2.632 ( -7.628 8.981 13.875) 18.204 2.996 ( 1.204 -2.009 -4.033) 4.664 3.206 ( 3.299 3.263 9.275) 10.371 3.395 ( -3.567 5.354 0.543) 6.457 3.693 ( -0.494 3.181 2.132) 3.861 4.450 ( 0.206 -7.854 -0.100) 7.857 4.758 ( 7.768 4.589 -4.042) 9.886 4.807 ( 1.487 11.456 -3.671) 12.121 5.245 ( 0.325 -2.850 -4.074) 4.982 5.654 ( 12.460 8.757 -2.953) 15.513 5.879 ( -12.533 6.399 0.010) 14.072 6.081 ( 0.060 2.311 4.364) 4.939 6.162 ( -4.278 -14.512 10.031) 18.152 7.419 ( -1.826 5.457 -3.110) 6.541 8.082 ( -0.331 -3.291 5.791) 6.669 8.403 ( 3.637 -6.840 -0.153) 7.748 9.528 ( 7.400 -7.207 -4.448) 11.247 9.966 ( -1.999 2.304 -5.742) 6.502 10.034 ( -0.337 -5.105 -11.345) 12.445 10.419 ( 3.224 1.195 -3.080) 4.616 10.534 ( -0.608 -6.775 14.869) 16.351 11.081 ( 0.403 1.726 8.519) 8.701 11.564 ( -2.095 -8.476 0.464) 8.743 11.818 ( 9.279 -3.681 -5.377) 11.338 11.988 ( -12.859 -0.739 1.191) 12.935 12.406 ( 1.260 -7.879 -1.323) 8.088 12.869 ( -7.601 4.168 -15.959) 18.162 13.098 ( 9.760 -9.335 6.394) 14.943 13.980 ( -1.344 -0.001 -5.827) 5.980 14.147 ( -0.340 -1.411 2.468) 2.863 14.502 ( 0.937 0.054 0.248) 0.971 14.721 ( -0.205 -1.432 -2.436) 2.833 15.156 ( -9.797 1.075 10.089) 14.104 15.563 ( -1.994 -3.117 15.762) 16.190 15.818 ( 7.743 0.696 5.644) 9.607 15.950 ( 5.805 2.652 -4.573) 7.851 16.359 ( -3.430 2.046 3.250) 5.149 16.714 ( 0.520 2.337 -0.708) 2.497 20.881 ( -0.688 -5.530 1.168) 5.694 21.532 ( -0.529 4.635 0.307) 4.675 22.406 ( 2.161 6.170 -1.999) 6.836 23.015 ( -2.637 -1.524 -10.038) 10.490 ======================= Grid point 143 (64/227) ======================= q-point: (-0.20 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( -1.813 10.873 -0.575) 11.038 1.838 ( -5.369 23.966 11.312) 27.040 2.131 ( 16.371 19.309 3.355) 25.536 2.586 ( 12.818 9.721 8.024) 17.977 2.991 ( -1.894 1.786 -2.481) 3.596 3.216 ( -4.824 -0.303 7.983) 9.332 3.302 ( 3.887 6.994 -0.177) 8.003 3.723 ( 6.438 1.457 0.406) 6.613 4.473 ( 1.049 5.116 -6.921) 8.670 4.731 ( -2.953 2.726 1.293) 4.221 4.784 ( 2.675 8.192 -6.059) 10.535 5.274 ( -2.351 -3.829 -4.963) 6.695 5.446 ( -18.027 11.287 5.502) 21.969 5.782 ( 9.562 7.154 -3.637) 12.484 6.079 ( -2.831 -1.824 5.411) 6.374 6.322 ( 2.877 -15.083 8.896) 17.746 7.403 ( 3.500 -0.527 -5.944) 6.918 8.095 ( -2.270 -3.014 5.495) 6.666 8.513 ( 0.160 -7.598 1.443) 7.736 9.698 ( 7.157 -2.551 -2.437) 7.979 9.915 ( -2.381 0.236 -4.862) 5.419 10.046 ( -3.461 -4.805 -11.557) 12.986 10.428 ( -1.939 -0.493 2.164) 2.947 10.630 ( 1.760 -6.036 10.964) 12.638 11.036 ( -2.934 4.230 5.018) 7.189 11.490 ( -5.484 3.203 1.856) 6.616 11.701 ( -14.735 1.953 -1.221) 14.914 12.020 ( -2.401 -15.723 -3.430) 16.271 12.643 ( 12.242 -7.309 -1.268) 14.315 12.761 ( 1.334 0.334 -10.257) 10.349 13.388 ( 9.621 -11.661 4.555) 15.789 13.969 ( -1.490 -1.766 -7.110) 7.476 14.149 ( -1.090 -1.553 0.385) 1.936 14.491 ( -2.945 -1.051 1.538) 3.485 14.709 ( -2.009 -0.060 0.411) 2.052 15.050 ( 0.215 2.371 10.850) 11.108 15.559 ( -2.076 -4.271 6.485) 8.037 15.914 ( 2.639 3.019 6.725) 7.830 16.087 ( 14.695 -0.274 2.259) 14.870 16.274 ( -3.347 1.981 1.075) 4.035 16.798 ( 11.157 0.915 2.531) 11.477 20.941 ( 0.665 -6.745 0.477) 6.795 21.495 ( 1.342 3.914 -0.992) 4.255 22.370 ( 0.315 4.700 0.476) 4.734 22.822 ( -17.651 8.078 -14.153) 24.023 ======================= Grid point 144 (65/227) ======================= q-point: (-0.10 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 1.553 8.459 4.051) 9.507 1.635 ( 8.319 19.218 7.962) 22.404 2.282 ( 21.450 14.906 1.345) 26.156 2.753 ( 11.155 4.738 -1.081) 12.168 2.959 ( 9.261 8.960 5.981) 14.207 3.074 ( -7.816 2.785 3.600) 9.045 3.373 ( 7.921 2.888 1.670) 8.595 3.820 ( 5.695 2.940 -2.036) 6.725 4.371 ( 0.728 16.634 -4.632) 17.282 4.583 ( -9.487 4.024 -2.159) 10.529 4.704 ( -4.134 1.460 -3.473) 5.593 5.167 ( -4.443 4.991 2.215) 7.039 5.261 ( -4.710 -1.780 -1.736) 5.326 5.860 ( 7.843 5.990 2.702) 10.232 6.012 ( -6.492 -1.556 3.118) 7.368 6.530 ( 4.261 -12.293 6.034) 14.342 7.512 ( 4.108 -6.277 -3.895) 8.452 8.075 ( -3.799 -2.607 4.897) 6.724 8.531 ( -6.631 -5.134 1.976) 8.616 9.784 ( 4.245 5.062 -4.053) 7.751 9.898 ( 0.469 -1.891 -3.142) 3.697 10.024 ( -7.230 -9.184 -11.682) 16.526 10.376 ( -5.149 -1.855 -0.593) 5.505 10.619 ( -6.628 1.183 7.393) 9.999 10.944 ( -2.305 3.780 3.859) 5.873 11.463 ( -2.358 8.695 -1.212) 9.091 11.493 ( 3.592 -1.184 5.650) 6.799 12.087 ( -8.905 -17.169 -5.852) 20.207 12.691 ( -2.701 -1.836 0.321) 3.281 13.028 ( 15.727 -5.512 -0.338) 16.669 13.591 ( 3.903 -6.683 2.403) 8.104 13.943 ( -4.085 -2.819 -5.676) 7.540 14.144 ( -0.519 -1.047 -5.002) 5.136 14.426 ( -6.359 -0.837 3.444) 7.280 14.659 ( -3.367 1.371 2.804) 4.591 15.114 ( 5.542 -0.846 8.358) 10.064 15.602 ( -0.067 -5.983 1.761) 6.237 15.890 ( -0.090 4.247 4.186) 5.964 16.220 ( -1.398 0.836 -3.341) 3.717 16.377 ( 12.218 -7.887 4.913) 15.350 17.085 ( 21.813 -6.453 6.158) 23.566 21.043 ( 2.595 -8.182 0.133) 8.585 21.498 ( 3.177 2.879 -0.799) 4.361 22.268 ( -23.364 21.287 -14.191) 34.647 22.336 ( -2.574 7.023 1.676) 7.665 ======================= Grid point 149 (66/227) ======================= q-point: ( 0.40 -0.60 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -8.050 -0.000 -2.569) 8.450 2.000 ( 4.612 0.000 -7.135) 8.496 2.875 ( 2.345 0.000 -2.750) 3.614 2.970 ( -4.125 -0.000 1.294) 4.323 2.975 ( -14.156 -0.000 1.387) 14.224 3.442 ( -3.067 -0.000 -0.263) 3.078 3.779 ( -4.039 -0.000 14.221) 14.784 3.807 ( -2.597 -0.000 -3.503) 4.361 3.980 ( -7.381 -0.000 4.548) 8.669 4.407 ( 5.740 0.000 -1.066) 5.838 4.911 ( 16.115 0.000 -6.818) 17.498 5.355 ( 11.052 0.000 -6.211) 12.677 5.517 ( 7.393 0.000 -2.860) 7.927 5.947 ( -1.314 -0.000 8.871) 8.968 6.003 ( -8.819 -0.000 8.431) 12.201 6.311 ( 2.674 0.000 2.659) 3.771 7.770 ( -4.116 -0.000 6.238) 7.474 7.935 ( 6.095 0.000 8.247) 10.255 8.098 ( 3.759 0.000 -4.235) 5.663 9.172 ( -1.832 -0.000 -15.093) 15.203 9.943 ( -7.070 -0.000 -13.026) 14.821 10.239 ( 2.459 0.000 9.261) 9.582 10.252 ( 4.193 0.000 -13.919) 14.537 10.398 ( -0.702 -0.000 4.364) 4.420 10.933 ( 9.889 0.000 1.288) 9.972 11.173 ( -1.996 -0.000 0.252) 2.012 11.737 ( -2.485 -0.000 1.400) 2.853 11.836 ( 13.340 0.000 8.077) 15.594 12.567 ( -13.494 -0.000 -0.513) 13.504 13.008 ( -14.545 -0.000 2.281) 14.723 13.289 ( -5.744 -0.000 -16.434) 17.409 14.016 ( 1.606 0.000 2.786) 3.216 14.145 ( -3.001 -0.000 -0.049) 3.001 14.384 ( 8.812 0.000 5.221) 10.242 14.600 ( 3.038 0.000 -7.313) 7.919 15.402 ( -5.922 -0.000 11.851) 13.248 15.408 ( 2.786 0.000 11.575) 11.906 15.784 ( 4.745 0.000 -9.690) 10.789 15.903 ( -6.944 -0.000 1.788) 7.171 16.377 ( 0.125 0.000 -2.198) 2.201 17.165 ( -17.789 -0.000 1.333) 17.839 20.751 ( 1.016 0.000 2.427) 2.631 21.717 ( -2.853 -0.000 3.614) 4.604 22.452 ( 8.350 0.000 -3.238) 8.955 22.709 ( 10.425 0.000 -4.989) 11.557 ======================= Grid point 151 (67/227) ======================= q-point: (-0.50 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( -5.689 3.335 -3.344) 7.394 2.093 ( 7.853 1.273 -7.667) 11.049 2.703 ( -14.627 -0.257 0.388) 14.634 2.878 ( -5.263 1.912 4.710) 7.317 2.945 ( 2.537 1.526 -2.406) 3.815 3.414 ( 3.751 7.466 2.707) 8.783 3.599 ( -2.913 11.458 9.193) 14.977 3.857 ( -5.979 2.241 3.686) 7.373 3.958 ( -0.255 -19.868 7.634) 21.286 4.515 ( 5.004 -4.234 -1.190) 6.662 5.107 ( 11.663 5.518 -7.656) 15.003 5.443 ( 1.561 5.503 -1.122) 5.829 5.598 ( 4.850 3.955 1.810) 6.515 5.906 ( -0.818 -2.823 7.180) 7.758 5.956 ( -0.377 -0.460 1.956) 2.045 6.321 ( -3.155 -0.348 -0.134) 3.177 7.680 ( -4.351 4.663 4.217) 7.645 7.994 ( 0.551 -1.532 7.091) 7.276 8.192 ( 5.571 -2.217 -2.715) 6.582 9.206 ( 4.744 -3.474 -9.732) 11.371 9.848 ( -6.297 -4.529 -12.494) 14.706 10.206 ( 1.845 8.628 0.068) 8.824 10.345 ( 1.936 -4.961 5.427) 7.603 10.424 ( 2.717 -0.343 -4.173) 4.991 11.077 ( 3.957 0.314 4.738) 6.181 11.169 ( 1.871 -5.360 3.453) 6.645 11.772 ( 8.056 1.572 -0.729) 8.240 12.026 ( 5.671 -0.419 1.607) 5.910 12.337 ( -15.354 -3.699 -1.207) 15.839 12.845 ( -5.849 -3.157 6.674) 9.419 13.159 ( -7.493 2.802 -20.743) 22.232 14.017 ( -1.684 -0.120 -1.627) 2.344 14.117 ( -0.387 -0.223 2.928) 2.962 14.484 ( 3.788 0.750 1.764) 4.246 14.655 ( 3.389 -0.776 -7.286) 8.073 15.293 ( -8.131 -0.815 10.449) 13.265 15.474 ( 3.093 -0.944 19.814) 20.076 15.811 ( -2.338 0.925 -0.320) 2.535 15.879 ( 6.586 -0.237 -8.897) 11.072 16.388 ( 0.716 -0.258 -1.172) 1.397 16.903 ( -12.576 1.659 1.994) 12.841 20.771 ( -0.064 -1.913 2.260) 2.962 21.663 ( -2.689 1.603 3.403) 4.624 22.536 ( 4.539 4.031 -3.874) 7.201 22.867 ( 6.806 -2.931 -5.574) 9.272 ======================= Grid point 152 (68/227) ======================= q-point: (-0.40 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( -0.754 5.057 -3.656) 6.285 2.229 ( 11.919 3.435 -7.699) 14.600 2.477 ( -11.250 3.760 2.338) 12.090 2.779 ( -1.527 6.318 7.884) 10.218 2.958 ( 0.345 0.323 -3.566) 3.597 3.380 ( 3.469 14.244 16.097) 21.772 3.489 ( -0.711 3.442 -0.659) 3.576 3.765 ( -1.239 3.442 2.653) 4.519 4.167 ( 1.431 -18.073 6.703) 19.329 4.647 ( 3.925 -6.487 0.051) 7.582 5.191 ( 7.631 8.102 -7.512) 13.427 5.323 ( -1.814 14.713 -1.670) 14.918 5.622 ( -0.722 -5.911 9.117) 10.890 5.954 ( -1.128 0.727 1.638) 2.117 5.995 ( 2.161 -4.594 0.857) 5.149 6.184 ( -7.447 6.514 -1.487) 10.005 7.553 ( -3.349 7.000 0.103) 7.760 8.014 ( -1.440 -3.706 6.369) 7.508 8.297 ( 3.679 -3.405 -0.252) 5.019 9.372 ( 8.418 -6.791 -3.774) 11.456 9.816 ( -5.062 -7.647 -9.204) 12.993 10.161 ( 3.187 8.118 -7.859) 11.740 10.403 ( -0.683 -4.341 13.585) 14.278 10.479 ( 5.110 2.042 -5.390) 7.703 11.103 ( 1.548 0.640 10.679) 10.809 11.293 ( -0.854 -12.932 1.221) 13.017 11.886 ( 3.020 6.011 -4.422) 8.051 11.973 ( -8.206 -0.427 -0.629) 8.241 12.238 ( -0.331 -8.611 -1.426) 8.734 12.899 ( 3.303 -3.330 5.492) 7.222 13.000 ( -4.046 1.312 -19.196) 19.662 13.981 ( -2.006 0.073 -3.622) 4.141 14.123 ( -0.171 -0.849 2.864) 2.992 14.502 ( -0.841 0.017 0.280) 0.887 14.708 ( 2.364 -0.182 -7.003) 7.394 15.174 ( -6.438 0.649 10.136) 12.025 15.506 ( -2.369 -2.366 17.495) 17.813 15.839 ( 6.943 1.169 4.479) 8.345 15.994 ( 8.453 1.559 -7.546) 11.438 16.383 ( -2.244 0.399 2.953) 3.730 16.754 ( -2.479 1.565 -0.337) 2.951 20.790 ( -0.821 -3.336 1.712) 3.839 21.606 ( -1.644 2.584 1.991) 3.653 22.528 ( 0.957 5.477 -3.264) 6.447 22.959 ( 0.035 -3.317 -6.439) 7.243 ======================= Grid point 153 (69/227) ======================= q-point: (-0.30 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( 1.381 7.828 -3.593) 8.723 2.228 ( -7.004 13.322 6.886) 16.551 2.415 ( 14.010 5.300 -7.928) 16.947 2.735 ( 5.723 8.401 5.291) 11.460 2.952 ( -1.388 -2.056 -2.066) 3.228 3.272 ( -2.869 7.662 12.824) 15.212 3.489 ( 6.827 8.181 1.268) 10.731 3.763 ( 4.507 2.406 1.470) 5.316 4.350 ( 1.265 -12.863 3.419) 13.369 4.733 ( -0.678 -2.597 2.807) 3.883 5.149 ( 5.111 21.167 -3.095) 21.994 5.206 ( -1.868 -0.654 -3.976) 4.441 5.649 ( -14.484 1.126 4.518) 15.214 5.800 ( -1.340 -0.751 1.944) 2.478 5.980 ( -3.741 -3.098 5.161) 7.087 6.180 ( 5.192 -1.022 -2.769) 5.973 7.458 ( 0.097 5.221 -4.071) 6.621 8.024 ( -2.857 -4.497 6.564) 8.454 8.378 ( 0.758 -5.247 1.660) 5.555 9.571 ( 6.176 -7.346 -0.064) 9.597 9.816 ( -3.083 -6.093 -6.519) 9.441 10.126 ( 1.620 6.717 -11.792) 13.667 10.418 ( -2.515 -1.567 9.008) 9.483 10.558 ( 6.113 -0.057 3.141) 6.873 11.108 ( -0.217 2.810 9.223) 9.644 11.373 ( -5.942 -13.083 -0.677) 14.385 11.731 ( -9.114 2.529 -0.936) 9.505 11.857 ( -7.952 -2.262 -0.946) 8.321 12.483 ( 14.256 -7.707 -0.838) 16.227 12.814 ( -1.919 3.865 -21.553) 21.981 13.171 ( 9.736 -9.468 5.812) 14.772 13.949 ( -2.249 -0.367 -4.394) 4.950 14.125 ( -0.589 -0.877 1.003) 1.457 14.464 ( -4.619 -1.525 1.337) 5.045 14.722 ( 0.073 0.966 -5.730) 5.812 15.102 ( -0.242 2.498 10.674) 10.965 15.487 ( -2.951 -3.037 8.826) 9.789 15.961 ( 6.996 1.956 9.639) 12.070 16.122 ( 10.751 2.729 -3.526) 11.639 16.310 ( -4.486 1.225 3.639) 5.905 16.805 ( 9.038 -0.049 -0.766) 9.070 20.819 ( -0.627 -5.126 0.903) 5.243 21.564 ( -0.008 2.869 0.169) 2.874 22.467 ( -1.754 4.666 -1.460) 5.195 22.898 ( -9.436 0.911 -7.780) 12.264 ======================= Grid point 154 (70/227) ======================= q-point: (-0.20 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -1.756 12.041 -1.634) 12.277 2.006 ( 0.305 16.191 7.428) 17.816 2.588 ( 17.715 12.648 -5.051) 22.345 2.774 ( 1.620 -0.833 -6.337) 6.593 3.005 ( 8.601 0.566 3.501) 9.303 3.145 ( -5.891 3.591 7.248) 10.007 3.544 ( 11.666 11.008 4.275) 16.600 3.849 ( 6.897 0.881 0.026) 6.953 4.454 ( -1.181 -6.054 -1.076) 6.261 4.669 ( -5.765 3.009 5.895) 8.777 4.955 ( -6.734 20.498 -5.934) 22.377 5.173 ( -4.657 -4.284 0.602) 6.357 5.340 ( -4.900 9.793 4.222) 11.736 5.909 ( -2.638 -8.602 0.657) 9.021 5.947 ( 0.618 1.001 6.388) 6.496 6.297 ( 4.325 -8.908 -1.654) 10.039 7.459 ( 3.580 0.647 -5.922) 6.950 8.009 ( -4.938 -4.419 6.835) 9.520 8.415 ( -3.583 -5.619 3.009) 7.313 9.684 ( -3.896 -10.250 -1.160) 11.027 9.850 ( 4.395 0.228 -3.609) 5.691 10.068 ( -0.180 5.965 -11.497) 12.954 10.353 ( -6.211 -0.463 1.858) 6.500 10.628 ( 0.200 0.732 7.260) 7.299 11.048 ( -0.938 5.826 5.902) 8.346 11.395 ( -2.679 -9.322 -0.287) 9.703 11.599 ( -2.158 4.707 2.077) 5.579 11.802 ( -6.641 -9.356 -3.331) 11.947 12.629 ( -2.825 -4.740 -9.063) 10.611 12.951 ( 18.001 -1.517 -5.104) 18.772 13.416 ( 7.412 -9.695 3.622) 12.730 13.901 ( -4.356 -1.209 -3.870) 5.951 14.129 ( 0.484 -0.500 -2.391) 2.490 14.390 ( -6.917 -2.624 3.209) 8.063 14.692 ( -1.668 1.725 -2.740) 3.642 15.128 ( 5.075 1.923 8.777) 10.319 15.497 ( -0.343 -4.295 3.286) 5.418 15.983 ( -0.155 4.919 7.665) 9.109 16.251 ( -0.974 1.325 2.028) 2.611 16.296 ( 11.028 -0.687 -0.065) 11.050 17.026 ( 16.379 -1.473 2.289) 16.603 20.882 ( 0.749 -7.563 0.038) 7.600 21.552 ( 1.975 2.485 -1.195) 3.392 22.379 ( -4.838 2.833 -0.075) 5.607 22.621 ( -16.182 10.247 -7.741) 20.659 ======================= Grid point 155 (71/227) ======================= q-point: (-0.10 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( 1.351 6.467 1.608) 6.800 1.949 ( 9.078 12.168 3.100) 15.495 2.667 ( 4.876 8.801 -4.228) 10.914 2.834 ( 5.591 0.609 -8.135) 9.890 3.020 ( -1.245 3.076 2.960) 4.447 3.232 ( 15.877 0.349 3.066) 16.175 3.646 ( 13.740 11.146 5.123) 18.419 3.912 ( 1.474 2.822 -0.280) 3.196 4.380 ( -11.633 -0.447 -6.118) 13.151 4.527 ( -3.374 7.225 9.317) 12.263 4.708 ( -0.714 9.055 -7.242) 11.617 5.126 ( -5.098 -0.902 0.722) 5.227 5.254 ( 1.718 7.089 4.005) 8.322 5.844 ( -7.749 -3.890 6.946) 11.110 5.997 ( 2.909 0.996 0.449) 3.107 6.486 ( 4.083 -11.765 0.853) 12.482 7.536 ( 4.507 -2.075 -4.717) 6.846 7.952 ( -8.014 -4.910 5.945) 11.121 8.369 ( -7.088 -2.797 4.380) 8.789 9.674 ( -9.352 -11.270 -4.574) 15.343 9.892 ( 0.999 5.553 -4.163) 7.012 10.027 ( 4.176 3.334 -5.412) 7.606 10.269 ( -4.555 -2.667 -6.354) 8.260 10.560 ( -4.004 3.700 4.707) 7.202 10.986 ( 0.579 7.202 4.660) 8.598 11.381 ( -6.594 0.920 -2.021) 6.958 11.685 ( 12.962 -5.108 0.176) 13.934 11.790 ( -6.666 -10.602 -0.847) 12.552 12.601 ( -5.296 -2.709 -1.393) 6.109 13.238 ( 13.862 -1.448 -0.899) 13.967 13.603 ( 5.541 -6.582 3.328) 9.225 13.837 ( -5.122 -2.226 -2.942) 6.313 14.163 ( 3.666 -0.697 -5.941) 7.016 14.291 ( -8.372 -1.891 4.263) 9.584 14.633 ( -2.736 2.972 0.624) 4.087 15.205 ( 5.121 0.838 5.532) 7.585 15.548 ( -0.086 -4.424 0.659) 4.473 15.911 ( -2.195 3.448 4.606) 6.158 16.225 ( -0.223 3.123 -2.073) 3.755 16.478 ( 7.413 -4.056 3.290) 9.068 17.341 ( 16.627 -5.517 3.668) 17.898 20.997 ( 2.586 -9.517 -0.551) 9.877 21.577 ( 3.564 2.016 -0.572) 4.135 22.105 ( -18.444 15.093 -10.756) 26.147 22.357 ( -2.857 5.315 4.237) 7.373 ======================= Grid point 161 (72/227) ======================= q-point: (-0.50 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -0.752 -0.000 -3.715) 3.791 2.247 ( 10.275 -0.000 -8.743) 13.491 2.491 ( -10.445 -0.000 1.358) 10.533 2.841 ( -0.633 -0.000 5.543) 5.579 2.977 ( 0.022 -0.000 -2.428) 2.428 3.511 ( 3.691 -0.000 -1.559) 4.007 3.753 ( 1.973 -0.000 21.911) 22.000 3.767 ( -0.628 0.000 1.538) 1.661 3.813 ( -0.085 -0.000 5.018) 5.019 4.574 ( 4.832 -0.000 0.356) 4.846 5.246 ( 2.871 -0.000 -6.073) 6.718 5.424 ( -4.995 -0.000 8.486) 9.847 5.707 ( 3.473 0.000 2.438) 4.244 5.888 ( 0.250 -0.000 -2.562) 2.575 5.952 ( -0.132 -0.000 2.189) 2.193 6.260 ( -4.947 0.000 -3.538) 6.082 7.642 ( -3.555 -0.000 2.985) 4.642 7.961 ( -3.059 -0.000 4.946) 5.816 8.265 ( 3.941 -0.000 0.008) 3.941 9.299 ( 9.334 -0.000 -3.714) 10.045 9.732 ( -4.255 -0.000 -10.819) 11.626 10.284 ( -0.792 -0.000 -11.703) 11.730 10.323 ( 2.635 0.000 19.845) 20.019 10.509 ( 6.035 -0.000 -8.466) 10.397 11.127 ( -0.137 -0.000 11.990) 11.991 11.131 ( 0.222 0.000 2.383) 2.393 11.958 ( 2.266 -0.000 -2.145) 3.120 12.001 ( -8.289 -0.000 -6.296) 10.409 12.107 ( 0.418 -0.000 0.815) 0.916 12.852 ( 6.941 -0.000 12.285) 14.110 13.028 ( -8.622 -0.000 -27.082) 28.421 13.982 ( -2.039 -0.000 -2.609) 3.311 14.115 ( -0.155 -0.000 2.939) 2.944 14.502 ( -1.773 -0.000 0.199) 1.784 14.707 ( 3.335 0.000 -8.174) 8.829 15.181 ( -5.248 -0.000 9.966) 11.263 15.480 ( -2.490 -0.000 18.440) 18.608 15.853 ( 6.711 -0.000 4.244) 7.940 16.010 ( 9.444 -0.000 -8.725) 12.858 16.385 ( -1.794 -0.000 2.540) 3.110 16.771 ( -3.692 -0.000 0.056) 3.693 20.755 ( -0.847 -0.000 1.944) 2.121 21.632 ( -1.980 -0.000 2.562) 3.238 22.592 ( -0.051 -0.000 -4.164) 4.164 22.917 ( 1.405 -0.000 -5.049) 5.240 ======================= Grid point 163 (73/227) ======================= q-point: (-0.40 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 3.490 3.274 -4.425) 6.517 2.322 ( -6.364 -1.136 1.452) 6.626 2.459 ( 11.612 1.339 -8.643) 14.537 2.862 ( 4.056 3.555 4.246) 6.864 2.951 ( -1.097 0.438 -1.156) 1.652 3.491 ( -4.004 7.845 3.042) 9.318 3.660 ( 9.827 13.514 10.949) 19.977 3.807 ( 2.756 1.515 1.595) 3.527 4.028 ( 4.270 -18.516 9.179) 21.103 4.662 ( 3.345 -2.725 4.487) 6.225 5.213 ( -5.255 1.349 -2.436) 5.947 5.381 ( -2.561 -3.296 3.318) 5.333 5.654 ( 1.271 10.974 3.966) 11.738 5.875 ( -8.814 -0.290 -0.737) 8.850 5.944 ( -1.212 -0.410 2.359) 2.683 6.169 ( -2.863 -0.416 -6.836) 7.423 7.572 ( -1.604 4.693 -0.734) 5.013 7.920 ( -4.811 -4.572 4.743) 8.158 8.309 ( 0.469 -1.685 1.766) 2.485 9.483 ( 10.573 -1.265 1.297) 10.727 9.701 ( -1.402 -4.276 -8.737) 9.828 10.237 ( -1.129 3.523 -11.043) 11.646 10.377 ( 0.228 -1.582 15.740) 15.821 10.597 ( 6.631 2.064 -5.767) 9.027 11.142 ( -3.883 -7.132 1.236) 8.214 11.146 ( 2.475 0.920 12.315) 12.595 11.782 ( -10.495 2.007 -0.816) 10.717 11.833 ( -10.731 -0.936 -2.485) 11.055 12.363 ( 15.309 -3.485 -0.143) 15.702 12.887 ( -2.707 2.790 -28.181) 28.448 13.024 ( 8.931 -4.644 7.689) 12.667 13.947 ( -2.330 0.057 -2.638) 3.520 14.113 ( -0.126 -0.302 1.133) 1.180 14.439 ( -6.048 -0.739 1.095) 6.190 14.738 ( 0.761 0.490 -7.237) 7.293 15.140 ( 0.604 1.106 9.338) 9.422 15.440 ( -3.119 -1.364 11.089) 11.600 15.994 ( 9.478 1.079 10.447) 14.147 16.166 ( 10.245 1.202 -5.981) 11.924 16.321 ( -5.619 0.039 5.480) 7.849 16.804 ( 7.729 -0.001 -2.905) 8.256 20.746 ( -1.432 -1.934 1.307) 2.738 21.605 ( -0.638 1.084 0.799) 1.490 22.541 ( -4.183 2.183 -3.674) 5.980 22.895 ( -4.784 -0.520 -4.139) 6.348 ======================= Grid point 164 (74/227) ======================= q-point: (-0.30 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 2.233 8.535 -4.548) 9.926 2.214 ( -4.369 3.748 5.023) 7.640 2.654 ( 9.293 -2.717 -12.374) 15.712 2.832 ( 1.819 6.315 -1.593) 6.762 3.041 ( 11.066 0.464 3.793) 11.708 3.303 ( -5.188 12.056 5.048) 14.063 3.745 ( 12.317 9.378 7.702) 17.291 3.866 ( 5.777 0.815 -0.129) 5.836 4.255 ( 3.206 -12.768 3.977) 13.752 4.700 ( -2.217 -0.209 9.167) 9.434 5.091 ( -9.463 -2.689 2.092) 10.058 5.300 ( -7.535 9.565 -2.508) 12.432 5.548 ( -5.683 9.218 1.810) 10.979 5.739 ( 1.101 -3.176 2.563) 4.227 5.930 ( -1.336 -1.664 3.633) 4.213 6.168 ( -2.393 -5.587 -7.317) 9.512 7.516 ( 1.025 4.442 -4.291) 6.261 7.889 ( -6.960 -7.143 5.372) 11.328 8.319 ( -2.651 -3.733 3.087) 5.523 9.583 ( 0.834 0.410 -2.796) 2.946 9.799 ( 6.953 -5.010 -1.533) 8.706 10.172 ( -1.545 3.896 -9.898) 10.749 10.347 ( -5.603 -0.437 6.444) 8.550 10.679 ( 5.583 4.175 2.958) 7.573 11.127 ( -2.627 -3.691 7.568) 8.820 11.195 ( 0.661 -2.931 -1.488) 3.353 11.657 ( -2.860 1.259 1.408) 3.427 11.701 ( -6.526 -2.090 1.627) 7.044 12.516 ( -2.171 -5.437 -10.880) 12.355 12.962 ( 16.130 1.871 -14.260) 21.611 13.236 ( 8.849 -7.477 4.158) 12.309 13.893 ( -4.228 0.150 -2.215) 4.776 14.122 ( 0.897 -0.236 -1.467) 1.736 14.336 ( -8.163 -2.381 2.873) 8.975 14.722 ( -1.080 1.111 -4.405) 4.670 15.174 ( 4.661 2.247 7.680) 9.260 15.428 ( -1.021 -2.618 5.283) 5.984 16.084 ( 2.121 5.067 10.092) 11.490 16.252 ( -0.956 -1.255 9.230) 9.364 16.311 ( 8.524 1.073 -4.671) 9.779 17.004 ( 15.730 -0.677 -3.071) 16.041 20.755 ( -1.182 -4.649 0.474) 4.820 21.595 ( 1.123 1.585 -1.165) 2.265 22.424 ( -7.389 1.559 -2.523) 7.962 22.753 ( -10.405 3.734 -3.103) 11.482 ======================= Grid point 165 (75/227) ======================= q-point: (-0.20 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -1.690 13.405 -2.202) 13.690 2.138 ( 1.253 5.591 3.672) 6.806 2.700 ( -4.297 -3.876 -7.363) 9.365 2.928 ( 13.530 6.631 -9.480) 17.802 3.089 ( -6.280 4.830 5.546) 9.671 3.279 ( 17.715 4.741 1.588) 18.407 3.860 ( 12.810 9.706 6.508) 17.339 3.949 ( 3.793 1.145 -0.273) 3.972 4.343 ( -5.997 -4.194 -3.383) 8.062 4.605 ( -5.623 2.708 8.357) 10.430 4.896 ( -12.583 3.897 0.060) 13.172 5.101 ( -2.804 3.165 8.416) 9.419 5.413 ( -2.007 6.549 -0.529) 6.870 5.767 ( -5.051 -2.828 2.882) 6.467 5.987 ( 3.575 -1.781 2.010) 4.471 6.230 ( 1.643 -12.673 -5.153) 13.779 7.520 ( 2.722 0.534 -6.355) 6.934 7.828 ( -9.594 -7.289 5.425) 13.214 8.300 ( -4.591 -4.013 4.620) 7.650 9.552 ( -3.626 -0.409 -5.532) 6.627 9.944 ( 5.022 -0.849 -1.629) 5.348 10.114 ( 0.856 4.546 -4.557) 6.493 10.239 ( -6.511 -0.254 -1.682) 6.730 10.651 ( -1.667 5.929 3.859) 7.268 11.139 ( 3.394 6.780 10.208) 12.716 11.255 ( -1.156 -10.302 -5.338) 11.660 11.623 ( -3.761 -1.168 -13.937) 14.483 11.682 ( 4.132 -1.886 13.696) 14.430 12.506 ( -4.267 -6.268 -9.063) 11.817 13.237 ( 16.717 0.970 -4.412) 17.316 13.453 ( 7.885 -7.571 2.282) 11.167 13.810 ( -5.414 -0.381 -1.978) 5.777 14.151 ( 2.605 -0.556 -3.751) 4.601 14.231 ( -8.325 -3.538 4.172) 9.962 14.685 ( -1.227 2.152 -1.335) 2.814 15.237 ( 5.043 2.136 5.726) 7.924 15.464 ( 1.148 -3.706 1.696) 4.234 15.997 ( -4.288 4.864 6.269) 9.019 16.282 ( 2.286 1.852 5.757) 6.465 16.432 ( 6.595 -0.761 0.875) 6.696 17.289 ( 16.870 -0.793 -1.248) 16.934 20.811 ( 0.368 -8.300 -0.484) 8.322 21.612 ( 3.006 1.494 -2.404) 4.129 22.252 ( -12.580 2.267 -3.802) 13.336 22.512 ( -9.418 8.002 0.679) 12.377 ======================= Grid point 166 (76/227) ======================= q-point: (-0.10 0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( -0.143 8.276 0.370) 8.285 2.137 ( 3.459 3.656 0.743) 5.088 2.673 ( -2.522 -3.399 -6.332) 7.616 2.881 ( -3.945 6.853 1.003) 7.971 3.135 ( 9.576 2.295 -6.962) 12.060 3.538 ( 17.332 3.451 0.888) 17.694 3.888 ( -4.465 3.730 6.031) 8.380 3.978 ( 6.250 8.629 -2.681) 10.987 4.130 ( -14.682 -0.556 -2.820) 14.960 4.548 ( 0.868 2.221 4.989) 5.529 4.778 ( 0.350 3.300 -2.602) 4.217 5.053 ( -2.966 1.264 7.111) 7.808 5.332 ( -1.956 2.323 1.186) 3.260 5.702 ( -4.676 -3.130 5.384) 7.788 6.011 ( -0.944 -0.856 0.312) 1.312 6.431 ( 4.404 -11.160 0.161) 11.999 7.586 ( 2.267 -5.606 -8.511) 10.440 7.743 ( -6.908 -4.228 4.592) 9.311 8.254 ( -5.158 -2.006 6.998) 8.922 9.480 ( -5.323 -0.866 -7.503) 9.240 9.914 ( -3.946 5.008 -6.007) 8.760 10.156 ( 6.330 0.951 2.324) 6.810 10.182 ( -1.102 -1.840 -5.404) 5.814 10.568 ( -0.774 5.630 -1.642) 5.916 11.100 ( 2.005 9.735 5.208) 11.221 11.275 ( -4.929 -2.728 0.804) 5.690 11.556 ( -6.460 -4.121 -16.276) 17.990 11.902 ( 14.887 -7.914 11.377) 20.340 12.482 ( -4.886 -2.906 -0.534) 5.710 13.425 ( 7.181 2.158 -2.036) 7.769 13.634 ( 5.282 -5.461 3.405) 8.326 13.754 ( -1.156 -1.948 -2.815) 3.613 14.129 ( -7.955 -2.705 3.410) 9.068 14.230 ( 5.396 -1.674 -4.449) 7.191 14.633 ( -1.433 4.086 1.762) 4.675 15.297 ( 4.298 1.494 4.438) 6.356 15.513 ( 0.052 -2.380 1.018) 2.589 15.900 ( -2.560 2.268 3.146) 4.647 16.266 ( -0.122 5.146 1.049) 5.253 16.538 ( 3.796 -2.668 2.880) 5.461 17.527 ( 10.113 -0.890 0.340) 10.158 20.937 ( 2.746 -11.140 -1.446) 11.564 21.652 ( 2.805 2.038 -0.700) 3.537 21.957 ( -13.352 8.237 -8.808) 17.992 22.352 ( -3.418 3.626 6.116) 7.889 ======================= Grid point 173 (77/227) ======================= q-point: (-0.40 0.60 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( 4.659 0.000 -5.578) 7.268 2.228 ( -4.547 -0.000 3.249) 5.589 2.616 ( 5.100 0.000 -12.430) 13.435 2.940 ( 3.718 0.000 0.676) 3.779 3.014 ( 9.984 0.000 4.335) 10.884 3.458 ( -5.180 -0.000 -1.253) 5.329 3.877 ( 5.245 0.000 -1.495) 5.453 3.955 ( 8.205 0.000 16.003) 17.984 3.991 ( 10.287 0.000 3.565) 10.887 4.688 ( 0.302 0.000 13.116) 13.120 5.068 ( -12.990 -0.000 1.660) 13.096 5.341 ( 0.317 0.000 -2.334) 2.356 5.649 ( -8.682 -0.000 1.386) 8.792 5.784 ( -4.051 -0.000 -0.284) 4.061 5.913 ( -2.470 -0.000 1.844) 3.082 6.081 ( -3.949 -0.000 -6.556) 7.654 7.587 ( 0.380 0.000 -2.038) 2.073 7.787 ( -8.399 -0.000 3.020) 8.925 8.278 ( -2.976 -0.000 2.806) 4.090 9.654 ( -0.712 -0.000 -9.161) 9.189 9.687 ( 12.459 0.000 5.361) 13.564 10.214 ( -2.350 -0.000 -9.585) 9.869 10.339 ( -5.057 -0.000 8.774) 10.127 10.742 ( 10.036 0.000 -1.554) 10.156 11.020 ( -7.065 -0.000 1.780) 7.286 11.219 ( 4.761 0.000 8.951) 10.138 11.661 ( -4.891 -0.000 -2.153) 5.344 11.689 ( -5.443 -0.000 4.643) 7.154 12.455 ( -2.142 -0.000 -10.791) 11.002 12.991 ( 15.065 0.000 -19.813) 24.890 13.150 ( 8.979 0.000 6.090) 10.849 13.897 ( -3.964 -0.000 -1.514) 4.244 14.120 ( 1.026 0.000 -1.213) 1.589 14.309 ( -8.836 -0.000 2.577) 9.204 14.733 ( -0.968 -0.000 -4.536) 4.638 15.201 ( 4.822 0.000 6.416) 8.026 15.399 ( -1.363 -0.000 6.641) 6.779 16.161 ( 8.930 0.000 12.883) 15.675 16.214 ( -7.054 -0.000 7.380) 10.209 16.323 ( 7.968 0.000 -3.129) 8.560 16.998 ( 15.813 0.000 -5.666) 16.797 20.707 ( -2.014 -0.000 0.734) 2.143 21.611 ( 0.839 0.000 -1.076) 1.364 22.440 ( -8.688 -0.000 -3.767) 9.469 22.789 ( -8.135 -0.000 -1.334) 8.244 ======================= Grid point 175 (78/227) ======================= q-point: (-0.30 0.60 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 1.472 7.364 -5.678) 9.415 2.170 ( -3.067 -0.903 3.899) 5.042 2.617 ( -4.086 -3.006 -9.544) 10.808 3.058 ( 13.032 5.869 -2.761) 14.557 3.146 ( -0.552 -0.187 6.361) 6.387 3.403 ( 8.360 5.143 -5.301) 11.155 3.967 ( 5.523 0.796 -1.475) 5.772 4.033 ( 9.941 7.382 7.502) 14.478 4.215 ( 4.253 -7.521 1.164) 8.718 4.652 ( -5.208 1.613 16.938) 17.794 4.839 ( -15.260 -4.119 5.593) 16.767 5.277 ( -5.934 8.770 0.226) 10.592 5.459 ( -10.813 -1.256 -1.799) 11.033 5.747 ( -2.325 -0.002 0.575) 2.395 5.929 ( 6.050 -3.719 -0.658) 7.133 6.050 ( -3.007 -3.594 -4.808) 6.714 7.563 ( -2.178 3.918 -3.288) 5.559 7.677 ( -7.583 -7.127 1.645) 10.536 8.229 ( -4.328 -2.304 3.664) 6.120 9.616 ( -0.292 4.408 -7.821) 8.982 9.884 ( 6.836 -3.666 1.022) 7.824 10.179 ( 0.526 1.861 -3.278) 3.806 10.242 ( -6.128 -0.033 0.827) 6.183 10.807 ( -0.341 9.317 2.706) 9.708 11.014 ( 3.176 -10.733 1.373) 11.277 11.276 ( 3.631 3.628 5.570) 7.574 11.609 ( -2.787 -0.151 -10.067) 10.447 11.664 ( 1.880 -0.515 12.129) 12.284 12.392 ( -4.667 -3.737 -13.084) 14.385 13.263 ( 17.406 1.454 -7.902) 19.171 13.328 ( 9.995 -4.217 0.885) 10.884 13.815 ( -5.681 0.429 -1.263) 5.835 14.142 ( 1.783 -0.235 -2.681) 3.228 14.172 ( -8.744 -1.835 3.709) 9.674 14.715 ( -0.488 0.763 -1.729) 1.952 15.279 ( 5.072 1.619 4.699) 7.102 15.406 ( 0.937 -1.904 3.288) 3.913 16.085 ( -6.289 3.030 6.414) 9.481 16.294 ( 5.506 -0.196 11.839) 13.058 16.427 ( 4.996 -0.108 1.255) 5.152 17.287 ( 18.662 0.176 -6.765) 19.851 20.689 ( -1.891 -3.351 0.078) 3.848 21.635 ( 2.560 0.636 -2.931) 3.943 22.270 ( -11.617 0.196 -3.250) 12.065 22.624 ( -9.999 2.849 1.257) 10.473 ======================= Grid point 176 (79/227) ======================= q-point: (-0.20 -0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -2.430 13.371 -3.098) 13.939 2.153 ( -1.580 -2.121 1.536) 3.059 2.581 ( -4.120 -4.498 -6.943) 9.242 3.016 ( -7.345 4.478 3.829) 9.416 3.216 ( 12.828 6.425 -6.063) 15.575 3.608 ( 16.308 2.878 -3.280) 16.881 3.958 ( -5.969 3.518 4.133) 8.068 4.129 ( -5.716 0.024 1.965) 6.045 4.145 ( -2.644 6.624 -7.252) 10.172 4.573 ( -0.069 0.695 10.719) 10.742 4.746 ( -2.084 -5.585 6.209) 8.608 5.094 ( -6.131 3.168 11.410) 13.335 5.331 ( -8.176 -2.000 -3.175) 8.996 5.670 ( -5.674 -0.648 2.443) 6.212 6.002 ( -2.025 0.003 -2.147) 2.951 6.199 ( 11.793 -10.142 -3.560) 15.957 7.450 ( -10.506 -5.975 -3.689) 12.637 7.692 ( 2.800 -1.684 -1.429) 3.566 8.189 ( -4.309 -3.440 5.013) 7.452 9.551 ( -0.682 6.019 -7.946) 9.992 9.945 ( -2.409 -2.124 -7.705) 8.347 10.157 ( -3.171 1.014 -5.369) 6.317 10.217 ( 6.171 2.683 8.299) 10.684 10.695 ( -1.102 7.047 -0.689) 7.166 11.164 ( 1.382 -6.326 -0.583) 6.501 11.280 ( 3.283 7.289 11.048) 13.637 11.538 ( -4.782 0.385 -18.010) 18.638 11.772 ( 8.348 -4.467 10.972) 14.493 12.392 ( -1.146 -5.106 -4.304) 6.776 13.482 ( 9.932 2.350 -4.127) 11.009 13.530 ( 8.694 -3.796 -0.152) 9.488 13.722 ( -3.885 -1.144 -2.009) 4.521 14.070 ( -6.695 -2.572 3.922) 8.175 14.193 ( 3.627 -1.801 -3.142) 5.125 14.699 ( 0.177 2.283 1.356) 2.661 15.335 ( 4.024 2.087 4.419) 6.331 15.461 ( 2.257 -2.549 1.549) 3.741 15.961 ( -4.902 3.164 4.129) 7.148 16.347 ( 1.956 2.733 8.610) 9.243 16.498 ( 2.819 -1.460 2.916) 4.311 17.553 ( 14.392 2.454 -5.768) 15.698 20.727 ( -0.216 -8.528 -0.857) 8.574 21.680 ( 3.917 0.976 -3.707) 5.481 22.052 ( -13.701 1.829 -3.949) 14.376 22.436 ( -7.727 3.915 4.775) 9.891 ======================= Grid point 177 (80/227) ======================= q-point: (-0.10 -0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( -2.216 10.117 -0.471) 10.367 2.136 ( -3.950 -2.297 -0.027) 4.570 2.567 ( -3.427 -5.404 -5.631) 8.524 2.887 ( -2.416 4.090 1.080) 4.872 3.331 ( 8.786 6.048 -3.784) 11.318 3.621 ( -22.516 -1.136 -8.920) 24.245 3.760 ( -11.911 1.266 7.935) 14.368 3.917 ( 6.243 4.650 -2.997) 8.341 4.240 ( 8.064 3.041 4.282) 9.623 4.573 ( -1.670 1.306 4.100) 4.615 4.813 ( 3.725 -0.244 -0.908) 3.842 5.017 ( -5.558 -5.036 9.767) 12.314 5.230 ( -4.700 0.009 -1.880) 5.062 5.631 ( -1.109 -3.850 6.890) 7.970 5.965 ( -2.335 -1.195 -2.315) 3.498 6.447 ( 7.509 -4.924 -0.034) 8.979 7.392 ( -6.840 -12.631 -5.905) 15.531 7.789 ( 8.593 0.686 -3.611) 9.346 8.156 ( -3.919 -2.494 6.846) 8.274 9.474 ( -0.162 6.949 -9.243) 11.565 9.874 ( -4.911 2.158 -6.350) 8.312 10.127 ( 0.004 -1.029 -12.216) 12.260 10.305 ( 6.511 1.674 12.619) 14.298 10.639 ( 1.845 6.116 -6.591) 9.179 11.186 ( -3.474 -0.148 4.481) 5.672 11.222 ( 1.021 7.239 -0.557) 7.332 11.453 ( -4.179 1.669 -8.892) 9.966 12.035 ( 12.707 -11.296 7.755) 18.687 12.413 ( -0.646 -0.612 2.016) 2.204 13.461 ( -5.649 3.364 -2.638) 7.084 13.670 ( 3.337 -2.184 1.834) 4.390 13.785 ( 6.915 -3.372 -5.002) 9.176 14.005 ( -3.489 -0.944 4.145) 5.499 14.289 ( 4.341 -3.058 -4.258) 6.807 14.672 ( 0.720 4.610 4.815) 6.705 15.370 ( 1.938 1.746 5.804) 6.363 15.514 ( 2.412 -0.625 1.675) 3.002 15.884 ( -1.560 1.258 1.336) 2.409 16.313 ( -1.199 5.623 3.595) 6.781 16.548 ( 0.384 -2.533 2.786) 3.785 17.663 ( 3.770 6.101 -3.713) 8.076 20.861 ( 2.988 -13.268 -2.357) 13.803 21.681 ( -5.566 5.257 0.230) 7.660 21.854 ( -2.208 0.197 -8.986) 9.255 22.326 ( -2.587 0.864 8.435) 8.865 ======================= Grid point 185 (81/227) ======================= q-point: (-0.30 -0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( -1.223 -0.000 -6.965) 7.072 2.101 ( -4.199 -0.000 4.172) 5.919 2.530 ( -3.623 -0.000 -7.306) 8.155 3.057 ( -7.792 -0.000 4.500) 8.998 3.307 ( 12.192 0.000 -2.930) 12.539 3.638 ( 15.590 0.000 -7.042) 17.107 4.008 ( -6.443 -0.000 -0.986) 6.518 4.116 ( -4.575 -0.000 4.338) 6.304 4.219 ( -1.206 -0.000 -6.901) 7.006 4.602 ( -2.223 -0.000 19.676) 19.801 4.643 ( -0.384 -0.000 7.856) 7.866 5.149 ( -20.476 -0.000 2.976) 20.691 5.288 ( -1.581 -0.000 3.304) 3.663 5.663 ( -6.740 -0.000 0.830) 6.791 6.005 ( -1.811 -0.000 -2.799) 3.334 6.088 ( 15.432 0.000 -5.884) 16.516 7.386 ( -14.443 -0.000 -1.629) 14.535 7.673 ( 5.583 0.000 -3.706) 6.702 8.150 ( -3.801 -0.000 4.039) 5.546 9.634 ( 0.015 0.000 -8.677) 8.677 9.902 ( -2.122 -0.000 -7.281) 7.584 10.171 ( -2.154 -0.000 -4.319) 4.826 10.247 ( 5.607 0.000 7.863) 9.657 10.795 ( -3.810 -0.000 0.900) 3.915 11.081 ( 7.555 0.000 -0.599) 7.578 11.360 ( 4.387 0.000 14.908) 15.540 11.539 ( -6.091 -0.000 -20.045) 20.950 11.730 ( 5.714 0.000 10.682) 12.115 12.330 ( 0.599 0.000 -5.900) 5.930 13.469 ( 10.291 0.000 -1.424) 10.389 13.530 ( 12.761 0.000 -5.861) 14.043 13.710 ( -7.340 -0.000 -1.586) 7.509 14.042 ( -5.378 -0.000 4.178) 6.810 14.172 ( 2.279 0.000 -2.782) 3.596 14.722 ( 0.776 0.000 1.331) 1.540 15.365 ( 3.743 0.000 4.025) 5.496 15.427 ( 2.995 0.000 2.093) 3.654 15.998 ( -5.815 -0.000 4.597) 7.413 16.376 ( 3.153 0.000 11.344) 11.774 16.480 ( 1.868 0.000 3.965) 4.382 17.585 ( 17.047 0.000 -9.236) 19.388 20.635 ( -2.213 -0.000 -0.205) 2.222 21.690 ( 4.060 0.000 -4.511) 6.069 22.065 ( -13.236 -0.000 -2.802) 13.530 22.479 ( -9.290 -0.000 4.499) 10.322 ======================= Grid point 186 (82/227) ======================= q-point: (-0.20 -0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -5.196 9.496 -4.799) 11.841 2.058 ( -4.958 -4.609 2.018) 7.064 2.491 ( -2.473 -1.987 -5.581) 6.420 2.935 ( -5.698 0.986 2.494) 6.297 3.451 ( 7.986 4.315 -2.876) 9.522 3.600 ( -27.511 -1.008 -5.398) 28.053 3.870 ( -10.801 8.428 5.021) 14.592 3.972 ( 5.304 0.233 -4.106) 6.712 4.235 ( 0.395 -3.486 -1.073) 3.668 4.605 ( 0.945 1.708 8.189) 8.418 4.769 ( 8.272 -2.598 5.859) 10.465 4.848 ( -16.281 -6.401 8.346) 19.383 5.276 ( 0.245 1.627 3.306) 3.693 5.573 ( -3.778 -1.592 4.813) 6.322 5.963 ( -2.840 0.473 -3.837) 4.797 6.365 ( 14.809 -2.464 -4.122) 15.568 7.203 ( -9.519 -5.290 -6.352) 12.607 7.795 ( 9.394 0.029 -4.268) 10.318 8.110 ( -2.319 -1.436 4.716) 5.448 9.611 ( 0.901 5.335 -9.112) 10.597 9.843 ( -5.781 -3.428 -9.221) 11.410 10.158 ( 1.702 2.082 -7.350) 7.827 10.333 ( 4.754 0.767 10.107) 11.196 10.751 ( 0.924 4.159 -4.683) 6.331 11.161 ( 1.750 -0.689 -0.169) 1.888 11.366 ( -4.818 5.470 -6.935) 10.061 11.467 ( 0.978 -1.293 7.305) 7.483 11.865 ( 8.375 -4.609 5.717) 11.139 12.389 ( 4.600 -1.105 0.446) 4.751 13.536 ( -7.206 3.239 -2.577) 8.310 13.641 ( 6.394 -0.016 -2.718) 6.948 13.697 ( 4.550 -4.750 -4.385) 7.905 14.011 ( 1.365 1.000 3.848) 4.204 14.226 ( 3.066 -2.461 -3.022) 4.959 14.737 ( 1.791 1.686 5.001) 5.574 15.402 ( 1.463 1.110 6.342) 6.603 15.498 ( 4.567 -0.715 1.403) 4.831 15.915 ( -3.280 1.210 1.926) 3.991 16.392 ( -0.268 2.289 8.629) 8.932 16.502 ( -0.258 -1.706 3.968) 4.327 17.795 ( 10.630 4.854 -10.053) 15.415 20.637 ( -1.010 -6.961 -0.823) 7.082 21.754 ( 2.677 2.128 -4.046) 5.297 21.848 ( -10.958 -0.682 -3.822) 11.626 22.345 ( -6.042 0.713 7.962) 10.020 ======================= Grid point 187 (83/227) ======================= q-point: (-0.10 -0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( -6.712 8.591 -1.391) 10.990 1.986 ( -9.906 -3.661 1.811) 10.715 2.475 ( -2.388 -2.823 -4.838) 6.090 2.853 ( -7.474 -1.489 -0.802) 7.663 3.105 ( -27.876 -4.868 -7.297) 29.223 3.511 ( 1.773 8.113 2.214) 8.594 3.563 ( -12.220 0.207 7.834) 14.517 3.953 ( -13.008 -1.634 6.487) 14.628 4.328 ( 4.718 -4.638 -0.881) 6.674 4.533 ( -4.446 3.873 1.481) 6.080 4.771 ( -2.524 -8.132 3.329) 9.142 4.945 ( 7.705 -1.345 0.619) 7.846 5.265 ( 2.017 4.053 -0.200) 4.532 5.591 ( 1.348 -3.489 9.393) 10.111 5.924 ( -1.039 -1.828 -4.350) 4.831 6.559 ( 7.843 1.617 -0.902) 8.059 7.199 ( -1.205 -11.019 -8.799) 14.152 7.973 ( 12.945 0.853 -5.193) 13.974 8.101 ( -0.628 -0.903 5.545) 5.654 9.551 ( 0.027 6.789 -10.701) 12.672 9.797 ( -3.188 -2.880 -8.008) 9.088 10.170 ( 4.039 4.440 -9.851) 11.536 10.406 ( 4.450 0.018 8.678) 9.753 10.716 ( 0.511 4.217 -9.585) 10.484 11.144 ( -4.416 3.126 -0.459) 5.430 11.265 ( 0.781 0.414 -6.257) 6.319 11.460 ( -0.390 6.295 15.674) 16.895 12.104 ( 10.053 -11.468 3.234) 15.590 12.459 ( 4.153 3.048 3.528) 6.244 13.354 ( -10.451 2.838 -3.087) 11.261 13.669 ( -1.744 -0.690 -0.278) 1.896 13.849 ( 6.586 -4.632 -6.738) 10.499 14.040 ( 4.564 3.401 3.161) 6.510 14.297 ( 0.831 -3.389 -4.009) 5.315 14.752 ( 3.447 3.811 7.834) 9.369 15.397 ( -0.577 1.501 10.656) 10.776 15.583 ( 5.350 0.411 1.201) 5.498 15.875 ( -0.672 0.554 0.044) 0.872 16.336 ( -2.530 4.517 4.314) 6.739 16.507 ( -2.002 -2.524 2.130) 3.862 17.777 ( -1.911 14.230 -8.411) 16.640 20.763 ( 2.842 -15.581 -2.972) 16.115 21.576 ( -11.545 4.714 -0.977) 12.508 21.883 ( 5.612 -2.240 -7.170) 9.377 22.300 ( -0.051 -2.079 11.472) 11.659 ======================= Grid point 196 (84/227) ======================= q-point: (-0.20 -0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -10.362 -0.000 -5.239) 11.611 1.934 ( -7.981 -0.000 3.699) 8.796 2.452 ( -0.955 -0.000 -4.727) 4.822 2.831 ( -12.696 -0.000 0.647) 12.713 3.051 ( -29.807 -0.000 -7.139) 30.650 3.554 ( -0.436 -0.000 -0.242) 0.499 3.667 ( -13.337 -0.000 9.562) 16.410 3.897 ( -23.406 -0.000 12.047) 26.324 4.248 ( 7.977 0.000 -4.902) 9.363 4.621 ( -1.952 -0.000 -0.213) 1.964 4.644 ( -1.053 -0.000 4.484) 4.606 4.931 ( 10.108 0.000 3.628) 10.739 5.297 ( 1.193 0.000 -1.552) 1.958 5.560 ( 2.940 0.000 12.681) 13.017 5.908 ( -3.581 -0.000 -6.273) 7.223 6.585 ( 12.181 0.000 -1.020) 12.224 7.075 ( -1.772 -0.000 -11.880) 12.011 7.982 ( 13.453 0.000 -4.944) 14.333 8.091 ( 0.464 0.000 4.595) 4.618 9.674 ( 3.085 0.000 -10.854) 11.284 9.699 ( -7.558 -0.000 -9.276) 11.965 10.234 ( 5.907 0.000 -5.551) 8.106 10.402 ( 3.585 0.000 7.735) 8.526 10.772 ( -1.974 -0.000 -15.794) 15.917 11.180 ( 0.654 0.000 1.993) 2.098 11.266 ( -5.380 -0.000 -8.919) 10.416 11.530 ( 2.434 0.000 24.104) 24.226 11.979 ( 8.947 0.000 2.819) 9.381 12.489 ( 6.924 0.000 1.928) 7.188 13.390 ( -11.295 -0.000 -3.183) 11.735 13.659 ( -1.371 -0.000 -1.479) 2.017 13.794 ( 8.012 0.000 -7.376) 10.890 14.091 ( 5.214 0.000 2.934) 5.983 14.245 ( 1.276 0.000 -3.710) 3.924 14.792 ( 3.543 0.000 8.158) 8.894 15.414 ( -0.647 -0.000 11.400) 11.418 15.586 ( 5.944 0.000 1.023) 6.032 15.884 ( -1.249 -0.000 -0.129) 1.255 16.384 ( -2.578 -0.000 6.866) 7.334 16.474 ( -1.840 -0.000 2.587) 3.174 17.959 ( 5.363 0.000 -13.950) 14.945 20.573 ( -1.432 -0.000 -0.513) 1.522 21.629 ( -12.478 -0.000 -1.719) 12.596 21.855 ( 5.937 0.000 -5.839) 8.327 22.278 ( -2.374 -0.000 11.639) 11.878 ======================= Grid point 197 (85/227) ======================= q-point: (-0.10 -0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( -13.321 3.267 -1.356) 13.783 1.747 ( -16.977 -1.842 6.260) 18.189 2.310 ( -33.770 -0.890 -7.375) 34.577 2.490 ( -2.158 -5.935 -5.257) 8.217 2.848 ( -10.867 -5.425 7.239) 14.139 3.343 ( -15.117 5.055 13.844) 21.113 3.529 ( -20.064 -9.834 10.635) 24.746 3.599 ( -1.336 2.268 2.038) 3.329 4.290 ( -5.272 -1.280 0.770) 5.479 4.539 ( -2.748 2.362 -4.820) 6.030 4.772 ( 9.908 -3.978 0.048) 10.677 5.071 ( 6.668 0.982 -1.057) 6.822 5.330 ( 3.295 0.986 -4.211) 5.438 5.636 ( 4.601 1.612 12.949) 13.836 5.879 ( -0.389 -4.470 -6.948) 8.271 6.715 ( 6.197 4.743 2.414) 8.169 7.131 ( 3.965 -6.306 -14.090) 15.938 8.119 ( 2.644 0.304 4.876) 5.555 8.215 ( 15.258 0.986 -4.989) 16.083 9.563 ( -4.416 3.052 -10.560) 11.846 9.748 ( 2.505 -3.151 -12.854) 13.469 10.326 ( 8.020 5.957 -2.948) 10.416 10.470 ( 3.836 -0.595 6.287) 7.389 10.689 ( -5.141 -1.897 -19.683) 20.431 11.131 ( -1.995 7.303 3.143) 8.197 11.276 ( 2.606 -4.863 0.434) 5.534 11.533 ( 0.472 5.027 23.594) 24.128 12.166 ( 9.313 -6.474 3.396) 11.840 12.581 ( 5.654 3.321 2.677) 7.082 13.182 ( -12.939 1.388 -3.926) 13.593 13.634 ( -1.658 0.602 -1.086) 2.071 13.901 ( 3.250 -2.282 -9.653) 10.438 14.154 ( 4.553 2.226 2.238) 5.541 14.266 ( 0.020 -1.859 -3.783) 4.215 14.853 ( 4.410 1.956 8.335) 9.631 15.407 ( 0.191 0.762 17.154) 17.172 15.675 ( 4.779 0.566 1.308) 4.987 15.868 ( -0.901 0.212 0.096) 0.930 16.324 ( -3.050 2.213 3.624) 5.228 16.450 ( -1.945 -1.359 -0.401) 2.406 17.876 ( -6.367 18.934 -14.858) 24.895 20.639 ( 1.537 -15.550 -2.442) 15.816 21.429 ( -10.267 2.248 -1.039) 10.562 21.959 ( 6.109 -1.451 -6.080) 8.740 22.304 ( 3.757 -3.534 15.166) 16.019 ======================= Grid point 207 (86/227) ======================= q-point: (-0.10 -0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.140 ( -20.715 -0.000 3.887) 21.076 1.383 ( -25.795 -0.000 13.321) 29.032 1.708 ( -29.908 -0.000 -5.800) 30.465 2.408 ( -36.548 -0.000 34.163) 50.029 2.526 ( 5.764 0.000 -4.639) 7.399 3.243 ( -6.866 -0.000 7.546) 10.202 3.254 ( -1.833 -0.000 0.717) 1.968 3.574 ( -3.704 -0.000 2.943) 4.731 4.149 ( -11.655 -0.000 1.573) 11.760 4.472 ( -3.899 -0.000 -6.423) 7.513 4.954 ( 12.368 0.000 1.473) 12.455 5.158 ( 3.058 0.000 -5.266) 6.090 5.393 ( 3.521 0.000 -6.115) 7.057 5.757 ( 6.265 0.000 14.290) 15.603 5.828 ( -1.009 -0.000 -12.422) 12.463 6.816 ( 2.193 0.000 8.614) 8.889 7.176 ( 5.141 0.000 -19.379) 20.050 8.184 ( 4.391 0.000 5.290) 6.875 8.465 ( 14.036 0.000 -4.062) 14.612 9.503 ( -2.739 -0.000 -10.660) 11.006 9.785 ( 3.394 0.000 -17.763) 18.084 10.513 ( -4.116 -0.000 -3.977) 5.723 10.532 ( 11.184 0.000 8.930) 14.312 10.557 ( 0.597 0.000 -11.116) 11.132 11.200 ( 0.832 0.000 1.126) 1.401 11.251 ( 1.009 0.000 3.000) 3.166 11.606 ( 5.952 0.000 25.448) 26.135 12.297 ( 10.371 0.000 9.722) 14.215 12.682 ( 4.028 0.000 1.285) 4.228 12.961 ( -14.510 -0.000 -4.696) 15.251 13.627 ( -0.256 -0.000 -1.238) 1.264 13.875 ( -3.974 -0.000 -12.352) 12.976 14.215 ( 1.836 0.000 1.941) 2.672 14.291 ( 4.062 0.000 -4.249) 5.878 14.928 ( 3.001 0.000 7.015) 7.630 15.443 ( 3.196 0.000 23.650) 23.865 15.738 ( 2.166 0.000 1.943) 2.909 15.844 ( -2.201 -0.000 1.087) 2.454 16.293 ( -1.761 -0.000 2.315) 2.909 16.430 ( 0.346 0.000 -3.608) 3.625 17.857 ( -12.632 -0.000 -24.009) 27.130 20.543 ( -0.405 -0.000 -0.484) 0.631 21.293 ( -7.428 -0.000 -0.569) 7.450 22.046 ( 5.649 0.000 -5.090) 7.603 22.383 ( 8.177 0.000 16.987) 18.853 ======================= Grid point 208 (87/227) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( -3.537 -0.000 27.706) 27.931 1.366 ( 4.905 0.000 22.527) 23.055 1.713 ( 10.253 0.000 11.353) 15.298 2.417 ( -11.432 -0.000 52.933) 54.154 2.614 ( 4.412 0.000 -6.897) 8.188 3.200 ( -3.901 -0.000 7.241) 8.225 3.412 ( -2.078 -0.000 -0.907) 2.268 3.511 ( -4.095 -0.000 4.809) 6.316 3.622 ( -7.768 -0.000 3.263) 8.426 4.340 ( 3.367 0.000 -8.384) 9.034 4.785 ( -2.827 -0.000 -14.637) 14.907 5.269 ( -0.570 -0.000 -7.942) 7.963 5.346 ( 5.328 0.000 -0.556) 5.356 5.382 ( -4.615 -0.000 -3.881) 6.030 6.253 ( 0.983 0.000 22.649) 22.671 7.097 ( 13.697 0.000 -18.797) 23.258 7.140 ( -0.674 -0.000 16.822) 16.835 8.363 ( -1.064 -0.000 3.418) 3.580 8.581 ( -1.593 -0.000 -11.699) 11.807 9.262 ( 5.381 0.000 -15.378) 16.293 9.575 ( 3.820 0.000 -10.761) 11.419 10.262 ( 6.380 0.000 -1.587) 6.574 10.816 ( 1.027 0.000 0.978) 1.419 11.005 ( -3.650 -0.000 12.168) 12.703 11.133 ( -2.602 -0.000 0.943) 2.768 11.194 ( 1.375 0.000 -1.653) 2.150 11.777 ( -19.228 -0.000 1.378) 19.277 12.594 ( 8.172 0.000 -2.552) 8.561 12.712 ( -2.401 -0.000 -0.643) 2.486 13.022 ( 2.955 0.000 1.176) 3.180 13.600 ( 0.298 0.000 -1.232) 1.267 13.648 ( 7.591 0.000 -17.261) 18.857 14.143 ( -4.651 -0.000 -2.959) 5.513 14.449 ( 6.565 0.000 -1.241) 6.682 15.184 ( -0.048 -0.000 8.128) 8.128 15.779 ( -5.064 -0.000 3.858) 6.366 15.824 ( -0.158 -0.000 3.777) 3.780 16.043 ( -8.900 -0.000 12.224) 15.121 16.305 ( 0.238 0.000 1.147) 1.172 16.481 ( 8.575 0.000 -0.007) 8.575 17.068 ( 10.021 0.000 -2.071) 10.233 20.535 ( 0.388 0.000 -0.349) 0.522 21.179 ( 0.550 0.000 0.320) 0.636 22.144 ( -8.800 -0.000 -1.729) 8.968 22.198 ( -11.452 -0.000 -0.235) 11.454 ======================= Grid point 209 (88/227) ======================= q-point: ( 0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.317 ( 5.601 3.581 21.620) 22.619 1.485 ( 1.443 -11.689 25.317) 27.923 1.831 ( 6.659 -0.389 9.990) 12.012 2.531 ( 14.436 -3.427 33.765) 36.881 2.686 ( 3.095 -5.218 -1.913) 6.361 3.232 ( -10.098 -0.838 2.205) 10.370 3.249 ( 1.462 -14.560 3.181) 14.974 3.459 ( -1.887 -0.534 5.860) 6.180 3.724 ( 10.180 -0.645 -2.616) 10.530 4.413 ( 2.368 -2.769 -8.694) 9.427 4.737 ( -3.220 -1.258 -10.889) 11.425 5.213 ( -5.346 0.484 -1.058) 5.471 5.245 ( -7.951 -2.533 -2.762) 8.790 5.530 ( 12.280 0.288 -3.359) 12.734 6.279 ( -0.211 -2.472 22.416) 22.553 7.075 ( -4.008 5.898 14.234) 15.920 7.336 ( 15.042 1.732 -19.690) 24.838 8.306 ( -3.978 2.429 4.881) 6.749 8.520 ( -4.781 -1.494 -13.651) 14.541 9.369 ( 5.844 -2.846 -13.532) 15.012 9.634 ( 3.699 -0.264 -10.613) 11.243 10.312 ( -0.705 3.564 -0.464) 3.662 10.747 ( -3.855 5.494 -0.372) 6.722 10.825 ( -17.941 -2.806 7.418) 19.616 11.110 ( -5.277 -2.438 6.470) 8.697 11.269 ( 7.171 4.537 2.926) 8.976 11.462 ( -14.333 -6.901 2.291) 16.072 12.612 ( -4.565 8.402 -0.795) 9.595 12.782 ( 11.943 1.207 -0.853) 12.034 13.032 ( 2.889 4.810 -1.126) 5.723 13.598 ( 1.140 1.426 -3.079) 3.579 13.742 ( 3.185 -2.148 -16.832) 17.265 14.059 ( -5.420 -0.428 -2.769) 6.101 14.511 ( 0.262 -0.992 -1.349) 1.695 15.146 ( -5.446 -0.359 11.019) 12.297 15.560 ( -17.537 6.428 13.063) 22.793 15.820 ( -0.250 -0.369 2.553) 2.591 15.857 ( -7.474 0.800 5.496) 9.312 16.291 ( -0.147 3.558 1.047) 3.711 16.598 ( 7.086 3.195 4.090) 8.783 17.304 ( 32.963 30.754 -6.611) 45.564 20.723 ( 2.099 -30.239 -7.751) 31.287 21.202 ( 3.919 3.574 0.284) 5.312 21.779 ( -24.972 -10.320 6.934) 27.896 22.267 ( 4.584 -1.185 1.067) 4.854 ======================= Grid point 210 (89/227) ======================= q-point: ( 0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( 9.719 6.528 13.113) 17.578 1.638 ( 3.518 -9.225 21.412) 23.578 2.067 ( 14.788 -9.717 2.094) 17.818 2.646 ( 0.817 -0.008 -6.135) 6.189 2.955 ( 12.814 -9.202 15.687) 22.248 3.139 ( -0.582 0.733 6.389) 6.457 3.414 ( 3.017 -2.337 2.949) 4.823 3.572 ( 5.853 -16.341 2.978) 17.611 3.941 ( 13.466 -8.163 -0.578) 15.758 4.409 ( -4.219 1.201 -9.370) 10.346 4.695 ( -4.614 -3.139 -4.421) 7.119 5.116 ( -8.355 -6.428 5.395) 11.841 5.156 ( -4.476 0.193 -7.540) 8.770 5.737 ( 12.204 -0.123 -5.820) 13.521 6.298 ( -2.032 -2.183 22.747) 22.941 6.911 ( -6.521 8.751 9.583) 14.523 7.502 ( 10.468 6.401 -15.312) 19.622 8.215 ( -4.274 1.740 5.806) 7.416 8.454 ( -5.370 -2.274 -11.936) 13.285 9.482 ( 3.353 -5.137 -11.807) 13.305 9.699 ( 4.485 -0.827 -10.393) 11.349 10.119 ( -12.717 10.063 -7.515) 17.873 10.479 ( -19.233 -0.333 3.403) 19.535 10.748 ( 0.439 -1.235 7.663) 7.774 10.973 ( -10.570 0.175 8.040) 13.281 11.241 ( -4.971 -4.932 -0.810) 7.049 11.574 ( 13.627 0.135 -1.669) 13.730 12.388 ( -7.382 15.359 1.314) 17.092 12.848 ( -2.041 2.435 4.255) 5.311 13.111 ( 12.960 5.129 -3.408) 14.348 13.613 ( 2.495 0.318 -3.837) 4.588 13.812 ( 3.964 -1.148 -10.751) 11.515 13.982 ( -4.648 -1.700 -2.902) 5.737 14.483 ( -5.028 -1.523 0.217) 5.258 14.991 ( -11.825 3.848 19.071) 22.768 15.312 ( -4.467 2.750 6.682) 8.495 15.748 ( -4.033 3.506 2.598) 5.941 15.843 ( -0.600 -4.386 1.448) 4.658 16.232 ( -0.820 6.265 0.454) 6.334 16.659 ( 6.069 5.639 6.518) 10.541 17.483 ( 24.114 25.263 -4.931) 35.271 21.069 ( -0.910 -31.890 -14.845) 35.187 21.219 ( 5.042 7.413 0.681) 8.991 21.590 ( -13.215 -12.897 6.177) 19.471 22.343 ( 2.595 -1.872 3.147) 4.488 ======================= Grid point 211 (90/227) ======================= q-point: ( 0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 7.916 10.987 6.377) 14.967 1.846 ( 8.558 -10.253 12.465) 18.268 2.399 ( 10.980 -9.098 -3.857) 14.772 2.655 ( 1.812 -0.009 -9.595) 9.765 3.080 ( 0.110 -1.811 8.011) 8.214 3.289 ( 13.728 -0.256 3.377) 14.140 3.530 ( 7.053 -6.093 1.750) 9.483 3.773 ( 2.737 -8.844 0.135) 9.259 4.260 ( -8.766 2.160 -9.710) 13.259 4.323 ( 13.809 -13.846 4.513) 20.069 4.630 ( -6.171 -2.637 4.233) 7.934 5.053 ( -7.507 -3.312 -2.164) 8.486 5.153 ( 0.854 -9.551 0.126) 9.590 5.885 ( 5.976 1.692 -6.505) 8.994 6.270 ( -2.280 1.593 23.747) 23.909 6.738 ( -4.681 6.525 3.305) 8.684 7.546 ( 4.954 7.615 -8.101) 12.172 8.128 ( -5.738 1.932 4.745) 7.693 8.381 ( -4.600 -1.430 -5.738) 7.492 9.568 ( 0.663 -6.002 -11.535) 13.020 9.759 ( -15.892 10.943 -10.369) 21.905 9.802 ( 6.619 -1.665 -12.946) 14.635 10.221 ( -12.787 -1.213 -2.958) 13.181 10.717 ( -6.773 0.221 15.576) 16.987 10.888 ( -1.590 -5.136 1.458) 5.571 11.221 ( -3.665 -4.464 -0.397) 5.789 11.733 ( 7.741 10.038 -11.588) 17.175 12.146 ( -0.838 11.808 7.607) 14.071 12.750 ( -6.275 1.747 6.511) 9.210 13.270 ( 12.039 5.313 -3.007) 13.499 13.683 ( 6.194 0.052 -2.296) 6.606 13.832 ( -2.144 1.335 -2.248) 3.381 13.987 ( 3.128 -3.140 -6.712) 8.043 14.381 ( -9.038 -1.226 2.356) 9.420 14.785 ( -8.658 2.501 14.807) 17.334 15.300 ( 2.162 -0.242 4.111) 4.651 15.649 ( -3.932 3.064 1.688) 5.263 15.887 ( -1.035 -6.449 1.238) 6.648 16.150 ( -1.247 6.140 -1.004) 6.345 16.698 ( 4.689 4.734 7.610) 10.115 17.590 ( 13.789 14.768 -3.462) 20.499 21.163 ( -1.763 1.191 -0.882) 2.303 21.347 ( 0.867 -17.558 -12.422) 21.525 21.573 ( -2.887 -7.419 2.977) 8.499 22.392 ( 0.959 -2.059 4.706) 5.225 ======================= Grid point 212 (91/227) ======================= q-point: ( 0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 4.045 8.756 3.762) 10.353 2.070 ( 6.687 -5.919 4.436) 9.971 2.550 ( 1.867 -2.643 -5.337) 6.241 2.714 ( 4.041 -0.627 -9.791) 10.611 3.122 ( 4.536 0.074 7.362) 8.648 3.512 ( 12.225 -1.788 0.863) 12.385 3.667 ( -2.290 -3.369 -11.393) 12.099 3.891 ( 3.913 -7.331 5.053) 9.726 4.105 ( -4.204 0.698 -4.022) 5.860 4.502 ( -2.749 -3.652 -2.528) 5.223 4.672 ( 2.849 -8.331 9.784) 13.162 4.966 ( -6.837 -5.420 -3.208) 9.296 5.314 ( 3.767 -9.316 3.675) 10.700 5.902 ( 2.392 4.333 -0.626) 4.989 6.218 ( -2.108 4.843 19.170) 19.884 6.634 ( -2.195 3.580 1.220) 4.373 7.540 ( 3.833 6.048 -6.561) 9.712 7.963 ( -8.804 5.993 3.689) 11.271 8.353 ( -1.633 -2.338 1.999) 3.483 9.388 ( -14.369 8.268 -12.923) 21.020 9.626 ( -1.336 -5.889 -10.405) 12.031 9.912 ( 2.540 -0.208 -16.192) 16.392 10.114 ( -0.564 -3.690 -7.261) 8.164 10.612 ( -5.875 -1.179 13.500) 14.770 10.949 ( 0.523 -6.158 1.643) 6.395 11.205 ( -2.871 -3.272 1.042) 4.476 11.593 ( -3.625 13.891 -7.063) 15.999 12.175 ( 9.878 6.016 0.152) 11.567 12.639 ( -4.945 1.730 8.926) 10.350 13.381 ( 6.162 3.066 -2.842) 7.447 13.758 ( -1.252 1.924 0.161) 2.301 13.796 ( 5.790 1.783 0.645) 6.093 14.088 ( 5.587 -1.405 -6.850) 8.950 14.230 ( -10.471 -1.494 3.190) 11.048 14.682 ( -3.962 -1.594 10.096) 10.962 15.360 ( 4.061 -0.623 3.480) 5.384 15.571 ( -2.713 1.017 1.307) 3.178 15.929 ( -1.055 -4.304 2.855) 5.272 16.085 ( -1.843 0.280 -3.617) 4.070 16.719 ( 2.293 3.412 7.820) 8.835 17.633 ( 5.239 7.558 -2.625) 9.564 21.113 ( -0.404 4.612 0.011) 4.629 21.480 ( -4.090 -14.685 -10.001) 18.232 21.620 ( 3.845 -0.080 -0.587) 3.890 22.424 ( 0.512 -1.889 5.605) 5.937 ======================= Grid point 213 (92/227) ======================= q-point: (-0.50 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( 1.903 3.988 2.637) 5.146 2.151 ( -0.914 -0.539 0.584) 1.211 2.554 ( 0.400 4.742 -6.894) 8.377 2.778 ( 1.888 -4.535 -2.138) 5.357 3.234 ( 7.311 -0.269 2.573) 7.755 3.459 ( -14.973 4.336 -10.983) 19.069 3.747 ( 7.428 -6.630 -1.266) 10.037 3.924 ( -3.885 0.881 4.340) 5.891 4.208 ( 10.323 -4.095 -0.668) 11.126 4.520 ( -1.465 -7.948 -2.719) 8.527 4.689 ( -5.667 -2.064 1.210) 6.151 4.988 ( -0.021 -8.508 1.329) 8.611 5.350 ( -4.339 3.078 1.685) 5.580 5.951 ( 6.702 1.563 4.766) 8.371 6.091 ( -5.636 8.480 15.858) 18.846 6.589 ( -0.497 1.361 3.454) 3.745 7.522 ( 1.878 10.368 -7.920) 13.181 7.802 ( -1.521 3.904 2.805) 5.043 8.333 ( -3.087 0.590 5.424) 6.269 9.167 ( -6.586 -1.971 -12.002) 13.831 9.638 ( -3.277 -4.639 -9.817) 11.342 9.872 ( -2.640 1.639 -15.292) 15.604 10.228 ( 5.703 -4.062 -15.713) 17.202 10.587 ( 1.358 -0.713 14.065) 14.148 11.005 ( -0.396 -4.926 -1.851) 5.277 11.205 ( -1.016 -2.653 2.777) 3.973 11.459 ( -1.002 2.393 2.262) 3.441 12.252 ( 6.891 6.651 -6.794) 11.743 12.574 ( -1.032 1.840 10.037) 10.256 13.380 ( -4.590 -0.245 -1.561) 4.854 13.743 ( 1.953 1.429 -0.680) 2.514 13.853 ( 4.622 5.879 2.369) 7.844 14.091 ( -6.440 -1.206 4.234) 7.801 14.182 ( 3.395 -1.169 -7.825) 8.609 14.692 ( 0.412 -5.087 8.290) 9.735 15.441 ( 4.567 -1.124 3.650) 5.954 15.549 ( 0.013 -1.122 1.558) 1.920 15.925 ( 0.052 3.147 2.363) 3.936 16.098 ( -3.321 -10.811 -3.671) 11.891 16.704 ( -0.863 2.587 7.677) 8.147 17.607 ( -2.185 2.219 -2.215) 3.822 21.059 ( 1.158 7.362 -0.509) 7.470 21.501 ( -6.960 -8.846 -4.953) 12.298 21.697 ( 6.953 2.758 -5.135) 9.073 22.457 ( 1.546 -1.142 5.925) 6.229 ======================= Grid point 214 (93/227) ======================= q-point: (-0.40 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -0.081 0.287 2.541) 2.559 2.072 ( -7.092 1.818 1.589) 7.492 2.487 ( -0.342 7.124 -4.284) 8.320 2.855 ( 1.234 -2.154 1.486) 2.893 3.040 ( -20.747 6.104 -9.039) 23.439 3.427 ( 8.769 -0.705 0.897) 8.843 3.781 ( -6.735 1.841 8.775) 11.214 3.921 ( -0.583 -6.878 -1.635) 7.093 4.367 ( 5.990 3.033 -2.306) 7.099 4.519 ( -5.764 -3.706 0.217) 6.856 4.699 ( 2.823 -7.413 -7.683) 11.043 5.036 ( -5.165 0.173 3.305) 6.134 5.201 ( -2.463 3.588 1.703) 4.673 5.875 ( -7.466 7.763 2.994) 11.179 6.072 ( 7.123 3.712 15.582) 17.530 6.590 ( 0.639 -1.156 4.879) 5.055 7.381 ( 0.218 16.421 -3.989) 16.900 7.864 ( 8.683 -1.111 -3.625) 9.474 8.259 ( -3.105 2.070 5.605) 6.734 9.189 ( 0.641 -8.834 -10.194) 13.505 9.613 ( -4.025 -3.718 -9.653) 11.100 9.826 ( -0.360 0.061 -15.584) 15.588 10.325 ( 4.254 -1.741 -14.732) 15.432 10.650 ( 5.085 2.599 9.311) 10.923 11.067 ( 1.579 -6.229 -0.490) 6.444 11.208 ( 0.775 1.289 0.211) 1.518 11.523 ( 2.198 -10.713 10.665) 15.275 12.271 ( 4.388 6.417 -7.958) 11.124 12.575 ( 2.065 0.509 8.920) 9.170 13.261 ( -10.706 -2.520 -0.594) 11.015 13.725 ( -4.165 1.083 0.360) 4.318 13.849 ( 3.333 6.214 -1.851) 7.290 14.066 ( 1.870 -1.124 3.363) 4.009 14.222 ( 1.255 0.334 -5.996) 6.135 14.791 ( 3.425 -6.907 7.975) 11.093 15.538 ( 4.929 -2.652 5.821) 8.076 15.593 ( 3.115 -1.940 1.414) 3.932 15.890 ( 0.294 3.925 0.000) 3.936 16.164 ( -3.965 -13.546 -1.323) 14.176 16.642 ( -4.126 2.218 7.296) 8.670 17.519 ( -8.775 -3.000 -2.283) 9.550 20.999 ( 2.643 11.048 -1.486) 11.456 21.441 ( -7.953 -4.495 -2.545) 9.483 21.782 ( 7.474 3.355 -6.739) 10.609 22.505 ( 3.614 0.491 5.559) 6.648 ======================= Grid point 215 (94/227) ======================= q-point: (-0.30 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -3.284 0.437 3.527) 4.839 1.912 ( -9.951 2.126 6.567) 12.110 2.371 ( -9.902 8.667 1.490) 13.243 2.565 ( -12.827 10.510 -3.842) 17.023 2.962 ( 3.837 0.073 0.290) 3.849 3.536 ( 1.200 0.384 -0.790) 1.487 3.651 ( -5.280 0.913 14.850) 15.787 3.856 ( -15.308 -2.747 4.408) 16.165 4.303 ( -8.262 2.027 0.426) 8.517 4.504 ( 3.499 6.100 -2.407) 7.433 4.806 ( 2.855 1.743 -5.609) 6.530 4.903 ( -2.002 -3.271 -4.854) 6.187 5.230 ( 2.185 -1.032 -0.751) 2.530 5.707 ( -5.030 4.009 -2.011) 6.739 6.130 ( 4.710 4.885 16.023) 17.401 6.645 ( 2.654 -4.515 4.288) 6.769 7.243 ( 2.773 15.197 -1.675) 15.539 8.064 ( 12.873 -2.949 -6.638) 14.781 8.228 ( 0.364 -0.433 5.579) 5.608 9.269 ( -0.289 -4.759 -9.236) 10.394 9.572 ( -2.927 0.105 -11.112) 11.491 9.882 ( 3.804 -7.200 -16.256) 18.182 10.432 ( 9.030 -0.504 -7.237) 11.583 10.686 ( 4.001 4.549 4.462) 7.525 11.134 ( -1.720 -4.848 6.683) 8.434 11.246 ( 5.660 0.850 -5.754) 8.115 11.696 ( 3.367 -10.891 12.235) 16.723 12.291 ( 4.667 1.376 -4.304) 6.496 12.637 ( 4.125 -1.779 7.394) 8.652 13.093 ( -13.065 -2.964 -0.630) 13.412 13.619 ( -7.616 -0.969 0.761) 7.715 13.822 ( 0.329 5.456 -6.409) 8.423 14.142 ( 4.966 -0.734 1.057) 5.130 14.224 ( 1.094 1.647 -3.285) 3.835 14.928 ( 4.172 -6.419 8.375) 11.347 15.660 ( 4.605 -4.668 10.558) 12.429 15.681 ( 5.466 -1.451 0.191) 5.658 15.863 ( 0.420 1.712 -1.479) 2.301 16.228 ( -3.785 -11.384 1.409) 12.079 16.535 ( -6.447 2.098 5.887) 8.979 17.386 ( -14.790 -9.477 -2.727) 17.777 20.917 ( 3.676 15.620 -2.875) 16.303 21.344 ( -8.127 -3.061 -1.322) 8.784 21.869 ( 7.649 3.268 -6.649) 10.649 22.565 ( 5.214 2.731 3.831) 7.023 ======================= Grid point 216 (95/227) ======================= q-point: (-0.20 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.342 ( -3.316 1.927 7.423) 8.355 1.702 ( -11.752 4.679 14.436) 19.194 1.940 ( -19.819 14.069 10.825) 26.607 2.481 ( 4.937 4.871 -6.021) 9.184 3.002 ( 1.114 3.763 10.072) 10.809 3.427 ( -9.746 2.525 12.706) 16.211 3.505 ( -19.857 3.597 11.190) 23.075 3.636 ( -1.895 0.098 6.542) 6.812 4.132 ( -11.376 -1.183 1.118) 11.492 4.458 ( 0.094 10.069 -4.812) 11.160 4.812 ( 2.623 0.958 -11.742) 12.070 5.009 ( 5.272 -6.179 -6.355) 10.313 5.253 ( 2.343 2.324 -4.500) 5.580 5.624 ( -2.530 2.244 -8.818) 9.444 6.160 ( 3.019 1.957 19.527) 19.856 6.764 ( 4.653 -6.201 -0.665) 7.781 7.165 ( 3.446 10.709 2.594) 11.545 8.265 ( 3.365 -2.630 2.310) 4.856 8.324 ( 12.506 -3.486 -4.989) 13.908 9.267 ( -2.255 -0.760 -10.399) 10.668 9.523 ( -0.054 2.554 -12.053) 12.321 10.030 ( 5.146 -6.230 -15.864) 17.804 10.620 ( 8.025 -4.492 4.052) 10.050 10.736 ( 10.708 5.044 2.183) 12.036 11.141 ( -2.041 -3.595 5.491) 6.873 11.306 ( 2.445 2.681 -5.590) 6.664 11.826 ( 4.659 -1.962 6.059) 7.891 12.432 ( 6.299 -10.840 3.960) 13.148 12.727 ( 2.402 -1.843 4.257) 5.224 12.908 ( -10.220 -1.227 1.213) 10.364 13.520 ( -7.396 -4.865 -1.698) 9.014 13.746 ( -1.960 5.885 -7.914) 10.055 14.207 ( 1.000 -0.970 -1.411) 1.983 14.248 ( 5.465 2.846 -1.298) 6.297 15.051 ( 3.829 -4.156 9.178) 10.778 15.758 ( 3.259 -1.780 4.178) 5.590 15.771 ( 1.692 -1.049 3.396) 3.936 15.917 ( 5.269 -4.865 7.560) 10.420 16.264 ( -3.352 -7.058 4.350) 8.943 16.413 ( -4.934 1.999 1.091) 5.434 17.230 ( -20.532 -17.423 -2.998) 27.094 20.799 ( 3.695 19.852 -4.176) 20.620 21.250 ( -6.607 -2.879 -0.408) 7.219 21.963 ( 7.641 2.537 -5.544) 9.776 22.604 ( 3.037 4.874 -0.331) 5.752 ======================= Grid point 217 (96/227) ======================= q-point: (-0.10 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( 0.297 1.850 17.388) 17.489 1.475 ( -10.451 7.591 23.050) 26.422 1.616 ( -1.933 6.325 14.885) 16.289 2.541 ( 6.265 2.528 -6.577) 9.429 2.768 ( -22.849 6.710 43.566) 49.650 3.301 ( -3.227 1.166 3.023) 4.573 3.317 ( 0.839 1.593 5.557) 5.841 3.586 ( -3.731 1.099 4.759) 6.146 3.913 ( -17.899 -0.097 2.131) 18.025 4.348 ( 0.383 7.821 -7.370) 10.753 4.826 ( -1.651 -1.612 -16.170) 16.333 5.171 ( 7.705 -4.529 -3.733) 9.686 5.274 ( 3.202 2.318 -5.551) 6.814 5.525 ( -5.585 4.067 -10.829) 12.845 6.212 ( 2.825 -0.327 22.392) 22.572 6.909 ( 7.102 -4.397 -10.261) 13.230 7.139 ( 2.358 4.611 10.621) 11.817 8.338 ( 2.074 -2.375 3.244) 4.524 8.530 ( 7.509 -2.302 -8.285) 11.416 9.231 ( 0.082 1.449 -14.178) 14.252 9.525 ( 3.017 1.153 -11.215) 11.670 10.152 ( 6.239 -1.270 -9.588) 11.510 10.737 ( 3.099 -4.775 6.660) 8.761 10.933 ( 11.726 1.409 7.725) 14.112 11.151 ( -1.223 -3.227 1.774) 3.880 11.254 ( -2.982 4.960 -5.394) 7.911 11.909 ( 3.140 1.292 0.663) 3.460 12.589 ( -6.624 -6.597 -0.314) 9.354 12.692 ( -1.295 -5.886 0.477) 6.045 12.920 ( 7.584 -0.037 7.552) 10.703 13.505 ( -0.610 -7.741 -6.052) 9.845 13.657 ( -0.053 6.746 -6.775) 9.561 14.202 ( -2.227 -0.273 -2.437) 3.313 14.333 ( 7.626 1.731 -0.846) 7.866 15.143 ( 3.457 -1.365 9.330) 10.043 15.791 ( 0.245 -2.004 1.470) 2.498 15.815 ( 1.508 -0.412 2.675) 3.098 16.049 ( 2.310 -3.282 21.157) 21.534 16.281 ( -0.515 -4.772 0.516) 4.827 16.376 ( 3.463 2.061 -3.099) 5.084 17.076 ( -21.552 -22.315 -1.913) 31.083 20.642 ( 2.148 19.596 -3.415) 20.007 21.192 ( -3.418 -2.020 0.160) 3.974 22.063 ( 7.221 1.378 -3.742) 8.249 22.516 ( -9.016 5.670 -5.224) 11.863 ======================= Grid point 219 (97/227) ======================= q-point: ( 0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 8.495 0.000 23.301) 24.801 1.586 ( 15.683 0.000 15.405) 21.983 1.944 ( 8.915 0.000 2.567) 9.277 2.651 ( -1.282 -0.000 -5.800) 5.940 2.841 ( 16.552 0.000 21.513) 27.144 3.202 ( 4.279 0.000 7.586) 8.710 3.252 ( 11.578 0.000 3.794) 12.183 3.442 ( -0.076 -0.000 4.283) 4.284 3.882 ( 10.248 0.000 -2.796) 10.623 4.448 ( 2.303 0.000 -7.538) 7.881 4.634 ( -7.476 -0.000 -11.127) 13.405 5.044 ( -10.140 -0.000 7.614) 12.680 5.158 ( -5.750 -0.000 -7.044) 9.092 5.749 ( 13.107 0.000 -6.607) 14.679 6.266 ( -0.456 -0.000 23.717) 23.721 7.001 ( -8.923 -0.000 12.230) 15.139 7.578 ( 11.847 0.000 -21.093) 24.192 8.241 ( -5.317 -0.000 7.213) 8.961 8.415 ( -5.283 -0.000 -12.355) 13.437 9.427 ( 3.453 0.000 -11.830) 12.324 9.693 ( 4.276 0.000 -10.617) 11.445 10.233 ( -12.189 -0.000 -8.884) 15.083 10.462 ( -20.519 -0.000 4.129) 20.930 10.746 ( 0.873 0.000 1.659) 1.875 10.967 ( -12.418 -0.000 16.514) 20.662 11.194 ( -6.241 -0.000 0.017) 6.241 11.569 ( 18.012 0.000 -1.484) 18.073 12.578 ( -5.069 -0.000 1.636) 5.327 12.851 ( -6.638 -0.000 3.519) 7.513 13.164 ( 12.563 0.000 -4.106) 13.217 13.614 ( 0.883 0.000 -1.339) 1.604 13.793 ( 5.845 0.000 -14.578) 15.706 13.966 ( -5.485 -0.000 -1.721) 5.749 14.462 ( -5.341 -0.000 -0.991) 5.432 15.025 ( -10.691 -0.000 19.087) 21.877 15.345 ( -9.028 -0.000 7.174) 11.532 15.780 ( -3.252 -0.000 2.574) 4.147 15.798 ( -2.469 -0.000 0.916) 2.633 16.316 ( 0.222 0.000 2.431) 2.441 16.695 ( 3.345 0.000 7.497) 8.209 17.914 ( 18.203 0.000 -23.283) 29.554 20.562 ( 1.338 0.000 -0.174) 1.350 21.322 ( 7.846 0.000 -0.090) 7.846 21.463 ( -8.758 -0.000 8.002) 11.863 22.323 ( 2.761 0.000 3.045) 4.111 ======================= Grid point 220 (98/227) ======================= q-point: ( 0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 15.195 -3.053 14.369) 21.135 1.747 ( 10.080 12.572 7.546) 17.793 2.202 ( 14.898 -9.824 -4.701) 18.454 2.633 ( -0.589 -1.291 -5.143) 5.335 3.062 ( 9.083 -0.171 6.775) 11.333 3.302 ( 11.985 2.068 6.074) 13.595 3.458 ( 3.721 -0.939 3.117) 4.944 3.570 ( 10.398 -9.792 2.461) 14.493 4.113 ( 16.332 -4.991 3.335) 17.401 4.380 ( -5.737 8.302 -8.115) 12.950 4.551 ( -6.539 -6.514 -3.878) 10.012 4.924 ( -7.459 -5.618 6.074) 11.140 5.057 ( -5.959 -1.389 -7.008) 9.303 5.925 ( 9.157 1.613 -6.635) 11.423 6.279 ( 0.296 -0.236 24.270) 24.273 6.818 ( -11.433 1.783 5.813) 12.949 7.678 ( 4.224 4.208 -12.388) 13.748 8.158 ( -4.355 1.012 7.126) 8.413 8.344 ( -4.425 -1.623 -7.732) 9.056 9.476 ( 1.605 -2.616 -11.601) 12.000 9.774 ( 6.135 -0.525 -10.610) 12.268 9.938 ( -18.224 5.103 -15.047) 24.177 10.198 ( -12.405 -0.898 -5.807) 13.726 10.740 ( -8.528 1.934 16.005) 18.238 10.806 ( -1.254 -3.218 5.749) 6.707 11.152 ( -1.940 -1.985 2.196) 3.539 11.848 ( 15.384 2.268 -9.690) 18.322 12.422 ( -5.669 13.110 6.236) 15.585 12.701 ( -11.983 -6.185 5.870) 14.707 13.374 ( 13.640 3.877 -2.798) 14.454 13.650 ( 3.316 -2.043 -1.712) 4.254 13.863 ( -3.093 1.694 -2.515) 4.332 13.923 ( 5.205 -2.761 -8.571) 10.400 14.344 ( -9.912 -1.576 -0.466) 10.048 14.823 ( -12.342 1.106 18.457) 22.231 15.301 ( 1.792 0.149 3.793) 4.198 15.698 ( -5.110 1.962 1.770) 5.753 15.783 ( -1.907 -3.503 -0.215) 3.994 16.290 ( -0.233 5.485 3.098) 6.303 16.730 ( 0.424 -0.818 9.202) 9.248 17.977 ( 6.564 17.624 -16.278) 24.874 20.711 ( -1.291 -22.382 -2.770) 22.590 21.378 ( 4.567 5.855 0.630) 7.452 21.495 ( 6.790 -3.172 0.451) 7.508 22.360 ( 1.092 -0.966 4.635) 4.858 ======================= Grid point 221 (99/227) ======================= q-point: ( 0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( 3.891 14.254 4.112) 15.337 1.969 ( 12.030 -3.427 6.457) 14.077 2.484 ( 9.010 -3.084 -6.696) 11.642 2.685 ( 4.550 -3.873 -8.426) 10.329 3.167 ( 8.181 4.993 7.805) 12.360 3.467 ( 6.125 -2.166 -0.680) 6.532 3.627 ( 11.932 -1.987 -3.152) 12.500 3.739 ( 3.509 -6.305 0.787) 7.258 4.172 ( -7.571 5.772 -6.864) 11.737 4.431 ( 3.595 -4.106 -0.002) 5.458 4.509 ( 1.988 -6.560 8.440) 10.873 4.868 ( -7.427 -4.391 -0.749) 8.660 5.080 ( 2.874 -11.522 0.256) 11.878 5.999 ( 4.147 4.375 -4.251) 7.376 6.289 ( 0.697 2.319 23.952) 24.074 6.640 ( -9.598 -1.726 -0.293) 9.757 7.663 ( 1.938 5.430 -5.194) 7.760 8.066 ( -4.884 3.805 5.282) 8.138 8.296 ( -3.384 -2.584 -0.740) 4.321 9.523 ( 0.785 -3.292 -13.558) 13.974 9.560 ( -18.316 6.715 -14.553) 24.338 9.903 ( 7.530 -0.832 -15.028) 16.830 10.059 ( -4.984 -1.501 -10.736) 11.931 10.594 ( -6.913 -0.594 15.893) 17.342 10.856 ( 1.396 -2.973 5.625) 6.514 11.146 ( -1.884 -2.309 3.555) 4.639 11.886 ( -3.164 13.196 -11.785) 17.973 12.282 ( 3.189 5.139 2.234) 6.447 12.616 ( -5.099 -4.075 10.207) 12.115 13.487 ( 6.310 7.120 -2.396) 9.811 13.758 ( 0.780 -3.649 -1.850) 4.165 13.798 ( 3.269 0.545 1.227) 3.534 14.051 ( 6.447 -2.136 -8.118) 10.584 14.177 ( -12.848 -2.974 0.649) 13.204 14.657 ( -8.033 -0.847 13.429) 15.672 15.360 ( 4.773 0.411 3.522) 5.946 15.595 ( -4.895 1.487 1.457) 5.319 15.800 ( -1.952 -6.058 -0.658) 6.399 16.208 ( -1.138 8.253 3.018) 8.861 16.739 ( -1.455 -1.794 9.706) 9.977 17.861 ( 0.345 14.034 -10.240) 17.376 20.882 ( -4.678 -20.526 -2.181) 21.165 21.424 ( 7.035 4.686 -3.350) 9.093 21.640 ( 9.255 1.201 -1.760) 9.497 22.386 ( 0.494 -1.733 5.594) 5.877 ======================= Grid point 222 (100/227) ======================= q-point: ( 0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( 1.107 12.123 2.383) 12.404 2.125 ( 2.668 -2.328 1.179) 3.732 2.594 ( 5.179 0.346 -5.747) 7.744 2.772 ( 3.715 1.950 -5.810) 7.166 3.276 ( 10.509 4.874 4.888) 12.574 3.553 ( -7.529 0.637 -10.105) 12.617 3.618 ( 1.906 -1.152 -2.975) 3.717 3.945 ( 4.173 0.019 4.483) 6.124 4.109 ( 7.721 -4.366 -2.222) 9.144 4.396 ( -4.110 -4.864 -0.188) 6.370 4.621 ( -4.089 -4.738 2.548) 6.757 4.843 ( 0.832 -4.665 0.997) 4.842 5.281 ( 4.011 -9.479 2.045) 10.493 6.016 ( 5.411 4.591 0.728) 7.133 6.242 ( -3.160 6.122 19.996) 21.150 6.546 ( -5.855 -4.606 -0.230) 7.453 7.669 ( 5.552 4.561 -5.592) 9.105 7.929 ( -4.305 7.635 4.043) 9.653 8.284 ( -3.115 -4.432 5.566) 7.767 9.216 ( -13.820 5.315 -14.712) 20.873 9.562 ( 0.225 -2.586 -12.856) 13.115 9.910 ( -2.468 1.704 -18.006) 18.255 10.133 ( 6.221 -4.865 -11.667) 14.089 10.567 ( 2.524 -1.182 15.328) 15.579 10.909 ( 0.438 -4.057 3.765) 5.552 11.137 ( -2.332 -2.755 4.645) 5.883 11.637 ( -6.497 13.015 -2.523) 14.763 12.304 ( -0.765 -2.095 -5.236) 5.691 12.619 ( 3.244 2.525 7.198) 8.289 13.420 ( -6.521 4.181 -2.389) 8.106 13.772 ( 2.871 1.743 0.737) 3.438 13.920 ( 5.662 -1.049 -0.056) 5.758 14.007 ( -10.701 -4.096 3.328) 11.932 14.162 ( 4.908 -1.457 -7.561) 9.132 14.596 ( -2.976 -4.131 9.644) 10.905 15.434 ( 4.339 0.533 3.618) 5.675 15.532 ( -1.488 -0.434 0.988) 1.838 15.841 ( -1.802 -8.452 -0.670) 8.667 16.101 ( -1.829 7.807 2.530) 8.408 16.721 ( -3.484 -1.665 9.423) 10.183 17.706 ( -5.574 7.739 -6.644) 11.623 20.973 ( -4.533 -13.598 -0.654) 14.348 21.484 ( 5.980 5.439 -4.519) 9.261 21.767 ( 9.546 4.042 -3.926) 11.085 22.424 ( 1.686 -2.149 5.606) 6.236 ======================= Grid point 223 (101/227) ======================= q-point: (-0.50 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( 0.386 8.038 1.750) 8.235 2.104 ( -5.482 0.751 -0.485) 5.554 2.630 ( 2.408 5.517 -5.953) 8.466 2.826 ( 6.382 0.763 0.247) 6.433 3.202 ( -15.377 10.090 -5.902) 19.315 3.453 ( 7.673 2.983 0.282) 8.237 3.731 ( 0.611 -8.663 -2.033) 8.919 3.876 ( -4.894 4.603 6.401) 9.280 4.376 ( 13.061 -3.975 -2.455) 13.871 4.406 ( -3.352 -5.338 -2.625) 6.829 4.577 ( -2.327 -4.893 -1.684) 5.674 4.937 ( 2.534 -5.611 5.985) 8.586 5.311 ( -3.948 3.007 -0.789) 5.026 6.045 ( -3.384 7.423 1.586) 8.311 6.144 ( 5.357 4.245 17.567) 18.850 6.526 ( -2.938 -4.922 3.039) 6.488 7.686 ( 2.531 12.469 -5.007) 13.673 7.853 ( 4.517 0.698 0.061) 4.571 8.263 ( -4.401 -2.462 7.503) 9.040 9.048 ( -3.702 -3.482 -12.128) 13.149 9.563 ( -1.298 -0.213 -12.628) 12.697 9.857 ( -0.923 1.237 -17.352) 17.421 10.252 ( 3.453 -4.691 -8.479) 10.287 10.696 ( 10.245 1.276 9.751) 14.201 10.953 ( -0.246 -4.758 1.639) 5.039 11.150 ( -0.838 -5.981 5.595) 8.233 11.472 ( -1.451 5.741 2.822) 6.560 12.304 ( -1.993 -3.802 -3.013) 5.244 12.644 ( 4.232 5.861 0.470) 7.245 13.234 ( -12.519 0.216 -1.346) 12.593 13.721 ( -9.290 -1.676 0.670) 9.464 13.961 ( 2.722 4.555 -1.552) 5.528 14.001 ( 2.950 -4.293 2.067) 5.604 14.233 ( 3.309 0.351 -3.285) 4.676 14.645 ( 1.217 -7.093 7.453) 10.361 15.494 ( 2.956 -1.443 5.500) 6.409 15.562 ( 3.616 -1.059 -0.735) 3.839 15.907 ( -2.726 -11.215 -1.026) 11.587 16.001 ( -1.115 6.712 2.761) 7.343 16.662 ( -5.805 -0.961 8.688) 10.493 17.515 ( -11.163 2.747 -3.889) 12.136 21.018 ( -3.173 -8.155 -0.046) 8.751 21.490 ( 3.099 8.243 -3.603) 9.515 21.870 ( 9.166 5.339 -5.683) 12.034 22.494 ( 4.396 -1.645 4.339) 6.392 ======================= Grid point 224 (102/227) ======================= q-point: (-0.40 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -0.802 4.950 1.457) 5.222 1.968 ( -7.686 2.790 2.606) 8.582 2.578 ( 0.344 10.362 -1.365) 10.457 2.792 ( -15.668 12.641 -0.799) 20.147 2.950 ( 6.338 -0.754 -1.360) 6.526 3.541 ( 3.596 0.624 0.275) 3.660 3.728 ( -10.550 -1.854 7.591) 13.129 3.768 ( -1.594 2.529 2.701) 4.029 4.334 ( -6.930 0.605 -0.773) 6.999 4.559 ( 6.112 -2.454 0.323) 6.594 4.704 ( 8.025 -6.040 -8.740) 13.314 4.976 ( -3.001 3.192 3.845) 5.829 5.198 ( -0.867 1.940 0.982) 2.341 5.863 ( -4.824 9.938 2.348) 11.294 6.227 ( 5.667 4.075 11.983) 13.868 6.547 ( -0.956 -5.585 4.055) 6.967 7.544 ( -0.929 14.248 0.122) 14.278 8.007 ( 10.740 -2.583 -6.077) 12.608 8.214 ( -2.878 -1.168 5.977) 6.736 9.132 ( 4.001 -9.085 -9.147) 13.499 9.531 ( -1.442 -0.351 -12.839) 12.925 9.846 ( 1.986 0.899 -16.065) 16.212 10.362 ( 4.494 -5.326 -2.441) 7.384 10.801 ( 6.750 6.083 -0.619) 9.108 11.017 ( 0.462 -6.323 7.933) 10.155 11.237 ( 4.053 -5.020 0.636) 6.484 11.489 ( 4.193 -4.312 8.998) 10.823 12.314 ( -0.893 -2.448 -4.019) 4.790 12.649 ( 3.498 4.478 -0.048) 5.682 13.025 ( -14.569 -3.411 -0.602) 14.975 13.564 ( -12.930 -4.531 0.611) 13.715 13.930 ( -0.297 5.046 -5.764) 7.667 14.107 ( 4.644 -2.455 0.827) 5.318 14.271 ( 3.814 2.666 0.651) 4.698 14.767 ( 3.048 -8.958 7.112) 11.837 15.577 ( 4.038 -3.235 7.260) 8.915 15.650 ( 5.208 -1.582 -1.362) 5.611 15.884 ( -6.966 -2.370 -2.431) 7.749 16.021 ( 2.592 -5.315 5.456) 8.046 16.560 ( -7.582 -0.198 7.150) 10.424 17.284 ( -15.880 -0.889 -1.316) 15.959 21.038 ( -1.879 -4.255 -0.027) 4.652 21.420 ( 0.564 10.894 -2.950) 11.301 21.958 ( 8.593 5.502 -6.191) 11.935 22.597 ( 6.727 0.112 1.548) 6.903 ======================= Grid point 225 (103/227) ======================= q-point: (-0.30 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -2.520 3.623 1.505) 4.663 1.826 ( -4.613 5.908 9.707) 12.264 2.273 ( -15.344 18.661 10.725) 26.433 2.612 ( 3.003 7.358 -6.981) 10.577 3.060 ( 6.776 1.474 2.188) 7.271 3.497 ( -14.403 3.062 13.610) 20.052 3.539 ( -8.484 -0.642 1.351) 8.615 3.698 ( -0.008 6.576 5.805) 8.772 4.173 ( -8.809 5.444 3.226) 10.846 4.638 ( 3.501 3.877 0.681) 5.268 4.825 ( -3.293 -1.265 -5.491) 6.526 4.907 ( 7.485 0.943 -11.279) 13.569 5.252 ( 3.704 -2.289 2.257) 4.905 5.725 ( -0.444 8.294 -4.616) 9.503 6.235 ( 0.798 4.902 12.127) 13.104 6.625 ( 2.177 -7.920 5.175) 9.708 7.394 ( -1.498 11.578 2.340) 11.907 8.207 ( 4.043 -2.935 -2.660) 5.660 8.235 ( 7.516 -4.763 0.112) 8.899 9.255 ( 3.353 -1.761 -9.368) 10.105 9.531 ( 0.540 -1.484 -13.245) 13.339 9.919 ( 6.742 -3.326 -13.412) 15.375 10.493 ( 2.766 -7.358 4.019) 8.829 10.850 ( 7.908 5.034 -4.637) 10.459 11.067 ( -0.681 -3.512 11.559) 12.100 11.355 ( 6.614 1.226 -5.326) 8.580 11.677 ( 7.650 -11.161 11.787) 17.946 12.312 ( -1.500 -2.026 -5.488) 6.040 12.677 ( -0.018 -1.218 1.280) 1.767 12.849 ( -9.725 -4.662 1.222) 10.854 13.408 ( -12.144 -6.426 -0.536) 13.750 13.857 ( -1.775 5.051 -7.352) 9.094 14.179 ( 1.546 -1.643 -0.659) 2.350 14.318 ( 5.987 3.763 1.197) 7.172 14.917 ( 3.599 -9.037 8.751) 13.084 15.690 ( 3.110 -5.591 7.475) 9.839 15.746 ( 2.806 -1.292 3.290) 4.514 15.800 ( -4.774 -4.711 -6.501) 9.340 16.120 ( 1.291 -5.754 12.018) 13.387 16.441 ( -6.138 0.265 2.887) 6.788 17.016 ( -19.349 -3.477 1.562) 19.721 21.044 ( -0.403 -0.775 -0.459) 0.987 21.300 ( -0.569 12.040 -3.390) 12.521 22.038 ( 7.971 4.928 -5.406) 10.819 22.692 ( 5.778 2.992 -3.375) 7.330 ======================= Grid point 226 (104/227) ======================= q-point: (-0.20 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( -1.209 1.727 4.606) 5.065 1.700 ( -0.643 12.181 17.421) 21.267 1.875 ( -8.359 18.273 16.231) 25.831 2.620 ( 4.953 4.926 -7.775) 10.452 3.003 ( -15.443 14.845 32.403) 38.843 3.248 ( -1.022 -4.018 2.384) 4.783 3.432 ( -2.840 5.304 -0.661) 6.052 3.640 ( -0.616 4.796 5.033) 6.979 3.959 ( -10.738 6.507 3.526) 13.041 4.581 ( 0.155 11.968 -3.538) 12.481 4.789 ( -1.310 -1.071 -10.338) 10.476 5.047 ( 5.469 -5.832 -9.487) 12.407 5.325 ( 4.530 1.452 0.674) 4.804 5.646 ( -1.699 7.505 -11.280) 13.655 6.216 ( 1.716 1.188 17.701) 17.824 6.771 ( 4.769 -9.144 1.880) 10.483 7.269 ( -1.966 7.551 4.501) 9.008 8.267 ( 1.150 -3.997 2.396) 4.800 8.443 ( 7.805 -5.826 -6.682) 11.811 9.287 ( 3.522 3.781 -13.003) 13.992 9.552 ( 2.387 0.850 -11.941) 12.207 10.092 ( 8.337 -4.622 -8.516) 12.782 10.587 ( -0.658 -8.913 6.133) 10.839 10.965 ( 7.911 -0.029 -1.695) 8.091 11.091 ( 0.234 -1.285 12.536) 12.604 11.376 ( 0.465 6.525 -6.586) 9.283 11.918 ( 8.411 -3.115 2.144) 9.222 12.329 ( -4.462 -13.455 -0.214) 14.177 12.605 ( -7.112 -3.969 -0.970) 8.202 12.865 ( 0.981 -5.216 3.454) 6.332 13.346 ( -1.771 -7.851 -1.774) 8.242 13.778 ( -0.872 5.188 -7.664) 9.296 14.192 ( -1.398 -0.650 -1.811) 2.379 14.388 ( 6.858 3.310 0.224) 7.618 15.070 ( 4.913 -6.748 11.118) 13.903 15.680 ( -10.299 -10.552 3.524) 15.160 15.803 ( 2.740 -0.886 2.467) 3.792 15.888 ( 2.368 -8.857 1.675) 9.320 16.164 ( -1.843 -4.665 17.898) 18.587 16.399 ( 0.825 0.000 -0.014) 0.825 16.739 ( -18.187 -4.913 5.155) 19.531 21.037 ( 2.753 6.867 -2.560) 7.828 21.175 ( -1.232 8.329 -3.627) 9.168 22.116 ( 7.230 3.852 -3.721) 8.998 22.674 ( -3.064 7.873 -10.012) 13.100 ======================= Grid point 227 (105/227) ======================= q-point: (-0.10 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -2.525 2.076 15.392) 15.736 1.576 ( 3.483 15.227 19.166) 24.725 1.743 ( 5.227 6.388 16.554) 18.498 2.557 ( -9.872 10.145 33.880) 36.718 2.685 ( 3.413 8.266 4.429) 9.979 3.305 ( -0.610 3.095 -2.115) 3.798 3.387 ( 2.477 -0.228 1.696) 3.010 3.600 ( 2.338 8.292 2.668) 9.019 3.664 ( -13.718 6.973 4.145) 15.936 4.458 ( 0.467 10.256 -7.528) 12.731 4.777 ( -0.987 -0.237 -11.318) 11.364 5.181 ( 2.739 -6.535 -7.866) 10.587 5.385 ( 6.139 2.757 0.207) 6.733 5.469 ( -8.849 7.503 -6.414) 13.257 6.270 ( 3.215 1.139 20.885) 21.162 6.962 ( 6.020 -10.333 -1.344) 12.034 7.203 ( 1.762 3.422 2.376) 4.523 8.313 ( -1.016 -3.963 2.979) 5.061 8.560 ( 0.926 -2.616 -10.455) 10.817 9.313 ( 5.938 4.732 -14.924) 16.744 9.586 ( 3.406 1.048 -10.654) 11.234 10.239 ( 5.042 -2.874 -2.256) 6.227 10.684 ( 0.391 -9.787 3.878) 10.534 11.039 ( -1.806 2.865 7.756) 8.464 11.109 ( -0.651 -6.673 4.840) 8.269 11.261 ( -2.725 9.096 -3.158) 10.006 11.826 ( -17.115 4.274 -0.967) 17.666 12.497 ( 5.845 -13.169 -2.428) 14.611 12.621 ( 2.041 -4.825 -0.122) 5.241 12.928 ( -0.057 -8.520 1.388) 8.632 13.498 ( 7.161 -6.605 -5.475) 11.175 13.732 ( 2.032 4.542 -10.128) 11.284 14.146 ( -4.190 0.259 -3.004) 5.162 14.472 ( 5.925 1.945 -0.678) 6.273 15.185 ( 2.045 -0.308 8.735) 8.976 15.663 ( -9.664 -15.935 9.535) 20.934 15.814 ( -1.177 -1.052 2.954) 3.349 15.968 ( -6.176 -7.805 6.855) 12.085 16.270 ( 4.757 -3.424 2.177) 6.252 16.382 ( -1.956 -11.852 9.041) 15.035 16.689 ( 8.738 -8.236 10.895) 16.214 20.949 ( 5.482 24.481 -9.201) 26.722 21.135 ( -0.288 -3.132 -0.239) 3.155 22.192 ( 5.672 2.831 -1.943) 6.631 22.359 ( -21.209 14.972 -8.614) 27.352 ======================= Grid point 230 (106/227) ======================= q-point: ( 0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( 9.068 0.000 8.973) 12.757 1.955 ( 3.389 0.000 3.371) 4.780 2.442 ( 20.620 0.000 -11.157) 23.445 2.619 ( 0.643 0.000 -3.161) 3.226 3.254 ( 11.688 0.000 5.278) 12.824 3.444 ( 2.737 0.000 -2.153) 3.482 3.574 ( 14.249 0.000 10.500) 17.700 3.684 ( 7.337 0.000 -8.690) 11.373 4.276 ( -7.633 -0.000 -9.526) 12.207 4.389 ( -6.558 -0.000 -1.560) 6.741 4.406 ( 12.156 0.000 9.374) 15.351 4.812 ( -0.665 -0.000 6.984) 7.016 4.952 ( -4.647 -0.000 -6.217) 7.762 6.048 ( 5.138 0.000 -5.139) 7.267 6.312 ( 2.078 0.000 24.843) 24.930 6.614 ( -12.923 -0.000 0.256) 12.926 7.724 ( 0.401 0.000 -4.837) 4.854 8.105 ( -3.132 -0.000 7.588) 8.209 8.268 ( -4.161 -0.000 -3.095) 5.186 9.485 ( 1.859 0.000 -13.019) 13.151 9.637 ( -19.578 -0.000 -18.480) 26.923 9.890 ( 8.707 0.000 -12.417) 15.166 10.048 ( -6.024 -0.000 -13.899) 15.148 10.588 ( -7.689 -0.000 16.930) 18.594 10.827 ( 1.812 0.000 7.244) 7.467 11.122 ( -1.170 -0.000 4.678) 4.822 12.031 ( 4.212 0.000 -16.443) 16.974 12.379 ( -17.008 -0.000 6.847) 18.334 12.523 ( 5.347 0.000 10.363) 11.661 13.620 ( 12.792 0.000 -1.568) 12.888 13.661 ( -2.296 -0.000 -3.450) 4.144 13.808 ( 0.335 0.000 2.301) 2.325 14.020 ( 4.859 0.000 -7.629) 9.045 14.143 ( -11.983 -0.000 -2.846) 12.317 14.649 ( -9.706 -0.000 14.909) 17.790 15.366 ( 5.212 0.000 3.605) 6.337 15.620 ( -5.755 -0.000 1.818) 6.035 15.728 ( -2.256 -0.000 -1.116) 2.517 16.315 ( -0.841 -0.000 5.239) 5.306 16.698 ( -3.376 -0.000 10.175) 10.720 18.045 ( -5.556 -0.000 -15.550) 16.513 20.627 ( 2.620 0.000 0.333) 2.641 21.481 ( 5.921 0.000 -2.853) 6.572 21.655 ( 11.840 0.000 -1.252) 11.906 22.366 ( 0.277 0.000 5.471) 5.478 ======================= Grid point 231 (107/227) ======================= q-point: ( 0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -0.875 11.043 1.711) 11.209 2.043 ( 1.706 -6.243 1.801) 6.718 2.627 ( 5.007 2.751 -3.792) 6.857 2.766 ( 11.935 -2.300 -7.563) 14.316 3.405 ( 11.121 5.696 3.536) 12.985 3.467 ( -1.141 -3.209 -2.232) 4.072 3.736 ( 0.790 6.561 -11.233) 13.032 3.881 ( 16.801 -5.042 5.564) 18.402 4.095 ( -6.098 2.036 -2.777) 7.003 4.293 ( -7.413 -5.048 1.332) 9.067 4.527 ( -1.606 -3.292 1.982) 4.165 4.844 ( 3.264 5.061 0.337) 6.032 5.040 ( 8.934 -12.279 3.165) 15.511 6.098 ( 3.795 2.701 -2.323) 5.206 6.323 ( -3.075 1.736 22.521) 22.796 6.461 ( -5.343 -2.598 -1.346) 6.092 7.729 ( 2.430 1.559 -0.757) 2.985 8.051 ( -2.101 3.704 5.779) 7.178 8.202 ( -5.168 -2.837 2.285) 6.323 9.310 ( -16.586 2.832 -16.039) 23.246 9.533 ( 3.668 -0.559 -17.486) 17.875 9.933 ( -4.239 0.562 -20.349) 20.793 10.058 ( 7.147 -2.044 -8.773) 11.498 10.547 ( 2.320 -0.628 16.856) 17.026 10.855 ( 0.556 -1.303 6.476) 6.629 11.104 ( -1.984 -0.679 5.438) 5.828 11.918 ( -7.691 13.282 -5.449) 16.287 12.189 ( -9.597 -8.447 1.734) 12.902 12.648 ( 7.337 0.329 3.023) 7.942 13.513 ( -10.295 3.500 -4.570) 11.795 13.805 ( 8.204 -0.888 0.250) 8.256 13.857 ( -7.434 1.441 0.739) 7.608 13.952 ( 2.183 -4.065 3.419) 5.743 14.130 ( 3.720 -0.995 -10.211) 10.913 14.537 ( -5.068 -1.536 10.851) 12.074 15.454 ( 5.322 0.970 3.177) 6.273 15.532 ( -3.722 0.310 1.889) 4.186 15.710 ( -2.412 -3.951 -1.036) 4.744 16.259 ( -2.169 6.064 6.494) 9.146 16.649 ( -5.475 -3.981 9.925) 12.014 17.867 ( -10.416 5.831 -11.511) 16.583 20.717 ( 1.639 -8.404 0.401) 8.572 21.577 ( 7.262 2.621 -4.633) 9.004 21.840 ( 11.867 2.432 -2.375) 12.344 22.383 ( 1.007 -1.421 5.315) 5.593 ======================= Grid point 232 (108/227) ======================= q-point: ( 0.40 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -1.777 10.606 -0.076) 10.755 2.075 ( -4.242 -3.990 -1.885) 6.121 2.686 ( 4.386 1.141 -4.467) 6.363 2.888 ( 6.017 3.834 -1.121) 7.222 3.394 ( -10.234 3.944 -3.274) 11.446 3.531 ( 6.004 4.181 -4.760) 8.728 3.617 ( -0.584 2.650 -0.868) 2.849 3.980 ( 0.307 4.747 4.431) 6.501 4.244 ( 11.545 -7.605 -1.062) 13.865 4.292 ( -0.099 -6.262 1.028) 6.347 4.496 ( -3.538 -3.411 0.379) 4.929 4.885 ( 5.585 0.643 2.139) 6.015 5.273 ( 5.007 -5.865 -0.563) 7.732 6.146 ( 3.662 3.288 -0.644) 4.964 6.221 ( -3.922 1.152 13.956) 14.543 6.448 ( -1.204 -1.070 7.732) 7.898 7.795 ( 6.896 0.210 -2.243) 7.255 7.953 ( -3.114 7.323 3.199) 8.577 8.172 ( -3.919 -5.414 7.172) 9.803 9.052 ( -9.710 2.469 -13.868) 17.108 9.589 ( 4.155 1.988 -18.410) 18.978 9.855 ( -3.839 -1.206 -19.386) 19.799 10.171 ( 3.959 -2.826 -4.078) 6.348 10.689 ( 11.631 -1.441 13.773) 18.085 10.882 ( 0.212 -2.415 4.316) 4.950 11.071 ( -3.115 -1.429 4.447) 5.615 11.665 ( -4.895 12.235 0.964) 13.213 12.161 ( -5.889 -9.722 1.670) 11.488 12.729 ( 3.769 1.792 -3.953) 5.748 13.275 ( -14.099 3.227 -5.250) 15.387 13.648 ( -15.913 -4.856 0.804) 16.657 13.948 ( 8.387 0.253 1.674) 8.556 14.048 ( 3.932 3.602 -1.212) 5.468 14.210 ( 4.697 -2.840 -3.065) 6.287 14.527 ( -0.352 -4.220 6.574) 7.820 15.481 ( 0.830 0.073 4.299) 4.379 15.549 ( 3.845 -0.312 -0.716) 3.924 15.725 ( -2.396 -6.662 0.362) 7.089 16.149 ( -2.674 7.369 6.703) 10.314 16.597 ( -7.142 -4.961 9.201) 12.660 17.609 ( -13.421 5.308 -7.733) 16.374 20.822 ( 0.209 -8.899 0.697) 8.929 21.643 ( 5.562 5.672 -3.698) 8.762 21.984 ( 10.696 5.375 -3.954) 12.607 22.445 ( 3.917 -2.899 3.444) 5.968 ======================= Grid point 233 (109/227) ======================= q-point: (-0.50 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -1.398 8.511 -1.326) 8.726 1.998 ( -6.701 -0.399 -1.431) 6.864 2.722 ( 3.131 3.781 -4.469) 6.639 2.950 ( 3.718 1.170 -1.102) 4.050 3.079 ( -12.354 13.700 2.283) 18.588 3.534 ( -2.409 -2.248 0.273) 3.307 3.624 ( -2.847 -1.446 0.152) 3.197 3.947 ( 3.498 9.690 6.100) 11.972 4.332 ( -0.331 -0.029 -3.729) 3.744 4.412 ( 1.542 -10.088 2.800) 10.583 4.593 ( 7.602 -5.948 -2.129) 9.884 5.005 ( 9.140 1.503 3.221) 9.807 5.298 ( -1.330 4.637 -2.163) 5.287 6.042 ( -4.864 6.525 4.961) 9.531 6.286 ( 6.069 1.573 9.412) 11.309 6.438 ( -2.623 -3.795 6.407) 7.895 7.792 ( -3.726 9.924 1.818) 10.755 7.957 ( 8.716 -2.518 -3.132) 9.597 8.168 ( -2.871 -3.482 6.818) 8.176 8.977 ( 0.660 -4.551 -10.273) 11.256 9.596 ( 2.335 5.545 -17.643) 18.640 9.833 ( -0.527 -2.787 -17.734) 17.959 10.263 ( 3.711 -3.704 0.608) 5.278 10.892 ( -2.261 -4.135 7.607) 8.949 10.906 ( 11.635 1.872 6.398) 13.409 11.080 ( 1.074 -6.352 3.435) 7.301 11.548 ( 2.434 7.186 1.715) 7.778 12.188 ( -2.598 -9.010 3.098) 9.876 12.742 ( 0.824 1.711 -7.018) 7.271 12.996 ( -16.304 1.857 -5.158) 17.201 13.448 ( -15.627 -6.405 0.850) 16.910 14.016 ( -1.136 3.108 -3.208) 4.609 14.075 ( 5.960 0.158 -0.613) 5.994 14.311 ( 5.882 0.999 2.511) 6.473 14.600 ( 1.803 -6.942 4.369) 8.398 15.531 ( 3.350 -1.548 5.467) 6.596 15.618 ( 3.734 -1.775 -4.595) 6.182 15.752 ( -3.377 -6.712 3.421) 8.256 16.054 ( -0.910 4.732 7.296) 8.744 16.517 ( -8.399 -3.843 7.635) 11.984 17.324 ( -15.290 3.900 -4.213) 16.332 20.900 ( -0.766 -7.397 1.017) 7.506 21.634 ( 2.438 8.838 -1.631) 9.313 22.083 ( 9.268 6.650 -5.169) 12.523 22.568 ( 7.009 -2.891 -0.090) 7.583 ======================= Grid point 234 (110/227) ======================= q-point: (-0.40 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -3.111 6.367 -2.686) 7.578 1.910 ( -1.859 2.384 2.911) 4.197 2.649 ( -10.806 17.005 7.085) 21.357 2.745 ( 0.524 5.420 -6.445) 8.438 3.065 ( 5.364 -0.669 1.923) 5.738 3.471 ( -10.060 -2.802 8.099) 13.215 3.564 ( -2.745 2.158 1.767) 3.913 3.872 ( -1.129 9.348 5.725) 11.020 4.314 ( 2.485 7.721 -3.106) 8.685 4.544 ( 1.889 -9.672 3.591) 10.489 4.753 ( 3.343 -5.932 -2.700) 7.325 5.055 ( 1.790 9.309 -6.085) 11.264 5.269 ( 8.161 5.374 4.021) 10.567 5.910 ( -1.653 8.713 0.599) 8.888 6.324 ( 0.579 3.348 8.899) 9.526 6.455 ( -2.262 -8.126 6.946) 10.927 7.615 ( -5.215 10.170 3.953) 12.093 8.137 ( 9.034 -3.998 -4.569) 10.885 8.163 ( -0.812 -2.280 3.856) 4.552 9.131 ( 7.630 -9.419 -6.810) 13.903 9.567 ( 2.766 5.811 -17.199) 18.363 9.870 ( 2.317 -3.274 -14.744) 15.280 10.359 ( 2.003 -5.068 4.329) 6.959 10.875 ( -2.049 -2.908 2.053) 4.107 11.052 ( 7.488 2.708 7.274) 10.785 11.255 ( 9.298 -10.656 4.668) 14.893 11.574 ( 4.980 2.106 1.360) 5.575 12.240 ( -1.570 -6.214 0.358) 6.419 12.716 ( -15.207 0.636 -5.312) 16.121 12.738 ( -1.106 -2.179 -4.715) 5.311 13.272 ( -13.323 -6.684 1.082) 14.945 13.946 ( -2.414 3.809 -5.558) 7.157 14.151 ( 2.567 -0.937 0.375) 2.758 14.386 ( 5.775 2.816 2.419) 6.865 14.720 ( 2.433 -9.405 5.217) 11.026 15.577 ( -3.353 -4.435 0.649) 5.597 15.715 ( 5.451 -2.155 -2.726) 6.464 15.742 ( -1.647 -1.719 5.195) 5.714 16.049 ( 1.198 -1.478 13.815) 13.946 16.418 ( -6.757 -2.268 3.365) 7.882 17.033 ( -15.426 3.567 -1.036) 15.867 20.948 ( -1.397 -5.937 1.160) 6.208 21.555 ( 0.555 11.038 -0.822) 11.083 22.155 ( 7.992 6.515 -5.131) 11.517 22.709 ( 6.991 -1.233 -4.754) 8.543 ======================= Grid point 235 (111/227) ======================= q-point: (-0.30 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -2.495 3.958 -1.723) 4.986 1.892 ( 4.021 6.502 7.642) 10.809 2.280 ( -9.001 20.260 11.791) 25.110 2.732 ( 2.783 5.923 -6.641) 9.324 3.143 ( -3.570 -6.520 2.234) 7.762 3.275 ( -5.692 10.812 18.541) 22.205 3.495 ( -3.170 2.361 2.983) 4.952 3.755 ( -3.169 5.804 3.967) 7.711 4.221 ( 1.777 18.129 0.347) 18.219 4.651 ( 0.724 -5.514 3.153) 6.393 4.791 ( -0.556 -0.013 -3.279) 3.326 5.024 ( 3.265 2.628 -14.906) 15.484 5.378 ( 10.423 6.680 4.989) 13.347 5.812 ( -0.945 8.421 -7.726) 11.467 6.259 ( -2.532 2.640 11.143) 11.728 6.551 ( 0.476 -12.243 9.304) 15.384 7.431 ( -5.744 8.477 4.552) 11.206 8.194 ( 0.685 -3.136 2.647) 4.161 8.323 ( 7.578 -5.676 -5.284) 10.843 9.325 ( 7.501 -2.542 -7.497) 10.906 9.571 ( 3.979 3.140 -16.353) 17.121 9.980 ( 5.504 -6.660 -9.699) 12.989 10.424 ( -0.826 -6.305 5.994) 8.739 10.895 ( -0.974 -5.260 4.256) 6.835 11.128 ( 5.396 3.423 7.660) 9.976 11.496 ( 7.618 4.210 -5.389) 10.237 11.698 ( 8.795 -14.790 5.974) 18.214 12.204 ( -9.712 -1.777 -4.538) 10.867 12.516 ( -9.278 -4.833 -1.525) 10.572 12.744 ( -4.406 -5.790 -4.691) 8.657 13.201 ( -1.123 -6.337 2.685) 6.973 13.868 ( -1.924 3.876 -6.084) 7.466 14.178 ( -0.232 -0.623 -0.676) 0.948 14.449 ( 5.269 2.540 1.204) 5.972 14.869 ( 2.605 -11.646 9.183) 15.058 15.486 ( -12.911 -5.828 1.232) 14.219 15.777 ( 2.996 -1.178 1.829) 3.702 15.812 ( 3.650 -0.972 -1.392) 4.026 16.087 ( -1.258 -3.762 24.158) 24.482 16.385 ( 0.885 -1.219 -1.213) 1.934 16.762 ( -11.832 4.276 0.748) 12.603 20.980 ( -1.433 -5.173 1.101) 5.479 21.445 ( 0.665 12.156 -1.854) 12.314 22.213 ( 6.776 5.575 -3.807) 9.565 22.780 ( 1.394 2.428 -10.620) 10.982 ======================= Grid point 236 (112/227) ======================= q-point: (-0.20 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -0.972 2.444 2.836) 3.868 1.881 ( 5.908 13.562 11.387) 18.668 2.001 ( -1.794 17.359 13.914) 22.319 2.677 ( -3.646 4.563 -1.008) 5.928 2.956 ( -4.886 11.305 19.918) 23.418 3.278 ( 3.165 -0.044 2.839) 4.252 3.423 ( -2.511 2.124 5.668) 6.553 3.680 ( -0.081 3.178 2.708) 4.176 4.032 ( 1.882 24.065 -1.399) 24.179 4.644 ( -2.274 5.159 -2.165) 6.039 4.786 ( 0.075 0.258 -4.871) 4.879 5.071 ( 3.352 -2.752 -13.425) 14.108 5.467 ( 8.146 6.550 1.877) 10.620 5.640 ( -8.932 8.770 -7.610) 14.649 6.277 ( 4.246 -0.860 16.637) 17.192 6.704 ( 0.897 -14.762 6.614) 16.201 7.284 ( -2.893 4.977 2.189) 6.159 8.235 ( -0.234 -3.460 2.851) 4.490 8.476 ( 3.958 -5.317 -7.608) 10.090 9.423 ( 7.251 4.914 -12.156) 14.983 9.608 ( 3.627 1.329 -12.847) 13.415 10.123 ( 0.669 -8.933 -3.640) 9.670 10.504 ( 2.967 -7.081 6.162) 9.844 10.943 ( -1.479 -7.644 5.518) 9.543 11.128 ( -2.678 4.431 7.234) 8.896 11.444 ( -1.192 8.581 -4.597) 9.808 11.920 ( -14.857 4.494 -3.378) 15.885 12.113 ( 6.210 -22.059 -0.143) 22.917 12.528 ( 3.609 -5.638 -0.994) 6.768 12.727 ( -4.584 -10.353 -2.106) 11.517 13.358 ( 9.204 -6.968 -0.839) 11.574 13.811 ( -0.077 3.377 -7.220) 7.971 14.153 ( -2.982 0.378 -2.607) 3.979 14.509 ( 4.120 1.385 0.496) 4.375 15.064 ( 4.226 -16.152 15.368) 22.692 15.311 ( -14.767 -5.385 6.698) 17.086 15.786 ( -3.859 -1.484 3.986) 5.743 15.877 ( 2.695 -1.650 -1.376) 3.446 16.152 ( 4.704 -4.592 18.055) 19.214 16.361 ( -5.812 3.394 2.646) 7.231 16.673 ( 7.480 1.148 2.518) 7.975 21.016 ( -0.297 -5.347 0.900) 5.431 21.341 ( 2.289 12.853 -4.558) 13.828 22.263 ( 5.481 4.230 -1.785) 7.150 22.641 ( -11.459 10.797 -14.988) 21.738 ======================= Grid point 237 (113/227) ======================= q-point: (-0.10 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( 0.180 1.494 10.615) 10.721 1.772 ( -2.909 15.893 21.714) 27.065 1.934 ( 11.839 10.787 7.801) 17.815 2.610 ( 2.657 2.685 3.516) 5.161 2.877 ( 7.142 12.032 14.706) 20.299 3.244 ( -7.024 0.431 1.925) 7.296 3.401 ( 0.565 0.773 6.542) 6.612 3.664 ( 1.434 8.283 1.427) 8.527 3.864 ( 10.477 21.613 -3.262) 24.239 4.512 ( -4.233 6.701 -7.934) 11.215 4.768 ( -1.692 1.052 -4.671) 5.078 5.156 ( 1.288 -4.387 -8.310) 9.485 5.351 ( -11.497 6.669 -0.290) 13.294 5.575 ( 10.361 5.838 -1.981) 12.056 6.334 ( 0.573 1.539 20.086) 20.153 6.856 ( -2.081 -14.825 8.037) 16.992 7.294 ( 7.413 -1.644 -7.897) 10.955 8.247 ( -2.465 -2.834 4.219) 5.649 8.529 ( -1.583 -1.454 -11.592) 11.790 9.469 ( 6.047 6.467 -13.292) 15.971 9.649 ( 3.565 1.228 -10.627) 11.277 10.168 ( -6.383 -10.561 -2.223) 12.539 10.623 ( 0.497 -5.476 7.946) 9.663 10.893 ( -14.840 1.321 5.227) 15.789 11.043 ( -1.072 -3.582 2.473) 4.483 11.348 ( 0.663 8.428 0.023) 8.454 11.587 ( -13.775 4.906 -0.142) 14.623 12.334 ( -4.834 -17.621 -1.279) 18.316 12.722 ( 10.463 -4.816 -1.127) 11.573 12.860 ( 6.805 -11.372 0.138) 13.253 13.542 ( 4.860 -4.374 -5.457) 8.517 13.792 ( 1.593 2.366 -9.959) 10.360 14.078 ( -4.687 1.315 -3.570) 6.037 14.536 ( -0.011 0.901 0.090) 0.905 15.137 ( -13.064 -5.076 14.179) 19.937 15.292 ( -0.513 -14.622 14.040) 20.278 15.750 ( -2.987 -4.642 4.085) 6.867 15.894 ( -0.214 2.949 1.906) 3.518 16.225 ( -4.425 -1.940 0.539) 4.861 16.398 ( 12.657 -10.217 7.254) 17.810 16.922 ( 20.697 -4.997 7.305) 22.510 21.089 ( 2.244 -6.347 0.688) 6.767 21.253 ( 4.253 15.996 -9.627) 19.148 22.152 ( -23.687 22.070 -9.652) 33.784 22.313 ( 3.583 3.597 1.291) 5.238 ======================= Grid point 241 (114/227) ======================= q-point: ( 0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -3.341 -0.000 -0.739) 3.422 1.970 ( -3.215 -0.000 -2.634) 4.157 2.697 ( 3.783 0.000 -2.864) 4.745 2.933 ( 6.838 0.000 -1.923) 7.104 3.378 ( -7.650 -0.000 -2.692) 8.110 3.577 ( 7.375 0.000 -5.376) 9.127 3.754 ( -8.123 -0.000 -4.425) 9.250 4.032 ( 3.361 0.000 4.562) 5.666 4.112 ( 8.857 0.000 0.034) 8.857 4.229 ( 6.006 0.000 7.285) 9.441 4.455 ( -3.630 -0.000 -1.597) 3.966 4.915 ( 3.598 0.000 -3.334) 4.906 5.179 ( 12.234 0.000 2.713) 12.531 6.182 ( 5.212 0.000 -0.806) 5.274 6.211 ( -8.097 -0.000 6.057) 10.112 6.457 ( 1.307 0.000 15.344) 15.400 7.791 ( 4.733 0.000 1.534) 4.976 8.069 ( 0.678 0.000 5.905) 5.944 8.075 ( -7.519 -0.000 2.686) 7.985 9.086 ( -11.254 -0.000 -14.186) 18.108 9.613 ( 6.915 0.000 -21.780) 22.851 9.836 ( -6.156 -0.000 -19.868) 20.800 10.143 ( 4.616 0.000 -2.779) 5.388 10.670 ( 10.695 0.000 16.045) 19.283 10.856 ( 0.511 0.000 5.457) 5.481 11.064 ( -2.613 -0.000 3.389) 4.279 11.915 ( -6.003 -0.000 -6.092) 8.553 11.941 ( -7.862 -0.000 9.836) 12.592 12.738 ( 2.404 0.000 -4.277) 4.907 13.317 ( -14.099 -0.000 -7.597) 16.016 13.588 ( -16.696 -0.000 1.127) 16.734 13.964 ( 7.108 0.000 1.688) 7.306 14.112 ( 12.702 0.000 4.022) 13.324 14.143 ( -0.539 -0.000 -8.902) 8.918 14.484 ( -0.816 -0.000 6.324) 6.376 15.486 ( -1.198 -0.000 3.535) 3.732 15.547 ( 4.369 0.000 -0.125) 4.371 15.654 ( -1.687 -0.000 1.287) 2.122 16.245 ( -4.032 -0.000 9.410) 10.238 16.523 ( -6.961 -0.000 7.780) 10.440 17.672 ( -15.193 -0.000 -9.307) 17.817 20.724 ( 2.978 0.000 1.229) 3.222 21.701 ( 5.962 0.000 -3.914) 7.132 22.047 ( 11.594 0.000 -3.147) 12.013 22.407 ( 3.137 0.000 3.187) 4.472 ======================= Grid point 242 (115/227) ======================= q-point: (-0.60 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( -2.833 8.909 -3.315) 9.919 1.939 ( -5.273 -5.524 -3.729) 8.499 2.758 ( 3.706 0.525 -3.701) 5.264 2.986 ( 1.912 1.704 0.238) 2.572 3.207 ( -13.408 -0.378 -1.762) 13.529 3.572 ( -7.629 4.237 2.470) 9.069 3.655 ( 4.234 4.069 -3.601) 6.888 4.066 ( 2.483 0.216 7.288) 7.702 4.229 ( -1.728 -5.259 7.357) 9.207 4.354 ( 6.924 1.194 3.514) 7.856 4.501 ( 9.118 -1.995 -6.812) 11.555 5.024 ( 10.142 0.031 -3.949) 10.884 5.345 ( 7.267 0.690 -0.676) 7.331 6.100 ( -5.666 0.149 3.557) 6.692 6.277 ( 5.571 -0.901 0.248) 5.649 6.444 ( -2.779 2.184 19.866) 20.178 7.898 ( 6.527 -1.340 0.197) 6.666 7.940 ( -5.065 3.172 2.784) 6.593 8.102 ( 0.456 -2.217 5.541) 5.986 8.948 ( -4.090 0.343 -11.055) 11.792 9.699 ( 3.577 3.757 -21.741) 22.351 9.758 ( -1.481 -3.465 -19.722) 20.079 10.221 ( 4.603 -0.792 1.865) 5.029 10.818 ( 1.773 -1.920 21.284) 21.444 10.894 ( 4.108 -2.005 4.525) 6.432 11.052 ( 3.505 1.175 -4.134) 5.546 11.732 ( -1.548 10.683 1.224) 10.863 11.978 ( -2.150 -11.355 5.095) 12.630 12.719 ( -5.348 -1.807 -5.493) 7.876 13.068 ( -13.471 3.106 -12.348) 18.536 13.341 ( -15.347 -3.313 2.515) 15.901 14.043 ( 1.489 0.360 1.496) 2.141 14.115 ( 1.258 2.113 -4.874) 5.459 14.311 ( 9.430 -0.525 2.695) 9.821 14.505 ( 1.290 -2.420 2.365) 3.621 15.511 ( 3.678 -0.492 5.332) 6.496 15.577 ( -0.997 -1.746 -7.026) 7.308 15.671 ( 2.088 -1.504 7.635) 8.057 16.148 ( -5.076 3.548 10.574) 12.254 16.433 ( -6.875 -3.382 5.014) 9.156 17.396 ( -16.056 2.325 -5.888) 17.259 20.786 ( 1.968 -3.241 1.709) 4.159 21.755 ( 2.473 3.069 -0.850) 4.032 22.201 ( 9.744 4.115 -4.359) 11.441 22.501 ( 6.510 -2.809 -0.880) 7.145 ======================= Grid point 243 (116/227) ======================= q-point: (-0.50 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -5.055 7.296 -5.190) 10.282 1.921 ( -0.098 -1.212 -1.916) 2.269 2.797 ( 2.188 0.900 -5.164) 5.680 2.909 ( -10.249 7.392 1.471) 12.722 3.039 ( -3.209 -1.827 1.992) 4.195 3.461 ( -3.213 1.214 6.340) 7.211 3.642 ( 1.531 6.865 3.308) 7.773 4.019 ( -5.065 4.921 6.308) 9.469 4.309 ( 1.207 -11.468 8.223) 14.163 4.457 ( 7.685 1.998 -0.472) 7.954 4.662 ( 8.985 0.661 -5.934) 10.787 5.186 ( 7.499 2.821 -6.467) 10.297 5.414 ( 8.829 7.166 1.350) 11.451 6.024 ( -2.770 1.848 2.945) 4.445 6.343 ( -2.347 -1.807 -0.750) 3.056 6.366 ( -2.606 0.677 21.121) 21.292 7.791 ( -5.706 6.964 4.051) 9.873 8.061 ( 7.814 -3.562 -1.691) 8.753 8.127 ( 0.180 -1.399 4.190) 4.421 8.971 ( 5.082 -5.184 -7.825) 10.674 9.676 ( 0.171 0.460 -17.101) 17.108 9.798 ( 2.297 0.166 -19.945) 20.077 10.304 ( 3.911 -0.866 3.669) 5.432 10.805 ( -3.908 -2.878 15.240) 15.994 11.052 ( 8.968 -7.503 5.213) 12.802 11.127 ( 6.586 3.113 0.160) 7.286 11.665 ( 2.510 5.806 -0.826) 6.379 12.078 ( 0.706 -9.052 3.603) 9.768 12.598 ( -13.848 -5.453 -1.964) 15.012 12.834 ( -8.574 4.578 -17.750) 20.237 13.159 ( -11.346 -4.180 4.513) 12.906 14.006 ( -2.732 1.985 -3.218) 4.665 14.146 ( 2.374 0.289 0.903) 2.556 14.429 ( 5.783 1.452 1.905) 6.259 14.571 ( 2.017 -5.114 1.251) 5.638 15.519 ( -4.569 -1.511 -2.212) 5.297 15.657 ( 7.696 -3.063 2.581) 8.676 15.722 ( 2.319 -0.469 6.101) 6.543 16.047 ( -4.492 0.818 13.285) 14.048 16.366 ( -4.705 -2.514 1.005) 5.428 17.112 ( -14.553 3.507 -2.384) 15.158 20.844 ( 0.462 -4.007 2.040) 4.520 21.724 ( -0.472 5.749 1.636) 5.996 22.287 ( 7.620 6.143 -5.124) 11.048 22.654 ( 7.417 -3.681 -5.118) 9.734 ======================= Grid point 244 (117/227) ======================= q-point: (-0.40 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( -4.023 5.659 -5.018) 8.567 1.968 ( 6.034 1.599 -0.015) 6.243 2.620 ( -10.420 11.666 4.530) 16.285 2.830 ( 3.237 3.310 -4.818) 6.683 3.014 ( -5.398 -4.476 4.519) 8.342 3.421 ( 0.104 3.519 7.393) 8.189 3.583 ( 0.015 7.646 8.890) 11.726 3.869 ( -6.048 5.329 5.639) 9.837 4.441 ( 1.101 -8.469 6.538) 10.756 4.563 ( 9.249 4.624 -4.313) 11.204 4.771 ( 5.733 1.922 -2.669) 6.610 5.141 ( -1.029 9.897 -7.676) 12.567 5.551 ( 14.078 7.320 2.558) 16.072 5.958 ( -1.629 5.511 -0.964) 5.827 6.281 ( -7.375 -3.506 -0.303) 8.172 6.345 ( -2.566 -4.116 20.590) 21.154 7.607 ( -6.828 8.982 4.993) 12.338 8.147 ( 0.815 -1.455 3.384) 3.773 8.220 ( 6.571 -4.593 -3.327) 8.680 9.184 ( 10.380 -9.082 -5.028) 14.680 9.687 ( 4.247 4.522 -18.326) 19.347 9.824 ( -0.642 -6.096 -12.491) 13.914 10.358 ( 1.872 -0.652 3.571) 4.084 10.799 ( -1.727 -3.876 12.458) 13.161 11.191 ( 4.899 2.321 4.468) 7.025 11.344 ( 13.023 -12.615 3.247) 18.420 11.654 ( 1.866 5.200 -3.588) 6.588 12.131 ( -5.732 -6.022 -0.337) 8.320 12.411 ( -12.754 -5.639 -1.454) 14.020 12.674 ( -9.205 -0.814 -17.928) 20.169 13.098 ( 0.056 -3.878 7.672) 8.597 13.935 ( -2.553 2.775 -3.805) 5.357 14.169 ( 0.335 -0.275 0.698) 0.821 14.487 ( 3.334 1.295 1.257) 3.791 14.669 ( 1.760 -7.594 2.761) 8.270 15.426 ( -7.910 -1.073 1.253) 8.081 15.767 ( 2.839 0.013 0.431) 2.871 15.802 ( 5.403 -0.292 0.166) 5.414 16.007 ( -2.139 -3.882 22.948) 23.372 16.355 ( 1.623 -1.551 -3.008) 3.753 16.858 ( -11.183 4.587 0.001) 12.087 20.883 ( -0.724 -4.156 2.084) 4.706 21.639 ( -1.501 7.370 1.975) 7.777 22.332 ( 5.722 5.990 -4.556) 9.454 22.780 ( 3.833 -1.964 -9.142) 10.106 ======================= Grid point 245 (118/227) ======================= q-point: (-0.30 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( -0.428 4.285 -2.969) 5.231 2.070 ( 9.698 5.095 1.635) 11.077 2.352 ( -5.822 15.217 7.357) 17.877 2.794 ( -3.058 6.826 -1.092) 7.559 2.977 ( -3.378 -4.890 4.790) 7.634 3.382 ( 0.189 6.004 3.974) 7.202 3.503 ( -0.609 7.075 13.536) 15.286 3.758 ( -0.738 4.605 4.891) 6.758 4.475 ( 2.224 8.678 1.875) 9.153 4.655 ( 7.031 4.293 -3.387) 8.907 4.801 ( 1.590 3.037 1.784) 3.864 5.062 ( 0.290 2.158 -12.741) 12.926 5.670 ( 10.955 11.190 2.550) 15.866 5.802 ( -10.156 7.649 -7.536) 14.780 6.225 ( -1.700 -4.803 7.903) 9.403 6.414 ( -1.244 -12.413 17.075) 21.147 7.412 ( -5.863 7.938 3.340) 10.418 8.180 ( 0.596 -2.069 3.231) 3.883 8.363 ( 4.593 -5.562 -4.403) 8.451 9.424 ( 9.287 -5.246 -5.382) 11.948 9.692 ( 4.534 7.082 -19.204) 20.965 9.897 ( -3.118 -12.532 -4.780) 13.771 10.418 ( 5.059 -1.727 3.467) 6.371 10.819 ( -1.954 -4.486 11.220) 12.241 11.214 ( -0.145 3.926 5.138) 6.468 11.557 ( -5.117 -3.232 -2.496) 6.546 11.729 ( 10.469 -9.031 -2.014) 13.972 11.980 ( -12.765 0.852 -2.104) 12.965 12.386 ( 1.506 -8.159 -0.619) 8.320 12.551 ( -7.446 -6.513 -12.521) 15.958 13.229 ( 8.004 -5.708 4.929) 10.998 13.872 ( -1.279 2.826 -4.391) 5.376 14.158 ( -1.940 0.096 -1.254) 2.312 14.521 ( 1.440 -0.141 1.300) 1.946 14.775 ( -0.148 -10.265 6.793) 12.310 15.307 ( -5.691 1.527 5.772) 8.248 15.764 ( -5.004 -0.591 4.319) 6.637 15.860 ( 4.881 -0.399 -3.478) 6.007 16.085 ( 4.832 -2.323 17.226) 18.042 16.412 ( 1.165 0.913 1.955) 2.452 16.704 ( 0.284 2.190 -0.081) 2.209 20.912 ( -0.954 -4.711 1.767) 5.121 21.541 ( -0.912 7.769 0.568) 7.843 22.355 ( 3.973 4.732 -2.836) 6.798 22.775 ( -4.412 3.116 -12.694) 13.795 ======================= Grid point 246 (119/227) ======================= q-point: (-0.20 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( -0.159 4.396 1.160) 4.549 2.093 ( -1.974 15.178 12.012) 19.457 2.197 ( 10.128 12.213 3.599) 16.269 2.661 ( -2.722 4.065 -1.860) 5.234 3.003 ( 2.456 -0.853 4.258) 4.989 3.294 ( -4.300 4.901 2.943) 7.153 3.462 ( 3.149 5.988 11.846) 13.642 3.756 ( 4.642 3.928 3.790) 7.165 4.378 ( 6.395 21.588 -0.752) 22.528 4.648 ( -2.790 6.988 -5.526) 9.335 4.779 ( -0.842 2.132 1.938) 3.002 5.083 ( 2.102 -2.424 -11.853) 12.279 5.491 ( -12.507 7.785 -1.833) 14.845 5.742 ( 8.325 9.117 -1.380) 12.423 6.291 ( -0.658 -6.741 14.069) 15.615 6.542 ( -0.815 -14.674 12.189) 19.093 7.302 ( 0.403 2.980 -1.869) 3.541 8.201 ( -0.896 -1.882 4.207) 4.695 8.461 ( 0.678 -4.819 -7.067) 8.581 9.578 ( 7.371 1.504 -9.011) 11.738 9.689 ( 3.465 4.301 -15.910) 16.842 9.923 ( -8.817 -12.405 -2.462) 15.418 10.541 ( 3.626 -2.777 8.331) 9.501 10.820 ( -4.946 -5.082 6.581) 9.675 11.099 ( -5.229 6.079 1.711) 8.199 11.486 ( -2.093 2.473 -3.107) 4.489 11.645 ( -16.702 1.110 -3.030) 17.011 11.994 ( -1.291 -13.027 0.912) 13.123 12.588 ( 3.468 -8.947 -2.504) 9.917 12.628 ( 14.037 -10.066 -3.008) 17.533 13.425 ( 6.985 -6.846 -0.928) 9.825 13.835 ( -0.029 2.082 -5.500) 5.881 14.104 ( -3.628 1.099 -3.087) 4.889 14.531 ( -1.462 -1.399 1.780) 2.695 14.862 ( -4.506 -12.432 11.582) 17.579 15.247 ( 1.022 2.239 8.437) 8.789 15.682 ( -5.696 -2.353 5.647) 8.359 15.950 ( 6.062 2.377 -2.962) 7.154 16.170 ( -0.102 -2.414 5.886) 6.363 16.361 ( 1.768 3.558 6.185) 7.352 16.862 ( 14.973 -3.036 3.718) 15.724 20.958 ( 0.215 -6.199 1.191) 6.316 21.464 ( 0.833 7.217 -2.029) 7.543 22.360 ( 0.663 3.335 -2.057) 3.974 22.539 ( -13.203 13.011 -11.871) 22.012 ======================= Grid point 247 (120/227) ======================= q-point: (-0.10 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 1.606 0.896 6.547) 6.801 1.901 ( 0.022 15.332 16.903) 22.821 2.291 ( 14.644 12.152 -0.045) 19.030 2.638 ( 0.186 -1.038 -8.976) 9.038 3.095 ( 9.001 0.581 5.978) 10.820 3.164 ( -4.700 5.201 6.033) 9.249 3.482 ( 5.812 5.832 6.616) 10.563 3.794 ( 4.596 5.927 0.758) 7.539 4.294 ( 11.303 22.339 0.554) 25.042 4.447 ( -10.565 5.495 -8.893) 14.863 4.730 ( -3.548 1.518 2.868) 4.808 5.126 ( -0.653 -1.778 -6.584) 6.851 5.271 ( -5.390 7.176 2.438) 9.300 5.792 ( 7.355 5.130 -5.643) 10.595 6.302 ( -4.376 -3.092 21.122) 21.791 6.675 ( -1.420 -13.562 6.876) 15.272 7.377 ( 6.767 -4.684 -7.254) 10.971 8.186 ( -3.196 -1.279 4.971) 6.046 8.463 ( -4.047 -1.638 -8.862) 9.880 9.611 ( 3.250 7.095 -12.243) 14.518 9.728 ( 4.956 1.354 -11.829) 12.897 9.872 ( -12.570 -12.904 -5.182) 18.745 10.468 ( -14.540 -0.796 6.372) 15.895 10.778 ( -2.185 0.454 9.107) 9.376 10.993 ( -3.890 3.600 1.124) 5.418 11.370 ( -7.396 7.011 -4.410) 11.104 11.529 ( 4.359 -5.445 -4.022) 8.051 12.069 ( -5.033 -14.157 3.910) 15.525 12.731 ( 1.336 -8.853 3.276) 9.533 12.983 ( 16.150 -6.853 -3.452) 17.880 13.575 ( 5.024 -3.949 -3.641) 7.355 13.826 ( 0.851 0.454 -5.473) 5.558 14.027 ( -3.005 2.331 -3.988) 5.511 14.494 ( -4.937 -0.935 2.454) 5.592 14.865 ( -7.834 -7.702 14.406) 18.116 15.275 ( 1.526 -0.239 6.536) 6.716 15.654 ( -2.693 -4.852 3.295) 6.454 15.962 ( 1.028 7.134 2.086) 7.503 16.139 ( -3.020 -2.582 -2.795) 4.858 16.504 ( 9.848 -6.304 6.739) 13.496 17.196 ( 19.031 -6.840 3.975) 20.610 21.052 ( 2.317 -8.359 0.691) 8.702 21.425 ( 3.281 7.272 -6.240) 10.128 22.015 ( -20.400 22.697 -8.970) 31.809 22.394 ( 1.766 3.395 2.958) 4.837 ======================= Grid point 252 (121/227) ======================= q-point: ( 0.40 -0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( -8.770 -0.000 -6.174) 10.726 1.889 ( 3.438 0.000 -3.269) 4.743 2.797 ( -0.832 -0.000 -5.194) 5.260 2.991 ( -10.380 -0.000 0.917) 10.420 3.003 ( -0.325 -0.000 1.949) 1.975 3.474 ( -4.881 -0.000 3.497) 6.005 3.766 ( 4.223 0.000 -0.808) 4.300 4.104 ( -7.975 -0.000 7.993) 11.291 4.111 ( 3.352 0.000 15.551) 15.908 4.446 ( 4.127 0.000 5.516) 6.889 4.719 ( 14.414 0.000 -12.286) 18.940 5.199 ( 11.478 0.000 -8.330) 14.182 5.495 ( 9.193 0.000 0.636) 9.215 6.025 ( -3.635 -0.000 1.815) 4.063 6.332 ( 1.423 0.000 -0.403) 1.479 6.379 ( -7.558 -0.000 25.843) 26.925 7.871 ( -4.477 -0.000 2.639) 5.197 8.014 ( 7.810 0.000 -1.088) 7.886 8.112 ( 0.889 0.000 5.797) 5.865 8.925 ( 2.160 0.000 -8.319) 8.595 9.633 ( -4.529 -0.000 -14.914) 15.587 9.842 ( 6.305 0.000 -25.840) 26.598 10.300 ( 4.863 0.000 3.473) 5.976 10.776 ( -4.265 -0.000 22.662) 23.060 10.970 ( 7.508 0.000 1.648) 7.686 11.165 ( 6.592 0.000 -0.573) 6.617 11.757 ( -2.210 -0.000 0.491) 2.264 11.948 ( 4.810 0.000 2.770) 5.551 12.539 ( -13.702 -0.000 -3.077) 14.043 12.884 ( -11.129 -0.000 -20.476) 23.305 13.115 ( -9.726 -0.000 7.039) 12.006 14.025 ( -2.608 -0.000 -2.016) 3.296 14.151 ( 1.678 0.000 0.942) 1.924 14.444 ( 5.979 0.000 1.196) 6.097 14.520 ( 1.976 0.000 -0.269) 1.994 15.507 ( -4.769 -0.000 -3.989) 6.217 15.621 ( 9.264 0.000 6.820) 11.504 15.718 ( 3.062 0.000 5.065) 5.919 16.060 ( -7.666 -0.000 13.888) 15.863 16.337 ( -2.855 -0.000 -0.889) 2.990 17.151 ( -14.667 -0.000 -2.689) 14.911 20.802 ( 1.390 0.000 2.417) 2.788 21.782 ( -0.845 -0.000 2.539) 2.676 22.363 ( 7.290 0.000 -5.356) 9.046 22.602 ( 7.648 0.000 -5.064) 9.173 ======================= Grid point 254 (122/227) ======================= q-point: (-0.50 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( -5.699 3.287 -6.012) 8.912 1.976 ( 6.783 -0.318 -3.530) 7.653 2.681 ( -11.635 -1.985 -2.887) 12.151 2.913 ( 1.177 4.056 0.279) 4.232 2.991 ( -1.482 0.312 5.467) 5.673 3.444 ( 0.770 -0.057 2.173) 2.306 3.769 ( 1.554 7.947 5.184) 9.615 3.962 ( -5.695 4.122 7.929) 10.597 4.223 ( 1.422 -9.970 15.398) 18.399 4.531 ( 4.643 -2.875 3.202) 6.330 4.896 ( 11.204 4.951 -13.165) 17.982 5.336 ( 6.613 6.378 -8.396) 12.446 5.636 ( 10.007 2.114 2.155) 10.453 5.990 ( -1.581 -1.837 1.502) 2.851 6.236 ( -8.661 1.552 19.551) 21.440 6.319 ( -4.685 -1.455 5.600) 7.445 7.769 ( -5.243 5.789 3.981) 8.767 8.111 ( 0.079 -2.605 2.542) 3.641 8.160 ( 6.523 -0.647 0.754) 6.598 9.037 ( 9.491 -4.314 -6.190) 12.125 9.599 ( -2.207 -5.307 -11.434) 12.797 9.886 ( 3.136 4.539 -24.015) 24.641 10.364 ( 3.031 0.524 1.973) 3.654 10.746 ( -1.007 -1.391 20.939) 21.009 11.133 ( 7.985 -4.978 1.689) 9.560 11.249 ( 4.953 0.802 3.792) 6.290 11.751 ( 4.529 3.645 -1.439) 5.989 12.005 ( -2.850 -4.827 -2.774) 6.254 12.314 ( -14.271 -3.087 -1.363) 14.664 12.682 ( -12.099 0.631 -23.829) 26.732 13.046 ( 0.289 -1.321 11.036) 11.118 13.974 ( -2.670 1.039 -2.178) 3.599 14.167 ( 0.161 -0.017 1.612) 1.620 14.505 ( 2.059 0.510 0.596) 2.203 14.569 ( 2.405 -2.490 -1.093) 3.630 15.420 ( -5.540 0.042 1.335) 5.699 15.770 ( 3.466 0.163 -0.126) 3.472 15.795 ( 8.669 -0.351 2.702) 9.087 15.949 ( -5.161 -1.594 19.910) 20.630 16.331 ( 1.746 -0.709 -3.828) 4.266 16.926 ( -11.365 1.885 0.120) 11.521 20.823 ( -0.006 -1.584 2.793) 3.211 21.740 ( -2.575 2.559 4.012) 5.411 22.435 ( 4.252 3.469 -5.841) 8.015 22.728 ( 5.639 -2.293 -7.702) 9.817 ======================= Grid point 255 (123/227) ======================= q-point: (-0.40 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -0.720 4.303 -5.436) 6.970 2.112 ( 9.880 0.108 -3.766) 10.574 2.515 ( -9.436 0.289 0.912) 9.484 2.898 ( 0.880 3.565 -2.129) 4.245 2.950 ( -1.291 3.045 8.863) 9.460 3.462 ( 1.285 2.551 -0.002) 2.856 3.682 ( -0.920 9.203 9.797) 13.473 3.860 ( -0.810 5.460 8.000) 9.720 4.349 ( 0.320 -10.727 10.156) 14.776 4.656 ( 5.723 -4.670 1.198) 7.483 4.990 ( 8.198 6.958 -12.411) 16.421 5.265 ( 1.227 16.681 -4.006) 17.199 5.768 ( 5.582 -0.231 2.294) 6.039 5.980 ( -1.545 6.242 0.629) 6.461 6.091 ( -9.408 -4.905 4.280) 11.441 6.256 ( -4.252 -4.442 17.490) 18.539 7.593 ( -6.258 9.338 3.898) 11.898 8.132 ( -0.977 -3.555 4.436) 5.768 8.275 ( 4.974 -2.526 -2.134) 5.973 9.283 ( 11.852 -6.922 -4.643) 14.489 9.648 ( -1.292 -9.859 -7.601) 12.516 9.857 ( 2.164 6.904 -21.069) 22.277 10.411 ( 4.334 0.407 0.162) 4.356 10.761 ( -0.931 -1.500 17.915) 18.002 11.267 ( 2.587 -1.535 5.138) 5.954 11.328 ( -0.533 -7.420 2.363) 7.805 11.787 ( 3.113 5.999 -5.342) 8.616 11.951 ( -7.176 -3.064 -1.463) 7.939 12.222 ( 0.029 -7.620 -0.242) 7.623 12.474 ( -11.338 -1.573 -22.741) 25.460 13.136 ( 6.053 -3.374 9.364) 11.649 13.921 ( -1.752 1.901 -2.171) 3.376 14.157 ( -1.593 -0.136 0.265) 1.621 14.513 ( -0.687 -0.327 0.880) 1.163 14.638 ( 1.810 -4.033 -0.128) 4.422 15.337 ( -3.489 1.284 6.340) 7.350 15.759 ( -7.075 -0.097 5.781) 9.136 15.854 ( 6.050 -0.231 -4.975) 7.836 16.054 ( 9.448 -0.853 15.745) 18.382 16.399 ( 4.460 -1.540 -1.320) 4.900 16.757 ( -5.377 2.534 0.654) 5.980 20.835 ( -1.134 -2.727 2.703) 4.004 21.661 ( -2.748 4.152 3.414) 6.037 22.442 ( 1.574 3.600 -4.984) 6.346 22.794 ( 0.254 -0.487 -9.420) 9.436 ======================= Grid point 256 (124/227) ======================= q-point: (-0.30 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 1.827 5.242 -3.908) 6.788 2.283 ( 11.305 1.790 -4.554) 12.318 2.363 ( -5.614 5.067 4.777) 8.945 2.801 ( -4.517 7.818 1.315) 9.124 2.966 ( 4.649 0.441 4.161) 6.255 3.396 ( -4.219 5.298 1.240) 6.885 3.618 ( 4.195 8.521 7.936) 12.377 3.837 ( 3.484 4.186 6.865) 8.763 4.442 ( -1.134 -7.690 5.327) 9.423 4.780 ( 3.800 -0.214 0.494) 3.838 5.014 ( 5.546 9.941 -9.157) 14.609 5.106 ( 0.337 13.803 -3.885) 14.343 5.663 ( -14.420 8.118 -3.303) 16.875 5.886 ( 3.754 4.454 3.085) 6.592 6.097 ( -2.733 -9.615 5.676) 11.495 6.303 ( -0.873 -9.706 18.148) 20.598 7.418 ( -3.301 8.172 0.811) 8.851 8.150 ( -1.995 -4.083 5.023) 6.774 8.365 ( 1.957 -3.954 -3.290) 5.503 9.500 ( 5.806 -6.361 -6.051) 10.525 9.717 ( -2.024 -8.069 -3.955) 9.211 9.822 ( 3.364 6.789 -19.411) 20.837 10.506 ( 5.120 -0.877 3.146) 6.073 10.744 ( -3.700 -2.454 11.268) 12.111 11.230 ( -2.821 6.510 3.041) 7.719 11.349 ( -8.663 -11.673 -1.760) 14.642 11.704 ( -6.949 3.924 -2.770) 8.447 11.870 ( -4.024 -2.050 1.972) 4.928 12.394 ( -2.444 -8.605 -12.983) 15.766 12.468 ( 18.213 -6.479 -2.886) 19.546 13.289 ( 6.096 -6.196 4.182) 9.646 13.878 ( -1.030 2.123 -2.555) 3.478 14.118 ( -2.835 0.344 -1.417) 3.188 14.493 ( -3.212 -1.953 1.744) 4.144 14.700 ( 0.222 -4.661 2.638) 5.361 15.294 ( -0.066 2.066 8.138) 8.396 15.646 ( -7.046 -1.329 6.752) 9.849 15.981 ( 9.429 0.780 -7.453) 12.044 16.172 ( 4.084 2.395 8.854) 10.040 16.434 ( -0.086 2.462 6.982) 7.404 16.791 ( 10.282 -3.410 -0.362) 10.839 20.850 ( -1.240 -4.379 2.127) 5.024 21.580 ( -1.707 4.557 1.390) 5.060 22.415 ( -1.397 2.060 -3.689) 4.450 22.717 ( -6.399 5.428 -9.401) 12.601 ======================= Grid point 257 (125/227) ======================= q-point: (-0.20 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 0.246 6.820 -0.290) 6.831 2.190 ( -2.921 11.651 9.895) 15.563 2.473 ( 12.049 1.913 -6.818) 13.976 2.659 ( -2.846 6.451 -3.519) 7.880 3.073 ( 7.882 0.013 2.866) 8.387 3.265 ( -4.302 4.350 5.687) 8.353 3.636 ( 7.687 8.609 2.813) 11.879 3.881 ( 5.372 3.271 3.688) 7.291 4.452 ( -5.231 -2.204 1.297) 5.823 4.698 ( -5.848 9.929 -6.904) 13.433 4.906 ( 0.776 18.277 6.112) 19.287 5.091 ( 2.117 -1.660 -7.376) 7.852 5.406 ( -4.753 6.799 0.973) 8.353 5.889 ( 0.437 2.806 -1.881) 3.406 6.159 ( -2.371 -9.457 11.201) 14.850 6.410 ( -0.551 -12.581 14.288) 19.045 7.353 ( 2.436 2.629 -3.461) 4.982 8.141 ( -4.739 -4.085 5.071) 8.054 8.406 ( -1.297 -3.291 -3.961) 5.311 9.579 ( -6.117 -10.279 -7.600) 14.172 9.735 ( 1.522 2.599 -8.683) 9.190 9.820 ( 4.502 4.952 -14.144) 15.648 10.461 ( -11.511 0.153 7.765) 13.886 10.761 ( 1.255 -1.587 5.655) 6.006 11.114 ( -2.535 7.085 0.170) 7.527 11.334 ( -4.271 -11.371 -3.721) 12.704 11.505 ( -8.938 5.713 -7.256) 12.852 11.883 ( 0.247 -4.867 7.312) 8.788 12.515 ( 2.375 -12.093 -0.852) 12.353 12.856 ( 20.097 -5.408 -4.454) 21.284 13.458 ( 6.121 -7.215 0.041) 9.462 13.840 ( -1.551 1.096 -2.302) 2.985 14.066 ( -1.922 1.481 -2.916) 3.793 14.449 ( -5.518 -3.092 2.856) 6.941 14.738 ( -1.546 -4.407 6.044) 7.638 15.295 ( 1.832 1.664 6.725) 7.166 15.577 ( -3.812 -2.787 4.512) 6.532 16.104 ( 5.688 1.653 -8.272) 10.174 16.129 ( -2.671 6.390 6.010) 9.170 16.456 ( 5.789 0.706 8.480) 10.291 17.078 ( 16.461 -6.093 2.229) 17.694 20.895 ( 0.006 -6.984 1.267) 7.098 21.525 ( 0.364 3.798 -1.401) 4.064 22.303 ( -11.487 5.534 -7.491) 14.788 22.518 ( -4.062 9.239 -1.811) 10.253 ======================= Grid point 258 (126/227) ======================= q-point: (-0.10 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( 1.391 2.083 3.678) 4.450 2.071 ( 2.642 10.862 8.834) 14.248 2.577 ( 0.688 5.986 -4.697) 7.640 2.629 ( 8.041 0.687 -10.750) 13.443 3.113 ( -1.954 1.143 5.695) 6.129 3.307 ( 12.657 1.653 4.525) 13.543 3.680 ( 7.311 8.364 -3.076) 11.527 3.917 ( 3.220 5.309 1.875) 6.486 4.265 ( -13.636 2.397 -4.867) 14.675 4.561 ( 0.417 6.591 -5.897) 8.854 4.754 ( -0.918 11.476 11.876) 16.540 5.092 ( -2.888 1.554 -3.441) 4.753 5.339 ( 2.964 7.504 3.082) 8.637 5.865 ( -0.632 -0.522 -3.159) 3.263 6.200 ( -2.528 -5.583 17.498) 18.541 6.549 ( 1.046 -12.099 5.580) 13.365 7.423 ( 4.587 -3.565 -5.648) 8.102 8.070 ( -9.193 -4.300 3.942) 10.888 8.392 ( -2.096 -0.395 -1.932) 2.878 9.520 ( -12.419 -10.194 -9.439) 18.634 9.703 ( 0.296 5.981 -11.574) 13.032 9.860 ( 6.072 3.885 -13.308) 15.135 10.247 ( -11.393 1.371 1.066) 11.524 10.726 ( -5.878 0.984 11.837) 13.253 11.016 ( -0.607 6.989 -1.311) 7.137 11.310 ( -5.811 3.803 -3.575) 7.811 11.471 ( 1.259 -13.257 -9.022) 16.085 11.979 ( 5.325 -5.597 7.869) 11.027 12.642 ( -1.081 -8.490 4.788) 9.807 13.184 ( 14.240 -3.180 -3.907) 15.105 13.628 ( 6.912 -5.259 -1.086) 8.753 13.806 ( -2.697 -1.155 -0.374) 2.958 14.041 ( 1.995 2.214 -4.937) 5.767 14.371 ( -7.760 -2.252 3.569) 8.833 14.736 ( -3.139 -2.025 8.766) 9.529 15.316 ( 2.460 1.405 4.580) 5.385 15.577 ( -1.336 -3.736 2.037) 4.460 16.005 ( -4.530 3.504 3.894) 6.925 16.127 ( 1.818 5.647 -5.609) 8.165 16.593 ( 6.924 -4.090 7.208) 10.800 17.400 ( 13.978 -6.422 1.379) 15.445 20.996 ( 1.932 -9.696 0.515) 9.900 21.521 ( 3.281 2.525 -4.874) 6.395 21.917 ( -16.656 17.927 -7.144) 25.492 22.442 ( 0.006 3.231 4.023) 5.160 ======================= Grid point 264 (127/227) ======================= q-point: (-0.50 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( -0.981 -0.000 -5.859) 5.941 2.108 ( 9.446 -0.000 -4.681) 10.542 2.487 ( -9.758 -0.000 -1.584) 9.886 2.950 ( 0.284 -0.000 -0.209) 0.353 2.987 ( 0.428 -0.000 8.556) 8.566 3.488 ( 3.362 -0.000 -0.590) 3.413 3.790 ( -2.517 -0.000 1.265) 2.816 3.955 ( -0.034 0.000 8.126) 8.126 4.190 ( 0.683 -0.000 19.043) 19.055 4.600 ( 5.798 -0.000 2.705) 6.398 5.054 ( 6.119 -0.000 -13.001) 14.369 5.471 ( 3.520 -0.000 -6.821) 7.676 5.774 ( 5.672 -0.000 4.129) 7.016 5.934 ( -3.230 -0.000 3.377) 4.673 6.137 ( -5.415 -0.000 23.803) 24.411 6.195 ( -9.014 0.000 -2.593) 9.380 7.715 ( -5.692 -0.000 3.804) 6.846 8.070 ( -2.917 0.000 5.304) 6.053 8.256 ( 4.899 -0.000 -1.002) 5.001 9.205 ( 13.960 -0.000 -5.202) 14.897 9.538 ( -1.191 -0.000 -8.452) 8.536 9.936 ( 1.329 -0.000 -23.234) 23.272 10.416 ( 3.620 -0.000 -0.807) 3.709 10.749 ( -0.123 -0.000 21.931) 21.931 11.180 ( 0.513 -0.000 2.309) 2.365 11.319 ( 3.408 -0.000 6.731) 7.544 11.881 ( -7.582 -0.000 -5.245) 9.219 11.895 ( 4.340 0.000 -4.382) 6.168 12.126 ( -0.327 -0.000 0.998) 1.051 12.463 ( -13.173 -0.000 -25.858) 29.020 13.101 ( 5.171 -0.000 11.054) 12.204 13.942 ( -1.814 -0.000 -1.306) 2.235 14.155 ( -1.576 0.000 0.833) 1.782 14.511 ( -1.472 -0.000 0.559) 1.575 14.598 ( 2.719 0.000 -2.347) 3.592 15.351 ( -3.033 -0.000 6.648) 7.307 15.758 ( -8.426 -0.000 7.132) 11.039 15.851 ( 6.864 -0.000 -6.033) 9.139 16.047 ( 12.264 -0.000 15.107) 19.458 16.379 ( 4.149 -0.000 -3.062) 5.157 16.785 ( -6.661 -0.000 1.256) 6.779 20.807 ( -1.161 -0.000 3.103) 3.314 21.704 ( -3.307 -0.000 4.416) 5.517 22.482 ( -0.079 -0.000 -6.451) 6.452 22.784 ( 2.494 -0.000 -7.758) 8.149 ======================= Grid point 266 (128/227) ======================= q-point: (-0.40 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 2.991 2.778 -5.756) 7.057 2.270 ( 9.435 -1.156 -5.414) 10.939 2.371 ( -5.754 -1.950 -0.924) 6.145 2.922 ( -1.497 3.987 0.965) 4.367 3.014 ( 4.453 1.906 7.884) 9.253 3.491 ( -2.431 3.085 -1.280) 4.131 3.763 ( 2.935 4.426 1.127) 5.429 3.936 ( 2.124 5.678 8.053) 10.080 4.257 ( 0.205 -8.634 11.642) 14.496 4.728 ( 8.092 -2.552 2.242) 8.776 5.093 ( 0.492 2.456 -9.879) 10.192 5.426 ( -1.828 9.052 -2.318) 9.521 5.768 ( -5.372 3.772 3.350) 7.369 5.905 ( -7.406 -3.256 5.515) 9.791 6.021 ( -0.761 2.991 2.035) 3.697 6.138 ( -3.528 -6.787 13.824) 15.800 7.589 ( -4.627 6.977 2.341) 8.693 8.037 ( -4.872 -5.519 5.988) 9.490 8.314 ( 1.585 -1.290 -1.403) 2.479 9.434 ( 10.141 0.671 -5.612) 11.610 9.562 ( 2.385 -6.757 -5.906) 9.286 9.929 ( 1.456 3.068 -20.563) 20.842 10.495 ( 5.233 -0.357 -2.045) 5.630 10.718 ( -4.665 -0.337 15.967) 16.638 11.160 ( -6.239 -5.102 0.549) 8.078 11.350 ( 1.697 3.846 7.435) 8.541 11.767 ( -5.339 2.503 -0.394) 5.910 11.824 ( -6.732 -2.944 0.549) 7.368 12.274 ( -8.580 -3.083 -21.370) 23.233 12.378 ( 21.712 -2.272 -4.605) 22.311 13.197 ( 4.507 -2.564 6.994) 8.707 13.912 ( -1.278 1.023 -0.857) 1.848 14.121 ( -2.356 0.023 -0.359) 2.383 14.464 ( -4.547 -0.805 1.320) 4.803 14.645 ( 2.024 -1.198 -1.651) 2.874 15.323 ( -0.442 0.751 8.124) 8.170 15.627 ( -7.567 -0.506 7.336) 10.552 15.990 ( 9.778 0.201 -9.127) 13.378 16.234 ( 9.922 2.691 11.708) 15.582 16.441 ( 1.826 -1.141 4.445) 4.939 16.749 ( 4.022 -0.749 -1.854) 4.492 20.789 ( -2.054 -1.594 2.868) 3.871 21.644 ( -2.863 1.709 3.060) 4.526 22.442 ( -3.769 0.646 -5.841) 6.981 22.782 ( -2.083 1.421 -6.787) 7.241 ======================= Grid point 267 (129/227) ======================= q-point: (-0.30 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 2.824 6.054 -4.583) 8.101 2.302 ( -3.922 -0.065 3.830) 5.483 2.430 ( 6.074 -3.333 -10.110) 12.256 2.838 ( 1.003 9.361 2.390) 9.713 3.117 ( 10.091 2.278 3.124) 10.806 3.360 ( -6.877 5.280 2.415) 9.000 3.790 ( 6.102 5.459 -1.886) 8.401 3.949 ( 5.386 4.691 5.865) 9.242 4.338 ( -1.852 -7.734 4.337) 9.058 4.849 ( 1.517 4.707 2.781) 5.674 5.044 ( -0.456 -1.117 -6.343) 6.456 5.251 ( -6.959 12.061 -0.962) 13.958 5.549 ( -8.375 6.730 -1.842) 10.901 5.859 ( -2.948 -4.143 6.934) 8.598 6.038 ( 0.238 -2.156 1.640) 2.719 6.176 ( -2.784 -9.996 17.045) 19.955 7.464 ( -0.924 7.442 -0.603) 7.523 8.010 ( -7.708 -8.280 5.747) 12.689 8.340 ( -0.946 -3.242 -1.052) 3.537 9.468 ( -1.923 -0.208 -6.978) 7.241 9.718 ( 5.448 -3.611 -7.502) 9.950 9.931 ( 5.028 4.621 -16.798) 18.133 10.469 ( -10.429 0.423 5.626) 11.858 10.726 ( 5.158 -1.750 2.357) 5.934 11.082 ( -9.798 -6.994 -4.606) 12.889 11.326 ( 4.059 8.149 7.842) 12.016 11.598 ( -10.831 3.159 -4.200) 12.039 11.821 ( 1.424 -2.102 5.800) 6.331 12.277 ( 0.667 -10.571 -7.975) 13.258 12.775 ( 22.919 -2.549 -5.464) 23.699 13.317 ( 5.139 -5.962 2.768) 8.343 13.869 ( -2.629 1.554 -0.365) 3.076 14.086 ( -1.190 0.606 -1.661) 2.131 14.388 ( -6.732 -2.599 2.357) 7.592 14.683 ( 1.061 -1.397 0.826) 1.939 15.325 ( 1.483 1.143 6.226) 6.502 15.537 ( -4.637 -1.298 5.372) 7.214 16.108 ( 3.093 0.323 -9.011) 9.533 16.297 ( 5.879 8.262 7.568) 12.653 16.482 ( 3.449 0.669 10.323) 10.905 16.950 ( 14.746 -5.908 -2.436) 16.071 20.782 ( -1.985 -4.020 2.141) 4.968 21.587 ( -1.398 2.348 0.541) 2.786 22.344 ( -7.813 0.312 -5.221) 9.402 22.679 ( -5.337 5.647 -4.048) 8.761 ======================= Grid point 268 (130/227) ======================= q-point: (-0.20 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 0.031 8.966 -1.233) 9.050 2.229 ( -2.339 4.022 5.190) 6.970 2.511 ( -1.004 -5.448 -10.804) 12.141 2.821 ( 9.076 11.375 -1.742) 14.656 3.161 ( -3.999 4.659 1.269) 6.270 3.336 ( 11.872 0.491 5.283) 13.003 3.841 ( 6.577 6.506 -6.026) 11.041 3.993 ( 3.729 3.456 1.722) 5.367 4.295 ( -10.571 -0.754 0.044) 10.598 4.688 ( -4.877 7.850 -2.802) 9.657 4.977 ( -8.170 8.604 9.177) 15.000 5.128 ( 2.670 2.027 -4.563) 5.662 5.434 ( -2.341 1.793 0.397) 2.975 5.851 ( -1.884 -1.399 4.727) 5.278 6.068 ( -1.539 -6.050 3.696) 7.255 6.282 ( 1.298 -13.238 14.529) 19.698 7.420 ( 1.744 3.036 -3.415) 4.892 7.942 ( -11.157 -8.400 4.721) 14.742 8.352 ( -1.847 -3.747 0.520) 4.210 9.406 ( -5.438 -0.359 -8.293) 9.924 9.768 ( -0.205 -0.163 -11.302) 11.305 9.972 ( 6.189 7.000 -15.312) 17.937 10.270 ( -10.488 0.665 2.759) 10.865 10.756 ( -3.914 2.033 7.430) 8.640 11.046 ( -2.084 -6.781 -11.106) 13.178 11.348 ( 5.445 6.462 6.742) 10.810 11.397 ( -7.165 2.537 -5.637) 9.463 11.895 ( 4.385 -3.168 7.045) 8.882 12.432 ( 2.656 -11.729 1.588) 12.130 13.138 ( 18.078 -1.530 -5.188) 18.869 13.489 ( 7.010 -7.837 0.707) 10.538 13.798 ( -4.434 0.476 0.541) 4.492 14.075 ( 1.262 1.208 -3.194) 3.641 14.304 ( -7.527 -3.883 3.127) 9.029 14.710 ( 0.791 -0.618 3.806) 3.936 15.348 ( 2.544 1.515 4.334) 5.248 15.512 ( -0.921 -2.523 2.921) 3.968 16.056 ( -5.357 2.452 -2.239) 6.303 16.309 ( 5.278 10.283 1.260) 11.627 16.552 ( 5.080 -0.318 8.731) 10.106 17.274 ( 15.210 -6.575 -0.958) 16.598 20.818 ( -0.574 -7.595 1.122) 7.699 21.561 ( 1.010 1.747 -2.392) 3.129 22.145 ( -13.530 5.257 -6.075) 15.735 22.536 ( -3.424 5.830 1.318) 6.889 ======================= Grid point 269 (131/227) ======================= q-point: (-0.10 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 0.407 4.931 1.910) 5.304 2.172 ( 0.058 3.515 2.734) 4.454 2.527 ( -1.827 -4.344 -8.166) 9.428 2.824 ( 3.447 10.120 -4.988) 11.797 3.126 ( 3.980 0.361 4.959) 6.369 3.541 ( 10.870 1.187 -0.890) 10.971 3.773 ( -7.281 6.762 -11.003) 14.826 3.982 ( -1.876 1.510 0.895) 2.569 4.145 ( 0.498 3.823 1.944) 4.317 4.600 ( 0.225 6.173 -3.549) 7.125 4.802 ( -5.381 4.579 8.305) 10.904 5.089 ( -1.674 6.427 -2.378) 7.055 5.389 ( -3.716 -1.947 1.924) 4.615 5.859 ( 2.699 -0.038 7.017) 7.518 6.093 ( -4.289 -7.303 10.422) 13.429 6.477 ( 4.818 -11.394 5.614) 13.585 7.442 ( 0.633 -3.433 -5.859) 6.820 7.839 ( -9.411 -6.403 3.827) 12.009 8.354 ( -2.087 -2.762 2.893) 4.512 9.298 ( -7.022 0.522 -10.256) 12.441 9.730 ( -2.039 2.966 -10.911) 11.490 9.936 ( -2.766 3.310 -13.999) 14.649 10.186 ( 2.659 3.076 -7.995) 8.970 10.641 ( -5.902 1.672 10.624) 12.268 11.056 ( -0.547 1.892 -6.466) 6.759 11.256 ( -3.812 1.385 -1.435) 4.302 11.429 ( 3.821 0.614 2.449) 4.580 12.046 ( 8.060 -6.343 2.264) 10.503 12.552 ( -0.233 -6.727 6.570) 9.406 13.361 ( 8.200 0.707 -3.946) 9.127 13.680 ( 6.152 -6.520 0.208) 8.967 13.740 ( -2.113 -2.191 1.903) 3.590 14.104 ( 2.933 0.193 -4.156) 5.091 14.221 ( -6.605 -2.238 2.351) 7.360 14.718 ( 0.471 1.841 6.566) 6.836 15.383 ( 3.667 1.542 3.431) 5.253 15.542 ( 0.641 -1.987 1.687) 2.684 15.946 ( -4.354 1.031 0.710) 4.531 16.242 ( 0.299 11.739 -1.975) 11.908 16.647 ( 3.489 -2.801 7.548) 8.774 17.527 ( 8.209 -4.152 -0.976) 9.251 20.922 ( 1.683 -11.021 0.076) 11.149 21.591 ( 4.097 0.128 -5.275) 6.680 21.814 ( -14.290 12.134 -4.881) 19.372 22.465 ( -0.749 2.394 4.906) 5.510 ======================= Grid point 276 (132/227) ======================= q-point: (-0.40 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( 4.139 0.000 -5.827) 7.147 2.282 ( -2.722 -0.000 2.150) 3.469 2.390 ( 4.151 0.000 -9.779) 10.624 2.960 ( 3.748 0.000 1.381) 3.994 3.125 ( 8.157 0.000 6.030) 10.144 3.428 ( -7.117 -0.000 -0.935) 7.178 3.838 ( 3.455 0.000 -2.433) 4.226 4.045 ( 6.124 0.000 1.926) 6.420 4.216 ( 0.298 0.000 9.446) 9.450 4.879 ( 11.325 0.000 2.603) 11.621 5.050 ( -7.465 -0.000 -4.175) 8.553 5.365 ( -8.956 -0.000 1.906) 9.156 5.626 ( -13.407 -0.000 -3.197) 13.783 5.822 ( -2.992 -0.000 5.143) 5.950 6.020 ( -0.228 -0.000 1.021) 1.047 6.059 ( -2.175 -0.000 17.019) 17.157 7.574 ( -1.714 -0.000 0.697) 1.851 7.890 ( -9.359 -0.000 6.416) 11.347 8.301 ( -1.782 -0.000 -0.587) 1.876 9.507 ( -0.591 -0.000 -6.095) 6.123 9.647 ( 8.559 0.000 -8.549) 12.097 9.980 ( 5.315 0.000 -16.572) 17.403 10.473 ( -10.227 -0.000 3.315) 10.751 10.705 ( 6.133 0.000 1.144) 6.239 11.012 ( -8.835 -0.000 -1.934) 9.044 11.435 ( 5.305 0.000 11.724) 12.868 11.623 ( -11.197 -0.000 -1.260) 11.268 11.799 ( 2.524 0.000 4.514) 5.171 12.153 ( -1.938 -0.000 -14.300) 14.431 12.752 ( 23.954 0.000 -5.881) 24.666 13.252 ( 4.202 0.000 3.647) 5.564 13.888 ( -2.758 -0.000 0.376) 2.784 14.092 ( -0.921 -0.000 -1.211) 1.522 14.359 ( -7.481 -0.000 2.282) 7.822 14.671 ( 1.790 0.000 -0.928) 2.017 15.337 ( 1.389 0.000 5.907) 6.068 15.524 ( -4.860 -0.000 5.680) 7.475 16.113 ( 3.840 0.000 -9.704) 10.436 16.417 ( 8.478 0.000 11.474) 14.266 16.462 ( 3.030 0.000 9.794) 10.252 16.882 ( 12.988 0.000 -5.871) 14.254 20.741 ( -2.773 -0.000 2.555) 3.771 21.612 ( -1.964 -0.000 1.244) 2.325 22.344 ( -7.813 -0.000 -5.457) 9.530 22.735 ( -4.560 -0.000 -3.825) 5.952 ======================= Grid point 278 (133/227) ======================= q-point: (-0.30 0.60 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 2.064 4.798 -4.731) 7.047 2.249 ( -2.574 -0.535 4.094) 4.866 2.416 ( -1.293 -3.072 -9.955) 10.498 3.033 ( 9.929 8.301 0.073) 12.942 3.266 ( -7.760 3.787 -2.890) 9.105 3.310 ( 10.789 -2.697 4.905) 12.154 3.905 ( 5.870 0.787 -4.745) 7.589 4.090 ( 1.902 4.915 -2.078) 5.666 4.242 ( -2.712 -3.435 3.033) 5.325 4.844 ( -9.643 5.898 1.261) 11.373 5.054 ( 0.847 -0.486 10.432) 10.478 5.189 ( -4.449 3.494 -6.725) 8.788 5.423 ( -10.747 -1.707 -2.167) 11.096 5.798 ( -1.346 -2.620 4.277) 5.193 6.011 ( -1.704 -0.173 1.002) 1.984 6.075 ( 0.637 -6.096 18.088) 19.098 7.527 ( -0.474 6.773 -0.409) 6.802 7.755 ( -12.182 -9.071 5.287) 16.082 8.275 ( -2.653 -2.646 0.902) 3.854 9.470 ( -0.860 4.415 -6.814) 8.165 9.719 ( -0.573 -3.341 -12.642) 13.088 10.093 ( 9.273 3.849 -14.421) 17.572 10.270 ( -11.977 -0.410 1.549) 12.083 10.809 ( 0.071 3.244 0.403) 3.270 10.899 ( -1.681 -5.818 -7.021) 9.272 11.438 ( -9.527 1.238 -3.823) 10.340 11.520 ( 8.175 6.813 13.465) 17.162 11.851 ( 2.921 -0.952 5.436) 6.244 12.216 ( 4.190 -7.830 -3.588) 9.578 13.123 ( 20.722 -0.083 -5.718) 21.496 13.356 ( 6.190 -4.245 0.905) 7.560 13.816 ( -5.502 0.823 1.024) 5.657 14.091 ( 1.033 0.389 -2.087) 2.361 14.239 ( -8.104 -2.049 2.898) 8.847 14.705 ( 2.515 -0.002 1.303) 2.833 15.371 ( 2.810 0.656 3.508) 4.542 15.478 ( -1.445 -0.905 3.737) 4.108 16.096 ( -3.861 1.206 -5.182) 6.573 16.488 ( 5.880 6.464 8.009) 11.854 16.553 ( 4.163 -0.490 10.079) 10.916 17.155 ( 16.703 -4.101 -6.430) 18.362 20.709 ( -2.670 -2.896 1.853) 4.353 21.589 ( -0.178 0.815 -1.426) 1.652 22.188 ( -10.866 0.418 -4.559) 11.791 22.632 ( -5.678 2.791 -0.437) 6.342 ======================= Grid point 279 (134/227) ======================= q-point: (-0.20 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( -1.023 9.130 -1.689) 9.341 2.202 ( -3.437 -0.184 3.455) 4.877 2.428 ( -1.537 -4.632 -8.108) 9.463 3.044 ( -2.873 9.444 -2.792) 10.258 3.162 ( 7.265 4.245 2.074) 8.666 3.542 ( 11.253 -1.694 -2.660) 11.686 3.911 ( -14.845 5.638 -11.441) 19.572 3.990 ( 1.105 0.651 -1.729) 2.152 4.201 ( 0.086 0.966 3.454) 3.587 4.726 ( 2.060 5.423 0.401) 5.815 4.879 ( -10.808 3.506 9.213) 14.628 5.198 ( 1.230 3.902 -4.890) 6.376 5.291 ( -10.701 -6.027 1.174) 12.338 5.838 ( 1.680 -3.632 12.505) 13.129 5.979 ( -3.525 -2.137 0.090) 4.124 6.237 ( 7.979 -10.655 10.589) 17.009 7.409 ( -8.902 0.053 -0.549) 8.919 7.707 ( -3.276 -6.324 2.235) 7.464 8.269 ( -2.598 -4.326 2.824) 5.783 9.389 ( -1.499 6.892 -8.349) 10.930 9.717 ( -2.792 -3.387 -12.154) 12.922 10.041 ( -6.142 5.295 -8.691) 11.887 10.234 ( 5.286 1.858 -14.292) 15.351 10.679 ( -7.176 2.009 6.373) 9.805 11.011 ( 4.337 -3.601 -8.546) 10.238 11.293 ( -5.768 1.838 -2.417) 6.518 11.577 ( 8.273 10.523 11.458) 17.619 11.937 ( 4.784 -4.255 4.251) 7.685 12.387 ( 4.835 -8.859 3.348) 10.633 13.388 ( 11.830 1.640 -4.945) 12.927 13.535 ( 7.792 -6.829 0.325) 10.367 13.712 ( -5.751 -0.743 0.885) 5.866 14.103 ( -0.700 -0.008 -1.331) 1.504 14.161 ( -3.082 -3.106 0.954) 4.479 14.751 ( 3.413 1.276 4.071) 5.463 15.415 ( 3.718 1.452 2.827) 4.891 15.500 ( 1.983 -1.969 2.138) 3.519 15.992 ( -5.561 2.628 -1.557) 6.345 16.471 ( 1.466 9.836 3.945) 10.699 16.615 ( 2.593 -0.645 8.769) 9.167 17.445 ( 12.424 -3.896 -5.270) 14.046 20.727 ( -1.192 -7.532 0.822) 7.670 21.597 ( 2.323 0.446 -4.103) 4.736 21.969 ( -13.292 3.799 -4.024) 14.398 22.521 ( -3.662 2.817 3.421) 5.749 ======================= Grid point 280 (135/227) ======================= q-point: (-0.10 -0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( -1.055 6.775 1.182) 6.958 2.149 ( -4.144 -0.847 1.533) 4.499 2.448 ( -1.488 -4.871 -5.837) 7.747 2.906 ( -2.435 6.300 0.030) 6.754 3.278 ( 9.529 4.314 -0.754) 10.487 3.409 ( -23.148 -0.499 -10.668) 25.493 3.828 ( 6.170 0.783 -2.250) 6.614 3.942 ( -2.621 3.161 4.423) 6.035 4.251 ( 5.410 -0.101 -1.269) 5.558 4.680 ( -6.283 5.179 5.284) 9.707 4.734 ( 0.733 4.725 -6.103) 7.753 5.127 ( -4.394 2.530 -0.316) 5.081 5.213 ( -6.260 -6.697 2.016) 9.386 5.930 ( 5.240 -2.370 16.267) 17.254 5.932 ( -6.782 -5.235 3.622) 9.302 6.490 ( 8.103 -7.557 5.089) 12.193 7.300 ( -8.110 -10.181 -3.098) 13.380 7.757 ( 4.193 -1.340 -0.460) 4.426 8.271 ( -2.746 -4.191 4.439) 6.694 9.285 ( -1.183 8.227 -9.686) 12.763 9.691 ( -3.097 -1.276 -10.657) 11.171 9.896 ( -4.026 5.292 -11.779) 13.527 10.283 ( 3.736 1.444 -21.426) 21.797 10.597 ( -0.974 0.411 12.959) 13.002 11.075 ( 2.595 1.414 -6.876) 7.485 11.214 ( -2.333 0.559 1.224) 2.693 11.579 ( 4.739 11.257 9.821) 15.673 12.097 ( 6.881 -7.431 -1.360) 10.219 12.520 ( 2.757 -4.070 7.458) 8.932 13.421 ( -4.106 3.492 -1.709) 5.654 13.694 ( 3.916 -4.518 -3.235) 6.798 13.724 ( 3.089 -5.588 3.032) 7.068 14.070 ( -2.620 -1.497 2.605) 3.986 14.192 ( 2.322 -0.852 -5.299) 5.848 14.785 ( 3.585 3.916 6.694) 8.544 15.471 ( 4.995 1.695 3.068) 6.102 15.560 ( 2.882 -0.394 2.732) 3.991 15.892 ( -3.350 0.671 -0.625) 3.474 16.351 ( -2.211 12.491 0.489) 12.694 16.652 ( -0.364 -2.078 7.820) 8.099 17.591 ( 2.545 0.036 -3.895) 4.652 20.830 ( 1.529 -12.439 -0.549) 12.544 21.658 ( 4.963 -1.125 -5.454) 7.459 21.690 ( -12.601 7.632 -3.767) 15.206 22.474 ( -0.133 0.680 5.890) 5.931 ======================= Grid point 288 (136/227) ======================= q-point: (-0.30 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -0.536 -0.000 -4.030) 4.066 2.193 ( -4.459 -0.000 5.205) 6.854 2.374 ( -0.760 -0.000 -8.143) 8.178 3.128 ( -9.271 -0.000 1.203) 9.349 3.261 ( 11.039 0.000 -1.579) 11.151 3.496 ( 12.715 0.000 -5.257) 13.759 3.949 ( -18.748 -0.000 -6.495) 19.841 4.030 ( 6.467 0.000 -8.188) 10.434 4.198 ( -3.248 -0.000 3.605) 4.853 4.785 ( 1.238 0.000 5.056) 5.205 4.925 ( -12.934 -0.000 9.693) 16.163 5.214 ( -12.674 -0.000 2.895) 13.000 5.238 ( 2.540 0.000 -8.610) 8.977 5.780 ( 1.823 0.000 8.667) 8.856 5.976 ( -3.373 -0.000 -0.155) 3.376 6.115 ( 8.459 0.000 13.341) 15.797 7.420 ( -18.310 -0.000 4.741) 18.914 7.629 ( 4.885 0.000 -1.084) 5.004 8.221 ( -2.145 -0.000 2.878) 3.590 9.490 ( -0.093 -0.000 -6.007) 6.008 9.654 ( -3.575 -0.000 -14.281) 14.721 10.096 ( -7.511 -0.000 -3.121) 8.134 10.258 ( 7.009 0.000 -20.496) 21.661 10.705 ( -8.487 -0.000 2.392) 8.818 10.971 ( 7.481 0.000 -6.176) 9.700 11.313 ( -5.786 -0.000 -1.934) 6.101 11.716 ( 8.932 0.000 16.602) 18.852 11.891 ( 3.109 0.000 4.583) 5.538 12.271 ( 7.253 0.000 -0.375) 7.263 13.424 ( 15.259 0.000 -4.743) 15.979 13.442 ( 7.141 0.000 -1.131) 7.230 13.706 ( -8.251 -0.000 0.941) 8.304 14.109 ( -5.797 -0.000 2.625) 6.364 14.119 ( 2.058 0.000 -2.397) 3.159 14.764 ( 4.342 0.000 3.246) 5.421 15.434 ( 4.264 0.000 2.158) 4.779 15.475 ( 1.630 0.000 2.602) 3.070 16.022 ( -5.481 -0.000 -2.334) 5.957 16.582 ( 1.008 0.000 8.382) 8.442 16.609 ( 2.417 0.000 9.249) 9.559 17.398 ( 15.024 0.000 -9.268) 17.653 20.647 ( -2.813 -0.000 1.363) 3.126 21.603 ( 1.700 0.000 -3.826) 4.187 22.000 ( -12.203 -0.000 -3.337) 12.651 22.554 ( -5.172 -0.000 2.700) 5.834 ======================= Grid point 289 (137/227) ======================= q-point: (-0.20 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( -3.775 5.432 -1.547) 6.793 2.122 ( -4.942 -1.270 4.369) 6.717 2.376 ( -0.562 -1.991 -5.832) 6.188 2.989 ( -6.082 1.945 2.224) 6.761 3.391 ( 9.148 5.058 -2.783) 10.817 3.422 ( -29.482 0.946 -10.451) 31.294 3.800 ( 10.115 -2.212 -7.005) 12.501 4.041 ( -4.356 6.423 4.431) 8.937 4.189 ( 1.042 -5.890 -1.786) 6.243 4.726 ( -10.282 1.233 3.290) 10.866 4.847 ( 5.607 3.637 1.416) 6.831 5.022 ( -13.338 -4.883 8.522) 16.564 5.213 ( -2.533 0.666 -8.378) 8.778 5.856 ( 3.295 -1.228 17.337) 17.690 5.906 ( -3.858 -0.900 -0.193) 3.967 6.349 ( 14.721 -4.719 5.355) 16.360 7.152 ( -15.123 -4.030 1.425) 15.715 7.737 ( 7.697 -0.552 -1.945) 7.959 8.206 ( -1.136 -1.811 4.602) 5.074 9.445 ( -0.695 6.696 -7.880) 10.364 9.614 ( -3.870 -4.880 -11.779) 13.324 10.014 ( -0.450 4.086 -7.369) 8.438 10.296 ( -0.316 0.194 -29.830) 29.832 10.604 ( -2.925 0.258 11.874) 12.232 11.078 ( 5.462 -0.290 -6.132) 8.217 11.248 ( -1.614 1.637 0.762) 2.422 11.780 ( 3.046 5.913 10.848) 12.725 12.001 ( 8.549 -1.244 7.274) 11.294 12.423 ( 7.301 -4.292 3.135) 9.030 13.504 ( -4.399 4.120 -1.107) 6.128 13.595 ( 5.081 -3.060 -1.665) 6.161 13.630 ( 2.080 -4.499 -1.733) 5.251 14.061 ( -0.103 0.347 1.381) 1.428 14.159 ( 1.864 -1.627 -3.621) 4.385 14.840 ( 5.222 1.387 5.635) 7.807 15.504 ( 5.350 1.601 2.651) 6.182 15.538 ( 4.647 -1.484 2.431) 5.450 15.924 ( -5.160 1.425 -0.961) 5.439 16.544 ( -2.426 5.529 5.748) 8.336 16.627 ( -0.961 -0.570 8.971) 9.040 17.596 ( 8.330 0.232 -9.704) 12.791 20.634 ( -1.730 -5.715 0.565) 5.998 21.647 ( 3.930 -0.174 -5.773) 6.986 21.785 ( -12.635 2.126 -2.477) 13.050 22.486 ( -2.389 0.442 5.522) 6.032 ======================= Grid point 290 (138/227) ======================= q-point: (-0.10 -0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( -4.473 4.722 1.504) 6.676 2.043 ( -7.077 -0.978 4.240) 8.307 2.383 ( -1.299 -2.969 -4.186) 5.294 2.851 ( -20.747 -2.586 0.297) 20.910 2.970 ( -11.474 -0.938 -5.059) 12.575 3.477 ( 6.798 3.304 -2.390) 7.927 3.794 ( -8.767 4.009 10.060) 13.933 4.018 ( 1.765 2.311 -0.260) 2.920 4.261 ( 1.338 -7.676 -5.040) 9.280 4.557 ( -9.060 1.080 0.295) 9.129 4.814 ( -4.573 0.291 0.098) 4.583 4.944 ( -1.714 -0.872 1.048) 2.190 5.199 ( 1.000 -0.926 -4.095) 4.316 5.789 ( -6.777 -0.627 -0.541) 6.827 5.993 ( 5.531 -3.519 19.174) 20.264 6.592 ( 8.719 -0.066 5.015) 10.059 7.074 ( -3.258 -13.044 -3.421) 13.873 7.887 ( 10.944 1.020 -4.037) 11.709 8.217 ( -0.204 -1.641 5.468) 5.712 9.350 ( -1.354 7.140 -9.204) 11.727 9.603 ( -3.290 -4.577 -10.132) 11.595 9.949 ( 1.456 10.686 -14.055) 17.716 10.304 ( 2.754 -3.711 -20.999) 21.502 10.611 ( 1.830 -1.205 11.017) 11.233 11.158 ( 4.945 -0.047 -5.607) 7.476 11.202 ( -1.090 4.111 3.470) 5.489 11.750 ( 1.847 8.144 10.000) 13.028 12.161 ( 8.473 -1.682 2.256) 8.928 12.563 ( 5.347 -1.698 6.271) 8.415 13.321 ( -11.070 3.018 -0.421) 11.482 13.677 ( -1.926 -3.346 -0.121) 3.862 13.729 ( 4.674 -5.101 -3.267) 7.651 14.081 ( 3.243 1.383 0.928) 3.646 14.202 ( 0.844 -2.008 -5.279) 5.711 14.901 ( 4.944 3.770 7.519) 9.756 15.586 ( 6.621 2.001 3.351) 7.686 15.628 ( 4.741 0.958 5.748) 7.513 15.850 ( -1.990 -0.185 -2.090) 2.892 16.409 ( -4.500 9.571 2.541) 10.877 16.599 ( -4.081 -1.678 7.840) 8.996 17.616 ( -2.661 5.736 -7.686) 9.953 20.722 ( 1.078 -13.214 -1.056) 13.300 21.550 ( -11.399 4.497 -1.509) 12.347 21.735 ( 6.115 -1.437 -6.985) 9.394 22.485 ( 1.649 -1.152 6.568) 6.869 ======================= Grid point 299 (139/227) ======================= q-point: (-0.20 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -7.409 -0.000 0.373) 7.419 2.033 ( -5.931 -0.000 6.091) 8.501 2.357 ( -0.264 -0.000 -4.868) 4.875 2.815 ( -32.107 -0.000 -1.809) 32.158 2.965 ( -7.260 -0.000 -0.932) 7.320 3.514 ( 3.467 0.000 -2.771) 4.438 3.903 ( -13.127 -0.000 12.869) 18.383 4.010 ( 10.992 0.000 -7.010) 13.037 4.137 ( -3.947 -0.000 -1.772) 4.326 4.576 ( -9.135 -0.000 -3.780) 9.886 4.775 ( -10.530 -0.000 9.544) 14.212 4.981 ( 5.214 0.000 1.317) 5.378 5.171 ( -0.808 -0.000 -9.925) 9.958 5.796 ( -6.748 -0.000 -4.977) 8.385 5.956 ( 6.027 0.000 23.384) 24.149 6.599 ( 16.625 0.000 3.730) 17.038 6.923 ( -8.816 -0.000 -2.541) 9.174 7.898 ( 11.974 0.000 -3.962) 12.612 8.200 ( 1.034 0.000 5.744) 5.836 9.480 ( -0.364 -0.000 -8.256) 8.264 9.491 ( -5.693 -0.000 -10.518) 11.960 10.118 ( 9.752 0.000 -5.532) 11.212 10.216 ( -5.639 -0.000 -32.074) 32.566 10.599 ( 1.084 0.000 11.597) 11.648 11.150 ( 3.605 0.000 -4.330) 5.634 11.260 ( 1.002 0.000 1.544) 1.841 11.808 ( -0.965 -0.000 5.265) 5.352 12.188 ( 12.057 0.000 14.261) 18.675 12.527 ( 7.370 0.000 2.216) 7.696 13.359 ( -12.259 -0.000 -0.072) 12.259 13.632 ( -0.418 -0.000 -1.169) 1.241 13.673 ( 5.197 0.000 -3.893) 6.493 14.114 ( 4.550 0.000 -0.418) 4.570 14.161 ( 0.130 0.000 -4.526) 4.527 14.939 ( 5.373 0.000 7.151) 8.944 15.612 ( 5.853 0.000 1.477) 6.036 15.630 ( 7.612 0.000 7.122) 10.424 15.855 ( -3.640 -0.000 -1.709) 4.021 16.511 ( -5.018 -0.000 5.167) 7.203 16.581 ( -4.456 -0.000 8.856) 9.914 17.689 ( 2.191 0.000 -12.721) 12.909 20.572 ( -1.729 -0.000 0.375) 1.769 21.597 ( -11.579 -0.000 -1.357) 11.659 21.721 ( 5.609 0.000 -6.808) 8.821 22.472 ( 0.406 0.000 6.925) 6.937 ======================= Grid point 300 (140/227) ======================= q-point: (-0.10 -0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.426 ( -7.427 0.745 4.279) 8.603 1.899 ( -11.359 0.476 8.913) 14.446 2.250 ( -28.631 -3.471 1.906) 28.904 2.394 ( -1.769 -5.053 -4.667) 7.102 2.949 ( 1.371 -0.715 4.044) 4.329 3.519 ( -3.525 -0.663 0.876) 3.692 3.701 ( -6.961 3.708 12.245) 14.565 3.858 ( -21.401 -1.372 15.460) 26.437 4.245 ( 2.370 -3.614 -6.164) 7.528 4.428 ( -6.068 0.125 -5.720) 8.340 4.716 ( 1.324 -4.025 -2.138) 4.747 5.018 ( 2.390 4.397 -4.212) 6.541 5.197 ( 2.007 -2.404 -7.679) 8.293 5.688 ( -5.574 0.170 -6.728) 8.738 6.065 ( 5.212 -1.281 22.998) 23.616 6.756 ( 5.365 7.386 0.962) 9.179 6.958 ( 5.514 -12.593 -1.809) 13.866 8.111 ( 14.597 1.417 -6.059) 15.868 8.234 ( 2.692 0.191 5.778) 6.377 9.359 ( -4.548 4.344 -8.890) 10.890 9.504 ( -1.426 -4.694 -10.567) 11.651 10.076 ( -0.365 8.530 -22.980) 24.515 10.371 ( 14.603 -4.827 -5.602) 16.368 10.639 ( 2.593 -0.706 9.333) 9.712 11.187 ( 0.430 0.639 -0.813) 1.120 11.264 ( 1.648 1.890 -0.950) 2.681 11.799 ( 0.307 0.360 5.290) 5.311 12.361 ( 11.621 6.158 11.227) 17.292 12.645 ( 5.658 -1.364 3.854) 6.981 13.137 ( -13.678 1.290 -0.630) 13.753 13.617 ( -2.250 -0.471 -0.558) 2.366 13.730 ( -0.198 -2.943 -6.175) 6.843 14.156 ( 3.223 1.107 -2.232) 4.074 14.194 ( 1.698 -1.560 -2.842) 3.660 15.013 ( 4.429 2.041 8.164) 9.509 15.704 ( 5.466 0.708 1.372) 5.680 15.738 ( 4.430 2.367 12.747) 13.701 15.839 ( 3.268 -0.638 -2.730) 4.306 16.398 ( -5.391 4.695 3.448) 7.937 16.497 ( -6.624 -1.286 6.523) 9.385 17.607 ( -7.673 8.938 -11.860) 16.716 20.607 ( 0.113 -10.930 -0.861) 10.965 21.411 ( -9.566 2.181 -0.669) 9.834 21.826 ( 6.988 -1.044 -6.686) 9.728 22.512 ( 3.153 -1.815 5.801) 6.847 ======================= Grid point 310 (141/227) ======================= q-point: (-0.10 -0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( -5.046 -0.000 11.229) 12.311 1.683 ( -15.786 -0.000 15.545) 22.155 1.755 ( -21.850 -0.000 10.521) 24.251 2.432 ( 5.383 0.000 -5.158) 7.455 2.955 ( -2.846 -0.000 16.193) 16.442 3.405 ( -8.212 -0.000 7.223) 10.936 3.459 ( -22.131 -0.000 20.598) 30.234 3.643 ( -3.649 -0.000 5.453) 6.561 4.167 ( -10.753 -0.000 0.537) 10.767 4.333 ( -3.740 -0.000 -7.591) 8.463 4.797 ( 7.557 0.000 -14.182) 16.070 5.076 ( 3.632 0.000 -2.950) 4.679 5.226 ( 2.944 0.000 -9.557) 10.000 5.598 ( -5.067 -0.000 -10.088) 11.289 6.148 ( 4.239 0.000 23.846) 24.220 6.857 ( 3.153 0.000 -12.395) 12.789 7.019 ( 7.868 0.000 10.616) 13.214 8.296 ( 3.803 0.000 4.885) 6.191 8.360 ( 14.109 0.000 -7.314) 15.892 9.283 ( -5.442 -0.000 -10.417) 11.753 9.482 ( 1.650 0.000 -11.519) 11.636 10.101 ( 1.570 0.000 -19.590) 19.653 10.653 ( 19.541 0.000 3.475) 19.848 10.692 ( 3.740 0.000 8.750) 9.516 11.194 ( -0.577 -0.000 -1.700) 1.795 11.265 ( -1.625 -0.000 -1.851) 2.463 11.827 ( 3.617 0.000 3.852) 5.284 12.618 ( 12.188 0.000 13.032) 17.844 12.706 ( 2.968 0.000 1.145) 3.181 12.915 ( -12.736 -0.000 0.351) 12.741 13.601 ( -0.465 -0.000 -1.264) 1.347 13.649 ( -6.209 -0.000 -9.167) 11.072 14.217 ( 5.148 0.000 -2.642) 5.786 14.217 ( 0.710 0.000 -1.699) 1.842 15.090 ( 3.562 0.000 8.830) 9.522 15.776 ( 0.965 0.000 3.056) 3.205 15.782 ( 3.309 0.000 2.339) 4.052 15.965 ( 8.528 0.000 14.254) 16.610 16.345 ( -3.700 -0.000 2.571) 4.506 16.382 ( -5.595 -0.000 1.257) 5.734 17.488 ( -14.010 -0.000 -13.701) 19.596 20.536 ( -0.489 -0.000 -0.180) 0.521 21.286 ( -6.826 -0.000 -0.090) 6.827 21.937 ( 7.456 0.000 -5.545) 9.292 22.545 ( 1.069 0.000 1.804) 2.097 ======================= Grid point 311 (142/227) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( 3.913 0.000 3.560) 5.290 1.764 ( -2.567 -0.000 19.536) 19.704 2.039 ( 5.029 0.000 15.956) 16.730 2.446 ( 3.268 0.000 -9.678) 10.215 3.241 ( -10.036 -0.000 15.950) 18.845 3.360 ( -3.122 -0.000 7.097) 7.753 3.510 ( 6.689 0.000 20.101) 21.185 3.635 ( -3.289 -0.000 8.589) 9.198 3.758 ( -15.583 -0.000 11.598) 19.425 4.136 ( 2.876 0.000 -11.874) 12.217 4.505 ( -1.578 -0.000 -10.712) 10.827 5.136 ( 0.134 0.000 -5.008) 5.009 5.179 ( 3.342 0.000 -17.009) 17.334 5.340 ( 4.576 0.000 -0.140) 4.578 6.758 ( -0.044 -0.000 26.420) 26.420 6.763 ( 7.249 0.000 -12.974) 14.862 7.425 ( 2.825 0.000 9.084) 9.513 8.275 ( -6.257 -0.000 -16.563) 17.706 8.405 ( -0.030 -0.000 0.863) 0.864 8.977 ( 5.551 0.000 -12.047) 13.264 9.416 ( 2.401 0.000 -5.036) 5.579 10.279 ( 9.530 0.000 2.670) 9.897 10.781 ( -6.741 -0.000 -3.866) 7.771 11.020 ( -3.271 -0.000 -2.275) 3.985 11.180 ( 4.668 0.000 0.276) 4.676 11.364 ( 4.299 0.000 13.400) 14.073 11.773 ( -15.146 -0.000 -1.968) 15.274 12.548 ( 5.548 0.000 -1.818) 5.838 12.704 ( -2.063 -0.000 -0.264) 2.080 13.018 ( 0.172 0.000 -1.940) 1.947 13.383 ( 2.920 0.000 -8.203) 8.707 13.583 ( 0.310 0.000 -0.449) 0.546 14.086 ( -3.365 -0.000 -2.409) 4.138 14.433 ( 4.210 0.000 -0.451) 4.234 15.314 ( -0.015 -0.000 4.581) 4.582 15.843 ( -1.423 -0.000 2.519) 2.893 15.890 ( -0.118 -0.000 2.518) 2.520 16.206 ( -11.175 -0.000 3.362) 11.670 16.325 ( 0.179 0.000 0.777) 0.798 16.542 ( 9.553 0.000 5.999) 11.281 17.012 ( 4.681 0.000 -3.297) 5.726 20.529 ( 0.277 0.000 -0.232) 0.361 21.185 ( 0.385 0.000 0.216) 0.441 22.112 ( -2.400 -0.000 -1.313) 2.735 22.195 ( -6.187 -0.000 -0.135) 6.188 ======================= Grid point 312 (143/227) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 3.568 6.734 5.151) 9.198 1.832 ( 4.054 -8.462 13.930) 16.795 2.093 ( 0.078 -1.047 12.757) 12.800 2.480 ( 1.129 0.013 -10.236) 10.298 3.199 ( 2.636 0.687 14.615) 14.867 3.351 ( -1.266 -2.763 9.752) 10.215 3.416 ( -11.856 -5.684 16.947) 21.450 3.626 ( -0.752 -4.315 10.981) 11.822 3.788 ( 11.543 -1.892 10.278) 15.571 4.207 ( 3.059 -2.289 -11.448) 12.069 4.503 ( -1.341 -6.199 -9.594) 11.500 5.094 ( -2.811 2.644 -5.618) 6.816 5.193 ( -1.285 -2.205 -8.404) 8.783 5.461 ( 7.751 -1.169 -3.645) 8.644 6.762 ( -0.734 -1.392 24.050) 24.101 6.908 ( 11.324 3.013 -17.143) 20.766 7.413 ( -4.304 1.862 13.587) 14.374 8.138 ( -7.124 -0.617 -21.258) 22.428 8.386 ( -1.687 0.970 1.857) 2.690 9.111 ( 8.628 -1.886 -11.704) 14.662 9.451 ( 2.003 -0.560 -6.970) 7.274 10.265 ( -10.149 3.762 -4.940) 11.898 10.744 ( 2.958 0.075 1.981) 3.561 10.895 ( -14.135 -1.949 1.691) 14.369 11.244 ( 5.803 7.112 -1.532) 9.306 11.342 ( -7.701 -1.258 6.791) 10.345 11.515 ( -12.871 -4.353 6.100) 14.894 12.612 ( -0.483 9.818 0.377) 9.837 12.736 ( 12.048 0.126 -2.762) 12.361 13.000 ( -0.109 2.406 -2.537) 3.498 13.445 ( 6.203 2.351 -7.587) 10.078 13.605 ( 0.730 -3.145 -1.324) 3.490 14.030 ( -3.381 -0.159 0.001) 3.385 14.470 ( -0.681 -1.713 -2.816) 3.365 15.310 ( -0.593 -0.318 5.429) 5.471 15.732 ( -12.408 2.819 5.233) 13.758 15.869 ( -1.455 0.817 2.030) 2.628 15.976 ( -12.231 1.128 6.196) 13.757 16.311 ( 0.834 4.732 0.889) 4.887 16.692 ( 11.022 5.788 4.532) 13.248 17.159 ( 17.088 9.051 -7.811) 20.855 20.631 ( 1.027 -17.394 -2.583) 17.614 21.205 ( 3.766 3.282 0.005) 4.995 21.876 ( -17.610 -4.583 3.459) 18.523 22.295 ( 6.934 -1.465 1.939) 7.348 ======================= Grid point 313 (144/227) ======================= q-point: ( 0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 5.167 9.667 5.203) 12.133 2.015 ( 4.525 -9.313 11.942) 15.806 2.139 ( 3.389 -5.821 7.507) 10.086 2.473 ( -0.455 1.396 -9.995) 10.102 3.234 ( 1.410 -0.894 10.567) 10.698 3.287 ( -1.683 0.004 10.537) 10.671 3.462 ( 1.405 -4.288 1.212) 4.672 3.729 ( 3.586 -9.162 11.791) 15.357 4.037 ( 9.924 -4.669 2.209) 11.187 4.247 ( 2.201 -3.358 -2.167) 4.562 4.600 ( 1.548 -12.397 -2.264) 12.697 5.004 ( -4.328 1.391 -6.963) 8.315 5.177 ( -4.129 -4.023 -1.078) 5.865 5.607 ( 8.804 -0.873 -6.781) 11.147 6.763 ( -3.032 -2.819 20.089) 20.511 6.986 ( 4.716 13.143 -6.137) 15.253 7.318 ( -2.702 -1.358 4.301) 5.258 8.066 ( -3.215 -2.045 -22.703) 23.020 8.343 ( -2.055 0.933 3.133) 3.861 9.252 ( 5.681 -2.788 -10.597) 12.343 9.493 ( 2.502 -1.001 -8.926) 9.324 9.956 ( -18.511 6.383 -8.628) 21.397 10.534 ( -22.559 0.607 2.670) 22.724 10.881 ( 4.080 -3.709 6.314) 8.383 11.146 ( -7.867 4.386 3.177) 9.551 11.275 ( -0.734 0.950 4.202) 4.371 11.476 ( 0.528 -1.546 -2.514) 2.998 12.447 ( -3.514 14.638 3.385) 15.429 12.874 ( 1.536 0.907 -1.430) 2.286 13.034 ( 10.899 3.480 -3.814) 12.061 13.525 ( 7.086 2.866 -3.605) 8.451 13.682 ( 4.289 -3.851 -3.150) 6.568 13.981 ( -3.187 -0.756 2.258) 3.978 14.447 ( -5.088 -3.577 -3.760) 7.268 15.306 ( -1.413 1.070 9.887) 10.045 15.419 ( -15.179 6.253 6.037) 17.492 15.812 ( -4.583 3.438 3.698) 6.819 15.870 ( -2.820 -4.071 1.218) 5.099 16.253 ( 0.243 8.429 1.465) 8.559 16.789 ( 9.318 7.932 5.762) 13.525 17.336 ( 15.260 8.697 -9.222) 19.838 20.860 ( 0.045 -23.771 -6.941) 24.764 21.232 ( 5.488 6.738 0.528) 8.707 21.692 ( -12.253 -7.434 4.270) 14.954 22.408 ( 4.322 -2.041 3.492) 5.919 ======================= Grid point 314 (145/227) ======================= q-point: ( 0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( 4.007 10.878 3.230) 12.034 2.141 ( 1.240 -5.827 15.299) 16.418 2.329 ( 8.127 -9.672 -2.624) 12.903 2.447 ( 0.940 2.608 -10.392) 10.756 3.265 ( -0.501 -3.012 8.995) 9.500 3.352 ( 8.916 1.576 2.032) 9.280 3.504 ( -0.120 -3.072 -0.709) 3.155 3.879 ( 3.755 -6.795 9.568) 12.321 4.055 ( -4.817 -0.412 -9.786) 10.915 4.427 ( 6.406 -5.666 3.570) 9.267 4.734 ( 0.292 -8.472 3.970) 9.361 4.974 ( -2.552 -4.876 -2.029) 5.866 5.189 ( 0.665 -9.988 1.471) 10.117 5.741 ( 7.169 0.074 -7.439) 10.332 6.732 ( -4.727 -2.064 8.893) 10.281 6.819 ( -4.077 13.653 16.272) 21.629 7.364 ( 4.271 0.296 -7.864) 8.953 8.015 ( -3.954 0.603 -18.667) 19.091 8.324 ( -0.122 -1.539 2.344) 2.806 9.323 ( -0.987 -1.094 -12.430) 12.517 9.506 ( -4.879 3.046 -10.430) 11.911 9.629 ( -7.548 1.450 -6.635) 10.154 10.196 ( -18.406 -2.195 0.537) 18.544 10.923 ( -5.128 0.052 3.076) 5.980 11.022 ( -1.816 -1.606 10.747) 11.017 11.264 ( 0.401 1.244 3.547) 3.780 11.487 ( 2.838 5.381 -8.871) 10.756 12.252 ( -2.854 12.017 2.781) 12.661 12.834 ( -3.380 0.938 1.371) 3.767 13.199 ( 12.706 5.154 -3.636) 14.186 13.630 ( 8.360 0.673 -2.066) 8.638 13.786 ( 4.239 -0.935 -2.257) 4.893 13.950 ( -1.895 -2.047 2.276) 3.601 14.377 ( -8.170 -4.588 -2.671) 9.744 15.083 ( -11.611 6.835 13.201) 18.862 15.356 ( 2.015 -0.276 1.997) 2.850 15.696 ( -4.982 3.383 3.116) 6.780 15.897 ( -1.661 -7.523 -0.180) 7.707 16.160 ( 0.120 10.264 1.720) 10.408 16.849 ( 6.757 6.678 6.795) 11.679 17.467 ( 9.485 5.049 -8.279) 13.564 21.052 ( -2.559 -16.950 -7.717) 18.799 21.256 ( 5.309 4.581 0.692) 7.046 21.622 ( -5.438 -6.378 2.166) 8.657 22.479 ( 1.961 -1.865 4.044) 4.866 ======================= Grid point 315 (146/227) ======================= q-point: ( 0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( 1.951 8.348 1.729) 8.746 2.183 ( -1.012 -2.152 5.489) 5.982 2.437 ( 1.475 1.419 -6.113) 6.446 2.566 ( 8.633 -6.924 -2.694) 11.390 3.292 ( 1.205 0.076 5.799) 5.923 3.422 ( -1.448 2.139 -6.884) 7.352 3.573 ( 5.171 -5.447 2.532) 7.926 3.949 ( -0.317 1.819 -2.889) 3.428 4.046 ( 2.368 -7.398 2.504) 8.161 4.481 ( -1.281 -0.665 0.542) 1.541 4.851 ( 4.532 -7.697 -1.256) 9.020 4.909 ( -10.567 -4.786 5.191) 12.709 5.363 ( 3.414 -7.381 0.983) 8.191 5.856 ( 7.259 -1.647 -2.527) 7.861 6.607 ( -4.132 9.347 5.125) 11.433 6.720 ( -2.241 -0.256 19.833) 19.961 7.399 ( 2.671 3.426 -6.828) 8.092 7.899 ( -6.079 4.180 -12.473) 14.491 8.370 ( 1.723 -3.285 0.984) 3.838 9.122 ( -13.047 5.845 -12.180) 18.781 9.446 ( -0.963 -3.375 -6.791) 7.644 9.631 ( 1.068 -0.587 -10.700) 10.769 10.001 ( -8.340 -3.185 -3.127) 9.459 10.817 ( -4.792 0.199 5.277) 7.131 11.037 ( -1.233 -1.416 6.571) 6.834 11.260 ( 0.845 2.251 1.394) 2.779 11.474 ( 2.887 3.623 -1.028) 4.746 12.133 ( -0.323 6.735 -3.540) 7.616 12.767 ( -2.894 1.701 3.256) 4.677 13.321 ( 7.382 3.580 -2.789) 8.665 13.770 ( 9.385 1.621 -1.267) 9.608 13.802 ( -1.580 0.837 2.582) 3.141 13.980 ( 1.810 -2.743 -3.571) 4.853 14.277 ( -8.425 -3.207 0.845) 9.054 14.900 ( -5.487 2.298 10.226) 11.830 15.405 ( 3.303 -0.402 1.218) 3.543 15.600 ( -3.375 1.570 1.660) 4.075 15.959 ( -1.916 -10.297 -0.233) 10.476 16.062 ( 0.318 9.693 1.377) 9.795 16.880 ( 3.548 4.659 7.515) 9.527 17.535 ( 3.462 2.121 -6.623) 7.768 21.097 ( -1.512 -1.104 -2.120) 2.829 21.327 ( 1.868 -5.315 -3.988) 6.902 21.622 ( -0.770 -2.585 0.204) 2.705 22.518 ( 0.869 -1.424 3.788) 4.139 ======================= Grid point 316 (147/227) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( 1.091 3.252 1.274) 3.659 2.171 ( -2.181 -0.564 1.019) 2.473 2.438 ( 1.593 3.302 -4.275) 5.632 2.737 ( 5.025 -4.982 -1.131) 7.166 3.218 ( -11.025 2.578 -6.998) 13.310 3.388 ( 4.272 2.867 6.103) 7.983 3.726 ( 4.941 -6.486 -0.523) 8.171 3.916 ( -0.861 1.840 -5.101) 5.491 4.191 ( 6.384 -4.685 -0.558) 7.938 4.479 ( -0.018 -2.901 -0.628) 2.968 4.749 ( -13.325 -2.793 4.230) 14.256 5.006 ( 5.789 -4.653 -0.095) 7.427 5.377 ( -3.513 2.196 1.047) 4.273 5.967 ( 2.467 0.799 -0.162) 2.598 6.473 ( -0.997 8.168 12.602) 15.051 6.723 ( -0.145 -2.744 15.112) 15.360 7.384 ( 1.819 6.799 -5.367) 8.851 7.764 ( -3.285 3.952 -8.676) 10.084 8.395 ( -1.342 1.146 1.831) 2.543 8.947 ( -4.141 -3.110 -9.031) 10.410 9.455 ( -2.650 -4.114 -7.161) 8.674 9.615 ( -2.077 0.640 -9.614) 9.857 9.982 ( 3.184 -0.681 -7.902) 8.547 10.796 ( 1.031 -1.320 5.374) 5.629 11.011 ( -2.087 0.176 3.347) 3.949 11.246 ( 0.695 2.783 -0.197) 2.875 11.542 ( 3.793 -5.861 6.659) 9.648 12.089 ( 1.636 4.232 -8.952) 10.036 12.718 ( -1.255 1.260 4.384) 4.731 13.351 ( -1.795 0.128 -1.384) 2.270 13.757 ( -0.989 2.892 2.594) 4.009 13.875 ( 5.317 3.513 0.292) 6.379 14.024 ( -0.686 -4.354 -7.339) 8.561 14.191 ( -2.345 1.289 4.456) 5.198 14.864 ( 0.040 -2.918 7.870) 8.394 15.466 ( 3.242 -0.548 -0.734) 3.369 15.573 ( 0.418 -1.836 0.664) 1.996 15.970 ( 0.608 8.278 2.279) 8.607 16.048 ( -2.541 -12.656 -1.658) 13.014 16.874 ( -0.073 2.802 8.433) 8.887 17.531 ( -2.300 0.142 -4.938) 5.449 21.060 ( 0.459 6.146 0.452) 6.179 21.388 ( -2.006 -6.574 -5.193) 8.614 21.640 ( 2.420 1.537 -1.358) 3.173 22.546 ( 1.052 -0.899 2.956) 3.263 ======================= Grid point 317 (148/227) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -0.002 -1.297 2.112) 2.479 2.126 ( -3.948 -0.686 3.706) 5.458 2.415 ( 1.125 5.423 -2.922) 6.262 2.811 ( -4.079 -0.273 -8.868) 9.764 2.980 ( -7.007 4.296 5.908) 10.122 3.457 ( 5.498 1.490 2.220) 6.113 3.839 ( 0.352 -6.548 -2.384) 6.977 3.881 ( -1.008 1.356 -4.112) 4.446 4.317 ( 6.112 1.299 -4.881) 7.929 4.510 ( -8.418 -4.237 3.688) 10.120 4.583 ( -1.389 -1.514 -3.577) 4.125 5.096 ( 0.661 1.434 1.343) 2.073 5.265 ( -3.821 4.071 4.298) 7.046 5.863 ( -7.742 8.732 -1.907) 11.825 6.445 ( 2.791 2.801 14.448) 14.980 6.778 ( 1.604 -4.025 17.142) 17.681 7.309 ( 2.055 13.039 -2.689) 13.471 7.745 ( 3.733 -0.306 -9.858) 10.546 8.334 ( -2.104 2.196 2.613) 4.010 9.020 ( 3.415 -8.923 -6.068) 11.318 9.434 ( -4.346 -4.043 -6.919) 9.116 9.573 ( -0.541 1.202 -8.655) 8.755 10.090 ( 10.872 1.554 -7.966) 13.568 10.839 ( 0.956 -0.543 8.419) 8.491 11.013 ( 2.639 -2.050 -2.608) 4.239 11.231 ( 0.346 1.939 0.367) 2.003 11.692 ( 3.056 -9.857 4.821) 11.391 12.102 ( 4.109 0.312 -7.685) 8.720 12.710 ( 0.869 -0.044 4.844) 4.922 13.263 ( -9.772 -2.440 0.484) 10.083 13.707 ( -2.519 2.445 -0.316) 3.524 13.853 ( -3.147 3.034 0.568) 4.409 14.064 ( 1.655 -2.880 -4.638) 5.705 14.182 ( 4.268 5.273 3.200) 7.501 14.950 ( 3.848 -6.254 7.093) 10.210 15.524 ( 3.269 -1.736 -4.209) 5.605 15.649 ( 4.208 -4.552 1.471) 6.371 15.902 ( 0.519 7.019 1.465) 7.189 16.141 ( -2.594 -13.891 -1.357) 14.197 16.826 ( -3.855 1.238 9.953) 10.745 17.456 ( -7.411 -1.646 -3.641) 8.420 20.992 ( 1.865 11.294 0.911) 11.483 21.381 ( -5.798 -5.343 -3.389) 8.582 21.677 ( 5.722 3.671 -3.651) 7.717 22.574 ( 1.626 0.033 1.516) 2.223 ======================= Grid point 318 (149/227) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( -2.428 -2.844 4.393) 5.769 2.067 ( -4.552 -1.061 8.410) 9.621 2.371 ( 1.374 6.498 -2.564) 7.119 2.524 ( -16.153 10.606 -1.544) 19.385 3.022 ( 6.488 -1.077 6.708) 9.394 3.509 ( 1.663 1.042 -1.754) 2.632 3.840 ( -8.162 -6.689 -5.028) 11.689 3.871 ( 0.605 0.849 4.185) 4.313 4.307 ( -1.390 8.899 1.671) 9.160 4.383 ( -3.606 1.336 -9.495) 10.244 4.679 ( 3.960 -5.057 -4.211) 7.680 4.967 ( -8.536 5.112 9.178) 13.537 5.215 ( 0.731 6.179 -2.098) 6.566 5.632 ( -8.680 6.419 -3.555) 11.366 6.483 ( 2.045 -0.884 14.226) 14.399 6.842 ( 0.711 -1.891 18.096) 18.208 7.232 ( 5.958 13.186 0.376) 14.475 7.869 ( 9.279 -3.260 -13.724) 16.884 8.316 ( 0.739 -0.548 3.290) 3.417 9.140 ( 0.331 -5.142 -3.526) 6.243 9.393 ( -3.740 -1.436 -5.610) 6.894 9.610 ( 6.319 -2.127 -9.223) 11.380 10.309 ( 17.737 0.629 -4.695) 18.359 10.842 ( -0.712 -0.583 9.892) 9.935 11.115 ( 5.684 -1.764 -6.041) 8.480 11.218 ( -0.011 1.213 0.968) 1.552 11.791 ( 0.718 -3.646 -3.281) 4.958 12.247 ( 7.321 -10.364 0.159) 12.690 12.746 ( 2.273 -0.984 3.955) 4.667 13.100 ( -12.936 -2.933 1.163) 13.316 13.619 ( -7.029 -0.730 -0.649) 7.097 13.751 ( -4.492 3.615 -0.926) 5.840 14.119 ( 2.429 -1.053 -3.617) 4.482 14.210 ( 5.942 6.127 2.495) 8.893 15.095 ( 5.182 -6.044 7.786) 11.135 15.618 ( 4.965 -3.722 -6.602) 9.060 15.780 ( 4.180 -5.867 1.954) 7.464 15.856 ( 1.726 3.907 0.962) 4.378 16.235 ( -1.507 -11.377 -0.965) 11.517 16.731 ( -7.501 -0.035 12.201) 14.323 17.327 ( -11.433 -4.106 -2.945) 12.500 20.891 ( 2.368 15.997 0.305) 16.174 21.317 ( -7.372 -4.439 -1.417) 8.721 21.751 ( 7.998 3.703 -5.048) 10.157 22.591 ( 0.990 1.457 -0.751) 1.915 ======================= Grid point 319 (150/227) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( -2.205 -2.930 6.678) 7.619 1.995 ( -4.736 1.782 13.408) 14.331 2.168 ( -12.007 11.196 9.315) 18.875 2.355 ( 3.561 4.301 -6.106) 8.274 3.156 ( 8.420 -0.775 7.574) 11.352 3.485 ( -2.707 1.144 -0.566) 2.992 3.716 ( -12.813 -3.704 2.178) 13.514 3.845 ( -4.113 1.647 10.523) 11.418 4.181 ( -7.429 1.987 0.662) 7.719 4.298 ( 1.732 11.374 -12.052) 16.662 4.693 ( -6.484 2.945 3.389) 7.887 4.885 ( 2.729 -4.000 -2.540) 5.468 5.144 ( 1.975 8.523 -9.007) 12.557 5.474 ( -5.899 2.336 -3.556) 7.273 6.545 ( 1.387 -5.020 12.810) 13.828 6.838 ( 0.331 4.835 14.402) 15.195 7.255 ( 7.823 5.807 4.261) 10.633 8.077 ( 10.826 -4.695 -15.875) 19.780 8.357 ( 2.512 -1.065 2.478) 3.686 9.106 ( -7.175 -1.167 -5.125) 8.895 9.360 ( 0.405 1.129 -3.721) 3.910 9.804 ( 13.228 -2.736 -5.543) 14.601 10.639 ( 19.410 -3.318 -1.358) 19.739 10.858 ( 1.521 -1.573 8.774) 9.042 11.181 ( 1.257 1.074 -6.560) 6.765 11.207 ( 1.261 2.432 1.505) 3.125 11.831 ( 2.571 -1.126 -4.807) 5.566 12.492 ( 4.957 -14.729 1.646) 15.628 12.773 ( -3.592 -1.679 1.678) 4.305 12.940 ( -5.800 -1.081 1.088) 5.999 13.497 ( -10.449 -3.948 -0.602) 11.186 13.650 ( -2.132 4.736 -1.901) 5.530 14.149 ( 0.354 -0.386 -4.165) 4.198 14.261 ( 7.095 4.813 2.783) 9.014 15.225 ( 4.314 -3.019 7.663) 9.298 15.731 ( 4.376 -2.354 -4.613) 6.780 15.823 ( 1.540 -0.037 2.221) 2.703 15.983 ( 7.291 -9.157 -1.114) 11.758 16.311 ( 0.336 -5.228 -0.822) 5.303 16.597 ( -9.834 -1.145 15.060) 18.023 17.173 ( -13.877 -7.274 -2.608) 15.883 20.751 ( 1.721 18.042 -0.726) 18.138 21.244 ( -6.226 -3.831 -0.198) 7.313 21.859 ( 9.369 2.876 -4.810) 10.917 22.559 ( -2.845 2.826 -3.462) 5.298 ======================= Grid point 320 (151/227) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( 1.836 -2.918 6.333) 7.211 1.869 ( -6.706 5.031 16.212) 18.252 1.990 ( 0.351 4.377 17.500) 18.043 2.392 ( 4.404 1.608 -8.162) 9.413 3.317 ( 8.157 -2.075 4.902) 9.740 3.416 ( -4.256 0.125 6.516) 7.784 3.504 ( -13.501 2.445 15.355) 20.592 3.724 ( -6.082 2.871 10.268) 12.274 4.032 ( -12.916 -0.910 7.380) 14.903 4.170 ( -2.180 9.117 -9.776) 13.544 4.562 ( -4.076 2.197 -5.571) 7.244 5.029 ( 8.294 -4.313 -10.701) 14.209 5.134 ( 4.568 4.723 -10.893) 12.721 5.366 ( -4.261 2.152 -2.039) 5.191 6.639 ( 2.507 -6.652 5.941) 9.265 6.791 ( 1.016 6.942 14.694) 16.283 7.345 ( 6.342 0.967 6.277) 8.975 8.263 ( 5.512 -4.439 -15.112) 16.687 8.399 ( 1.697 0.678 0.256) 1.846 8.985 ( -5.159 0.938 -8.742) 10.194 9.378 ( 2.635 0.666 -3.709) 4.598 10.058 ( 14.926 -1.053 0.293) 14.966 10.841 ( -1.918 -5.420 2.450) 6.249 10.997 ( 10.796 0.640 0.019) 10.815 11.141 ( -2.180 0.017 -4.288) 4.811 11.244 ( 7.778 3.363 6.320) 10.571 11.882 ( 0.918 -0.413 -4.066) 4.189 12.582 ( -9.611 -5.500 0.247) 11.076 12.703 ( -1.567 -4.504 0.339) 4.780 12.975 ( 4.083 -1.613 -1.122) 4.532 13.386 ( -5.767 -2.867 -3.560) 7.359 13.594 ( -0.012 2.929 -0.983) 3.089 14.134 ( -2.130 -0.069 -3.965) 4.501 14.346 ( 7.111 2.220 2.053) 7.727 15.296 ( 2.060 -0.423 5.690) 6.067 15.807 ( 3.835 -0.724 0.262) 3.911 15.868 ( 1.752 -1.294 2.139) 3.053 16.208 ( 7.447 -8.550 -3.827) 11.967 16.327 ( -2.571 -0.308 -0.225) 2.599 16.480 ( -4.512 -1.108 15.966) 16.628 17.035 ( -11.339 -8.132 -2.049) 14.104 20.602 ( 0.616 13.900 -0.889) 13.942 21.197 ( -3.318 -2.351 0.298) 4.077 21.993 ( 9.748 1.525 -3.244) 10.387 22.421 ( -10.492 2.917 -4.244) 11.688 ======================= Grid point 322 (152/227) ======================= q-point: ( 0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 9.420 0.000 1.604) 9.556 1.876 ( 6.817 0.000 13.083) 14.752 2.073 ( -1.324 -0.000 11.653) 11.728 2.489 ( 0.344 0.000 -9.853) 9.859 3.203 ( -5.757 -0.000 15.899) 16.909 3.345 ( 1.884 0.000 6.036) 6.323 3.370 ( 10.096 0.000 5.299) 11.403 3.621 ( 2.177 0.000 13.219) 13.397 3.986 ( 13.019 0.000 10.826) 16.932 4.284 ( 5.939 0.000 -8.968) 10.757 4.404 ( -3.856 -0.000 -7.514) 8.446 5.022 ( -6.591 -0.000 -5.846) 8.810 5.132 ( -4.934 -0.000 -0.530) 4.963 5.606 ( 10.330 0.000 -7.542) 12.791 6.732 ( -2.436 -0.000 20.480) 20.624 7.145 ( 14.383 0.000 -20.752) 25.249 7.283 ( -12.917 -0.000 16.551) 20.995 8.043 ( -2.296 -0.000 -23.948) 24.058 8.354 ( -2.875 -0.000 3.607) 4.613 9.220 ( 5.780 0.000 -8.334) 10.142 9.483 ( 2.761 0.000 -9.210) 9.615 10.021 ( -19.460 -0.000 -11.098) 22.402 10.546 ( -24.448 -0.000 4.160) 24.799 10.839 ( 6.091 0.000 6.614) 8.992 11.170 ( -11.285 -0.000 -0.572) 11.300 11.339 ( -4.966 -0.000 18.003) 18.675 11.425 ( 9.123 0.000 -11.326) 14.543 12.646 ( -1.001 -0.000 4.161) 4.280 12.842 ( -5.208 -0.000 -3.599) 6.331 13.068 ( 12.827 0.000 -4.871) 13.720 13.591 ( 0.681 0.000 -0.915) 1.141 13.605 ( 10.552 0.000 -4.734) 11.565 13.975 ( -3.449 -0.000 2.485) 4.251 14.403 ( -6.088 -0.000 -4.789) 7.746 15.312 ( 0.602 0.000 7.726) 7.750 15.483 ( -18.159 -0.000 8.181) 19.917 15.824 ( -4.115 -0.000 1.639) 4.429 15.845 ( -5.054 -0.000 3.861) 6.360 16.363 ( 1.845 0.000 2.062) 2.767 16.859 ( 6.223 0.000 8.417) 10.467 17.487 ( 14.828 0.000 -19.856) 24.782 20.555 ( 1.401 0.000 -0.483) 1.482 21.315 ( 7.278 0.000 -0.557) 7.299 21.611 ( -11.537 -0.000 6.502) 13.243 22.385 ( 4.583 0.000 3.335) 5.668 ======================= Grid point 323 (153/227) ======================= q-point: ( 0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 8.174 14.425 0.819) 16.600 2.056 ( 8.292 -3.276 16.865) 19.076 2.124 ( 4.192 -10.578 -0.371) 11.385 2.486 ( 0.785 1.130 -8.952) 9.057 3.206 ( 3.878 -1.878 6.413) 7.726 3.386 ( 4.261 0.704 3.391) 5.491 3.489 ( 3.368 1.603 0.070) 3.731 3.729 ( 5.766 -6.188 13.936) 16.302 4.114 ( -0.431 3.545 -7.626) 8.421 4.345 ( 9.247 0.479 4.055) 10.108 4.514 ( 5.111 -12.030 4.273) 13.751 4.908 ( -6.307 -1.470 -6.940) 9.492 5.050 ( -5.779 -3.289 4.540) 8.051 5.764 ( 9.457 1.190 -8.996) 13.107 6.689 ( -5.094 -1.447 11.685) 12.829 7.026 ( -11.924 5.786 18.247) 22.553 7.359 ( 10.257 -0.481 -16.914) 19.786 8.024 ( -0.020 0.221 -22.271) 22.272 8.307 ( -2.747 -0.294 4.878) 5.606 9.284 ( 1.194 -1.598 -6.728) 7.017 9.534 ( 3.394 0.374 -11.509) 12.005 9.676 ( -19.102 1.752 -10.696) 21.962 10.171 ( -19.922 -0.420 1.768) 20.005 10.925 ( 2.085 0.104 6.366) 6.700 10.993 ( -8.982 -0.973 6.472) 11.113 11.296 ( -0.504 1.283 13.191) 13.263 11.554 ( 7.015 1.348 -16.691) 18.155 12.525 ( -5.017 13.881 2.868) 15.036 12.762 ( -6.786 -8.025 0.711) 10.534 13.295 ( 14.699 3.343 -4.645) 15.773 13.618 ( 3.068 -1.060 -1.215) 3.466 13.775 ( 8.885 -0.221 -3.129) 9.422 13.921 ( -3.356 -0.749 4.133) 5.376 14.280 ( -10.307 -3.497 -5.432) 12.164 15.176 ( -15.613 2.278 14.847) 21.665 15.357 ( 2.658 0.186 2.584) 3.711 15.740 ( -5.992 0.772 2.396) 6.500 15.794 ( -2.514 -2.345 1.193) 3.639 16.360 ( 1.911 7.085 3.600) 8.174 16.927 ( 2.532 0.629 9.996) 10.331 17.612 ( 7.175 7.205 -19.329) 21.840 20.659 ( 0.980 -14.253 -2.231) 14.459 21.404 ( 5.824 6.906 0.912) 9.080 21.524 ( -0.923 -4.483 2.661) 5.294 22.446 ( 2.197 -1.061 4.111) 4.780 ======================= Grid point 324 (154/227) ======================= q-point: ( 0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 2.088 14.569 -0.106) 14.718 2.149 ( 1.262 -1.890 8.788) 9.077 2.375 ( 9.584 -5.796 -1.842) 11.350 2.516 ( 6.157 -0.137 -7.457) 9.672 3.313 ( 7.072 2.183 1.696) 7.593 3.471 ( 1.168 -3.540 2.049) 4.254 3.482 ( 1.805 2.483 -3.864) 4.935 3.903 ( 7.871 -5.315 11.136) 14.636 4.022 ( -2.617 4.173 -6.625) 8.256 4.449 ( -1.394 -2.833 1.872) 3.670 4.690 ( 5.257 -7.366 6.640) 11.224 4.830 ( -7.741 -2.347 -1.159) 8.171 5.132 ( 6.149 -12.667 4.097) 14.664 5.877 ( 7.475 2.449 -7.116) 10.607 6.593 ( -9.738 -4.239 -0.974) 10.665 6.839 ( -4.362 6.279 26.353) 27.440 7.478 ( 7.125 3.733 -11.973) 14.424 7.984 ( -2.183 3.740 -17.657) 18.180 8.295 ( -0.629 -3.364 3.152) 4.653 9.229 ( -11.018 3.153 -10.780) 15.734 9.391 ( -6.673 -1.202 -5.134) 8.505 9.614 ( 2.485 -0.968 -12.137) 12.427 9.945 ( -8.173 -1.975 -1.794) 8.598 10.832 ( -5.705 1.089 6.802) 8.944 10.994 ( 0.077 -2.138 7.329) 7.635 11.291 ( 0.394 1.054 10.790) 10.849 11.598 ( 3.409 5.937 -14.852) 16.354 12.302 ( -5.592 10.078 -0.217) 11.527 12.740 ( -4.339 -4.434 2.283) 6.610 13.431 ( 7.434 6.966 -3.056) 10.637 13.712 ( 3.708 -5.046 -2.663) 6.805 13.853 ( 3.039 2.481 3.659) 5.364 13.932 ( 2.392 -1.928 -3.251) 4.472 14.156 ( -10.132 -7.465 -2.570) 12.845 14.939 ( -10.993 1.443 13.091) 17.156 15.409 ( 3.749 0.638 1.695) 4.163 15.632 ( -5.410 1.475 2.368) 6.087 15.799 ( -1.944 -5.454 0.434) 5.806 16.291 ( 1.301 11.496 4.857) 12.547 16.946 ( 0.008 0.430 10.277) 10.286 17.602 ( 0.756 5.220 -14.706) 15.623 20.821 ( -1.181 -16.819 -3.419) 17.204 21.406 ( 4.075 5.886 1.056) 7.237 21.611 ( 6.763 0.671 -1.215) 6.904 22.485 ( 0.809 -1.674 4.247) 4.636 ======================= Grid point 325 (155/227) ======================= q-point: ( 0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -0.333 11.371 -0.600) 11.392 2.159 ( -2.047 -1.365 1.825) 3.063 2.474 ( 3.486 0.940 -5.886) 6.905 2.693 ( 10.598 -0.237 -0.535) 10.614 3.317 ( -2.784 6.892 -7.889) 10.839 3.444 ( 2.878 2.667 5.728) 6.943 3.588 ( 3.078 -6.241 -0.075) 6.959 3.961 ( -0.862 2.461 -4.665) 5.344 4.104 ( 10.381 -3.527 4.297) 11.776 4.420 ( -3.582 -3.565 1.809) 5.368 4.693 ( -10.129 -2.551 5.249) 11.690 4.886 ( 7.913 -6.189 2.632) 10.385 5.326 ( 1.527 -7.519 1.904) 7.905 5.980 ( 7.501 1.292 -2.782) 8.104 6.490 ( -8.820 -6.523 -2.143) 11.177 6.751 ( -0.357 6.369 25.429) 26.217 7.529 ( 6.867 6.905 -7.797) 12.475 7.872 ( -3.681 6.260 -12.660) 14.595 8.346 ( 0.308 -5.219 1.902) 5.563 8.975 ( -10.358 4.518 -7.714) 13.682 9.365 ( -3.067 -4.469 -5.560) 7.765 9.615 ( -2.195 -0.726 -11.011) 11.251 9.954 ( 5.544 -1.737 -5.836) 8.235 10.783 ( 0.487 0.107 5.692) 5.714 10.998 ( -1.885 -1.241 4.938) 5.429 11.291 ( 0.402 0.932 8.672) 8.732 11.554 ( 0.704 6.454 -3.806) 7.526 12.170 ( -1.988 3.751 -7.248) 8.400 12.709 ( -3.308 -2.025 2.004) 4.366 13.392 ( -4.778 3.654 -0.966) 6.092 13.789 ( 1.215 0.327 0.712) 1.445 13.897 ( -1.252 -5.306 -3.846) 6.672 13.941 ( 0.693 0.974 -3.167) 3.385 14.154 ( 1.895 -4.839 2.260) 5.667 14.810 ( -5.556 -2.169 10.517) 12.091 15.463 ( 3.286 0.328 -0.444) 3.332 15.555 ( -2.500 0.121 1.611) 2.977 15.837 ( -1.555 -7.744 0.256) 7.903 16.188 ( 0.672 12.114 5.333) 13.253 16.925 ( -2.344 0.771 9.930) 10.232 17.531 ( -4.945 1.062 -9.907) 11.123 20.940 ( -2.538 -13.177 -2.497) 13.649 21.425 ( 5.182 6.151 -1.215) 8.134 21.705 ( 7.913 4.567 -2.328) 9.428 22.516 ( 0.776 -1.955 3.603) 4.172 ======================= Grid point 326 (156/227) ======================= q-point: (-0.50 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.541 ( -0.917 6.364 -0.695) 6.467 2.116 ( -4.491 -0.974 1.924) 4.982 2.508 ( 3.557 3.505 -6.101) 7.884 2.813 ( 5.005 1.760 -2.057) 5.690 3.143 ( -5.443 10.678 1.123) 12.038 3.487 ( 3.475 0.897 1.509) 3.893 3.687 ( 0.166 -6.866 -1.065) 6.950 3.931 ( 0.794 2.934 -2.402) 3.874 4.290 ( 7.828 -1.968 -4.087) 9.047 4.437 ( -0.007 -4.720 3.879) 6.110 4.563 ( -6.207 -0.282 2.606) 6.738 5.060 ( 5.789 -4.327 5.052) 8.818 5.324 ( -4.386 1.047 1.738) 4.832 6.025 ( -0.146 6.137 -1.964) 6.445 6.442 ( -3.800 -5.195 4.186) 7.678 6.727 ( 1.726 1.908 21.850) 22.001 7.561 ( 7.434 10.981 -6.601) 14.813 7.773 ( -0.079 3.446 -10.227) 10.792 8.361 ( -3.151 -0.880 3.221) 4.591 8.876 ( 0.301 -3.935 -4.566) 6.035 9.347 ( -4.260 -4.001 -6.961) 9.090 9.589 ( -0.636 -0.446 -8.972) 9.005 10.100 ( 10.655 -0.453 -5.789) 12.134 10.834 ( 3.917 0.056 3.529) 5.272 10.977 ( -0.977 -1.317 1.589) 2.284 11.288 ( 0.722 2.342 4.638) 5.246 11.543 ( 1.621 -2.234 5.715) 6.347 12.135 ( 0.542 1.305 -11.540) 11.626 12.686 ( -1.801 -2.021 2.584) 3.743 13.234 ( -11.869 -0.622 0.635) 11.902 13.714 ( -9.613 -2.262 -0.851) 9.913 13.894 ( -1.389 0.866 -4.168) 4.478 14.003 ( 4.754 -1.626 -0.895) 5.103 14.250 ( 5.892 0.772 3.034) 6.672 14.811 ( -0.612 -6.927 8.080) 10.660 15.500 ( 1.374 -0.646 -3.824) 4.115 15.571 ( 2.717 -2.736 1.628) 4.185 15.897 ( -1.900 -8.907 0.145) 9.108 16.088 ( 1.253 10.091 4.876) 11.277 16.860 ( -4.922 1.107 9.639) 10.880 17.411 ( -9.901 -1.949 -5.550) 11.517 21.005 ( -2.337 -8.282 -1.134) 8.680 21.431 ( 3.891 8.295 -2.077) 9.395 21.780 ( 8.297 6.469 -3.272) 11.018 22.556 ( 1.647 -1.815 1.897) 3.099 ======================= Grid point 327 (157/227) ======================= q-point: (-0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( -2.188 1.829 0.112) 2.854 2.050 ( -4.120 -0.916 5.477) 6.915 2.508 ( 2.808 6.360 -4.868) 8.487 2.745 ( -7.874 10.107 -5.382) 13.897 3.044 ( 4.997 4.531 10.423) 12.415 3.525 ( 1.435 0.124 -2.149) 2.587 3.709 ( -4.917 -5.601 -1.945) 7.703 3.931 ( 3.164 4.517 3.519) 6.542 4.315 ( -7.191 -2.647 -0.862) 7.711 4.494 ( 7.852 5.540 -3.482) 10.221 4.582 ( 3.720 -5.348 -2.732) 7.064 5.084 ( -5.993 4.804 6.185) 9.862 5.264 ( 1.562 0.514 4.210) 4.519 5.848 ( -7.295 13.079 -2.539) 15.189 6.458 ( -0.822 -3.188 6.072) 6.907 6.780 ( 2.869 -2.315 21.691) 22.002 7.516 ( 3.629 14.104 -3.676) 15.020 7.826 ( 7.711 -0.763 -12.081) 14.353 8.308 ( -2.311 -0.332 3.860) 4.511 9.014 ( 6.006 -7.672 -2.989) 10.191 9.311 ( -3.907 -4.320 -6.769) 8.930 9.604 ( 3.213 0.104 -7.647) 8.295 10.306 ( 13.887 -1.123 -2.569) 14.167 10.845 ( -1.118 1.223 4.579) 4.870 11.053 ( 6.143 -3.678 -2.994) 7.761 11.276 ( 1.733 3.684 2.332) 4.692 11.646 ( 2.614 -8.540 4.535) 10.016 12.147 ( 1.868 -1.134 -9.315) 9.568 12.698 ( -0.281 -3.210 3.292) 4.607 13.037 ( -14.189 -3.487 1.239) 14.663 13.561 ( -13.016 -4.787 -0.710) 13.887 13.835 ( -1.912 4.453 -3.214) 5.814 14.091 ( 3.723 -1.356 -2.062) 4.466 14.320 ( 5.673 4.080 3.685) 7.900 14.924 ( 3.045 -10.382 7.665) 13.259 15.541 ( 1.645 -3.516 -7.189) 8.170 15.671 ( 4.375 -4.232 1.829) 6.356 15.902 ( -4.813 -1.698 2.571) 5.715 16.089 ( 5.645 -0.230 1.596) 5.871 16.750 ( -7.527 1.252 9.742) 12.374 17.245 ( -13.635 -3.673 -1.691) 14.222 21.034 ( -1.355 -3.792 -0.224) 4.033 21.373 ( 1.126 11.250 -1.674) 11.429 21.853 ( 8.969 6.444 -4.069) 11.770 22.601 ( 1.857 -0.714 -0.925) 2.194 ======================= Grid point 328 (158/227) ======================= q-point: (-0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( -2.964 -1.234 2.373) 3.993 2.016 ( -1.219 0.007 8.980) 9.062 2.443 ( -9.602 13.751 0.193) 16.773 2.485 ( 2.216 9.193 -1.633) 9.596 3.138 ( 6.395 -0.965 5.711) 8.628 3.521 ( -0.348 2.376 -0.440) 2.441 3.651 ( -6.966 -2.746 1.876) 7.719 3.914 ( -0.418 5.402 10.802) 12.085 4.203 ( -6.920 0.365 -0.838) 6.980 4.536 ( 5.489 10.239 -12.597) 17.136 4.700 ( 3.698 -3.796 -3.493) 6.347 4.882 ( -8.327 5.571 9.955) 14.123 5.296 ( 3.599 4.314 -0.532) 5.644 5.597 ( -6.333 11.568 -5.118) 14.147 6.475 ( -0.540 -2.822 7.483) 8.015 6.857 ( 2.169 -1.993 20.841) 21.048 7.434 ( 2.675 11.105 -0.197) 11.425 7.991 ( 9.757 -3.024 -14.549) 17.777 8.317 ( 1.052 -2.727 3.863) 4.844 9.093 ( -1.881 -0.151 -6.891) 7.144 9.339 ( 1.525 -4.059 -3.784) 5.755 9.730 ( 11.193 -3.857 -5.027) 12.862 10.559 ( 11.992 -4.543 1.674) 12.932 10.833 ( 1.343 -0.555 3.217) 3.530 11.178 ( 4.690 -1.109 -2.600) 5.476 11.284 ( 4.266 4.550 0.961) 6.311 11.764 ( 2.505 -6.576 -3.595) 7.902 12.228 ( 1.844 -9.174 -1.665) 9.505 12.705 ( -6.107 -4.224 1.746) 7.628 12.883 ( -7.189 -4.941 1.541) 8.859 13.399 ( -12.335 -5.486 -0.287) 13.503 13.753 ( -1.706 5.285 -2.974) 6.300 14.140 ( 1.083 -0.458 -3.175) 3.385 14.366 ( 5.593 4.863 3.545) 8.216 15.104 ( 5.402 -9.767 9.214) 14.473 15.622 ( 0.846 -8.983 -9.045) 12.776 15.784 ( 3.451 -4.864 1.945) 6.273 15.832 ( -3.566 -0.393 3.908) 5.305 16.229 ( 8.107 -3.112 -0.454) 8.696 16.601 ( -9.347 1.353 10.076) 13.810 17.046 ( -15.598 -4.931 2.124) 16.496 21.038 ( 0.484 1.872 0.117) 1.937 21.250 ( -1.561 11.381 -1.655) 11.606 21.943 ( 9.572 5.470 -3.889) 11.691 22.610 ( -0.781 1.686 -4.381) 4.758 ======================= Grid point 329 (159/227) ======================= q-point: (-0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -0.212 -3.890 4.555) 5.994 1.992 ( -0.784 4.720 12.172) 13.079 2.161 ( -5.118 12.628 9.747) 16.753 2.463 ( 3.279 5.606 -7.224) 9.715 3.243 ( 1.643 -4.533 0.501) 4.847 3.483 ( 1.683 5.767 6.372) 8.757 3.548 ( -6.074 1.889 13.083) 14.548 3.808 ( -5.853 4.874 13.209) 15.248 4.069 ( -7.823 4.678 3.914) 9.920 4.429 ( -1.419 14.889 -12.403) 19.430 4.650 ( -3.714 6.456 -0.774) 7.488 4.896 ( 4.547 -7.827 -2.595) 9.417 5.295 ( 5.328 9.552 -11.007) 15.518 5.432 ( -3.574 5.048 -2.795) 6.788 6.526 ( 2.239 -4.803 7.326) 9.042 6.889 ( 0.434 1.863 16.809) 16.918 7.396 ( 2.352 4.599 4.236) 6.680 8.160 ( 5.776 -4.602 -13.890) 15.731 8.377 ( 1.561 -3.023 1.682) 3.796 9.025 ( -1.853 3.159 -11.424) 11.996 9.391 ( 2.582 0.016 -3.899) 4.676 10.000 ( 14.191 -5.143 -0.593) 15.106 10.710 ( -0.572 -6.869 5.307) 8.699 10.946 ( 7.659 -4.111 0.296) 8.697 11.201 ( -0.558 4.306 -5.366) 6.902 11.320 ( 6.442 4.020 5.228) 9.219 11.864 ( 3.269 -1.865 -6.218) 7.268 12.344 ( -4.691 -15.639 0.782) 16.346 12.609 ( -6.402 -4.707 1.319) 8.055 12.892 ( -2.176 -6.993 -0.239) 7.328 13.305 ( -3.872 -4.268 -1.691) 6.006 13.680 ( -0.651 4.974 -2.355) 5.541 14.134 ( -1.715 0.089 -3.610) 3.998 14.415 ( 5.661 3.979 2.317) 7.297 15.268 ( 4.810 -3.385 7.920) 9.865 15.725 ( -1.950 -12.722 0.158) 12.871 15.835 ( 2.251 -1.555 1.051) 2.931 15.893 ( 1.142 -12.109 0.454) 12.171 16.364 ( 3.008 1.605 -2.823) 4.426 16.455 ( -4.780 -0.352 9.499) 10.640 16.863 ( -12.189 -6.672 6.849) 15.492 20.986 ( 3.345 17.031 -1.649) 17.435 21.136 ( -3.484 -0.058 -0.962) 3.615 22.051 ( 9.562 4.144 -2.635) 10.749 22.511 ( -7.585 5.074 -6.460) 11.181 ======================= Grid point 330 (160/227) ======================= q-point: (-0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( 1.861 -5.762 5.550) 8.214 1.888 ( -0.562 9.742 13.908) 16.990 2.083 ( 2.592 4.299 13.369) 14.280 2.467 ( 2.190 2.220 -9.498) 9.997 3.232 ( -5.830 -1.468 6.090) 8.558 3.417 ( -3.672 3.800 9.544) 10.909 3.537 ( 5.712 4.020 22.419) 23.482 3.697 ( -0.555 4.062 7.801) 8.813 3.820 ( -13.829 8.317 10.540) 19.275 4.259 ( -0.528 11.177 -12.219) 16.568 4.566 ( 0.592 5.900 -6.988) 9.165 5.044 ( 2.727 -7.507 -5.297) 9.583 5.252 ( 0.006 6.351 -15.679) 16.916 5.389 ( 4.115 4.159 0.131) 5.852 6.657 ( 6.822 -5.500 4.779) 9.981 6.856 ( -0.585 4.016 10.833) 11.569 7.412 ( 0.784 -0.908 9.052) 9.131 8.230 ( -2.386 -3.180 -15.061) 15.577 8.398 ( -1.456 -1.380 0.267) 2.024 9.015 ( 5.843 3.529 -13.677) 15.286 9.426 ( 2.399 0.797 -5.134) 5.723 10.237 ( 7.275 -4.533 1.469) 8.696 10.734 ( -2.551 -3.641 0.984) 4.553 11.085 ( -5.984 5.193 -4.030) 8.890 11.093 ( 3.853 -7.006 0.736) 8.029 11.395 ( 3.229 2.129 10.500) 11.190 11.793 ( -12.783 1.991 -2.488) 13.174 12.442 ( 3.235 -11.683 -2.575) 12.393 12.631 ( 0.341 -5.226 0.944) 5.321 12.937 ( -0.593 -7.942 -0.585) 7.985 13.349 ( 3.616 -2.539 -6.775) 8.089 13.632 ( 0.291 3.969 -1.648) 4.307 14.088 ( -3.227 0.250 -2.435) 4.050 14.464 ( 3.852 2.682 -0.166) 4.696 15.320 ( 0.481 0.613 4.657) 4.721 15.806 ( -1.990 -6.449 5.027) 8.415 15.865 ( -0.459 -1.251 1.896) 2.317 16.074 ( -4.967 -19.525 3.405) 20.432 16.284 ( -1.636 3.473 0.008) 3.839 16.474 ( 2.263 -5.165 2.830) 6.310 16.877 ( 5.697 -7.205 6.216) 11.091 20.819 ( 2.227 22.876 -3.992) 23.329 21.136 ( -0.157 -4.272 0.128) 4.277 22.150 ( 3.175 3.335 -1.838) 4.958 22.265 ( -10.469 6.657 -2.113) 12.585 ======================= Grid point 333 (161/227) ======================= q-point: ( 0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( 0.284 0.000 4.532) 4.541 2.036 ( -1.942 -0.000 -1.295) 2.334 2.306 ( 21.334 0.000 4.610) 21.826 2.510 ( 1.934 0.000 -7.311) 7.563 3.348 ( 13.099 0.000 0.549) 13.110 3.424 ( 0.962 0.000 -0.032) 0.962 3.521 ( -1.645 -0.000 -4.069) 4.389 3.841 ( 10.755 0.000 15.250) 18.661 4.086 ( -4.378 -0.000 -8.016) 9.133 4.400 ( -1.613 -0.000 2.635) 3.089 4.605 ( 6.427 0.000 9.958) 11.852 4.817 ( -1.645 -0.000 -7.091) 7.279 4.978 ( 1.738 0.000 8.532) 8.708 5.909 ( 7.626 0.000 -8.270) 11.249 6.542 ( -11.840 -0.000 -1.404) 11.923 6.904 ( -5.250 -0.000 27.229) 27.731 7.520 ( 8.951 0.000 -13.775) 16.428 8.026 ( 0.239 0.000 -21.599) 21.601 8.258 ( -3.003 -0.000 6.155) 6.849 9.247 ( -5.774 -0.000 -7.601) 9.546 9.392 ( -13.097 -0.000 -6.991) 14.846 9.602 ( 3.398 0.000 -13.617) 14.034 9.926 ( -8.446 -0.000 -1.011) 8.506 10.847 ( -6.417 -0.000 7.969) 10.231 10.969 ( 1.066 0.000 6.634) 6.719 11.303 ( -0.076 -0.000 14.035) 14.035 11.660 ( 5.119 0.000 -19.754) 20.407 12.465 ( -13.181 -0.000 1.831) 13.308 12.640 ( -0.170 -0.000 2.075) 2.082 13.552 ( 13.873 0.000 -4.755) 14.665 13.618 ( -2.969 -0.000 -1.020) 3.140 13.888 ( 1.589 0.000 5.172) 5.411 13.906 ( 6.039 0.000 -3.940) 7.211 14.059 ( -13.121 -0.000 -5.002) 14.042 14.954 ( -12.850 -0.000 13.912) 18.938 15.418 ( 3.930 0.000 1.946) 4.385 15.650 ( -5.585 -0.000 1.029) 5.679 15.743 ( -2.199 -0.000 2.426) 3.274 16.433 ( 1.805 0.000 6.087) 6.350 16.925 ( -2.568 -0.000 12.112) 12.382 17.680 ( -1.621 -0.000 -20.043) 20.109 20.625 ( 2.897 0.000 -0.529) 2.945 21.468 ( 1.461 0.000 1.087) 1.821 21.623 ( 10.943 0.000 -1.735) 11.079 22.465 ( 0.722 0.000 4.394) 4.453 ======================= Grid point 334 (162/227) ======================= q-point: ( 0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( -3.408 11.551 -1.012) 12.085 2.078 ( -4.063 -7.081 1.319) 8.270 2.524 ( 5.327 3.828 -5.844) 8.786 2.669 ( 16.291 -2.499 0.061) 16.482 3.410 ( -2.584 0.433 -3.966) 4.753 3.475 ( -2.012 0.030 -3.176) 3.760 3.564 ( 13.043 4.409 0.917) 13.799 3.999 ( -1.562 1.422 -5.270) 5.678 4.050 ( 9.967 -2.445 9.719) 14.134 4.357 ( -3.553 -1.518 5.082) 6.384 4.622 ( -5.719 -4.022 7.028) 9.913 4.830 ( 5.040 0.877 -1.041) 5.221 5.141 ( 7.966 -7.808 5.673) 12.514 6.014 ( 7.093 1.430 -5.386) 9.020 6.362 ( -11.100 -4.195 -5.084) 12.910 6.861 ( -0.157 3.282 26.623) 26.824 7.634 ( 7.670 2.977 -7.736) 11.293 7.985 ( -2.236 4.105 -17.914) 18.514 8.238 ( -1.683 -4.224 4.409) 6.334 9.060 ( -11.551 2.693 -6.597) 13.572 9.295 ( -2.780 -2.039 -5.700) 6.662 9.595 ( -3.365 -0.783 -13.046) 13.496 9.927 ( 6.881 -0.704 -4.067) 8.024 10.794 ( 0.176 0.569 7.095) 7.120 10.973 ( -1.269 -0.898 5.107) 5.339 11.302 ( -0.533 0.326 14.315) 14.328 11.691 ( 2.047 4.645 -14.696) 15.548 12.243 ( -9.613 3.103 1.920) 10.282 12.646 ( -2.191 -3.216 -2.236) 4.488 13.472 ( -10.432 3.187 -0.258) 10.911 13.763 ( 7.960 -2.313 -4.329) 9.352 13.821 ( -11.136 -0.823 -5.056) 12.257 13.971 ( 5.606 1.571 0.194) 5.825 14.036 ( 5.544 -5.414 0.708) 7.781 14.782 ( -8.765 -0.646 12.149) 14.995 15.473 ( 2.808 0.425 -0.617) 2.907 15.568 ( -3.556 0.727 1.548) 3.946 15.731 ( -1.090 -2.871 2.652) 4.057 16.412 ( 0.449 8.201 8.061) 11.508 16.879 ( -5.736 -3.895 12.445) 14.246 17.581 ( -6.968 2.592 -16.210) 17.834 20.713 ( 2.506 -6.997 -0.793) 7.474 21.513 ( 5.071 2.190 -1.879) 5.835 21.790 ( 10.861 2.811 -2.377) 11.468 22.480 ( 0.311 -1.224 4.263) 4.446 ======================= Grid point 335 (163/227) ======================= q-point: ( 0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -4.043 9.729 -2.061) 10.735 2.059 ( -5.586 -5.152 0.931) 7.656 2.570 ( 4.794 2.887 -6.879) 8.868 2.871 ( 8.154 3.069 -0.094) 8.713 3.324 ( -5.261 3.693 -2.265) 6.815 3.470 ( 0.971 -0.840 -3.294) 3.535 3.652 ( 4.116 4.461 4.849) 7.769 3.992 ( 4.068 2.984 -4.555) 6.797 4.251 ( 8.464 -5.116 2.109) 10.112 4.346 ( 0.263 0.038 4.615) 4.623 4.553 ( -4.415 -1.686 6.184) 7.783 4.959 ( 6.660 -4.836 4.849) 9.553 5.289 ( 2.066 -3.724 1.638) 4.563 6.108 ( 5.130 2.595 -2.872) 6.426 6.279 ( -5.775 -8.217 -3.434) 10.614 6.835 ( 1.505 6.248 24.812) 25.631 7.721 ( 8.589 5.005 -4.521) 10.920 7.877 ( -2.948 5.956 -13.411) 14.968 8.277 ( -1.466 -6.388 3.784) 7.568 8.880 ( -5.460 2.914 -2.841) 6.810 9.283 ( -1.652 -2.281 -9.442) 9.853 9.552 ( -2.557 -2.716 -10.522) 11.164 10.086 ( 10.688 -0.606 -3.575) 11.287 10.843 ( 5.743 0.776 2.051) 6.148 10.956 ( -1.840 -0.941 3.165) 3.780 11.295 ( -0.710 -0.523 15.119) 15.145 11.628 ( -0.236 8.130 -3.923) 9.030 12.128 ( -3.811 -1.779 -5.065) 6.584 12.631 ( -3.140 -3.402 -4.092) 6.179 13.236 ( -15.395 0.810 0.233) 15.418 13.624 ( -14.210 -5.254 -2.933) 15.432 13.912 ( 6.926 1.545 -4.568) 8.440 14.009 ( 2.418 1.177 -0.021) 2.689 14.215 ( 8.690 -3.519 1.033) 9.432 14.700 ( -4.335 -3.722 9.302) 10.917 15.495 ( 0.060 -0.028 -3.156) 3.156 15.542 ( 1.142 -0.431 1.788) 2.166 15.764 ( 0.368 -4.433 2.465) 5.085 16.307 ( -1.078 10.965 8.351) 13.825 16.822 ( -7.717 -5.193 12.222) 15.359 17.410 ( -10.368 1.686 -11.479) 15.560 20.822 ( 1.283 -7.943 -0.708) 8.077 21.572 ( 6.011 4.869 -3.206) 8.374 21.915 ( 9.953 6.018 -2.750) 11.951 22.509 ( 1.038 -2.417 2.934) 3.940 ======================= Grid point 336 (164/227) ======================= q-point: (-0.50 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( -4.157 6.325 -2.832) 8.082 2.013 ( -4.651 -3.252 3.246) 6.538 2.608 ( 3.743 3.547 -6.679) 8.438 2.898 ( 0.901 5.769 -3.072) 6.598 3.176 ( -5.840 4.903 5.309) 9.292 3.515 ( 4.354 0.815 -1.138) 4.573 3.650 ( -1.788 -0.306 2.357) 2.974 4.048 ( 8.123 7.040 -0.058) 10.750 4.298 ( -5.176 1.315 2.774) 6.018 4.432 ( 5.586 -7.748 -0.154) 9.553 4.573 ( 5.464 0.921 1.009) 5.633 5.096 ( 2.425 -3.319 5.362) 6.757 5.305 ( 1.469 3.140 2.324) 4.173 6.066 ( -3.395 7.139 -1.361) 8.021 6.331 ( -0.214 -7.832 -1.876) 8.057 6.814 ( 2.373 5.344 25.235) 25.903 7.761 ( 0.728 9.279 -7.040) 11.670 7.836 ( 7.665 1.738 -7.872) 11.124 8.283 ( -3.747 -2.900 5.070) 6.939 8.872 ( 4.315 -4.581 -0.941) 6.363 9.265 ( -1.746 -0.530 -11.963) 12.101 9.569 ( 0.827 -3.942 -8.282) 9.209 10.273 ( 10.890 -1.612 0.495) 11.020 10.891 ( -0.452 2.989 -0.089) 3.025 10.986 ( 5.894 -2.676 -1.144) 6.574 11.315 ( 1.521 -0.880 12.641) 12.763 11.572 ( 1.365 3.011 1.819) 3.774 12.117 ( -0.978 -2.878 -9.665) 10.132 12.623 ( -2.417 -4.696 -2.872) 6.012 12.969 ( -17.833 -2.512 0.606) 18.019 13.450 ( -13.592 -5.456 -0.479) 14.655 13.922 ( -0.388 4.080 -4.157) 5.838 14.077 ( 5.086 -0.062 -0.449) 5.106 14.360 ( 6.506 -0.085 2.033) 6.817 14.725 ( -0.431 -8.369 6.893) 10.851 15.489 ( -1.285 -1.672 -5.300) 5.704 15.609 ( 5.049 -2.095 1.545) 5.680 15.821 ( 0.446 -4.134 2.325) 4.764 16.194 ( -0.160 8.127 6.466) 10.387 16.733 ( -9.389 -3.912 12.091) 15.800 17.208 ( -12.449 0.443 -6.765) 14.176 20.908 ( 0.206 -6.641 -0.265) 6.650 21.591 ( 4.418 8.712 -2.535) 10.091 21.999 ( 9.125 7.492 -2.878) 12.152 22.563 ( 2.047 -2.774 -0.191) 3.453 ======================= Grid point 337 (165/227) ======================= q-point: (-0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( -4.449 2.784 -1.988) 5.612 1.995 ( -0.675 -2.039 5.500) 5.904 2.607 ( 1.615 5.544 -6.853) 8.962 2.753 ( -6.111 12.686 1.891) 14.208 3.113 ( -0.506 -1.823 2.515) 3.147 3.584 ( 5.816 2.911 4.287) 7.789 3.607 ( -3.666 -0.298 1.991) 4.183 4.057 ( -0.213 8.314 10.679) 13.535 4.221 ( 0.236 2.173 -5.316) 5.748 4.584 ( 3.998 -6.821 -0.224) 7.910 4.662 ( 6.355 2.273 -5.766) 8.877 5.033 ( -6.501 7.033 4.599) 10.624 5.357 ( 7.870 3.464 3.389) 9.242 5.879 ( -5.689 13.875 -2.335) 15.177 6.384 ( -1.991 -6.567 -0.090) 6.863 6.833 ( 2.405 1.049 25.791) 25.924 7.655 ( -1.262 9.861 -2.578) 10.270 7.967 ( 9.163 0.489 -10.118) 13.659 8.259 ( -1.696 -2.855 4.883) 5.906 9.055 ( 7.443 -5.771 -3.295) 9.978 9.245 ( 0.292 -1.793 -10.141) 10.302 9.653 ( 5.168 -4.720 -6.532) 9.574 10.463 ( 7.273 -4.564 5.410) 10.149 10.848 ( 0.386 2.216 -1.315) 2.605 11.141 ( 8.353 -2.525 -1.120) 8.798 11.365 ( 5.418 2.322 5.532) 8.084 11.608 ( 0.781 -5.463 0.945) 5.598 12.128 ( -1.024 -2.827 -8.437) 8.957 12.625 ( -5.701 -4.098 -1.249) 7.131 12.736 ( -14.704 -8.852 0.355) 17.167 13.299 ( -9.929 -3.969 1.538) 10.803 13.857 ( -1.432 4.942 -3.133) 6.024 14.137 ( 2.164 0.274 -1.817) 2.839 14.437 ( 4.588 2.090 2.733) 5.735 14.856 ( 2.752 -13.033 7.054) 15.073 15.483 ( -2.899 -4.103 -6.076) 7.884 15.728 ( 6.135 -1.775 1.200) 6.498 15.830 ( -2.367 -0.409 3.350) 4.122 16.195 ( 5.972 0.262 2.143) 6.350 16.606 ( -10.142 -2.113 12.097) 15.927 16.993 ( -13.188 0.086 -2.272) 13.382 20.963 ( -0.601 -5.153 0.209) 5.192 21.535 ( 2.057 12.731 -1.168) 12.949 22.071 ( 8.886 6.933 -2.816) 11.618 22.615 ( 1.095 -1.254 -4.295) 4.606 ======================= Grid point 338 (166/227) ======================= q-point: (-0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.376 ( -1.995 -0.767 0.392) 2.173 2.030 ( 2.716 -0.370 6.198) 6.777 2.450 ( -7.546 14.159 3.097) 16.340 2.608 ( 1.945 8.363 -3.952) 9.452 3.144 ( -1.034 -5.134 -0.869) 5.309 3.543 ( -4.233 0.107 4.848) 6.437 3.640 ( 6.197 6.553 11.655) 14.737 3.914 ( -6.958 5.762 12.402) 15.344 4.213 ( 3.441 9.242 -3.459) 10.451 4.682 ( 0.839 7.720 -10.534) 13.087 4.712 ( 3.882 -6.080 -4.694) 8.606 4.839 ( -4.753 8.556 8.503) 12.965 5.446 ( 8.491 6.384 -1.343) 10.707 5.633 ( -5.864 14.274 -5.932) 16.532 6.419 ( -0.837 -6.609 3.237) 7.406 6.878 ( 1.192 -1.442 23.781) 23.854 7.529 ( -2.756 8.029 2.178) 8.764 8.100 ( 6.503 -1.368 -11.509) 13.290 8.296 ( 0.796 -4.519 3.464) 5.749 9.108 ( 2.014 4.680 -14.930) 15.775 9.348 ( 4.435 -4.866 -3.133) 7.292 9.853 ( 10.324 -9.147 -2.909) 14.097 10.573 ( -0.372 -6.638 8.236) 10.584 10.888 ( 4.424 -0.841 -1.862) 4.873 11.261 ( 4.421 1.296 1.156) 4.750 11.419 ( 4.322 5.942 -0.717) 7.382 11.741 ( 6.496 -11.664 -2.239) 13.538 12.108 ( -7.611 -5.271 -2.976) 9.724 12.505 ( -8.580 -5.582 0.363) 10.243 12.691 ( -8.664 -12.744 -1.530) 15.487 13.239 ( -0.582 -2.069 1.286) 2.505 13.783 ( -1.070 5.188 -2.441) 5.832 14.140 ( -0.952 0.595 -2.758) 2.978 14.483 ( 3.923 2.485 2.098) 5.096 15.072 ( 4.914 -16.334 9.642) 19.593 15.461 ( -6.063 -5.980 -3.130) 9.073 15.800 ( -0.657 -0.971 1.467) 1.878 15.825 ( 3.708 -0.702 1.201) 3.961 16.339 ( 6.754 -2.916 -1.971) 7.616 16.474 ( -6.531 -0.090 11.688) 13.389 16.788 ( -10.757 -0.421 2.863) 11.139 20.997 ( -0.875 -4.405 0.557) 4.526 21.413 ( 0.934 15.766 -1.202) 15.839 22.151 ( 8.543 5.495 -2.004) 10.354 22.593 ( -3.547 2.581 -7.754) 8.909 ======================= Grid point 339 (167/227) ======================= q-point: (-0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 0.892 -3.764 2.677) 4.704 2.068 ( 3.387 5.283 7.449) 9.740 2.225 ( -2.394 11.098 7.200) 13.444 2.552 ( 0.236 6.678 -6.782) 9.521 3.162 ( -3.126 -5.089 1.015) 6.058 3.473 ( -3.556 1.612 9.442) 10.217 3.648 ( -0.121 5.433 16.684) 17.547 3.787 ( 0.441 5.666 9.261) 10.866 4.100 ( -0.414 17.702 3.616) 18.072 4.524 ( -4.170 13.539 -11.196) 18.056 4.719 ( 2.142 8.111 0.032) 8.389 4.875 ( 3.960 -8.281 -3.534) 9.835 5.410 ( -4.881 9.211 -12.935) 16.613 5.508 ( 6.521 7.993 0.198) 10.318 6.521 ( 4.313 -8.502 3.175) 10.048 6.899 ( -0.963 0.131 18.972) 18.997 7.421 ( -3.651 2.666 7.260) 8.552 8.181 ( 1.780 -1.472 -12.457) 12.670 8.344 ( -0.736 -3.645 0.529) 3.756 9.108 ( 5.930 5.507 -17.345) 19.140 9.431 ( 2.926 -0.852 -4.961) 5.823 10.085 ( 3.059 -10.655 -0.543) 11.099 10.648 ( 2.950 -5.354 7.324) 9.540 10.958 ( 0.477 -4.605 -1.292) 4.807 11.201 ( -6.511 5.688 -2.315) 8.950 11.435 ( 1.813 1.897 4.212) 4.963 11.850 ( -9.312 3.503 -3.219) 10.457 12.108 ( 2.175 -19.396 -0.326) 19.520 12.520 ( 2.011 -6.215 0.307) 6.539 12.714 ( -2.606 -13.745 0.179) 13.991 13.303 ( 4.672 -1.872 -3.601) 6.188 13.721 ( -0.196 4.746 -2.105) 5.196 14.099 ( -2.748 0.893 -2.307) 3.698 14.517 ( 2.858 2.184 0.339) 3.613 15.315 ( 5.246 -7.344 8.285) 12.251 15.428 ( -8.884 -18.160 5.485) 20.948 15.842 ( 1.959 -4.132 -1.086) 4.700 15.852 ( -1.236 -0.424 1.901) 2.307 16.371 ( -0.043 -1.826 4.535) 4.889 16.401 ( -6.310 3.760 1.267) 7.454 16.774 ( 7.800 -4.188 6.320) 10.877 21.033 ( -0.082 -4.796 0.710) 4.849 21.258 ( 1.289 18.233 -3.304) 18.575 22.229 ( 5.887 4.184 -1.459) 7.368 22.424 ( -9.574 8.000 -6.857) 14.236 ======================= Grid point 340 (168/227) ======================= q-point: (-0.10 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 1.650 -5.867 5.177) 7.997 2.042 ( 4.975 11.316 7.693) 14.560 2.156 ( 0.924 5.352 10.795) 12.085 2.490 ( -1.392 1.703 -8.533) 8.812 3.168 ( 0.041 -2.894 6.217) 6.858 3.400 ( -4.313 2.272 14.158) 14.974 3.542 ( -5.235 4.844 7.367) 10.254 3.782 ( 1.177 6.666 10.090) 12.150 3.954 ( 9.797 17.858 7.028) 21.548 4.330 ( -2.989 10.189 -8.721) 13.741 4.679 ( 2.559 9.317 -1.985) 9.864 5.000 ( 1.141 -6.164 -6.222) 8.832 5.268 ( -2.980 4.904 -8.809) 10.514 5.529 ( 5.679 6.254 -2.704) 8.870 6.725 ( 8.240 -9.251 3.617) 12.906 6.857 ( -2.868 1.349 10.468) 10.938 7.365 ( -3.701 -1.865 10.309) 11.111 8.160 ( -3.587 1.313 -18.622) 19.009 8.352 ( -1.330 -2.180 1.248) 2.842 9.174 ( 8.059 4.030 -15.043) 17.535 9.469 ( 2.277 0.892 -6.848) 7.272 10.123 ( -10.741 -10.046 -3.038) 15.018 10.741 ( 0.893 -0.277 3.346) 3.474 10.942 ( -9.936 0.120 1.758) 10.091 11.085 ( 0.735 -4.906 0.726) 5.013 11.385 ( -5.642 2.682 3.077) 6.964 11.598 ( -12.254 2.885 2.120) 12.766 12.331 ( -0.280 -16.392 0.702) 16.410 12.683 ( 11.218 -4.774 -2.181) 12.385 12.875 ( 4.734 -10.158 0.849) 11.239 13.399 ( 5.137 -1.906 -7.139) 8.999 13.683 ( 1.176 4.129 -2.254) 4.849 14.040 ( -3.102 0.917 -0.227) 3.243 14.519 ( -0.200 2.496 -1.757) 3.059 15.324 ( -1.582 0.826 5.523) 5.804 15.535 ( -11.589 -19.328 9.505) 24.459 15.824 ( -2.674 -3.225 3.084) 5.202 15.910 ( 0.336 -2.733 -0.133) 2.757 16.249 ( -6.104 0.553 1.905) 6.418 16.509 ( 10.947 -7.790 3.964) 14.008 17.019 ( 14.902 -4.380 1.757) 15.632 21.079 ( 0.439 16.626 -6.395) 17.819 21.106 ( 3.394 -0.942 0.376) 3.543 22.040 ( -16.432 10.849 -2.770) 19.884 22.347 ( 5.821 3.475 2.300) 7.159 ======================= Grid point 344 (169/227) ======================= q-point: ( 0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -6.908 -0.000 -5.805) 9.023 1.931 ( -4.456 -0.000 3.814) 5.866 2.605 ( 3.751 0.000 -6.219) 7.263 2.907 ( 10.665 0.000 0.224) 10.667 3.318 ( -7.953 -0.000 -2.925) 8.474 3.480 ( 4.316 0.000 -3.693) 5.680 3.744 ( -0.190 -0.000 2.613) 2.620 4.039 ( 10.412 0.000 -7.325) 12.730 4.146 ( 3.625 0.000 6.087) 7.085 4.400 ( 7.620 0.000 9.644) 12.291 4.504 ( -6.359 -0.000 6.639) 9.193 4.903 ( 4.204 0.000 2.099) 4.699 5.238 ( 7.424 0.000 2.892) 7.967 6.135 ( 7.052 0.000 -3.503) 7.874 6.187 ( -7.153 -0.000 -5.053) 8.758 6.907 ( 2.005 0.000 24.659) 24.741 7.772 ( 7.641 0.000 -2.795) 8.137 7.955 ( -3.849 -0.000 -16.017) 16.473 8.188 ( -0.987 -0.000 4.921) 5.019 8.921 ( -6.614 -0.000 -1.894) 6.880 9.259 ( -0.001 -0.000 -10.645) 10.645 9.516 ( -4.330 -0.000 -11.640) 12.420 10.080 ( 10.853 0.000 -2.824) 11.215 10.855 ( 6.138 0.000 2.481) 6.621 10.943 ( -1.595 -0.000 3.177) 3.555 11.290 ( -1.639 -0.000 17.769) 17.844 11.740 ( 1.137 0.000 -11.103) 11.162 12.097 ( -8.228 -0.000 5.278) 9.775 12.583 ( -3.880 -0.000 -9.332) 10.106 13.251 ( -16.736 -0.000 -0.065) 16.736 13.562 ( -13.986 -0.000 -3.577) 14.436 13.936 ( 8.822 0.000 -5.029) 10.155 14.026 ( 0.891 0.000 -1.184) 1.481 14.163 ( 11.019 0.000 1.237) 11.088 14.663 ( -5.621 -0.000 9.923) 11.405 15.495 ( -0.371 -0.000 -2.827) 2.851 15.541 ( 0.008 0.000 1.685) 1.685 15.719 ( 1.302 0.000 3.611) 3.839 16.457 ( -1.184 -0.000 10.734) 10.799 16.726 ( -9.746 -0.000 11.830) 15.327 17.437 ( -10.836 -0.000 -13.630) 17.413 20.736 ( 3.638 0.000 -0.087) 3.639 21.621 ( 6.603 0.000 -3.814) 7.625 21.982 ( 10.413 0.000 -3.104) 10.866 22.480 ( 0.569 0.000 3.850) 3.892 ======================= Grid point 345 (170/227) ======================= q-point: (-0.60 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -6.843 7.148 -4.816) 11.006 1.917 ( -3.365 -5.663 2.433) 7.023 2.654 ( 3.065 1.101 -6.599) 7.359 2.991 ( 2.870 3.154 0.547) 4.299 3.175 ( -10.300 -2.345 -1.461) 10.664 3.586 ( 7.901 3.507 -0.256) 8.648 3.663 ( -4.110 0.912 3.365) 5.390 4.184 ( 9.798 5.021 -1.132) 11.068 4.281 ( 6.738 -4.265 -2.955) 8.504 4.379 ( -3.797 3.799 8.564) 10.109 4.551 ( 6.032 -2.220 7.994) 10.258 5.002 ( 4.880 -4.258 2.447) 6.923 5.355 ( 7.282 1.483 1.047) 7.505 6.106 ( -4.268 -1.748 -2.253) 5.133 6.241 ( 4.932 -0.617 -3.320) 5.977 6.929 ( 1.645 4.134 25.390) 25.776 7.862 ( -2.070 2.617 -10.310) 10.837 7.892 ( 6.344 1.485 -1.653) 6.722 8.204 ( -0.509 -3.340 4.125) 5.333 8.850 ( -0.791 0.952 0.466) 1.322 9.271 ( 1.702 0.671 -16.134) 16.237 9.472 ( -2.340 -4.089 -9.206) 10.342 10.254 ( 9.845 -0.366 1.371) 9.947 10.934 ( 0.351 0.360 1.081) 1.193 10.959 ( 6.044 0.361 -3.949) 7.229 11.284 ( 0.303 -1.042 21.031) 21.059 11.706 ( 0.179 7.213 -3.390) 7.972 12.030 ( -3.141 -4.823 -0.857) 5.819 12.514 ( -6.340 -4.450 -11.827) 14.138 12.954 ( -18.788 0.372 -0.867) 18.811 13.367 ( -11.209 -2.357 -0.111) 11.454 13.987 ( -0.445 1.943 -4.431) 4.858 14.083 ( 5.859 0.394 -0.197) 5.875 14.337 ( 8.533 -1.276 0.124) 8.628 14.612 ( -2.567 -2.746 7.043) 7.983 15.469 ( -2.454 -0.459 -3.463) 4.269 15.582 ( 4.756 -0.656 1.705) 5.095 15.763 ( 2.585 -1.455 2.516) 3.889 16.370 ( -3.722 8.368 10.529) 13.955 16.604 ( -10.618 -7.507 11.078) 17.083 17.238 ( -11.565 1.441 -9.530) 15.055 20.807 ( 2.849 -2.805 0.340) 4.013 21.709 ( 5.688 3.008 -3.473) 7.312 22.119 ( 8.741 3.601 -3.464) 10.069 22.509 ( 1.713 -1.950 1.640) 3.071 ======================= Grid point 346 (171/227) ======================= q-point: (-0.50 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -6.358 5.504 -4.818) 9.692 1.937 ( 0.246 -3.564 3.512) 5.009 2.671 ( 0.401 0.848 -7.134) 7.195 2.944 ( -4.222 6.311 1.451) 7.730 3.072 ( -2.955 -1.707 1.363) 3.675 3.568 ( -3.503 -0.956 4.078) 5.460 3.702 ( 7.525 5.386 2.441) 9.571 4.202 ( -6.500 5.314 11.326) 14.098 4.310 ( 9.900 4.875 -7.741) 13.479 4.460 ( 6.025 -3.431 1.141) 7.027 4.658 ( 4.187 -1.847 4.159) 6.184 5.098 ( 1.808 -0.644 -0.870) 2.107 5.456 ( 10.037 5.650 2.207) 11.728 6.054 ( -3.022 1.647 0.277) 3.453 6.282 ( -0.952 -1.019 -4.007) 4.242 6.901 ( -0.146 4.749 28.801) 29.190 7.792 ( -2.050 3.545 -6.933) 8.052 7.998 ( 7.641 1.740 -2.349) 8.181 8.211 ( -1.674 -1.559 4.189) 4.773 8.916 ( 6.799 -5.268 1.031) 8.663 9.274 ( 1.653 2.788 -19.148) 19.420 9.519 ( 0.729 -7.934 -7.178) 10.724 10.398 ( 5.774 -1.706 5.053) 7.860 10.919 ( 1.268 4.443 -0.229) 4.626 11.079 ( 8.113 -3.369 -2.442) 9.118 11.343 ( 3.293 -2.605 16.498) 17.024 11.637 ( 0.286 6.569 -1.850) 6.831 12.051 ( -1.446 -5.438 -6.525) 8.616 12.463 ( -8.678 -10.197 -9.589) 16.469 12.646 ( -18.182 -0.477 -1.384) 18.241 13.245 ( -5.986 -1.601 3.283) 7.012 13.942 ( -1.377 3.219 -2.653) 4.393 14.150 ( 2.768 0.821 -0.843) 3.007 14.454 ( 4.900 -0.153 0.724) 4.956 14.645 ( 0.142 -7.257 4.994) 8.810 15.434 ( -2.455 -1.283 -3.261) 4.279 15.699 ( 7.539 -1.066 0.972) 7.676 15.813 ( 0.931 -1.037 2.196) 2.601 16.247 ( -1.302 4.671 5.945) 7.672 16.510 ( -10.541 -6.666 12.164) 17.422 17.032 ( -10.651 2.671 -5.471) 12.268 20.874 ( 1.365 -3.320 0.832) 3.685 21.730 ( 2.771 6.699 -1.247) 7.356 22.200 ( 7.194 5.316 -3.071) 9.458 22.570 ( 2.375 -2.674 -2.770) 4.524 ======================= Grid point 347 (172/227) ======================= q-point: (-0.40 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -3.636 3.124 -3.388) 5.870 2.001 ( 3.812 -2.133 3.080) 5.345 2.628 ( -5.061 1.994 -4.465) 7.038 2.793 ( -1.571 9.478 1.655) 9.748 3.071 ( -0.332 -0.923 1.453) 1.753 3.530 ( -3.117 -1.177 3.900) 5.129 3.757 ( 4.959 4.909 6.387) 9.460 4.036 ( -6.189 6.345 11.319) 14.377 4.406 ( 9.680 8.378 -7.787) 14.984 4.576 ( 2.870 -5.230 2.607) 6.510 4.731 ( 2.624 -1.432 -2.367) 3.813 5.049 ( -1.351 9.586 0.395) 9.689 5.574 ( 10.830 6.124 -0.663) 12.459 5.929 ( -4.532 12.748 -0.987) 13.566 6.266 ( -3.957 -7.026 -1.177) 8.149 6.874 ( -0.753 1.056 29.979) 30.007 7.688 ( -4.436 7.007 -0.099) 8.294 8.096 ( 5.796 0.711 -6.305) 8.594 8.218 ( 0.609 -2.644 2.974) 4.026 9.134 ( 9.256 -6.391 -3.069) 11.659 9.268 ( 2.554 1.908 -17.947) 18.228 9.645 ( 3.347 -11.257 -5.017) 12.771 10.468 ( 0.014 -3.319 6.380) 7.192 10.924 ( 4.533 4.324 1.634) 6.474 11.256 ( 7.682 -1.911 0.837) 7.961 11.480 ( 6.944 -9.314 9.189) 14.812 11.563 ( -1.675 5.993 -5.533) 8.327 12.057 ( -4.251 -2.720 -5.929) 7.786 12.387 ( -13.101 -8.727 -1.961) 15.863 12.428 ( -10.773 -8.979 -5.676) 15.129 13.217 ( 1.141 -0.408 3.957) 4.138 13.881 ( -1.241 4.321 -1.607) 4.775 14.157 ( -0.443 0.988 -1.651) 1.974 14.511 ( 2.684 0.460 1.150) 2.956 14.760 ( 1.198 -12.555 4.888) 13.526 15.414 ( -1.214 -0.613 -0.726) 1.542 15.797 ( -1.439 0.412 1.954) 2.462 15.817 ( 4.304 -0.128 0.579) 4.344 16.282 ( 5.506 -2.247 -1.343) 6.097 16.414 ( -7.346 -4.911 14.457) 16.944 16.837 ( -8.661 3.996 -1.988) 9.743 20.918 ( -0.047 -3.251 1.238) 3.479 21.668 ( 0.140 9.774 0.641) 9.796 22.257 ( 6.217 4.699 -2.388) 8.150 22.612 ( 0.158 -0.445 -6.990) 7.006 ======================= Grid point 348 (173/227) ======================= q-point: (-0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 0.362 0.258 -1.458) 1.525 2.098 ( 5.834 -0.808 1.009) 5.976 2.463 ( -5.755 9.308 3.212) 11.405 2.719 ( 1.337 8.795 -3.428) 9.533 3.066 ( -2.155 -2.677 2.411) 4.198 3.488 ( -2.810 0.196 6.048) 6.671 3.739 ( -2.972 3.802 9.316) 10.491 3.919 ( 0.588 7.046 10.894) 12.988 4.433 ( 6.762 13.273 -6.222) 16.144 4.659 ( -0.834 -4.484 1.682) 4.861 4.762 ( 2.683 1.617 -12.098) 12.496 4.925 ( 1.763 12.197 6.871) 14.110 5.611 ( -4.182 9.131 -9.995) 14.169 5.720 ( 4.023 13.736 1.819) 14.429 6.318 ( -0.739 -11.052 1.921) 11.242 6.878 ( -0.790 -1.738 27.610) 27.676 7.522 ( -6.596 6.871 4.875) 10.700 8.164 ( 2.932 -0.428 -7.823) 8.365 8.272 ( 1.403 -3.057 -0.143) 3.366 9.225 ( 5.637 5.812 -20.840) 22.358 9.369 ( 4.497 -5.598 -4.639) 8.549 9.825 ( 0.474 -14.583 -2.258) 14.764 10.528 ( 3.676 -5.463 6.244) 9.075 10.942 ( 0.831 2.807 2.256) 3.696 11.295 ( -3.986 3.359 1.965) 5.571 11.462 ( -3.806 -0.611 -5.012) 6.323 11.758 ( 6.541 -12.409 3.560) 14.472 11.920 ( -8.191 2.870 -3.000) 9.183 12.379 ( 1.569 -7.693 -0.233) 7.855 12.411 ( -4.407 -15.656 -2.595) 16.470 13.275 ( 4.197 -1.022 0.130) 4.321 13.818 ( -0.735 4.730 -1.210) 4.938 14.122 ( -2.172 1.266 -1.775) 3.078 14.541 ( 1.326 0.144 0.673) 1.494 14.924 ( -0.527 -17.700 6.409) 18.832 15.396 ( -0.626 1.816 3.251) 3.776 15.793 ( 1.693 -1.192 -0.561) 2.145 15.846 ( -1.477 -0.233 1.583) 2.178 16.307 ( -3.697 -2.703 3.420) 5.716 16.475 ( 4.240 0.012 4.927) 6.500 16.719 ( 1.541 0.121 1.614) 2.235 20.945 ( -0.664 -3.712 1.380) 4.016 21.553 ( -0.784 11.506 0.521) 11.544 22.306 ( 4.260 3.176 -1.806) 5.613 22.555 ( -4.393 4.786 -8.526) 10.719 ======================= Grid point 349 (174/227) ======================= q-point: (-0.20 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 1.649 -1.672 1.036) 2.567 2.195 ( 6.342 2.227 -0.471) 6.738 2.314 ( -0.104 9.728 5.983) 11.421 2.602 ( -3.912 10.058 -2.034) 10.981 3.086 ( 0.855 -4.466 2.801) 5.341 3.437 ( -3.148 1.371 10.592) 11.135 3.632 ( -3.933 4.481 6.280) 8.659 3.896 ( 2.505 5.424 9.048) 10.842 4.357 ( 4.257 18.594 -5.270) 19.790 4.558 ( -5.669 8.792 -3.409) 11.003 4.813 ( 2.772 1.957 -4.759) 5.845 4.920 ( 6.616 2.919 3.819) 8.178 5.387 ( -6.466 7.306 -7.636) 12.390 5.708 ( 5.226 10.705 -2.312) 12.134 6.464 ( 2.285 -14.801 1.785) 15.082 6.882 ( -2.087 -0.409 22.671) 22.771 7.372 ( -4.859 3.029 7.093) 9.116 8.179 ( -1.239 0.375 -12.290) 12.358 8.311 ( 0.580 -1.723 -0.803) 1.987 9.264 ( 6.480 4.732 -20.073) 21.617 9.463 ( 2.771 -2.267 -6.903) 7.776 9.885 ( -9.823 -12.771 -1.854) 16.218 10.701 ( 6.232 -5.141 5.900) 10.004 10.873 ( -7.198 -1.453 -0.303) 7.349 11.131 ( -6.486 5.838 1.950) 8.942 11.417 ( -3.831 -1.146 -1.732) 4.358 11.617 ( -16.426 -0.310 0.187) 16.430 12.041 ( 3.925 -10.360 2.945) 11.463 12.561 ( 10.532 -7.026 -1.706) 12.775 12.612 ( 8.373 -15.270 1.789) 17.507 13.361 ( 4.688 -2.020 -4.673) 6.921 13.767 ( 0.329 4.271 -1.542) 4.553 14.066 ( -2.629 1.596 -0.407) 3.103 14.548 ( -0.687 0.053 -0.220) 0.723 15.081 ( -4.766 -20.008 9.192) 22.528 15.367 ( -0.319 1.902 3.415) 3.922 15.779 ( -5.500 -1.493 3.925) 6.920 15.881 ( 5.419 -0.947 -3.067) 6.298 16.256 ( -6.448 -0.495 2.764) 7.033 16.478 ( 5.371 3.796 5.075) 8.307 16.921 ( 14.114 -6.020 1.230) 15.394 20.983 ( 0.127 -5.284 1.160) 5.411 21.423 ( -0.132 12.480 -1.744) 12.602 22.247 ( -9.648 7.768 -7.213) 14.333 22.436 ( 1.781 5.739 0.045) 6.010 ======================= Grid point 350 (175/227) ======================= q-point: (-0.10 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 1.907 -4.493 4.023) 6.325 2.212 ( 0.721 8.570 11.013) 13.973 2.286 ( 7.307 8.059 0.269) 10.882 2.458 ( -3.374 2.042 -7.046) 8.075 3.189 ( 6.161 -3.742 3.748) 8.124 3.354 ( -4.149 4.042 12.922) 14.161 3.547 ( -0.810 4.619 0.340) 4.702 3.885 ( 2.543 5.397 7.535) 9.611 4.200 ( -3.349 12.294 -9.972) 16.181 4.420 ( 2.557 10.084 3.679) 11.035 4.799 ( 1.320 6.479 1.956) 6.896 4.997 ( 3.607 1.979 -2.426) 4.776 5.273 ( -1.268 5.066 -3.204) 6.127 5.682 ( 4.303 7.113 -5.122) 9.765 6.667 ( 1.326 -17.737 2.482) 17.959 6.824 ( -4.142 2.457 18.953) 19.555 7.326 ( 0.397 -0.023 3.072) 3.098 8.108 ( -4.766 1.660 -17.807) 18.509 8.329 ( 0.310 -0.234 1.072) 1.140 9.313 ( 4.627 3.001 -16.241) 17.152 9.508 ( 1.402 -0.632 -9.145) 9.274 9.785 ( -14.881 -9.269 -4.214) 18.031 10.541 ( -19.809 1.326 1.448) 19.906 10.954 ( 5.517 0.147 5.753) 7.972 11.027 ( -3.247 -2.736 2.420) 4.888 11.324 ( -6.059 4.334 -0.609) 7.474 11.443 ( -4.964 -4.856 -0.376) 6.954 12.166 ( -1.349 -11.691 4.329) 12.539 12.782 ( 4.911 -7.835 0.594) 9.266 12.921 ( 13.782 -7.450 -1.925) 15.784 13.477 ( 7.350 -2.355 -5.080) 9.240 13.750 ( 2.510 3.090 -2.201) 4.548 14.007 ( -2.613 1.735 1.501) 3.477 14.506 ( -3.915 1.460 -1.360) 4.394 15.147 ( -9.258 -14.490 12.557) 21.291 15.351 ( -0.458 0.552 1.308) 1.492 15.726 ( -4.292 -4.072 3.633) 6.943 15.952 ( 3.178 2.868 -2.204) 4.815 16.140 ( -5.961 -1.161 2.091) 6.423 16.630 ( 10.442 -4.936 5.609) 12.840 17.218 ( 14.440 -5.000 -1.974) 15.408 21.064 ( 1.911 -7.072 0.179) 7.328 21.295 ( 1.056 14.698 -5.429) 15.705 21.906 ( -14.560 13.341 -2.647) 19.924 22.455 ( 3.394 2.513 3.280) 5.347 ======================= Grid point 355 (176/227) ======================= q-point: ( 0.40 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -8.466 -0.000 -5.939) 10.342 1.885 ( 2.315 0.000 2.937) 3.739 2.670 ( -2.099 -0.000 -7.353) 7.647 3.011 ( -6.756 -0.000 0.812) 6.805 3.052 ( 2.643 0.000 3.079) 4.058 3.559 ( -5.239 -0.000 4.050) 6.622 3.764 ( 7.399 0.000 0.340) 7.407 4.269 ( -6.457 -0.000 4.657) 7.961 4.313 ( 6.557 0.000 5.441) 8.521 4.480 ( 10.512 0.000 -6.822) 12.532 4.629 ( 3.512 0.000 10.617) 11.183 5.071 ( 6.313 0.000 -3.144) 7.053 5.525 ( 11.216 0.000 1.774) 11.356 6.036 ( -3.073 -0.000 -0.701) 3.152 6.296 ( 1.287 0.000 -3.264) 3.509 6.963 ( -1.964 -0.000 29.966) 30.030 7.822 ( -2.106 -0.000 -8.266) 8.530 8.009 ( 6.534 0.000 0.898) 6.595 8.200 ( 0.929 0.000 2.773) 2.925 8.871 ( 3.187 0.000 1.803) 3.662 9.317 ( 3.186 0.000 -22.343) 22.569 9.409 ( -1.256 -0.000 -7.120) 7.230 10.384 ( 5.642 0.000 4.332) 7.113 10.990 ( 5.913 0.000 0.357) 5.924 11.024 ( 3.187 0.000 -1.684) 3.604 11.315 ( 2.634 0.000 18.438) 18.626 11.754 ( 0.516 0.000 -0.879) 1.019 11.951 ( -2.939 -0.000 -2.304) 3.734 12.345 ( -9.827 -0.000 -15.605) 18.442 12.647 ( -18.462 -0.000 -2.922) 18.692 13.230 ( -4.341 -0.000 3.746) 5.734 13.975 ( -1.436 -0.000 -2.287) 2.700 14.160 ( 2.820 0.000 -0.580) 2.879 14.449 ( 5.482 0.000 -0.472) 5.502 14.572 ( -0.763 -0.000 4.553) 4.616 15.422 ( -2.221 -0.000 -2.286) 3.187 15.688 ( 8.077 0.000 0.985) 8.137 15.801 ( 2.128 0.000 1.728) 2.742 16.360 ( -4.866 -0.000 13.879) 14.708 16.375 ( -9.769 -0.000 4.886) 10.923 17.063 ( -10.191 -0.000 -5.879) 11.765 20.840 ( 2.292 0.000 1.170) 2.573 21.799 ( 3.102 0.000 -1.192) 3.323 22.259 ( 6.246 0.000 -4.487) 7.691 22.536 ( 2.901 0.000 -1.048) 3.085 ======================= Grid point 357 (177/227) ======================= q-point: (-0.50 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( -5.150 2.815 -5.033) 7.732 1.960 ( 5.197 -1.464 1.842) 5.704 2.591 ( -7.554 -2.727 -5.710) 9.854 2.937 ( -0.960 4.056 1.482) 4.423 3.093 ( 2.666 1.476 4.708) 5.608 3.505 ( -2.174 -0.963 3.016) 3.841 3.827 ( 1.776 1.857 1.513) 2.981 4.153 ( -4.787 4.213 9.707) 11.615 4.427 ( 4.395 -2.924 4.283) 6.798 4.605 ( 8.132 4.675 -8.341) 12.552 4.686 ( 2.375 -2.298 5.572) 6.478 5.166 ( 5.345 2.197 -6.973) 9.056 5.688 ( 10.654 4.483 2.863) 11.908 6.011 ( -1.384 -2.746 0.586) 3.130 6.250 ( -5.203 3.550 -3.150) 7.042 6.902 ( -5.056 1.124 34.694) 35.079 7.784 ( -2.041 2.376 -4.471) 5.459 8.105 ( 4.740 -0.151 -0.436) 4.762 8.208 ( 0.746 1.079 2.076) 2.455 8.986 ( 8.321 -4.982 0.756) 9.728 9.337 ( 2.835 2.971 -24.720) 25.059 9.443 ( 0.448 -7.160 -6.474) 9.663 10.435 ( 0.658 -0.439 4.104) 4.179 11.042 ( 6.038 6.677 5.904) 10.766 11.173 ( 8.619 -5.900 1.587) 10.565 11.362 ( 1.092 -2.010 10.205) 10.458 11.712 ( 0.390 7.615 -2.520) 8.031 11.938 ( -4.490 -8.355 -3.705) 10.183 12.205 ( -8.965 -4.888 -12.609) 16.226 12.364 ( -15.978 -0.919 -4.167) 16.538 13.214 ( 1.578 0.002 5.328) 5.556 13.944 ( -1.249 1.718 -0.784) 2.264 14.174 ( -0.474 0.512 -0.846) 1.096 14.511 ( 2.193 -0.172 0.057) 2.200 14.593 ( 0.555 -4.095 2.500) 4.829 15.409 ( 0.727 -0.078 0.070) 0.735 15.808 ( 0.496 0.525 1.484) 1.650 15.816 ( 4.009 -0.138 0.452) 4.037 16.263 ( 0.296 0.438 0.678) 0.860 16.319 ( -4.995 -3.809 12.534) 14.020 16.903 ( -7.937 1.965 -2.398) 8.521 20.872 ( 0.728 -1.186 1.853) 2.318 21.804 ( -0.266 3.532 1.799) 3.973 22.326 ( 3.718 1.906 -4.420) 6.082 22.593 ( 2.906 -0.880 -4.952) 5.809 ======================= Grid point 358 (178/227) ======================= q-point: (-0.40 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.397 ( -0.309 2.925 -4.023) 4.984 2.072 ( 6.443 -1.288 -0.679) 6.605 2.505 ( -6.672 -3.893 -1.510) 7.871 2.880 ( 0.904 7.012 0.100) 7.071 3.099 ( 0.875 4.124 5.250) 6.733 3.489 ( -1.264 -0.014 2.361) 2.678 3.800 ( -2.437 2.205 4.078) 5.238 4.053 ( -1.417 5.757 9.848) 11.495 4.500 ( 0.025 -4.313 3.625) 5.634 4.673 ( 6.989 5.098 -5.295) 10.142 4.753 ( 3.000 -1.284 -4.660) 5.689 5.173 ( 3.465 9.743 -4.634) 11.332 5.759 ( 2.653 6.431 -1.375) 7.092 5.996 ( -1.155 9.908 1.251) 10.053 6.119 ( -5.202 -6.711 0.197) 8.493 6.838 ( -4.402 -2.091 34.830) 35.170 7.671 ( -5.886 7.075 1.672) 9.354 8.156 ( 1.479 -0.599 -2.370) 2.857 8.234 ( 2.765 -0.520 -0.578) 2.872 9.207 ( 8.608 -7.812 -2.660) 11.925 9.342 ( 3.429 4.022 -26.371) 26.895 9.545 ( 0.248 -11.776 -4.117) 12.477 10.457 ( 2.053 -1.730 3.263) 4.225 11.046 ( 0.851 6.653 9.719) 11.808 11.315 ( -0.497 -4.534 -0.063) 4.561 11.374 ( -3.421 -1.488 1.470) 4.009 11.701 ( 5.657 3.442 -1.650) 6.824 11.919 ( -5.278 -5.023 -1.676) 7.476 12.148 ( -8.565 -7.658 -9.116) 14.666 12.228 ( 1.630 -6.742 -0.124) 6.937 13.259 ( 2.820 -0.526 3.069) 4.201 13.901 ( -0.976 3.211 -0.001) 3.356 14.145 ( -1.956 0.852 -0.987) 2.351 14.531 ( -0.241 -0.824 0.660) 1.083 14.669 ( 0.985 -7.964 2.016) 8.274 15.429 ( 1.217 1.288 3.126) 3.593 15.785 ( 0.620 0.229 -0.419) 0.783 15.842 ( -2.446 -0.224 1.785) 3.036 16.275 ( -0.318 -0.296 1.640) 1.697 16.402 ( 8.746 -5.351 5.435) 11.604 16.771 ( -4.198 3.305 0.561) 5.372 20.887 ( -0.784 -1.969 2.216) 3.066 21.730 ( -2.424 6.183 3.090) 7.325 22.350 ( 1.360 1.210 -3.715) 4.137 22.618 ( 0.418 1.780 -7.331) 7.556 ======================= Grid point 359 (179/227) ======================= q-point: (-0.30 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 2.717 2.100 -2.674) 4.352 2.188 ( 5.885 -1.650 -5.122) 7.975 2.441 ( -3.315 0.996 3.441) 4.881 2.818 ( -0.240 9.008 0.774) 9.044 3.059 ( 0.777 3.498 3.241) 4.831 3.460 ( -1.678 1.055 5.722) 6.056 3.722 ( -2.560 4.331 4.165) 6.531 3.998 ( 0.260 4.563 7.858) 9.091 4.529 ( -2.035 -4.356 2.443) 5.393 4.685 ( 1.475 9.840 -10.438) 14.421 4.816 ( 4.313 -1.120 -7.959) 9.122 5.117 ( 4.415 12.064 2.478) 13.083 5.571 ( -10.184 10.659 -4.252) 15.343 5.915 ( 3.160 8.901 0.697) 9.471 6.187 ( -0.768 -11.727 3.277) 12.201 6.827 ( -3.034 -4.586 30.996) 31.479 7.486 ( -6.233 7.875 4.631) 11.059 8.169 ( -1.516 -1.503 -5.365) 5.774 8.286 ( 2.504 -0.874 -1.721) 3.162 9.353 ( 3.227 2.137 -24.173) 24.481 9.369 ( 3.418 -4.344 -8.069) 9.781 9.647 ( -2.734 -10.657 -2.994) 11.402 10.573 ( 6.713 -5.910 2.604) 9.315 10.913 ( -10.555 3.822 4.700) 12.170 11.243 ( -8.988 0.963 -1.392) 9.146 11.326 ( -1.822 -1.235 1.635) 2.742 11.651 ( -8.825 3.829 -1.268) 9.703 11.922 ( 1.430 -3.394 2.725) 4.581 12.278 ( 7.241 -16.943 -0.202) 18.426 12.432 ( 14.129 -5.726 -1.503) 15.319 13.317 ( 2.864 -2.278 -1.064) 3.810 13.851 ( -0.529 3.932 -0.202) 3.973 14.098 ( -2.231 1.385 -0.075) 2.627 14.524 ( -2.354 -2.016 1.039) 3.269 14.775 ( 0.200 -10.380 3.687) 11.017 15.409 ( -1.179 1.963 3.138) 3.884 15.755 ( -6.676 -0.979 4.190) 7.943 15.863 ( 6.124 -0.890 -3.891) 7.310 16.272 ( 0.354 2.646 1.393) 3.011 16.562 ( 4.633 2.196 5.231) 7.325 16.793 ( 9.540 -5.314 0.252) 10.923 20.895 ( -1.320 -3.391 2.142) 4.222 21.617 ( -2.816 7.323 2.235) 8.158 22.328 ( -3.728 1.210 -4.688) 6.110 22.564 ( -1.025 5.886 -5.176) 7.905 ======================= Grid point 360 (180/227) ======================= q-point: (-0.20 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.419 ( 2.191 1.638 0.051) 2.736 2.289 ( 4.355 -1.662 -7.123) 8.513 2.376 ( -2.157 3.577 4.513) 6.149 2.665 ( -1.885 14.560 3.173) 15.021 3.115 ( 5.959 -2.481 1.618) 6.655 3.420 ( -1.158 2.580 10.027) 10.419 3.650 ( -0.254 5.450 -0.460) 5.476 3.968 ( 0.548 3.381 4.260) 5.466 4.473 ( -11.029 8.640 -4.111) 14.601 4.529 ( -0.415 5.073 -3.661) 6.270 4.881 ( 3.378 2.144 -11.120) 11.817 5.100 ( 4.701 7.173 7.672) 11.507 5.381 ( -1.305 6.032 -2.304) 6.588 5.858 ( 0.912 8.835 -0.988) 8.936 6.317 ( -0.424 -15.839 4.703) 16.528 6.827 ( -3.841 -2.929 24.916) 25.380 7.357 ( -1.510 4.110 3.737) 5.756 8.118 ( -5.890 -0.878 -10.065) 11.695 8.331 ( 2.362 -0.047 -0.620) 2.442 9.357 ( -1.971 -0.822 -20.332) 20.444 9.430 ( 0.576 -3.558 -11.043) 11.617 9.660 ( -3.409 -3.539 -4.384) 6.585 10.570 ( -16.983 0.596 2.042) 17.116 10.846 ( 7.089 -5.743 1.959) 9.332 11.072 ( -9.596 0.708 -1.757) 9.781 11.341 ( 1.824 -0.648 5.076) 5.433 11.435 ( -9.478 5.813 -0.037) 11.119 11.997 ( 0.845 -5.964 3.560) 6.997 12.560 ( 6.036 -14.130 3.735) 15.813 12.777 ( 19.039 -5.975 -3.298) 20.225 13.415 ( 5.897 -3.861 -3.745) 7.982 13.812 ( 0.340 3.124 -0.502) 3.182 14.046 ( -2.109 1.948 0.933) 3.019 14.492 ( -4.575 -2.539 1.104) 5.347 14.874 ( -1.847 -10.909 6.329) 12.747 15.377 ( -0.313 1.565 1.753) 2.371 15.665 ( -5.733 -2.177 3.929) 7.283 15.960 ( 3.519 -1.169 -5.568) 6.690 16.213 ( -1.541 7.150 2.084) 7.605 16.613 ( 6.630 2.252 7.291) 10.109 17.087 ( 14.639 -8.253 -1.830) 16.905 20.927 ( -0.318 -6.002 1.699) 6.246 21.505 ( -1.641 7.346 -0.359) 7.536 22.148 ( -11.703 8.777 -6.741) 16.107 22.514 ( 1.367 3.795 0.850) 4.123 ======================= Grid point 361 (181/227) ======================= q-point: (-0.10 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.441 ( 1.330 -1.452 2.788) 3.413 2.262 ( -3.713 5.333 8.949) 11.059 2.382 ( 2.172 -3.562 -10.839) 11.614 2.552 ( 5.327 12.751 0.228) 13.821 3.246 ( 3.793 -3.628 7.198) 8.909 3.397 ( 3.480 4.437 2.924) 6.351 3.594 ( 0.012 5.590 -2.540) 6.140 3.949 ( 0.099 1.416 0.047) 1.420 4.183 ( -8.276 10.289 -2.424) 13.425 4.498 ( -0.288 1.378 -0.450) 1.478 4.874 ( 1.959 5.859 -5.458) 8.243 5.075 ( -2.821 4.677 5.841) 7.996 5.362 ( 4.013 5.317 -0.632) 6.691 5.805 ( 3.515 6.515 -1.999) 7.667 6.486 ( -0.479 -17.516 6.540) 18.703 6.777 ( -4.057 0.538 19.461) 19.886 7.351 ( 1.812 -0.302 -0.875) 2.035 8.001 ( -8.200 -1.037 -12.738) 15.184 8.361 ( 2.170 1.477 0.392) 2.654 9.273 ( -11.002 -5.606 -15.656) 19.940 9.461 ( 1.406 0.287 -10.668) 10.764 9.634 ( -0.516 0.780 -7.702) 7.759 10.252 ( -17.154 2.936 0.104) 17.404 10.919 ( -7.663 -0.453 3.374) 8.385 11.016 ( 3.566 -3.858 2.734) 5.922 11.270 ( -4.024 2.566 -0.930) 4.862 11.396 ( 3.509 -1.037 3.628) 5.152 12.067 ( -0.017 -6.704 1.311) 6.831 12.736 ( 1.055 -8.394 3.270) 9.070 13.107 ( 14.433 -3.975 -3.268) 15.323 13.582 ( 9.232 -4.030 -2.621) 10.409 13.805 ( 0.955 0.742 -0.121) 1.216 13.997 ( -0.866 2.463 0.460) 2.651 14.417 ( -7.057 -0.940 0.663) 7.150 14.925 ( -4.122 -7.865 8.724) 12.448 15.373 ( 1.546 1.307 1.416) 2.471 15.624 ( -3.229 -3.341 2.516) 5.284 15.999 ( -0.491 -3.968 -3.277) 5.170 16.095 ( -1.678 10.506 1.420) 10.734 16.741 ( 7.378 -2.813 7.174) 10.669 17.376 ( 11.246 -5.443 -3.854) 13.075 21.013 ( 1.596 -8.818 1.000) 9.017 21.416 ( 0.090 8.493 -4.617) 9.667 21.823 ( -11.970 12.731 -2.657) 17.675 22.514 ( 1.318 1.661 3.179) 3.821 ======================= Grid point 367 (182/227) ======================= q-point: (-0.50 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( -0.632 -0.000 -4.593) 4.637 2.058 ( 6.837 -0.000 -0.829) 6.887 2.442 ( -7.143 -0.000 -2.390) 7.532 2.959 ( 0.221 -0.000 0.776) 0.807 3.148 ( 2.297 -0.000 6.594) 6.983 3.489 ( 0.131 -0.000 0.513) 0.529 3.823 ( -1.888 -0.000 1.978) 2.735 4.119 ( -2.948 0.000 8.218) 8.731 4.446 ( -0.564 -0.000 6.821) 6.845 4.702 ( 2.461 -0.000 7.198) 7.607 4.761 ( 7.345 0.000 -15.074) 16.768 5.270 ( 4.926 -0.000 -10.747) 11.822 5.860 ( 5.496 0.000 3.986) 6.789 5.968 ( -0.993 -0.000 0.820) 1.288 6.156 ( -8.419 -0.000 -1.464) 8.545 6.811 ( -7.025 -0.000 38.673) 39.306 7.755 ( -3.812 -0.000 -1.472) 4.086 8.145 ( -0.041 0.000 1.677) 1.678 8.236 ( 1.921 -0.000 -0.344) 1.951 9.112 ( 10.662 -0.000 -3.698) 11.285 9.392 ( 2.972 0.000 -28.736) 28.890 9.410 ( 0.566 -0.000 -4.181) 4.219 10.443 ( 1.148 -0.000 2.334) 2.601 11.149 ( -3.719 -0.000 16.901) 17.305 11.217 ( 1.058 -0.000 1.372) 1.732 11.396 ( 5.569 0.000 1.416) 5.747 11.775 ( 1.277 0.000 -7.113) 7.226 11.790 ( -3.806 -0.000 -4.106) 5.598 12.097 ( -12.284 -0.000 -8.795) 15.108 12.149 ( 3.198 -0.000 -0.173) 3.202 13.254 ( 2.100 -0.000 4.208) 4.703 13.935 ( -0.985 -0.000 0.538) 1.123 14.153 ( -1.996 -0.000 -0.616) 2.089 14.521 ( -0.791 -0.000 0.412) 0.892 14.591 ( 1.745 -0.000 0.500) 1.815 15.442 ( 1.934 -0.000 2.913) 3.496 15.791 ( 0.145 -0.000 -0.515) 0.535 15.838 ( -3.462 -0.000 2.243) 4.125 16.291 ( 4.891 -0.000 -4.686) 6.774 16.322 ( 5.566 0.000 10.459) 11.847 16.808 ( -4.785 -0.000 0.833) 4.857 20.867 ( -0.796 -0.000 2.576) 2.696 21.794 ( -2.963 -0.000 4.136) 5.088 22.360 ( -0.060 -0.000 -5.083) 5.083 22.635 ( 2.390 -0.000 -6.381) 6.813 ======================= Grid point 369 (183/227) ======================= q-point: (-0.40 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 3.434 2.251 -3.949) 5.697 2.156 ( 4.157 -1.130 -6.113) 7.478 2.386 ( -1.869 -3.415 2.704) 4.740 2.944 ( 0.503 3.548 1.080) 3.743 3.161 ( 1.088 3.726 4.747) 6.132 3.481 ( -0.858 0.840 1.219) 1.711 3.792 ( -0.902 2.163 2.106) 3.150 4.070 ( -1.495 2.228 5.986) 6.560 4.427 ( -3.466 -3.629 5.278) 7.283 4.768 ( 4.584 -1.343 2.044) 5.196 4.838 ( 4.235 3.500 -14.727) 15.719 5.293 ( 1.343 4.604 -9.194) 10.370 5.771 ( -10.802 7.575 -1.122) 13.241 5.984 ( -3.073 -4.500 2.347) 5.933 6.066 ( 1.656 1.979 4.176) 4.909 6.736 ( -5.469 -3.216 37.801) 38.330 7.644 ( -5.572 5.974 1.955) 8.400 8.123 ( -3.654 -2.378 1.829) 4.728 8.268 ( 1.418 -0.864 -2.325) 2.858 9.285 ( 7.236 -0.409 -9.792) 12.182 9.419 ( 3.449 1.452 -25.905) 26.174 9.458 ( 1.264 -7.093 -5.952) 9.346 10.492 ( 3.684 -1.975 0.948) 4.286 10.980 ( -13.573 2.035 9.333) 16.598 11.155 ( -9.474 -3.317 -0.948) 10.083 11.470 ( 6.563 8.789 5.259) 12.164 11.743 ( -2.830 4.557 -2.084) 5.755 11.837 ( -2.228 -5.705 0.806) 6.177 11.976 ( 1.760 -10.693 -5.781) 12.282 12.353 ( 17.157 -1.935 -0.653) 17.278 13.280 ( 0.835 -1.092 1.494) 2.030 13.912 ( -0.841 1.731 0.703) 2.049 14.117 ( -2.010 0.461 0.453) 2.112 14.489 ( -3.589 -0.985 1.137) 3.892 14.645 ( 2.509 -3.092 0.473) 4.010 15.438 ( -1.737 0.811 3.004) 3.564 15.740 ( -7.506 -0.434 4.223) 8.623 15.849 ( 5.958 -0.409 -4.378) 7.405 16.361 ( 6.975 5.859 -0.586) 9.128 16.503 ( 10.022 -6.481 2.985) 12.302 16.760 ( 0.353 0.655 2.891) 2.986 20.849 ( -2.146 -1.176 2.807) 3.724 21.720 ( -4.222 2.751 4.284) 6.614 22.331 ( -3.410 -0.271 -4.628) 5.755 22.646 ( 0.248 2.091 -6.260) 6.604 ======================= Grid point 370 (184/227) ======================= q-point: (-0.30 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( 4.244 3.985 -2.630) 6.388 2.224 ( 2.141 -3.873 -9.395) 10.385 2.401 ( -1.345 -1.079 5.236) 5.513 2.907 ( 1.309 8.304 3.601) 9.146 3.133 ( 2.152 3.874 -1.294) 4.616 3.460 ( -0.096 1.392 7.521) 7.649 3.750 ( -0.013 3.929 -1.629) 4.254 4.033 ( -0.370 3.219 3.163) 4.528 4.415 ( -4.670 -5.537 3.054) 7.861 4.770 ( -3.613 10.423 -10.070) 14.937 4.880 ( 5.558 -1.641 -8.317) 10.137 5.232 ( -1.708 5.253 -2.600) 6.105 5.508 ( -8.486 5.735 -1.426) 10.341 5.968 ( -2.046 -0.306 4.325) 4.795 6.094 ( -0.289 -3.804 4.407) 5.829 6.723 ( -3.930 -5.921 33.226) 33.978 7.492 ( -3.223 8.255 2.777) 9.287 8.068 ( -7.467 -3.972 -1.301) 8.557 8.303 ( 0.975 -2.678 -1.346) 3.152 9.305 ( -2.522 0.821 -10.779) 11.100 9.456 ( 4.445 2.334 -25.277) 25.771 9.569 ( 2.029 -6.401 -8.229) 10.621 10.532 ( -9.003 -3.632 0.034) 9.709 10.788 ( -2.054 -0.245 4.128) 4.617 11.021 ( -10.185 -3.281 -1.038) 10.751 11.471 ( 6.745 11.194 6.876) 14.768 11.561 ( -8.820 6.607 1.043) 11.069 11.888 ( 1.174 -5.335 0.903) 5.537 12.242 ( 8.281 -16.564 2.626) 18.704 12.695 ( 21.013 -2.219 -3.021) 21.345 13.332 ( 3.265 -3.863 -1.082) 5.172 13.872 ( -1.285 2.627 0.718) 3.011 14.078 ( -1.744 1.200 1.038) 2.358 14.431 ( -5.877 -2.829 1.854) 6.781 14.723 ( 2.038 -4.547 1.958) 5.353 15.404 ( -0.886 0.953 1.710) 2.149 15.632 ( -6.333 -1.114 3.981) 7.563 15.938 ( 3.265 -0.765 -7.084) 7.837 16.388 ( 5.629 9.860 0.933) 11.392 16.665 ( 5.215 1.369 7.839) 9.515 16.903 ( 12.563 -8.962 -2.303) 15.603 20.832 ( -2.427 -3.289 2.546) 4.816 21.618 ( -3.822 4.026 2.528) 6.100 22.239 ( -7.721 1.243 -4.668) 9.107 22.602 ( -0.896 4.095 -3.402) 5.399 ======================= Grid point 371 (185/227) ======================= q-point: (-0.20 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( 2.166 5.220 0.056) 5.652 2.299 ( 1.511 -4.693 -9.939) 11.094 2.341 ( -4.407 2.408 5.925) 7.767 2.821 ( 2.428 13.017 0.942) 13.275 3.185 ( 4.157 -1.722 2.022) 4.933 3.467 ( 2.868 2.082 6.528) 7.428 3.715 ( 0.896 5.717 -5.222) 7.794 3.978 ( -3.318 1.968 -2.047) 4.367 4.336 ( -8.734 1.431 2.836) 9.294 4.569 ( -3.002 9.006 -7.149) 11.884 4.953 ( 3.411 1.621 -11.421) 12.029 5.153 ( -3.818 2.995 5.108) 7.046 5.406 ( -2.419 -0.131 -2.118) 3.218 5.938 ( 1.491 4.583 4.080) 6.315 6.162 ( -0.944 -12.914 5.652) 14.128 6.733 ( -3.346 -4.792 27.192) 27.813 7.397 ( -0.093 5.435 1.233) 5.574 7.957 ( -10.422 -3.807 -4.706) 12.053 8.348 ( 0.769 -3.149 0.202) 3.247 9.210 ( -6.637 1.329 -12.524) 14.236 9.494 ( 3.714 2.055 -19.189) 19.652 9.622 ( 0.060 -2.342 -11.220) 11.462 10.291 ( -16.717 0.586 -0.072) 16.727 10.887 ( -0.281 -5.642 -3.759) 6.785 10.910 ( -1.087 -1.329 5.969) 6.211 11.360 ( -7.116 5.243 1.757) 9.012 11.493 ( 7.879 10.281 7.624) 15.030 11.957 ( 0.898 -4.820 -0.453) 4.924 12.513 ( 5.375 -13.430 4.921) 15.280 13.044 ( 18.037 -2.044 -3.874) 18.561 13.475 ( 7.711 -6.326 -1.709) 10.119 13.822 ( -2.389 1.148 1.655) 3.124 14.042 ( -0.519 1.928 -0.130) 2.001 14.358 ( -7.375 -4.072 2.134) 8.691 14.800 ( 1.718 -4.324 4.018) 6.148 15.398 ( 1.279 1.009 1.068) 1.948 15.571 ( -2.936 -1.898 2.675) 4.402 15.953 ( -1.534 -0.707 -5.844) 6.084 16.341 ( 2.640 13.168 0.344) 13.434 16.735 ( 5.391 1.428 9.230) 10.783 17.226 ( 13.226 -9.418 -4.214) 16.774 20.851 ( -1.151 -6.801 2.024) 7.189 21.530 ( -1.869 3.910 -0.501) 4.363 22.035 ( -11.659 6.992 -4.512) 14.324 22.556 ( -0.236 2.657 0.575) 2.729 ======================= Grid point 372 (186/227) ======================= q-point: (-0.10 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.466 ( 0.736 2.968 2.231) 3.785 2.231 ( -4.006 2.324 1.855) 4.989 2.377 ( 1.874 -3.840 -5.126) 6.673 2.751 ( 3.616 10.562 -1.796) 11.307 3.271 ( 3.372 -2.235 8.719) 9.612 3.434 ( -7.400 3.257 -9.620) 12.566 3.677 ( 4.842 4.840 1.699) 7.054 3.921 ( -1.865 -1.099 -5.655) 6.056 4.200 ( -0.583 6.816 2.610) 7.322 4.502 ( 0.072 2.599 -4.214) 4.952 4.973 ( 3.721 3.895 -6.068) 8.114 4.997 ( -11.525 3.768 5.647) 13.376 5.391 ( -1.938 -3.079 -0.939) 3.757 5.936 ( 3.585 4.478 2.382) 6.211 6.328 ( 1.900 -15.641 8.455) 17.881 6.732 ( -1.395 -1.333 20.452) 20.543 7.363 ( -0.985 0.406 -1.673) 1.983 7.826 ( -8.609 -3.460 -6.976) 11.609 8.385 ( 0.093 -2.437 1.126) 2.686 9.072 ( -6.934 2.233 -12.269) 14.269 9.506 ( 0.791 2.370 -11.759) 12.021 9.630 ( -0.108 -0.752 -12.067) 12.091 10.052 ( -9.745 1.497 -3.745) 10.546 10.822 ( -3.099 0.546 3.979) 5.073 11.009 ( 0.934 -3.970 2.609) 4.841 11.242 ( -2.274 1.743 -0.021) 2.865 11.524 ( 6.560 8.162 6.945) 12.565 12.020 ( 1.238 -4.781 -4.018) 6.366 12.676 ( 1.477 -7.297 4.554) 8.727 13.286 ( 9.608 -0.209 -3.057) 10.084 13.678 ( 7.952 -6.047 0.151) 9.991 13.786 ( -1.661 -1.813 2.248) 3.331 14.031 ( 1.742 2.124 -2.902) 3.996 14.271 ( -7.759 -3.112 2.261) 8.660 14.858 ( 1.072 -1.630 6.261) 6.558 15.422 ( 2.809 1.039 0.692) 3.074 15.571 ( -0.034 -1.484 0.980) 1.778 15.928 ( -2.360 -2.989 -1.685) 4.164 16.216 ( -0.646 14.426 -1.123) 14.484 16.816 ( 3.825 -1.213 8.781) 9.654 17.469 ( 6.824 -5.129 -4.839) 9.812 20.939 ( 1.071 -10.446 1.523) 10.610 21.480 ( 0.306 4.508 -4.876) 6.647 21.753 ( -10.353 9.341 -1.675) 14.044 22.541 ( 0.426 0.993 2.675) 2.885 ======================= Grid point 379 (187/227) ======================= q-point: (-0.40 0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 5.238 0.000 -2.920) 5.997 2.172 ( 0.543 0.000 -9.549) 9.564 2.381 ( 0.980 0.000 5.458) 5.545 2.992 ( 3.830 0.000 1.574) 4.141 3.188 ( -0.874 -0.000 -0.919) 1.268 3.475 ( -0.276 -0.000 6.118) 6.125 3.791 ( -0.969 -0.000 -1.918) 2.149 4.078 ( 0.585 0.000 1.905) 1.993 4.342 ( -4.100 -0.000 3.705) 5.526 4.847 ( 5.937 0.000 -3.411) 6.847 4.887 ( -0.695 -0.000 -11.767) 11.787 5.290 ( -3.792 -0.000 -8.047) 8.896 5.572 ( -15.090 -0.000 -1.602) 15.174 5.925 ( -2.663 -0.000 4.461) 5.196 6.094 ( 0.077 0.000 5.391) 5.392 6.653 ( -4.058 -0.000 37.386) 37.605 7.603 ( -3.257 -0.000 1.583) 3.621 8.004 ( -8.988 -0.000 4.208) 9.924 8.265 ( -0.348 -0.000 -2.361) 2.387 9.401 ( -0.565 -0.000 -4.410) 4.446 9.417 ( 4.166 0.000 -13.764) 14.380 9.485 ( 5.584 0.000 -30.168) 30.681 10.487 ( -6.163 -0.000 -0.721) 6.205 10.792 ( -6.346 -0.000 6.208) 8.877 10.986 ( -8.157 -0.000 -0.287) 8.162 11.638 ( -11.067 -0.000 3.031) 11.475 11.667 ( 8.826 0.000 10.925) 14.045 11.819 ( 3.001 0.000 -3.093) 4.310 12.000 ( 8.404 0.000 -1.463) 8.531 12.676 ( 21.920 0.000 -2.534) 22.066 13.288 ( 1.617 0.000 0.168) 1.626 13.902 ( -1.744 -0.000 1.067) 2.044 14.091 ( -1.545 -0.000 1.227) 1.973 14.400 ( -6.579 -0.000 1.815) 6.825 14.678 ( 3.220 0.000 0.584) 3.273 15.413 ( -1.202 -0.000 1.727) 2.104 15.621 ( -6.392 -0.000 3.958) 7.518 15.930 ( 3.590 0.000 -7.774) 8.563 16.577 ( 6.563 0.000 3.955) 7.663 16.598 ( 12.136 0.000 0.814) 12.164 16.807 ( 6.055 0.000 1.297) 6.192 20.799 ( -3.249 -0.000 2.865) 4.332 21.661 ( -4.590 -0.000 3.516) 5.782 22.244 ( -6.651 -0.000 -3.961) 7.741 22.647 ( -1.290 -0.000 -4.721) 4.894 ======================= Grid point 381 (188/227) ======================= q-point: (-0.30 0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 4.167 3.837 -1.051) 5.761 2.204 ( 1.518 -3.654 -9.391) 10.191 2.367 ( -3.077 0.463 5.919) 6.687 3.042 ( 4.041 8.393 0.075) 9.316 3.165 ( 0.689 -1.652 -3.639) 4.055 3.480 ( 0.588 -0.311 8.715) 8.741 3.790 ( 2.649 1.656 -5.814) 6.600 4.035 ( -5.568 2.778 -2.123) 6.575 4.299 ( -3.746 -2.420 1.987) 4.882 4.782 ( -5.001 8.624 -7.151) 12.269 4.945 ( 3.924 -1.820 -11.502) 12.288 5.190 ( -6.406 0.695 -1.301) 6.573 5.380 ( -8.251 -1.548 -1.353) 8.504 5.907 ( -0.940 -4.154 6.222) 7.540 6.068 ( -2.833 0.699 4.177) 5.095 6.636 ( -1.922 -3.292 34.294) 34.505 7.539 ( -0.671 6.828 1.119) 6.951 7.849 ( -12.951 -5.698 3.305) 14.530 8.272 ( -0.302 -2.804 -0.719) 2.910 9.321 ( -1.409 8.177 -9.635) 12.716 9.481 ( -0.615 -5.518 -10.473) 11.854 9.574 ( 5.007 -0.405 -30.429) 30.841 10.284 ( -15.727 -0.666 0.016) 15.741 10.810 ( 4.061 -1.651 0.468) 4.409 10.896 ( -3.157 -0.385 4.034) 5.137 11.454 ( -8.761 3.296 4.380) 10.334 11.748 ( 9.124 12.502 8.534) 17.675 11.871 ( 2.093 -3.032 -2.766) 4.607 12.228 ( 8.791 -12.949 3.754) 16.095 13.029 ( 20.465 0.185 -3.797) 20.815 13.359 ( 5.262 -3.957 -0.368) 6.594 13.847 ( -4.536 0.957 2.165) 5.117 14.070 ( -0.412 0.769 -0.104) 0.879 14.289 ( -7.999 -2.135 2.163) 8.556 14.747 ( 4.292 -1.206 1.723) 4.780 15.411 ( 1.097 0.315 0.903) 1.455 15.546 ( -3.065 -0.614 2.928) 4.283 15.952 ( -0.422 0.139 -7.810) 7.823 16.595 ( 4.414 10.624 1.389) 11.588 16.760 ( 4.992 0.060 10.242) 11.394 17.029 ( 14.274 -8.332 -6.042) 17.597 20.755 ( -3.354 -2.528 2.484) 4.879 21.586 ( -3.353 1.539 1.223) 3.886 22.107 ( -9.550 1.115 -3.132) 10.112 22.607 ( -1.971 1.725 -2.063) 3.334 ======================= Grid point 382 (189/227) ======================= q-point: (-0.20 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 1.429 7.124 1.498) 7.419 2.254 ( -1.837 -1.823 -5.129) 5.745 2.307 ( -1.001 -1.086 3.076) 3.412 2.959 ( -0.624 9.332 -4.425) 10.347 3.240 ( 5.243 -0.283 4.501) 6.915 3.487 ( -4.909 0.302 -4.105) 6.406 3.765 ( -3.866 3.802 -1.201) 5.554 3.910 ( -0.920 0.313 -5.665) 5.747 4.264 ( -1.692 -0.257 2.424) 2.967 4.634 ( -0.062 10.026 -7.848) 12.732 4.990 ( -1.002 -2.302 -6.116) 6.611 5.055 ( -8.917 1.687 -1.791) 9.251 5.305 ( -5.122 -4.249 0.702) 6.692 5.991 ( -1.683 0.865 2.752) 3.340 6.043 ( 4.042 -11.191 6.631) 13.621 6.673 ( 0.519 -3.478 29.432) 29.641 7.427 ( -5.668 5.727 2.152) 8.340 7.734 ( -7.759 -6.179 -1.003) 9.969 8.304 ( -0.468 -4.124 0.977) 4.264 9.200 ( -1.859 9.012 -11.516) 14.740 9.508 ( -1.149 -3.356 -9.015) 9.688 9.621 ( 2.212 0.603 -24.571) 24.678 10.059 ( -11.061 -0.482 -2.743) 11.407 10.840 ( -0.150 1.382 3.182) 3.473 10.932 ( 3.189 -3.195 2.797) 5.310 11.304 ( -5.140 3.505 3.019) 6.915 11.752 ( 6.772 12.316 5.147) 14.968 11.944 ( 3.718 -1.829 -1.968) 4.587 12.485 ( 6.394 -11.294 5.250) 14.000 13.302 ( 13.281 1.699 -3.410) 13.817 13.539 ( 8.599 -7.355 0.291) 11.319 13.751 ( -6.071 -1.084 2.950) 6.837 14.064 ( 0.884 1.176 -1.999) 2.482 14.193 ( -7.292 -3.747 1.656) 8.364 14.837 ( 5.234 -0.517 3.493) 6.313 15.440 ( 2.800 0.684 0.097) 2.884 15.540 ( 0.995 -1.399 1.665) 2.391 15.916 ( -2.626 0.805 -5.027) 5.728 16.511 ( 0.444 13.821 -0.357) 13.833 16.821 ( 3.041 1.047 11.335) 11.782 17.328 ( 10.568 -8.251 -6.712) 14.994 20.756 ( -1.968 -6.946 1.952) 7.479 21.534 ( -0.686 1.676 -1.912) 2.634 21.903 ( -11.542 4.686 -2.348) 12.676 22.564 ( -1.012 1.229 0.805) 1.784 ======================= Grid point 383 (190/227) ======================= q-point: (-0.10 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 0.024 6.292 3.044) 6.990 2.191 ( -3.274 1.348 1.984) 4.058 2.356 ( 0.773 -4.482 -2.668) 5.273 2.868 ( 0.238 7.009 -3.884) 8.017 3.210 ( -19.372 1.471 -5.875) 20.297 3.344 ( 5.883 -0.926 4.605) 7.528 3.793 ( 4.703 -1.847 -0.580) 5.086 3.914 ( 1.360 3.198 -6.740) 7.583 4.258 ( 1.476 0.930 0.839) 1.936 4.570 ( 2.390 6.662 -7.847) 10.567 4.791 ( -16.058 1.423 4.132) 16.642 5.051 ( 3.160 -0.265 -6.037) 6.819 5.282 ( -4.719 -6.190 3.712) 8.623 5.921 ( -6.409 -3.354 -0.032) 7.233 6.287 ( 8.251 -9.289 10.972) 16.576 6.741 ( 3.364 -1.062 21.930) 22.211 7.281 ( -8.155 -3.130 1.452) 8.855 7.712 ( -0.253 -1.777 -5.946) 6.211 8.331 ( -1.296 -3.730 1.939) 4.399 9.086 ( 0.203 9.333 -9.993) 13.675 9.502 ( -1.738 -0.595 -7.930) 8.140 9.609 ( -1.865 1.013 -14.327) 14.484 9.974 ( 0.700 -1.381 -7.960) 8.110 10.831 ( 1.018 1.964 7.371) 7.695 10.992 ( 1.155 -1.348 0.366) 1.813 11.230 ( -1.088 1.281 0.277) 1.703 11.732 ( 4.530 10.570 4.332) 12.288 12.025 ( 4.693 -0.677 -4.239) 6.360 12.650 ( 3.213 -5.558 4.943) 8.102 13.388 ( -0.257 3.605 -1.383) 3.870 13.678 ( -0.183 -4.646 1.778) 4.978 13.779 ( 5.008 -6.368 2.252) 8.409 14.074 ( 1.507 0.830 -4.962) 5.251 14.130 ( -4.375 -3.578 1.992) 5.992 14.917 ( 4.946 2.183 5.526) 7.730 15.483 ( 3.457 1.119 -1.349) 3.876 15.600 ( 4.398 -0.171 0.754) 4.466 15.868 ( -2.265 -1.325 -1.380) 2.965 16.342 ( -2.594 15.435 -1.452) 15.718 16.846 ( 0.052 0.043 10.970) 10.970 17.494 ( 2.020 -3.656 -5.859) 7.196 20.841 ( 0.561 -11.925 1.502) 12.032 21.521 ( 0.237 3.316 -5.892) 6.765 21.668 ( -8.160 4.557 -0.336) 9.352 22.554 ( 0.488 0.087 2.176) 2.232 ======================= Grid point 391 (191/227) ======================= q-point: (-0.30 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 2.240 0.000 1.765) 2.852 2.208 ( 1.400 0.000 -8.412) 8.528 2.314 ( -3.730 -0.000 6.860) 7.808 3.070 ( -4.896 -0.000 -5.880) 7.652 3.247 ( 9.311 0.000 0.268) 9.315 3.464 ( -2.769 -0.000 0.185) 2.775 3.810 ( -12.234 -0.000 -3.093) 12.619 3.922 ( 2.637 0.000 -4.737) 5.421 4.249 ( -1.859 -0.000 1.299) 2.268 4.806 ( 1.797 0.000 -3.404) 3.849 4.907 ( -6.618 -0.000 -12.118) 13.808 5.069 ( -7.235 -0.000 -4.581) 8.563 5.259 ( -5.907 -0.000 1.774) 6.168 5.921 ( 6.616 0.000 6.583) 9.333 5.998 ( -6.278 -0.000 2.249) 6.669 6.632 ( 1.779 0.000 33.365) 33.413 7.548 ( -18.049 -0.000 7.342) 19.486 7.608 ( 3.074 0.000 -1.888) 3.608 8.259 ( 0.459 0.000 0.860) 0.975 9.371 ( -3.087 -0.000 -14.727) 15.047 9.394 ( 0.369 0.000 -3.348) 3.369 9.634 ( 3.219 0.000 -31.874) 32.036 10.051 ( -11.447 -0.000 -1.355) 11.527 10.874 ( -0.306 -0.000 8.801) 8.806 10.881 ( 5.100 0.000 -2.564) 5.708 11.347 ( -6.128 -0.000 4.611) 7.669 11.851 ( -0.522 -0.000 -5.124) 5.151 12.015 ( 11.448 0.000 9.379) 14.799 12.306 ( 9.372 0.000 3.778) 10.105 13.340 ( 16.521 0.000 -3.646) 16.918 13.435 ( 7.009 0.000 0.804) 7.055 13.743 ( -8.490 -0.000 2.878) 8.964 14.077 ( 0.586 0.000 -1.912) 2.000 14.150 ( -7.080 -0.000 1.514) 7.240 14.833 ( 6.518 0.000 2.590) 7.013 15.448 ( 3.148 0.000 -0.261) 3.158 15.524 ( 0.582 0.000 2.090) 2.170 15.928 ( -2.098 -0.000 -6.187) 6.533 16.683 ( -0.434 -0.000 1.331) 1.400 16.834 ( 3.036 0.000 12.508) 12.871 17.215 ( 13.301 0.000 -9.146) 16.142 20.683 ( -3.556 -0.000 2.054) 4.107 21.552 ( -1.416 -0.000 -1.105) 1.796 21.946 ( -10.836 -0.000 -1.799) 10.985 22.579 ( -1.995 -0.000 -0.211) 2.006 ======================= Grid point 392 (192/227) ======================= q-point: (-0.20 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( -0.828 5.056 4.579) 6.872 2.208 ( -2.448 -0.150 0.872) 2.603 2.282 ( -0.434 -1.896 -0.293) 1.967 2.978 ( -3.470 3.132 -5.239) 7.022 3.248 ( -23.199 1.430 -4.057) 23.594 3.366 ( 6.523 2.508 0.177) 6.991 3.700 ( 2.209 -4.822 -2.568) 5.893 4.002 ( 5.249 3.802 -5.598) 8.564 4.228 ( -2.328 -2.614 2.729) 4.438 4.710 ( -6.970 4.648 -6.008) 10.309 4.829 ( -6.107 3.705 -1.817) 7.370 4.997 ( -0.616 -4.933 -11.384) 12.422 5.175 ( -6.440 -3.144 5.642) 9.121 5.875 ( -8.740 -0.745 0.001) 8.772 6.128 ( 13.209 -5.302 7.328) 16.009 6.711 ( 5.460 -1.129 29.002) 29.534 7.252 ( -16.672 -0.308 8.038) 18.511 7.681 ( 4.404 -1.070 -5.039) 6.778 8.279 ( 0.774 -1.266 2.466) 2.879 9.271 ( -0.596 8.017 -10.540) 13.256 9.434 ( -1.404 -5.125 -5.075) 7.348 9.646 ( 0.320 1.575 -25.385) 25.436 9.943 ( -1.107 -1.151 -4.663) 4.929 10.865 ( -0.393 1.155 11.637) 11.701 10.968 ( 4.531 -0.795 -3.717) 5.914 11.270 ( -2.337 1.698 1.412) 3.215 11.834 ( -0.929 0.268 -4.779) 4.876 12.144 ( 11.242 9.941 6.413) 16.319 12.504 ( 7.543 -7.881 4.460) 11.786 13.486 ( 2.789 6.031 -0.531) 6.666 13.595 ( 1.667 -2.934 1.881) 3.863 13.631 ( 0.715 -7.427 1.822) 7.681 14.072 ( -1.751 -0.620 -0.397) 1.900 14.085 ( -0.805 -0.750 -3.493) 3.662 14.947 ( 7.283 0.767 4.256) 8.470 15.509 ( 4.759 1.269 -1.999) 5.315 15.571 ( 4.392 -1.708 1.174) 4.857 15.880 ( -2.742 1.064 -3.329) 4.442 16.604 ( -3.288 8.492 0.162) 9.107 16.860 ( -0.096 0.729 13.922) 13.941 17.406 ( 6.740 -3.714 -9.469) 12.202 20.657 ( -2.501 -5.237 1.522) 6.000 21.549 ( 1.576 0.415 -3.768) 4.105 21.751 ( -11.306 2.370 -0.871) 11.585 22.555 ( -0.667 0.026 1.355) 1.510 ======================= Grid point 393 (193/227) ======================= q-point: (-0.10 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -2.361 5.848 5.559) 8.407 2.150 ( -3.660 1.481 5.979) 7.165 2.311 ( -0.292 -4.533 -2.844) 5.359 2.782 ( -21.705 -1.970 -8.081) 23.244 2.980 ( -0.958 2.203 6.309) 6.751 3.446 ( 5.216 0.660 -0.358) 5.269 3.821 ( 4.515 -2.730 -6.085) 8.054 3.988 ( -0.196 6.300 -4.615) 7.812 4.226 ( -3.067 -6.425 2.129) 7.431 4.534 ( -12.431 -2.188 -1.386) 12.698 4.701 ( 1.859 9.843 -8.239) 12.970 5.033 ( -3.852 -3.627 2.100) 5.692 5.147 ( -2.225 -7.786 0.660) 8.124 5.740 ( -9.671 -2.971 -2.105) 10.333 6.379 ( 9.356 -3.250 13.709) 16.913 6.829 ( 5.175 1.225 20.913) 21.579 7.081 ( -6.536 -8.820 4.572) 11.892 7.767 ( 6.711 1.370 -9.522) 11.730 8.303 ( 0.601 -0.802 3.076) 3.236 9.192 ( 1.043 7.718 -6.439) 10.105 9.443 ( -2.608 -3.334 -5.184) 6.693 9.601 ( -0.440 3.573 -16.392) 16.783 10.047 ( 11.206 -2.289 -6.826) 13.319 10.852 ( -0.586 0.580 12.594) 12.621 11.042 ( 4.806 0.613 -5.239) 7.136 11.231 ( -0.682 1.598 -0.495) 1.807 11.814 ( -0.369 1.275 -3.896) 4.116 12.211 ( 9.927 11.195 3.117) 15.283 12.671 ( 4.789 -4.195 4.177) 7.614 13.331 ( -10.717 3.948 1.350) 11.500 13.642 ( 0.245 -3.184 -0.706) 3.271 13.765 ( 0.613 -5.876 4.018) 7.145 14.086 ( 1.814 -1.733 -0.522) 2.563 14.093 ( 1.785 -1.181 -5.053) 5.487 15.044 ( 6.356 3.022 6.190) 9.372 15.569 ( 5.113 2.660 -4.007) 7.019 15.696 ( 7.870 -1.622 0.411) 8.046 15.827 ( -1.913 0.600 -0.343) 2.034 16.426 ( -4.676 12.745 -0.779) 13.598 16.825 ( -3.837 0.878 13.988) 14.531 17.465 ( -2.487 -0.568 -7.532) 7.952 20.722 ( -0.088 -12.261 0.998) 12.302 21.511 ( -8.323 5.671 -2.634) 10.410 21.626 ( 3.169 -1.748 -3.486) 5.025 22.562 ( 0.804 -0.885 1.366) 1.816 ======================= Grid point 402 (194/227) ======================= q-point: (-0.20 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -4.050 -0.000 7.911) 8.887 2.168 ( -3.040 -0.000 6.705) 7.362 2.258 ( -0.629 -0.000 -4.355) 4.400 2.763 ( -27.202 -0.000 -5.222) 27.699 3.007 ( -1.001 -0.000 5.876) 5.961 3.464 ( 3.350 0.000 -2.034) 3.919 3.785 ( 10.490 0.000 -11.539) 15.595 4.078 ( 0.222 0.000 -4.782) 4.787 4.129 ( -7.134 -0.000 7.841) 10.601 4.496 ( -14.487 -0.000 -3.186) 14.833 4.897 ( -0.552 -0.000 -1.792) 1.875 4.921 ( 1.006 0.000 -13.970) 14.006 5.047 ( -6.847 -0.000 7.064) 9.838 5.718 ( -9.539 -0.000 -2.123) 9.772 6.341 ( 13.883 0.000 11.901) 18.286 6.841 ( 9.540 0.000 22.948) 24.852 6.986 ( -14.221 -0.000 8.492) 16.563 7.783 ( 8.287 0.000 -9.101) 12.309 8.296 ( 1.614 0.000 3.522) 3.874 9.304 ( -0.883 -0.000 -8.058) 8.106 9.370 ( -2.147 -0.000 -2.215) 3.084 9.646 ( 0.038 0.000 -22.653) 22.653 10.020 ( 11.675 0.000 -4.293) 12.440 10.858 ( -1.002 -0.000 14.058) 14.094 11.046 ( 4.884 0.000 -5.373) 7.260 11.256 ( -0.874 -0.000 -1.643) 1.861 11.813 ( -0.872 -0.000 -4.925) 5.002 12.394 ( 11.205 0.000 6.038) 12.728 12.580 ( 6.772 0.000 2.986) 7.401 13.383 ( -13.046 -0.000 2.513) 13.286 13.614 ( 0.498 0.000 -0.580) 0.764 13.673 ( 4.856 0.000 4.078) 6.341 14.073 ( -0.273 -0.000 -4.116) 4.125 14.078 ( 2.937 0.000 -3.125) 4.288 15.074 ( 6.956 0.000 5.816) 9.067 15.622 ( 7.423 0.000 -5.940) 9.507 15.641 ( 5.675 0.000 1.261) 5.813 15.850 ( -1.136 -0.000 -0.402) 1.206 16.570 ( -5.723 -0.000 0.624) 5.757 16.839 ( -3.771 -0.000 16.448) 16.875 17.454 ( 0.985 0.000 -11.050) 11.094 20.586 ( -2.301 -0.000 1.013) 2.514 21.581 ( -10.702 -0.000 -0.123) 10.703 21.599 ( 4.593 0.000 -5.301) 7.014 22.551 ( 0.187 0.000 1.279) 1.292 ======================= Grid point 403 (195/227) ======================= q-point: (-0.10 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( -4.460 2.642 8.539) 9.990 2.091 ( -6.221 0.966 10.106) 11.907 2.277 ( 1.473 -2.503 -4.759) 5.575 2.358 ( -22.058 -4.971 3.871) 22.940 3.045 ( 5.211 0.764 6.345) 8.246 3.494 ( 0.598 -0.359 -2.072) 2.186 3.899 ( 0.832 4.374 -4.702) 6.476 3.980 ( -10.522 5.088 1.765) 11.820 4.094 ( 3.344 -9.312 -1.562) 10.017 4.314 ( -9.947 -4.855 -6.275) 12.724 4.792 ( -4.562 4.476 2.711) 6.942 4.922 ( -3.041 1.736 0.856) 3.605 5.046 ( 0.360 -8.780 -8.267) 12.065 5.575 ( -8.003 -0.782 -3.284) 8.686 6.523 ( 7.369 2.579 19.105) 20.639 6.822 ( -6.112 -3.081 8.010) 10.536 7.044 ( 10.428 -4.399 10.749) 15.609 7.931 ( 11.124 2.037 -13.401) 17.535 8.326 ( 1.984 0.326 3.232) 3.807 9.233 ( -4.046 3.912 -3.653) 6.710 9.359 ( -2.288 -3.105 -3.502) 5.210 9.667 ( 6.098 1.962 -14.756) 16.087 10.297 ( 20.817 -0.323 -3.272) 21.075 10.856 ( 0.256 0.510 12.305) 12.318 11.117 ( 3.897 -0.535 -4.470) 5.954 11.229 ( -1.618 1.034 -3.089) 3.637 11.810 ( 0.609 -0.233 -4.347) 4.396 12.501 ( 9.838 11.934 3.430) 15.842 12.713 ( 5.025 -4.490 2.449) 7.170 13.150 ( -14.078 1.613 1.804) 14.284 13.605 ( -1.793 -1.024 -0.600) 2.150 13.695 ( -4.967 -1.912 1.987) 5.681 14.114 ( 4.865 -2.536 -0.616) 5.521 14.130 ( 2.684 -0.022 -4.259) 5.034 15.169 ( 5.327 1.635 7.082) 9.011 15.690 ( 4.956 3.559 -5.241) 8.043 15.769 ( 3.683 -3.882 -0.823) 5.414 15.878 ( 7.615 2.485 0.734) 8.044 16.438 ( -5.582 6.479 0.477) 8.565 16.748 ( -7.496 0.965 17.294) 18.874 17.398 ( -6.652 2.431 -9.373) 11.747 20.603 ( -0.777 -9.200 0.459) 9.245 21.404 ( -8.909 2.791 -0.005) 9.336 21.701 ( 7.393 -1.293 -5.785) 9.476 22.560 ( -0.048 -1.140 -0.346) 1.193 ======================= Grid point 413 (196/227) ======================= q-point: (-0.10 -0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 220 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( -2.061 -0.000 8.601) 8.845 1.973 ( -8.700 -0.000 13.120) 15.742 2.043 ( -11.563 -0.000 14.475) 18.527 2.314 ( 4.152 0.000 -6.564) 7.767 3.165 ( 8.551 0.000 8.462) 12.030 3.474 ( -2.400 -0.000 0.148) 2.405 3.768 ( -15.948 -0.000 3.432) 16.313 3.833 ( -9.412 -0.000 12.513) 15.658 4.156 ( 2.797 0.000 -5.473) 6.146 4.159 ( -4.629 -0.000 -10.271) 11.266 4.656 ( -9.235 -0.000 6.989) 11.581 4.943 ( 2.285 0.000 -11.645) 11.867 5.045 ( 4.882 0.000 -7.653) 9.077 5.451 ( -6.667 -0.000 -3.344) 7.459 6.664 ( 5.095 0.000 26.056) 26.549 6.711 ( -3.084 -0.000 -1.559) 3.455 7.202 ( 9.713 0.000 7.719) 12.407 8.134 ( 12.115 0.000 -16.060) 20.117 8.364 ( 2.076 0.000 2.105) 2.957 9.123 ( -9.698 -0.000 -4.893) 10.862 9.340 ( 1.322 0.000 -2.924) 3.209 9.829 ( 12.796 0.000 -6.489) 14.347 10.677 ( 23.858 0.000 -0.962) 23.877 10.878 ( 1.026 0.000 9.532) 9.587 11.157 ( 2.173 0.000 -1.339) 2.552 11.189 ( -3.242 -0.000 -4.904) 5.879 11.840 ( 3.110 0.000 -3.346) 4.568 12.724 ( 1.626 0.000 0.408) 1.676 12.730 ( 3.663 0.000 1.201) 3.855 12.946 ( -8.121 -0.000 1.467) 8.252 13.553 ( -10.405 -0.000 -0.884) 10.443 13.581 ( -0.624 -0.000 -0.579) 0.851 14.153 ( 0.239 0.000 -4.480) 4.486 14.207 ( 7.689 0.000 1.952) 7.933 15.252 ( 3.566 0.000 6.851) 7.724 15.754 ( 2.462 0.000 -3.251) 4.078 15.823 ( 4.283 0.000 1.576) 4.564 16.064 ( 12.318 0.000 -3.711) 12.865 16.385 ( -4.356 -0.000 1.231) 4.526 16.617 ( -9.596 -0.000 19.354) 21.603 17.271 ( -10.733 -0.000 -8.919) 13.955 20.537 ( -0.805 -0.000 0.234) 0.838 21.290 ( -6.539 -0.000 0.442) 6.554 21.829 ( 9.225 0.000 -5.252) 10.615 22.525 ( -3.853 -0.000 -2.803) 4.765 ======================= Grid point 414 (197/227) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 117 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 0.000 0.000 0.000) 0.000 2.009 ( 0.000 0.000 0.000) 0.000 2.208 ( 0.000 0.000 0.000) 0.000 2.296 ( 0.000 0.000 -0.000) 0.000 3.308 ( 0.000 0.000 0.000) 0.000 3.431 ( 0.000 0.000 0.000) 0.000 3.826 ( 0.000 0.000 0.000) 0.000 3.852 ( -0.000 -0.000 -0.000) 0.000 3.857 ( 0.000 0.000 0.000) 0.000 3.917 ( 0.000 0.000 0.000) 0.000 4.550 ( -0.000 -0.000 0.000) 0.000 4.824 ( 0.000 0.000 0.000) 0.000 5.084 ( 0.000 0.000 0.000) 0.000 5.339 ( 0.000 0.000 0.000) 0.000 6.629 ( 0.000 0.000 0.000) 0.000 7.145 ( -0.000 -0.000 0.000) 0.000 7.429 ( 0.000 0.000 -0.000) 0.000 8.089 ( 0.000 0.000 0.000) 0.000 8.410 ( 0.000 0.000 0.000) 0.000 8.841 ( -0.000 -0.000 0.000) 0.000 9.368 ( 0.000 0.000 0.000) 0.000 10.320 ( 0.000 0.000 0.000) 0.000 10.726 ( -0.000 -0.000 0.000) 0.000 10.995 ( 0.000 0.000 0.000) 0.000 11.187 ( -0.000 -0.000 0.000) 0.000 11.532 ( 0.000 0.000 0.000) 0.000 11.725 ( 0.000 0.000 0.000) 0.000 12.529 ( 0.000 0.000 0.000) 0.000 12.701 ( -0.000 -0.000 0.000) 0.000 12.983 ( 0.000 0.000 0.000) 0.000 13.312 ( 0.000 0.000 0.000) 0.000 13.580 ( -0.000 -0.000 0.000) 0.000 14.060 ( 0.000 0.000 0.000) 0.000 14.428 ( 0.000 0.000 0.000) 0.000 15.360 ( 0.000 0.000 0.000) 0.000 15.870 ( 0.000 0.000 0.000) 0.000 15.916 ( 0.000 0.000 0.000) 0.000 16.227 ( 0.000 0.000 0.000) 0.000 16.333 ( 0.000 0.000 0.000) 0.000 16.627 ( -0.000 -0.000 0.000) 0.000 16.967 ( 0.000 0.000 0.000) 0.000 20.527 ( -0.000 -0.000 0.000) 0.000 21.187 ( 0.000 0.000 0.000) 0.000 22.098 ( -0.000 -0.000 0.000) 0.000 22.193 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 416 (198/227) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.601 ( 1.444 3.250 -3.228) 4.803 2.051 ( 2.618 -3.593 3.594) 5.717 2.198 ( -0.492 -0.562 -3.356) 3.439 2.299 ( -0.516 -1.741 -3.853) 4.260 3.322 ( 2.320 3.342 2.694) 4.880 3.452 ( -0.004 -3.318 1.724) 3.739 3.682 ( -9.720 -0.930 0.719) 9.791 3.872 ( 2.942 -4.019 10.424) 11.553 3.948 ( 2.853 0.503 -1.957) 3.496 4.038 ( 7.756 -5.649 1.684) 9.742 4.566 ( -0.054 -5.967 14.725) 15.888 4.893 ( 5.226 -3.205 -15.645) 16.804 5.040 ( -3.022 2.263 -0.457) 3.803 5.391 ( 4.228 -2.024 -3.026) 5.579 6.669 ( 5.341 1.495 -5.790) 8.018 7.113 ( -4.868 -2.563 3.331) 6.432 7.438 ( 1.195 0.473 -11.171) 11.244 7.961 ( -11.884 2.245 10.063) 15.733 8.405 ( -1.016 -0.139 0.183) 1.041 8.938 ( 9.810 -0.224 -4.274) 10.703 9.363 ( -0.672 -0.562 -1.931) 2.120 10.138 ( -16.691 2.053 -6.552) 18.048 10.815 ( 5.338 2.681 3.898) 7.132 10.948 ( -7.284 -3.595 3.757) 8.950 11.161 ( -0.356 4.622 -4.871) 6.725 11.351 ( -14.396 -2.426 -3.676) 15.055 11.728 ( -2.928 0.443 11.143) 11.530 12.603 ( 7.882 8.569 -1.404) 11.727 12.705 ( 4.404 0.865 -0.248) 4.495 12.956 ( -1.977 0.884 -0.728) 2.284 13.367 ( 8.067 2.623 -1.139) 8.559 13.590 ( 0.082 -2.429 -0.326) 2.452 14.061 ( -0.079 -0.050 2.952) 2.954 14.404 ( -4.011 -2.185 -3.487) 5.746 15.359 ( -0.342 -0.117 -0.468) 0.591 15.796 ( -8.176 1.021 1.609) 8.395 15.890 ( -1.932 1.218 -0.043) 2.285 16.100 ( -10.609 3.068 6.189) 12.660 16.323 ( 1.637 4.130 0.332) 4.455 16.713 ( 12.731 8.290 -5.021) 16.000 17.029 ( 7.690 0.852 -3.217) 8.380 20.601 ( 0.263 -13.269 -0.676) 13.289 21.202 ( 3.488 2.812 -0.224) 4.486 21.934 ( -12.928 -2.335 2.717) 13.415 22.347 ( 8.998 -1.922 3.205) 9.744 ======================= Grid point 417 (199/227) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( 3.556 6.318 -4.178) 8.367 2.166 ( 4.581 -6.897 6.359) 10.440 2.222 ( 2.908 -0.064 -7.284) 7.843 2.319 ( -0.317 -4.450 -1.184) 4.616 3.290 ( -3.030 2.189 -3.644) 5.220 3.450 ( -2.712 -1.761 2.449) 4.056 3.616 ( 0.204 -0.413 12.638) 12.646 3.947 ( -0.206 1.524 -3.562) 3.879 4.004 ( 3.585 -6.806 14.550) 16.458 4.231 ( 7.570 -7.696 -4.377) 11.649 4.696 ( 2.931 -8.363 7.104) 11.358 4.944 ( -1.358 -3.461 3.550) 5.141 5.043 ( 4.263 -3.147 -11.124) 12.321 5.492 ( 5.484 -2.197 -4.100) 7.191 6.726 ( 4.645 5.900 -10.010) 12.514 7.080 ( -3.974 -7.500 2.792) 8.935 7.423 ( -1.494 2.939 -11.941) 12.388 7.745 ( -11.181 0.333 8.541) 14.074 8.380 ( -1.507 0.724 0.321) 1.702 9.095 ( 8.460 0.960 -4.239) 9.512 9.365 ( 0.190 -1.046 -3.714) 3.863 9.809 ( -18.599 3.125 -5.053) 19.525 10.592 ( -21.510 2.487 2.950) 21.853 10.990 ( 3.561 -1.460 1.592) 4.165 11.102 ( -1.000 3.672 -3.375) 5.087 11.234 ( -4.885 -3.182 -2.398) 6.304 11.650 ( -3.991 1.959 12.481) 13.249 12.495 ( -3.490 14.203 1.231) 14.677 12.821 ( 3.648 0.525 -3.054) 4.787 12.970 ( 8.208 1.494 -2.390) 8.679 13.492 ( 10.250 4.113 -0.203) 11.046 13.645 ( 3.072 -3.913 -0.887) 5.053 14.056 ( -1.073 -0.234 4.747) 4.872 14.349 ( -6.628 -4.999 -5.394) 9.900 15.337 ( -2.562 1.128 -3.258) 4.295 15.598 ( -10.226 5.797 8.745) 14.651 15.852 ( -1.612 0.090 -0.353) 1.653 15.921 ( -7.006 2.758 4.087) 8.567 16.284 ( 0.830 7.913 1.560) 8.108 16.827 ( 11.894 9.225 -4.662) 15.758 17.172 ( 9.787 0.288 -4.629) 10.831 20.769 ( -0.514 -18.967 -2.561) 19.146 21.240 ( 5.898 5.196 0.292) 7.866 21.772 ( -10.902 -4.282 4.018) 12.383 22.483 ( 4.701 -2.237 3.959) 6.540 ======================= Grid point 418 (200/227) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 2.281 7.728 -2.765) 8.519 2.236 ( 1.238 2.391 -8.190) 8.621 2.317 ( 1.824 -5.909 1.213) 6.302 2.418 ( 6.998 -7.101 9.382) 13.689 3.208 ( -5.117 -1.665 -9.940) 11.303 3.454 ( 1.708 0.122 4.477) 4.793 3.645 ( 1.585 -0.479 12.491) 12.600 3.908 ( -2.025 1.175 -3.576) 4.275 4.117 ( 1.900 -4.545 13.062) 13.960 4.430 ( 7.921 -6.057 -3.834) 10.683 4.683 ( -4.594 1.588 -4.651) 6.727 5.071 ( -0.533 -8.071 5.816) 9.962 5.167 ( 7.022 -9.872 -2.715) 12.415 5.623 ( 7.942 -3.746 -3.275) 9.372 6.677 ( -2.253 4.867 -6.950) 8.779 7.133 ( 1.150 -3.044 0.682) 3.325 7.316 ( -5.623 2.083 -2.761) 6.601 7.634 ( -4.545 -2.198 -4.733) 6.920 8.355 ( -0.584 -0.039 -0.255) 0.638 9.143 ( -1.020 4.683 -4.490) 6.567 9.372 ( -0.060 1.216 -3.230) 3.451 9.539 ( -8.652 0.077 -1.441) 8.771 10.234 ( -19.750 -1.019 2.971) 19.998 10.992 ( -4.561 1.700 2.771) 5.601 11.063 ( 1.854 2.571 -6.749) 7.456 11.214 ( -1.019 -1.577 -0.642) 1.984 11.606 ( 0.272 1.327 13.019) 13.089 12.267 ( -6.438 12.949 -0.809) 14.484 12.813 ( -1.936 0.237 -2.763) 3.382 13.137 ( 12.917 3.816 -2.518) 13.702 13.611 ( 7.825 0.961 -0.091) 7.884 13.754 ( 5.958 -1.643 -0.891) 6.244 14.030 ( -2.737 -0.214 4.873) 5.593 14.293 ( -7.197 -7.030 -5.038) 11.252 15.205 ( -8.240 6.247 -1.817) 10.499 15.454 ( -1.645 3.052 8.555) 9.231 15.762 ( -5.298 4.776 2.941) 7.716 15.882 ( -1.756 -6.431 -1.255) 6.783 16.201 ( 1.208 11.458 2.116) 11.714 16.910 ( 8.130 6.490 -2.896) 10.798 17.319 ( 8.067 -0.247 -4.104) 9.054 20.933 ( -1.688 -16.657 -4.038) 17.222 21.286 ( 6.139 5.738 1.721) 8.577 21.671 ( -7.146 -4.816 3.051) 9.141 22.551 ( 1.438 -1.504 3.020) 3.668 ======================= Grid point 419 (201/227) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( 0.346 5.362 -1.149) 5.494 2.206 ( -1.391 1.617 -3.351) 3.972 2.375 ( 1.082 -1.996 0.586) 2.344 2.628 ( 8.100 -5.181 7.835) 12.403 3.155 ( -3.405 -1.926 -10.448) 11.156 3.480 ( 0.998 0.287 1.816) 2.092 3.689 ( 2.125 -1.648 9.676) 10.043 3.859 ( -1.960 1.908 -2.977) 4.042 4.170 ( 0.530 -1.737 7.899) 8.105 4.513 ( -2.032 1.295 2.430) 3.422 4.695 ( 7.309 -3.418 -10.278) 13.067 5.057 ( -6.735 -3.969 5.320) 9.456 5.344 ( 3.539 -4.466 -2.883) 6.386 5.833 ( 9.130 -7.343 0.459) 11.725 6.592 ( -3.376 1.307 -3.208) 4.837 7.085 ( -2.432 6.234 2.539) 7.157 7.301 ( 0.138 -4.613 -2.346) 5.177 7.591 ( -2.802 -0.561 -6.649) 7.237 8.377 ( 1.631 -2.682 -1.155) 3.345 8.973 ( -7.927 7.454 -2.117) 11.085 9.370 ( 1.657 0.991 -0.543) 2.005 9.506 ( 0.020 -1.521 -1.723) 2.298 9.993 ( -11.650 -2.202 2.199) 12.058 10.883 ( -4.698 2.047 2.391) 5.655 11.074 ( 1.913 1.819 -5.349) 5.965 11.217 ( -0.251 -0.695 0.113) 0.748 11.628 ( 2.164 0.234 10.392) 10.618 12.057 ( -5.531 7.907 -2.989) 10.102 12.776 ( -1.589 0.494 -1.795) 2.448 13.280 ( 8.347 3.035 -1.346) 8.983 13.731 ( 6.055 -1.837 -2.178) 6.692 13.850 ( 5.043 1.142 1.096) 5.285 13.973 ( -4.656 -0.251 3.120) 5.610 14.254 ( -5.046 -5.629 -2.906) 8.099 15.024 ( -5.295 5.134 1.017) 7.445 15.439 ( 0.855 0.645 3.166) 3.342 15.638 ( -4.420 3.370 1.891) 5.871 15.937 ( -1.442 -9.264 -1.671) 9.523 16.105 ( 1.759 12.486 2.236) 12.807 16.960 ( 4.043 3.191 -1.336) 5.321 17.425 ( 4.469 -0.307 -2.309) 5.040 21.035 ( -1.518 -9.144 -3.224) 9.814 21.320 ( 3.491 3.512 2.234) 5.432 21.632 ( -2.990 -3.289 1.122) 4.585 22.572 ( 0.091 -0.613 1.523) 1.644 ======================= Grid point 420 (202/227) ======================= q-point: ( 0.50 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 202 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.495 ( -0.000 0.000 0.000) 0.000 2.182 ( -0.000 0.000 0.000) 0.000 2.394 ( -0.000 0.000 0.000) 0.000 2.732 ( -0.000 0.000 0.000) 0.000 3.131 ( 0.000 0.000 0.000) 0.000 3.484 ( -0.000 0.000 0.000) 0.000 3.731 ( -0.000 0.000 -0.000) 0.000 3.820 ( -0.000 -0.000 0.000) 0.000 4.184 ( -0.000 0.000 0.000) 0.000 4.478 ( -0.000 0.000 0.000) 0.000 4.812 ( -0.000 0.000 0.000) 0.000 4.992 ( -0.000 0.000 -0.000) 0.000 5.389 ( -0.000 0.000 0.000) 0.000 5.965 ( -0.000 0.000 0.000) 0.000 6.554 ( -0.000 0.000 0.000) 0.000 7.026 ( -0.000 0.000 0.000) 0.000 7.331 ( -0.000 0.000 0.000) 0.000 7.562 ( -0.000 0.000 -0.000) 0.000 8.421 ( -0.000 0.000 0.000) 0.000 8.849 ( -0.000 0.000 0.000) 0.000 9.382 ( -0.000 0.000 0.000) 0.000 9.518 ( -0.000 0.000 0.000) 0.000 9.907 ( -0.000 -0.000 0.000) 0.000 10.831 ( -0.000 0.000 0.000) 0.000 11.080 ( -0.000 -0.000 0.000) 0.000 11.218 ( -0.000 0.000 0.000) 0.000 11.654 ( -0.000 0.000 -0.000) 0.000 11.962 ( -0.000 0.000 0.000) 0.000 12.759 ( -0.000 0.000 0.000) 0.000 13.335 ( -0.000 0.000 0.000) 0.000 13.810 ( -0.000 0.000 0.000) 0.000 13.899 ( -0.000 -0.000 -0.000) 0.000 13.904 ( 0.000 0.000 0.000) 0.000 14.240 ( -0.000 0.000 0.000) 0.000 14.953 ( -0.000 0.000 0.000) 0.000 15.450 ( -0.000 0.000 0.000) 0.000 15.577 ( -0.000 0.000 0.000) 0.000 16.011 ( -0.000 -0.000 0.000) 0.000 16.017 ( -0.000 0.000 0.000) 0.000 16.977 ( -0.000 0.000 0.000) 0.000 17.464 ( -0.000 0.000 0.000) 0.000 21.067 ( -0.000 -0.000 0.000) 0.000 21.331 ( -0.000 0.000 0.000) 0.000 21.627 ( -0.000 0.000 0.000) 0.000 22.575 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 427 (203/227) ======================= q-point: ( 0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 5.536 0.000 -6.969) 8.900 2.088 ( 3.374 0.000 6.594) 7.407 2.209 ( 3.770 0.000 -0.633) 3.823 2.286 ( 0.279 0.000 -8.729) 8.734 3.311 ( -6.767 -0.000 -4.617) 8.192 3.439 ( 0.366 0.000 3.387) 3.407 3.607 ( 0.676 0.000 16.354) 16.368 3.911 ( 4.259 0.000 14.252) 14.875 4.055 ( -0.375 -0.000 0.021) 0.375 4.083 ( 10.240 0.000 -11.390) 15.316 4.565 ( 5.422 0.000 18.670) 19.441 4.960 ( -7.132 -0.000 0.370) 7.141 4.988 ( 6.239 0.000 -13.666) 15.023 5.473 ( 6.831 0.000 -4.791) 8.344 6.811 ( 10.667 0.000 -11.542) 15.716 6.971 ( -10.530 -0.000 0.695) 10.553 7.451 ( 0.204 0.000 -17.277) 17.278 7.761 ( -12.753 -0.000 15.686) 20.217 8.386 ( -1.415 -0.000 -0.054) 1.416 9.105 ( 9.472 0.000 -2.883) 9.901 9.352 ( 0.079 0.000 -3.760) 3.761 9.837 ( -19.479 -0.000 -6.129) 20.420 10.626 ( -24.357 -0.000 3.664) 24.631 10.966 ( 6.603 0.000 4.073) 7.759 11.152 ( -7.312 -0.000 -0.659) 7.342 11.195 ( 1.465 0.000 -9.158) 9.275 11.668 ( -4.396 -0.000 13.619) 14.311 12.711 ( -0.301 -0.000 1.969) 1.992 12.763 ( -3.788 -0.000 -3.088) 4.887 12.986 ( 11.289 0.000 -3.092) 11.705 13.560 ( 12.049 0.000 -0.897) 12.083 13.579 ( 0.608 0.000 -0.302) 0.679 14.054 ( -1.127 -0.000 5.015) 5.140 14.290 ( -7.966 -0.000 -5.777) 9.840 15.347 ( -1.545 -0.000 -2.322) 2.790 15.653 ( -9.636 -0.000 7.178) 12.016 15.840 ( -4.548 -0.000 -0.047) 4.548 15.950 ( -8.473 -0.000 6.320) 10.570 16.391 ( 3.512 0.000 0.639) 3.569 16.953 ( 10.413 0.000 -6.537) 12.295 17.168 ( 8.440 0.000 -5.131) 9.877 20.545 ( 1.177 0.000 -0.510) 1.282 21.302 ( 6.736 0.000 -0.707) 6.773 21.726 ( -10.765 -0.000 5.273) 11.987 22.456 ( 5.218 0.000 3.753) 6.428 ======================= Grid point 428 (204/227) ======================= q-point: ( 0.20 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( 5.591 6.866 -8.666) 12.390 2.165 ( 1.846 -5.956 5.291) 8.178 2.294 ( 2.856 1.583 -9.968) 10.489 2.341 ( 9.972 -1.565 7.605) 12.638 3.197 ( -4.753 0.121 -7.055) 8.508 3.447 ( 0.404 -0.438 2.688) 2.754 3.627 ( -0.657 -0.902 13.867) 13.912 3.980 ( 0.574 4.460 2.452) 5.122 4.037 ( 4.677 -2.269 7.994) 9.536 4.308 ( 11.303 -5.748 -5.399) 13.782 4.700 ( 2.584 0.059 7.675) 8.098 4.864 ( -2.638 -6.916 5.736) 9.364 5.062 ( 2.442 -2.243 -4.238) 5.381 5.601 ( 8.752 0.083 -5.984) 10.603 6.745 ( -12.390 2.054 -4.136) 13.223 7.027 ( 10.478 -4.234 -12.397) 16.776 7.401 ( -4.809 2.931 -8.996) 10.614 7.611 ( -5.052 -0.192 4.791) 6.966 8.358 ( -1.729 0.193 0.241) 1.756 9.209 ( 3.121 1.725 -1.143) 3.745 9.369 ( 1.597 -0.511 -4.513) 4.814 9.541 ( -14.650 -0.084 -1.593) 14.736 10.229 ( -21.874 0.175 3.468) 22.148 11.026 ( -2.141 1.821 2.982) 4.098 11.064 ( -1.542 -1.693 -0.214) 2.300 11.226 ( 3.293 1.341 -9.715) 10.345 11.619 ( -1.660 0.157 14.017) 14.116 12.539 ( -7.620 12.539 -0.878) 14.699 12.751 ( -4.116 -6.351 -1.450) 7.706 13.207 ( 14.659 2.402 -3.838) 15.342 13.603 ( 2.255 -0.793 -0.365) 2.418 13.739 ( 8.805 -0.242 -1.541) 8.942 14.026 ( -2.538 -0.138 5.784) 6.318 14.162 ( -9.357 -4.408 -5.243) 11.596 15.274 ( -7.346 1.370 -2.816) 7.986 15.516 ( -4.725 2.270 11.030) 12.212 15.770 ( -6.014 -3.195 0.241) 6.814 15.840 ( -3.884 1.741 3.150) 5.296 16.420 ( 4.252 7.452 2.187) 8.854 17.051 ( 5.834 5.150 -4.718) 9.100 17.290 ( 5.591 -1.490 -5.728) 8.142 20.623 ( 1.269 -10.141 -1.429) 10.319 21.408 ( 8.265 4.489 -0.230) 9.408 21.598 ( -6.226 -2.486 4.548) 8.101 22.521 ( 1.984 -1.055 3.156) 3.875 ======================= Grid point 429 (205/227) ======================= q-point: ( 0.30 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 1.347 10.724 -5.973) 12.350 2.217 ( -2.092 -3.032 0.446) 3.711 2.328 ( 2.891 -0.300 -5.490) 6.212 2.569 ( 14.103 -1.015 11.867) 18.460 3.162 ( 1.493 1.963 -10.697) 10.978 3.458 ( -0.879 -1.771 -1.029) 2.229 3.640 ( 0.223 -3.213 10.984) 11.446 3.926 ( -0.806 4.772 -0.573) 4.874 4.149 ( 4.701 -1.236 10.242) 11.337 4.506 ( 2.607 -1.950 3.398) 4.706 4.653 ( 4.071 0.658 -4.859) 6.374 4.942 ( -4.824 -7.861 8.004) 12.212 5.190 ( 6.767 -8.258 0.279) 10.680 5.754 ( 10.107 -0.817 -4.102) 10.939 6.537 ( -13.253 -4.501 -4.398) 14.671 7.218 ( 8.170 2.555 -8.533) 12.087 7.265 ( -2.839 3.122 -3.017) 5.187 7.579 ( -0.794 -0.729 -6.809) 6.894 8.336 ( -1.049 -1.123 0.045) 1.537 9.121 ( -7.528 6.409 -0.316) 9.892 9.368 ( -1.334 -0.593 2.883) 3.232 9.457 ( 0.133 -3.175 -2.711) 4.177 9.958 ( -11.138 -1.057 2.629) 11.492 10.926 ( -5.185 2.076 3.904) 6.815 11.075 ( -0.755 -1.174 -2.034) 2.467 11.260 ( 4.186 3.680 -8.320) 10.014 11.625 ( 1.033 -0.784 13.190) 13.254 12.273 ( -8.531 12.650 -2.572) 15.473 12.734 ( -4.350 -4.664 -2.170) 6.736 13.372 ( 9.437 5.723 -2.668) 11.355 13.661 ( 2.004 -4.025 -2.179) 4.997 13.844 ( 2.257 -2.009 -3.322) 4.490 13.980 ( -2.683 0.640 5.568) 6.214 14.103 ( -4.229 -7.643 -1.979) 8.956 15.103 ( -9.505 2.520 1.964) 10.028 15.464 ( -0.422 1.628 4.773) 5.060 15.680 ( -6.733 -0.415 1.931) 7.016 15.813 ( -0.448 -2.222 0.918) 2.446 16.381 ( 3.593 13.137 3.675) 14.107 17.059 ( 2.266 5.326 -3.965) 7.016 17.373 ( 1.244 -3.968 -3.017) 5.138 20.759 ( 0.306 -13.435 -2.601) 13.688 21.450 ( 3.383 5.997 3.052) 7.531 21.596 ( 3.437 -0.683 -0.054) 3.505 22.551 ( 0.340 -1.250 2.173) 2.530 ======================= Grid point 430 (206/227) ======================= q-point: ( 0.40 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( -0.814 8.965 -3.662) 9.718 2.193 ( -1.571 -0.015 1.507) 2.177 2.372 ( 1.391 -1.191 -3.881) 4.291 2.759 ( 7.505 2.155 5.999) 9.846 3.185 ( 6.084 4.918 -3.547) 8.589 3.450 ( -2.553 -2.848 -4.598) 5.981 3.707 ( 3.150 -2.218 9.594) 10.339 3.855 ( -2.549 3.052 -3.916) 5.581 4.214 ( 3.706 2.237 5.181) 6.751 4.461 ( -3.386 -0.635 2.948) 4.534 4.809 ( 3.897 -0.076 3.931) 5.536 4.936 ( 1.922 -5.535 3.608) 6.881 5.336 ( 1.661 -5.199 -1.216) 5.591 5.933 ( 8.352 -2.082 -1.507) 8.739 6.420 ( -9.428 -10.039 -4.490) 14.485 7.120 ( -2.118 6.589 -0.504) 6.939 7.371 ( 7.895 3.390 -8.404) 12.019 7.575 ( 1.072 0.863 -3.344) 3.616 8.362 ( 0.796 -4.293 -0.788) 4.436 8.935 ( -5.232 6.919 3.614) 9.397 9.357 ( -2.514 -2.161 4.567) 5.643 9.490 ( -0.290 -2.677 -1.234) 2.962 9.900 ( 2.792 -0.465 0.338) 2.850 10.846 ( -1.957 1.445 1.941) 3.112 11.060 ( -2.444 -1.545 -0.344) 2.912 11.279 ( 3.889 5.110 -5.992) 8.783 11.661 ( 1.347 -0.135 10.259) 10.348 12.037 ( -6.329 7.654 -5.407) 11.308 12.712 ( -3.500 -4.574 -1.440) 5.937 13.377 ( -2.257 3.986 -0.307) 4.591 13.751 ( 2.846 -5.007 -4.732) 7.454 13.815 ( -8.261 -4.458 -1.824) 9.562 13.974 ( 2.871 2.712 4.258) 5.808 14.168 ( 3.051 -6.069 -0.962) 6.861 14.955 ( -6.218 0.172 2.789) 6.816 15.455 ( 0.036 0.534 0.497) 0.731 15.589 ( -3.540 0.515 1.500) 3.879 15.847 ( -0.096 -4.946 0.713) 4.998 16.287 ( 2.257 14.789 4.104) 15.513 17.022 ( -0.974 3.768 -3.322) 5.117 17.403 ( -3.364 -5.507 0.227) 6.457 20.885 ( -0.788 -12.275 -2.748) 12.604 21.438 ( 2.452 5.440 2.454) 6.451 21.673 ( 7.326 4.236 -0.902) 8.510 22.564 ( -0.063 -0.984 1.083) 1.465 ======================= Grid point 431 (207/227) ======================= q-point: (-0.50 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -1.191 3.923 -2.123) 4.616 2.182 ( -0.701 -1.151 4.466) 4.665 2.396 ( 1.637 0.690 -4.828) 5.145 2.758 ( -1.056 7.141 -2.351) 7.592 3.245 ( 6.913 6.427 8.221) 12.517 3.435 ( -2.808 -3.624 -6.604) 8.039 3.723 ( -2.599 2.021 1.493) 3.615 3.842 ( 4.071 -0.033 -1.988) 4.531 4.237 ( 3.299 4.763 -1.583) 6.006 4.461 ( 0.751 -3.371 0.319) 3.469 4.749 ( -5.861 1.538 12.745) 14.113 5.099 ( 8.743 -0.193 -1.648) 8.899 5.363 ( -1.533 -1.484 1.869) 2.837 5.981 ( -1.644 5.607 -2.262) 6.265 6.433 ( -3.502 -12.945 -3.044) 13.752 7.065 ( 1.898 3.552 -0.735) 4.093 7.409 ( 3.311 5.319 -8.552) 10.602 7.618 ( 6.008 2.557 5.630) 8.621 8.403 ( -1.189 -1.520 0.312) 1.954 8.875 ( 3.340 -0.702 5.280) 6.286 9.326 ( -4.309 -2.974 4.653) 7.004 9.510 ( 0.539 -1.428 0.980) 1.814 10.030 ( 12.596 1.191 -1.274) 12.716 10.849 ( 2.676 -1.098 -0.621) 2.958 11.028 ( -3.632 -2.036 2.161) 4.691 11.283 ( 3.378 5.288 -3.251) 7.067 11.643 ( -2.495 2.223 -0.742) 3.423 11.960 ( 0.906 -2.011 -2.141) 3.074 12.717 ( -1.888 -5.251 0.163) 5.582 13.248 ( -10.545 -0.432 0.982) 10.599 13.693 ( -11.359 -5.381 -1.192) 12.626 13.830 ( 1.370 -0.514 -2.328) 2.749 13.995 ( 2.917 1.724 0.561) 3.435 14.291 ( 6.323 -1.821 0.577) 6.605 14.916 ( -1.310 -5.008 1.367) 5.354 15.439 ( -1.374 0.423 -1.784) 2.291 15.582 ( 1.852 -1.935 -0.206) 2.687 15.904 ( -0.164 -6.567 0.620) 6.598 16.174 ( 1.407 13.211 3.335) 13.698 16.950 ( -4.274 1.838 -2.472) 5.268 17.370 ( -7.643 -5.668 2.952) 9.962 20.975 ( -1.420 -9.452 -1.835) 9.732 21.419 ( 2.717 7.545 1.110) 8.096 21.742 ( 8.253 7.363 -0.587) 11.076 22.571 ( -0.083 -0.632 -0.364) 0.734 ======================= Grid point 432 (208/227) ======================= q-point: (-0.40 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( -1.804 -1.483 -0.645) 2.422 2.185 ( -1.818 -2.565 8.119) 8.706 2.408 ( 2.291 3.575 -5.298) 6.789 2.619 ( -3.133 11.657 -6.078) 13.515 3.258 ( -0.798 1.851 8.513) 8.748 3.446 ( 3.279 0.512 -5.167) 6.141 3.654 ( -3.100 0.828 -5.087) 6.015 3.921 ( 5.712 1.804 0.293) 5.997 4.220 ( 1.380 6.301 -5.556) 8.514 4.515 ( 0.515 0.283 -1.226) 1.359 4.660 ( -1.339 0.697 12.334) 12.426 5.163 ( 0.449 2.729 0.048) 2.766 5.328 ( -2.202 3.750 2.318) 4.928 5.800 ( -6.779 12.503 -1.516) 14.303 6.519 ( -1.826 -11.328 1.192) 11.536 7.110 ( 4.825 -0.774 -2.343) 5.420 7.393 ( 2.268 5.800 -5.818) 8.522 7.698 ( 7.127 4.261 8.202) 11.671 8.365 ( -1.972 0.817 1.257) 2.477 9.028 ( 6.253 -6.352 6.206) 10.861 9.305 ( -1.754 -4.664 4.952) 7.025 9.544 ( 3.535 -0.065 1.227) 3.742 10.267 ( 17.861 1.727 -1.385) 17.998 10.938 ( 2.462 -3.957 2.121) 5.120 11.000 ( -0.427 -2.272 0.497) 2.365 11.286 ( 3.720 5.094 -1.090) 6.401 11.579 ( -2.757 -0.451 -10.438) 10.805 12.060 ( 4.147 -7.559 0.417) 8.632 12.750 ( -1.290 -5.662 1.537) 6.007 13.063 ( -14.138 -3.802 1.437) 14.710 13.551 ( -11.843 -4.598 0.263) 12.707 13.803 ( -2.195 2.864 -0.334) 3.624 14.038 ( 3.113 0.689 -2.943) 4.339 14.392 ( 5.964 2.196 2.940) 7.002 15.020 ( 4.088 -11.017 0.438) 11.759 15.417 ( -0.890 -0.602 -4.273) 4.406 15.668 ( 4.441 -3.947 -1.631) 6.161 15.948 ( -2.606 -3.610 2.071) 4.910 16.107 ( 4.209 6.015 0.296) 7.347 16.843 ( -7.672 -0.109 -1.511) 7.820 17.273 ( -10.853 -5.033 4.909) 12.931 21.029 ( -1.457 -6.194 -0.457) 6.380 21.361 ( 1.445 11.304 0.822) 11.426 21.804 ( 9.528 8.480 -0.758) 12.778 22.568 ( -0.835 0.125 -2.248) 2.401 ======================= Grid point 433 (209/227) ======================= q-point: (-0.30 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -2.462 -4.898 1.051) 5.581 2.182 ( -1.720 -2.417 7.513) 8.078 2.348 ( -3.107 8.552 -3.846) 9.879 2.471 ( 0.695 10.965 -4.121) 11.735 3.225 ( -3.627 -4.101 1.179) 5.601 3.523 ( 8.137 5.173 0.357) 9.648 3.615 ( 0.037 -0.487 -7.668) 7.684 3.976 ( 4.072 3.592 -0.151) 5.432 4.142 ( -2.630 6.832 -6.577) 9.841 4.415 ( -3.872 10.113 2.872) 11.203 4.722 ( 2.892 -3.250 4.707) 6.409 5.083 ( -5.854 3.271 3.264) 7.458 5.187 ( -3.462 12.886 -3.801) 13.874 5.594 ( -4.001 9.173 3.451) 10.586 6.585 ( -2.760 -8.759 5.394) 10.650 7.186 ( 3.512 1.692 -4.921) 6.278 7.386 ( 2.480 1.680 0.753) 3.088 7.782 ( 8.725 3.897 3.027) 10.024 8.357 ( 0.507 -1.407 -0.223) 1.512 9.069 ( -5.689 -1.591 6.147) 8.525 9.365 ( 1.089 -2.220 5.009) 5.586 9.711 ( 14.535 -5.904 2.379) 15.867 10.561 ( 17.936 -0.336 -0.802) 17.957 10.945 ( -4.350 -5.898 6.113) 9.543 11.080 ( 4.661 1.475 -4.815) 6.862 11.314 ( 5.883 4.540 0.805) 7.474 11.588 ( 2.572 -3.953 -11.512) 12.440 12.218 ( 2.343 -12.030 -0.838) 12.285 12.751 ( -7.656 -5.390 2.622) 9.724 12.904 ( -8.981 -5.964 0.621) 10.799 13.408 ( -10.560 -3.924 1.635) 11.383 13.728 ( -1.997 4.330 0.120) 4.770 14.065 ( 1.282 0.768 -3.848) 4.128 14.447 ( 4.530 3.883 4.067) 7.221 15.248 ( 7.613 -11.455 3.951) 14.310 15.436 ( 1.287 -5.960 -9.127) 10.976 15.783 ( 4.031 -4.261 -1.740) 6.118 15.901 ( -3.365 -0.056 2.910) 4.450 16.190 ( 6.870 -1.193 -2.595) 7.440 16.701 ( -10.862 -2.147 -0.436) 11.081 17.130 ( -12.079 -4.178 5.788) 14.030 21.052 ( -0.411 -1.243 1.089) 1.703 21.237 ( -1.181 13.399 0.616) 13.465 21.892 ( 11.346 7.645 -1.062) 13.722 22.527 ( -3.402 1.744 -3.927) 5.480 ======================= Grid point 434 (210/227) ======================= q-point: (-0.20 0.10 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -1.340 -6.123 1.652) 6.482 2.182 ( -0.813 3.064 -4.074) 5.162 2.196 ( -2.531 5.017 5.279) 7.710 2.392 ( 0.503 7.554 0.146) 7.572 3.231 ( -1.818 -5.279 -1.638) 5.819 3.532 ( 0.006 3.496 -0.831) 3.594 3.717 ( 11.279 2.426 0.030) 11.537 3.975 ( 0.391 5.308 -1.429) 5.511 4.009 ( -3.988 6.042 -8.045) 10.823 4.221 ( -5.204 12.688 0.241) 13.716 4.716 ( -3.542 5.826 0.001) 6.818 4.978 ( -2.304 -2.127 -0.155) 3.140 5.042 ( 0.496 11.631 3.472) 12.148 5.469 ( -2.839 5.852 3.165) 7.234 6.607 ( -3.041 -5.018 4.934) 7.666 7.193 ( 2.496 4.497 -5.099) 7.243 7.418 ( 0.334 -1.157 6.495) 6.606 7.918 ( 9.185 -0.669 -3.608) 9.891 8.394 ( 1.696 -1.563 -1.349) 2.672 8.947 ( -8.384 0.671 5.222) 9.900 9.379 ( 0.429 0.583 2.191) 2.307 10.046 ( 14.874 -7.399 4.105) 17.112 10.765 ( 1.748 -1.757 0.401) 2.511 10.980 ( 3.162 -5.495 0.934) 6.408 11.087 ( 0.422 2.951 -3.135) 4.326 11.404 ( 9.794 2.246 1.940) 10.233 11.709 ( 6.517 -1.600 -8.258) 10.641 12.346 ( -4.352 -15.081 -0.510) 15.705 12.644 ( -7.720 -4.879 1.846) 9.317 12.884 ( -3.671 -7.245 -0.247) 8.126 13.305 ( -5.617 -2.559 2.111) 6.523 13.662 ( -0.638 4.329 0.163) 4.379 14.067 ( 0.093 0.592 -2.696) 2.762 14.470 ( 2.758 3.615 2.932) 5.410 15.364 ( 1.483 0.219 1.487) 2.111 15.675 ( 10.073 -17.144 -4.841) 20.465 15.854 ( 0.145 -1.932 0.324) 1.965 15.902 ( 0.161 -8.477 0.323) 8.484 16.300 ( 5.314 1.766 -3.140) 6.420 16.548 ( -11.015 -4.997 0.578) 12.109 16.987 ( -9.521 -3.620 4.641) 11.193 20.990 ( 1.518 19.606 2.233) 19.792 21.121 ( -3.360 -2.750 -0.728) 4.403 22.019 ( 12.237 5.800 -0.415) 13.549 22.409 ( -7.483 3.707 -4.000) 9.260 ======================= Grid point 435 (211/227) ======================= q-point: (-0.10 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.548 ( 0.000 -5.520 0.000) 5.520 2.081 ( -0.000 6.994 0.000) 6.994 2.201 ( 0.000 -1.131 0.000) 1.131 2.336 ( 0.000 4.476 0.000) 4.476 3.261 ( 0.000 -4.033 0.000) 4.033 3.489 ( -0.000 4.313 0.000) 4.313 3.852 ( -0.000 1.821 -0.000) 1.821 3.894 ( 0.000 5.077 -0.000) 5.077 3.896 ( -0.000 4.045 0.000) 4.045 4.045 ( 0.000 11.291 0.000) 11.291 4.606 ( -0.000 5.647 -0.000) 5.647 4.937 ( 0.000 10.312 0.000) 10.312 5.017 ( 0.000 -5.514 0.000) 5.514 5.390 ( -0.000 4.501 0.000) 4.501 6.612 ( 0.000 -2.054 0.000) 2.054 7.179 ( 0.000 3.120 0.000) 3.120 7.425 ( 0.000 -0.458 -0.000) 0.458 8.033 ( -0.000 -3.875 0.000) 3.875 8.420 ( -0.000 0.056 0.000) 0.056 8.852 ( -0.000 1.142 0.000) 1.142 9.377 ( 0.000 0.728 0.000) 0.728 10.261 ( 0.000 -5.913 0.000) 5.913 10.736 ( -0.000 0.906 0.000) 0.906 11.039 ( 0.000 4.247 0.000) 4.247 11.103 ( 0.000 -7.637 0.000) 7.637 11.523 ( -0.000 -0.909 0.000) 0.909 11.751 ( 0.000 2.348 0.000) 2.348 12.413 ( 0.000 -11.561 0.000) 11.561 12.644 ( -0.000 -4.789 0.000) 4.789 12.923 ( 0.000 -6.407 0.000) 6.407 13.282 ( 0.000 -2.010 0.000) 2.010 13.619 ( -0.000 3.432 0.000) 3.432 14.062 ( 0.000 0.252 0.000) 0.252 14.463 ( 0.000 2.922 0.000) 2.922 15.367 ( 0.000 0.698 0.000) 0.698 15.861 ( -0.000 -1.620 0.000) 1.620 15.882 ( 0.000 -2.901 -0.000) 2.901 16.106 ( 0.000 -23.172 0.000) 23.172 16.282 ( 0.000 5.090 0.000) 5.090 16.507 ( -0.000 -6.328 0.000) 6.328 16.936 ( 0.000 -3.039 0.000) 3.039 20.781 ( -0.000 21.384 0.000) 21.384 21.137 ( 0.000 -4.370 0.000) 4.370 22.131 ( 0.000 3.165 0.000) 3.165 22.247 ( -0.000 4.767 0.000) 4.767 ======================= Grid point 439 (212/227) ======================= q-point: ( 0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( 2.086 0.000 -11.691) 11.876 2.133 ( -1.153 -0.000 5.365) 5.487 2.348 ( 3.371 0.000 -8.441) 9.090 2.561 ( 15.102 0.000 14.253) 20.766 3.193 ( 4.546 0.000 -11.302) 12.182 3.434 ( -1.683 -0.000 0.997) 1.956 3.597 ( -1.003 -0.000 7.516) 7.583 4.008 ( -2.331 -0.000 0.614) 2.411 4.113 ( 6.721 0.000 9.545) 11.674 4.471 ( 9.605 0.000 2.271) 9.869 4.725 ( -2.219 -0.000 1.580) 2.724 4.786 ( 0.519 0.000 7.893) 7.910 5.105 ( 5.064 0.000 2.705) 5.741 5.754 ( 9.858 0.000 -5.958) 11.518 6.481 ( -17.060 -0.000 -4.371) 17.611 7.227 ( 14.365 0.000 -14.563) 20.455 7.321 ( -5.867 -0.000 -4.304) 7.276 7.570 ( -0.612 -0.000 -4.776) 4.815 8.327 ( -2.211 -0.000 0.761) 2.338 9.194 ( -6.378 -0.000 1.862) 6.644 9.370 ( -5.160 -0.000 5.518) 7.555 9.404 ( 2.295 0.000 -5.836) 6.271 9.949 ( -11.173 -0.000 2.701) 11.495 10.952 ( -5.258 -0.000 4.189) 6.723 11.058 ( -0.778 -0.000 -0.572) 0.966 11.307 ( 5.677 0.000 -12.395) 13.633 11.611 ( -0.058 -0.000 14.534) 14.534 12.464 ( -10.290 -0.000 -1.685) 10.427 12.634 ( -4.569 -0.000 -2.024) 4.997 13.455 ( 13.690 0.000 -4.503) 14.411 13.609 ( -1.647 -0.000 -0.037) 1.648 13.801 ( -3.092 -0.000 -7.185) 7.823 13.994 ( -0.477 -0.000 5.095) 5.118 14.013 ( -3.136 -0.000 1.143) 3.338 15.127 ( -10.624 -0.000 2.161) 10.841 15.486 ( -1.320 -0.000 5.949) 6.093 15.657 ( -5.555 -0.000 -0.286) 5.562 15.807 ( -1.332 -0.000 3.400) 3.651 16.536 ( 4.456 0.000 3.829) 5.875 17.115 ( -0.224 -0.000 -0.146) 0.267 17.324 ( 0.043 0.000 -8.287) 8.287 20.608 ( 2.778 0.000 -1.068) 2.977 21.513 ( -2.287 -0.000 3.303) 4.018 21.592 ( 10.440 0.000 -1.194) 10.508 22.536 ( 0.564 0.000 2.446) 2.511 ======================= Grid point 440 (213/227) ======================= q-point: ( 0.30 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( -2.514 8.156 -7.317) 11.242 2.131 ( -3.158 -4.917 4.414) 7.324 2.391 ( 3.626 2.058 -7.194) 8.315 2.793 ( 11.559 0.837 10.414) 15.581 3.288 ( 8.352 3.989 -6.206) 11.144 3.394 ( -4.226 -2.216 -2.491) 5.383 3.658 ( 7.308 -1.840 3.587) 8.346 3.927 ( -4.728 3.207 -0.030) 5.713 4.216 ( 3.515 -1.893 4.754) 6.208 4.513 ( 0.247 5.299 10.794) 12.027 4.787 ( -4.739 -6.755 8.922) 12.153 4.817 ( 11.756 -0.273 0.275) 11.763 5.221 ( 4.931 -4.290 1.345) 6.673 5.913 ( 9.774 -0.029 -3.963) 10.547 6.251 ( -12.967 -5.206 -5.823) 15.138 7.222 ( -3.780 2.836 -5.232) 7.050 7.442 ( 12.848 2.937 -11.190) 17.289 7.575 ( 1.515 -0.856 -6.860) 7.077 8.297 ( -1.934 -1.715 0.924) 2.745 9.064 ( -5.622 4.439 6.951) 9.981 9.316 ( -3.679 -1.330 7.691) 8.629 9.427 ( -1.076 -2.639 -3.742) 4.703 9.894 ( 4.012 -0.127 0.512) 4.046 10.879 ( -2.713 1.341 3.064) 4.307 11.030 ( -2.891 -1.123 -0.811) 3.206 11.382 ( 5.953 3.928 -11.026) 13.132 11.633 ( 1.071 -1.903 13.690) 13.863 12.237 ( -9.786 9.780 -2.624) 14.082 12.585 ( -6.193 -6.979 -3.637) 10.014 13.478 ( -7.764 5.122 0.466) 9.313 13.665 ( 1.596 -2.645 -4.713) 5.635 13.705 ( -3.741 -5.689 -5.426) 8.706 14.012 ( 2.256 1.193 3.203) 4.095 14.061 ( 5.150 -3.416 1.117) 6.280 14.958 ( -9.360 0.104 4.266) 10.287 15.468 ( -0.748 0.553 0.925) 1.312 15.584 ( -3.709 -0.597 0.027) 3.756 15.801 ( 0.167 -0.494 4.170) 4.202 16.551 ( 2.607 9.234 5.273) 10.948 17.075 ( -3.908 0.270 1.283) 4.122 17.294 ( -5.094 -3.397 -6.537) 8.957 20.689 ( 2.856 -5.738 -1.560) 6.596 21.502 ( 1.619 1.398 0.860) 2.305 21.754 ( 10.557 2.573 -1.115) 10.923 22.545 ( 0.197 -0.607 2.107) 2.202 ======================= Grid point 441 (214/227) ======================= q-point: ( 0.40 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -4.019 8.182 -3.894) 9.913 2.126 ( -3.459 -4.795 5.554) 8.112 2.428 ( 4.193 2.528 -7.026) 8.563 2.891 ( 4.183 5.628 2.189) 7.346 3.308 ( -5.263 -2.295 -1.182) 5.862 3.418 ( 8.247 3.095 0.144) 8.810 3.775 ( -0.905 3.263 6.317) 7.167 3.854 ( 5.977 1.236 -6.915) 9.223 4.285 ( 3.379 -2.311 0.474) 4.121 4.469 ( 1.753 6.822 7.715) 10.447 4.751 ( -4.304 -1.665 12.710) 13.522 5.044 ( 10.175 -4.643 2.776) 11.523 5.313 ( 1.661 -2.988 0.318) 3.433 6.046 ( 5.061 1.440 -3.037) 6.076 6.175 ( -4.968 -10.683 -6.328) 13.374 7.153 ( 0.065 3.830 -5.249) 6.498 7.510 ( 2.659 5.069 -12.191) 13.468 7.676 ( 9.819 2.050 0.980) 10.078 8.316 ( -0.237 -5.413 0.086) 5.418 8.947 ( -1.907 6.027 10.177) 11.981 9.269 ( -4.719 -2.268 7.505) 9.151 9.446 ( -0.339 -4.573 -0.193) 4.589 10.042 ( 12.892 0.226 -0.773) 12.917 10.847 ( 0.416 0.833 -0.283) 0.973 10.993 ( -3.294 -1.630 -0.258) 3.684 11.410 ( 4.721 6.785 -5.643) 10.008 11.679 ( 0.883 -0.578 10.201) 10.256 11.997 ( -7.021 6.633 -6.714) 11.763 12.568 ( -5.655 -9.407 -3.133) 11.414 13.255 ( -14.756 1.160 1.510) 14.878 13.563 ( -11.185 -6.512 -2.403) 13.164 13.823 ( 5.952 -0.077 -4.113) 7.235 14.028 ( 1.612 1.288 1.549) 2.580 14.218 ( 8.207 -4.168 -0.711) 9.232 14.842 ( -5.991 -2.295 3.777) 7.444 15.448 ( -1.284 0.404 -1.317) 1.884 15.558 ( 0.211 -0.649 -0.081) 0.687 15.824 ( 0.777 -1.983 3.838) 4.389 16.451 ( -0.331 13.565 5.497) 14.640 16.992 ( -5.771 0.496 -0.343) 5.802 17.228 ( -9.111 -6.849 -1.798) 11.539 20.796 ( 2.036 -7.133 -1.819) 7.637 21.526 ( 3.855 3.411 -1.114) 5.266 21.882 ( 10.176 5.447 -0.356) 11.547 22.555 ( 0.109 -0.689 1.528) 1.680 ======================= Grid point 442 (215/227) ======================= q-point: (-0.50 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -4.125 4.530 -1.985) 6.440 2.122 ( -2.723 -4.073 7.459) 8.924 2.470 ( 4.084 2.591 -6.886) 8.415 2.847 ( 1.153 10.408 -1.868) 10.637 3.226 ( -8.281 -3.983 -0.753) 9.220 3.518 ( 8.825 5.208 1.069) 10.303 3.682 ( -4.195 1.847 -0.212) 4.589 3.972 ( 8.575 3.352 -3.028) 9.692 4.369 ( 5.675 5.972 0.675) 8.266 4.452 ( 1.298 -2.285 3.583) 4.444 4.702 ( -1.765 2.061 11.779) 12.087 5.178 ( 1.051 -1.677 2.103) 2.888 5.360 ( 3.123 0.554 2.698) 4.164 6.014 ( -2.201 7.071 -3.461) 8.174 6.266 ( -0.246 -11.749 -4.452) 12.567 7.150 ( 4.166 3.463 -2.787) 6.092 7.487 ( 1.424 4.216 -11.927) 12.730 7.800 ( 9.382 5.204 5.770) 12.182 8.354 ( -1.950 -3.089 1.089) 3.812 8.936 ( 4.235 -1.187 9.849) 10.787 9.223 ( -3.859 -2.970 6.647) 8.240 9.505 ( 1.799 -4.239 1.589) 4.872 10.284 ( 16.204 -0.124 0.523) 16.212 10.874 ( 0.456 -1.702 -1.285) 2.181 10.968 ( 0.537 -1.310 -0.757) 1.606 11.410 ( 4.362 7.067 -1.417) 8.425 11.622 ( -4.233 4.821 -1.607) 6.614 11.944 ( 1.033 -4.435 -3.239) 5.588 12.587 ( -4.625 -10.866 -2.208) 12.014 12.991 ( -18.140 -2.663 1.624) 18.406 13.447 ( -10.278 -5.371 0.609) 11.613 13.861 ( 0.718 2.763 -2.321) 3.679 14.057 ( 3.238 1.118 -1.234) 3.641 14.381 ( 6.895 -2.684 -0.046) 7.399 14.825 ( -1.736 -7.389 2.154) 7.890 15.419 ( -1.367 0.489 -1.807) 2.318 15.611 ( 4.441 -1.905 -1.166) 4.971 15.865 ( 0.581 -3.215 2.914) 4.378 16.303 ( -1.539 11.545 4.056) 12.333 16.874 ( -7.259 1.645 -1.646) 7.623 17.132 ( -11.711 -7.953 2.278) 14.338 20.889 ( 1.009 -6.385 -1.562) 6.650 21.544 ( 4.102 6.626 -1.828) 8.004 21.979 ( 9.812 7.626 0.955) 12.463 22.561 ( -0.325 -0.519 -0.090) 0.619 ======================= Grid point 443 (216/227) ======================= q-point: (-0.40 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 404 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -3.704 0.065 -0.368) 3.722 2.126 ( -1.642 -3.214 7.624) 8.435 2.482 ( 1.304 4.665 -5.614) 7.415 2.735 ( 0.117 13.568 -2.913) 13.878 3.138 ( -6.275 -4.018 -0.227) 7.454 3.600 ( -0.514 -0.806 -5.041) 5.131 3.635 ( 7.739 5.505 1.082) 9.559 4.054 ( 5.870 3.751 -5.255) 8.726 4.307 ( -1.313 9.622 8.887) 13.164 4.550 ( 3.430 -0.728 -1.637) 3.870 4.671 ( 1.064 1.952 7.223) 7.557 5.139 ( -4.241 2.271 3.800) 6.130 5.375 ( 1.954 6.381 -1.187) 6.779 5.850 ( -4.063 13.787 -0.353) 14.377 6.370 ( -1.514 -11.816 -1.270) 11.980 7.208 ( 5.805 2.123 -0.584) 6.208 7.463 ( 1.016 4.208 -10.090) 10.979 7.885 ( 7.811 5.849 5.911) 11.409 8.330 ( -2.058 -1.330 1.329) 2.787 9.029 ( -0.888 -2.604 7.335) 7.834 9.259 ( 3.200 -6.904 6.795) 10.202 9.603 ( 6.061 -5.191 0.880) 8.029 10.553 ( 14.255 -1.802 3.176) 14.715 10.845 ( -3.882 -2.069 0.749) 4.462 11.088 ( 9.601 -1.524 -2.674) 10.083 11.415 ( 3.677 5.845 -0.193) 6.908 11.533 ( -0.800 -0.133 -8.359) 8.399 12.032 ( 1.241 -7.026 -1.280) 7.248 12.613 ( -6.162 -9.840 -1.057) 11.658 12.739 ( -17.875 -8.141 0.440) 19.646 13.342 ( -7.268 -2.729 3.026) 8.332 13.818 ( -0.751 4.486 -1.042) 4.666 14.088 ( 1.740 1.385 -2.763) 3.547 14.485 ( 4.079 -0.122 1.687) 4.416 14.942 ( 2.403 -14.678 0.452) 14.880 15.400 ( -0.240 0.208 -1.917) 1.944 15.723 ( 6.139 -2.105 -1.711) 6.712 15.883 ( -2.500 -1.754 2.569) 3.991 16.221 ( 2.582 4.197 0.786) 4.990 16.723 ( -8.410 2.732 -1.942) 9.053 17.009 ( -12.522 -7.181 4.571) 15.141 20.955 ( 0.094 -5.163 -0.992) 5.258 21.512 ( 2.611 11.114 -0.921) 11.454 22.060 ( 9.965 8.090 1.926) 12.980 22.547 ( -1.838 0.409 -2.467) 3.104 ======================= Grid point 444 (217/227) ======================= q-point: (-0.30 0.20 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.392 ( -2.020 -3.603 0.642) 4.180 2.139 ( -0.706 -2.766 4.576) 5.394 2.405 ( -1.123 9.922 -4.240) 10.849 2.592 ( -0.936 11.970 -0.027) 12.006 3.123 ( -1.390 -4.937 -1.284) 5.287 3.569 ( -1.390 0.285 -1.812) 2.301 3.764 ( 10.026 2.021 -2.469) 10.521 4.070 ( 0.686 4.264 -8.288) 9.346 4.181 ( -1.304 10.384 11.006) 15.188 4.492 ( -1.316 12.443 -0.676) 12.531 4.723 ( 1.325 -3.942 2.039) 4.632 5.018 ( -5.501 5.302 3.896) 8.576 5.306 ( 2.322 12.806 -5.119) 13.985 5.647 ( -3.511 12.350 3.476) 13.302 6.453 ( -1.647 -10.149 1.246) 10.357 7.265 ( 3.203 2.690 -0.897) 4.278 7.432 ( 0.604 3.101 -3.540) 4.744 7.952 ( 6.017 3.626 2.088) 7.329 8.343 ( 0.635 -3.282 -0.821) 3.442 8.967 ( -5.557 1.284 5.378) 7.839 9.362 ( 1.259 -3.066 3.291) 4.671 9.847 ( 11.246 -11.686 1.556) 16.293 10.713 ( -0.691 -5.741 4.541) 7.352 10.865 ( 4.840 -1.175 -0.217) 4.985 11.196 ( 4.246 5.731 -4.637) 8.507 11.424 ( 3.167 -0.610 -0.793) 3.321 11.656 ( 12.009 -3.416 -4.010) 13.113 12.083 ( -6.112 -9.357 -1.045) 11.226 12.526 ( -9.289 -6.402 1.599) 11.394 12.657 ( -8.992 -14.823 -2.101) 17.464 13.277 ( -2.630 -0.434 3.100) 4.088 13.758 ( -0.417 5.130 -0.374) 5.160 14.087 ( 0.221 1.373 -2.207) 2.609 14.525 ( 1.832 1.510 1.870) 3.022 15.185 ( 4.049 -22.035 0.089) 22.404 15.403 ( 0.575 0.116 -1.713) 1.811 15.828 ( 2.764 -0.839 -0.343) 2.909 15.836 ( -1.955 -1.311 1.153) 2.621 16.298 ( 6.411 -2.010 -1.882) 6.977 16.552 ( -7.615 4.144 -1.734) 8.842 16.885 ( -10.245 -6.089 4.783) 12.842 20.999 ( -0.356 -4.455 -0.371) 4.484 21.402 ( 0.762 16.065 0.269) 16.085 22.150 ( 9.852 6.570 2.262) 12.056 22.477 ( -4.770 2.880 -3.889) 6.795 ======================= Grid point 445 (218/227) ======================= q-point: (-0.20 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 0.000 -5.733 0.000) 5.733 2.161 ( -0.000 -2.562 0.000) 2.562 2.276 ( -0.000 11.722 0.000) 11.722 2.479 ( 0.000 9.369 0.000) 9.369 3.165 ( 0.000 -5.160 0.000) 5.160 3.550 ( -0.000 1.412 0.000) 1.412 3.866 ( 0.000 -0.247 0.000) 0.247 3.998 ( 0.000 5.575 -0.000) 5.575 4.070 ( 0.000 11.126 0.000) 11.126 4.326 ( 0.000 15.439 0.000) 15.439 4.738 ( -0.000 3.736 -0.000) 3.736 4.927 ( 0.000 -0.118 0.000) 0.118 5.191 ( 0.000 14.118 0.000) 14.118 5.515 ( -0.000 8.303 0.000) 8.303 6.525 ( 0.000 -7.110 0.000) 7.110 7.254 ( 0.000 3.910 -0.000) 3.910 7.420 ( 0.000 0.682 -0.000) 0.682 7.991 ( -0.000 0.235 0.000) 0.235 8.389 ( 0.000 -3.149 0.000) 3.149 8.888 ( 0.000 2.430 0.000) 2.430 9.385 ( 0.000 -0.420 0.000) 0.420 10.083 ( 0.000 -11.685 0.000) 11.685 10.736 ( -0.000 -2.764 -0.000) 2.764 10.942 ( 0.000 -5.503 0.000) 5.503 11.154 ( -0.000 6.746 0.000) 6.746 11.492 ( -0.000 -2.339 0.000) 2.339 11.813 ( 0.000 3.665 0.000) 3.665 12.105 ( -0.000 -17.265 0.000) 17.265 12.527 ( -0.000 -6.775 0.000) 6.775 12.718 ( 0.000 -13.793 0.000) 13.793 13.260 ( 0.000 -0.101 0.000) 0.101 13.704 ( 0.000 4.876 0.000) 4.876 14.074 ( 0.000 1.050 0.000) 1.050 14.521 ( 0.000 2.395 0.000) 2.395 15.387 ( 0.000 0.418 0.000) 0.418 15.500 ( 0.000 -27.609 0.000) 27.609 15.822 ( 0.000 -2.599 0.000) 2.599 15.878 ( -0.000 -1.041 0.000) 1.041 16.406 ( 0.000 -4.457 0.000) 4.457 16.412 ( -0.000 7.258 0.000) 7.258 16.847 ( 0.000 -5.582 0.000) 5.582 21.040 ( -0.000 -4.719 0.000) 4.719 21.223 ( 0.000 20.252 0.000) 20.252 22.213 ( 0.000 4.503 0.000) 4.503 22.358 ( 0.000 5.783 0.000) 5.783 ======================= Grid point 451 (219/227) ======================= q-point: ( 0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 225 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( -5.879 -0.000 -6.163) 8.517 2.046 ( -3.593 -0.000 7.408) 8.234 2.462 ( 3.801 0.000 -7.724) 8.608 2.957 ( 7.174 0.000 4.574) 8.508 3.269 ( -8.282 -0.000 -1.873) 8.491 3.450 ( 8.850 0.000 0.540) 8.867 3.823 ( -2.135 -0.000 4.658) 5.124 3.874 ( 9.892 0.000 -7.498) 12.412 4.239 ( 1.796 0.000 2.602) 3.161 4.627 ( 5.771 0.000 13.450) 14.636 4.672 ( -3.871 -0.000 8.851) 9.661 4.980 ( 8.149 0.000 4.826) 9.470 5.276 ( 4.478 0.000 0.481) 4.504 6.059 ( 7.934 0.000 -3.743) 8.773 6.060 ( -6.197 -0.000 -7.122) 9.441 7.193 ( -0.841 -0.000 -9.394) 9.431 7.582 ( 1.196 0.000 -8.356) 8.441 7.685 ( 13.437 0.000 -5.878) 14.666 8.252 ( -1.815 -0.000 1.654) 2.456 9.028 ( -2.695 -0.000 14.343) 14.594 9.248 ( -3.647 -0.000 8.215) 8.988 9.379 ( -2.118 -0.000 -2.474) 3.257 10.044 ( 12.857 0.000 -0.734) 12.877 10.863 ( -0.476 -0.000 -0.197) 0.516 10.972 ( -2.971 -0.000 -0.964) 3.123 11.507 ( 6.625 0.000 -11.046) 12.880 11.639 ( 0.720 0.000 15.251) 15.268 12.133 ( -9.535 -0.000 -2.017) 9.746 12.415 ( -8.511 -0.000 -7.079) 11.070 13.279 ( -17.036 -0.000 2.448) 17.211 13.481 ( -10.084 -0.000 -3.681) 10.734 13.824 ( 8.249 0.000 -5.222) 9.763 14.041 ( 1.323 0.000 1.652) 2.117 14.169 ( 8.888 0.000 -0.419) 8.898 14.820 ( -7.425 -0.000 4.608) 8.739 15.453 ( -1.332 -0.000 -1.245) 1.823 15.551 ( 0.024 0.000 -0.531) 0.531 15.806 ( 0.526 0.000 5.487) 5.512 16.632 ( 0.522 0.000 6.157) 6.180 16.950 ( -10.348 -0.000 8.193) 13.199 17.166 ( -7.568 -0.000 -11.214) 13.529 20.720 ( 3.923 0.000 -1.436) 4.177 21.561 ( 4.509 0.000 -1.937) 4.907 21.938 ( 10.044 0.000 -1.030) 10.096 22.548 ( 0.395 0.000 2.706) 2.734 ======================= Grid point 452 (220/227) ======================= q-point: (-0.60 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -6.724 4.766 -3.305) 8.880 2.026 ( -2.276 -4.335 7.838) 9.241 2.507 ( 2.736 0.983 -7.668) 8.201 3.016 ( 3.275 5.955 1.919) 7.062 3.148 ( -7.491 -3.351 -1.060) 8.275 3.589 ( 7.521 1.508 -1.027) 7.739 3.716 ( -4.778 1.097 1.745) 5.204 4.050 ( 9.075 3.522 -4.990) 10.938 4.310 ( 4.524 -4.172 1.051) 6.243 4.591 ( 0.638 7.762 11.209) 13.649 4.723 ( 2.298 -0.119 9.893) 10.157 5.102 ( 3.218 -4.302 6.208) 8.209 5.370 ( 7.350 0.363 0.309) 7.365 6.027 ( -1.219 -3.689 -5.397) 6.650 6.159 ( 4.359 0.424 -4.619) 6.366 7.200 ( 3.197 1.173 -10.313) 10.861 7.579 ( 1.219 3.876 -8.240) 9.187 7.875 ( 10.624 1.911 -0.273) 10.798 8.257 ( -0.516 -4.363 1.182) 4.550 8.976 ( -1.711 2.930 16.105) 16.459 9.201 ( -2.231 0.973 7.016) 7.426 9.387 ( -0.217 -5.960 0.542) 5.989 10.275 ( 14.348 -0.337 0.786) 14.374 10.864 ( 1.052 0.173 -4.300) 4.430 10.947 ( 0.037 -0.657 -0.810) 1.043 11.558 ( 4.772 7.168 -1.970) 8.834 11.685 ( 0.963 -2.165 9.174) 9.476 11.940 ( -7.181 5.922 -7.036) 11.668 12.333 ( -9.151 -12.177 -6.598) 16.599 12.971 ( -19.804 0.174 2.043) 19.909 13.356 ( -7.210 -2.918 -0.370) 7.787 13.906 ( 2.581 1.409 -3.696) 4.723 14.076 ( 3.296 0.564 -0.434) 3.372 14.324 ( 8.130 -2.014 -1.313) 8.478 14.731 ( -4.610 -2.180 3.786) 6.352 15.427 ( -1.354 0.261 -1.127) 1.780 15.587 ( 4.125 -0.529 -1.047) 4.289 15.824 ( 0.696 -0.986 4.536) 4.694 16.542 ( -4.334 11.370 6.219) 13.665 16.810 ( -11.596 -8.408 7.809) 16.314 17.039 ( -7.899 -0.603 -9.211) 12.149 20.796 ( 3.471 -2.494 -1.433) 4.508 21.635 ( 5.664 2.381 -3.493) 7.067 22.078 ( 8.618 2.236 -0.380) 8.912 22.556 ( 0.267 0.005 2.762) 2.775 ======================= Grid point 453 (221/227) ======================= q-point: (-0.50 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( -5.758 3.925 -1.313) 7.091 2.051 ( -0.608 -4.110 7.603) 8.664 2.526 ( 0.519 -0.063 -7.089) 7.108 2.953 ( -2.122 7.005 -0.778) 7.361 3.099 ( -1.017 0.759 1.591) 2.035 3.588 ( -3.359 -0.316 -3.108) 4.587 3.731 ( 6.484 3.712 0.548) 7.492 4.122 ( 5.050 2.942 -7.080) 9.181 4.438 ( 2.538 -4.472 3.466) 6.201 4.518 ( 1.655 7.838 10.789) 13.438 4.748 ( 2.109 3.062 5.174) 6.371 5.149 ( -1.177 -1.516 4.677) 5.055 5.488 ( 9.256 5.196 1.045) 10.666 6.035 ( -0.874 1.487 -2.223) 2.814 6.191 ( -0.515 -2.583 -4.963) 5.618 7.259 ( 5.730 1.975 -6.873) 9.163 7.549 ( 1.195 4.711 -7.952) 9.320 7.992 ( 7.456 4.164 2.718) 8.962 8.286 ( -2.006 -3.437 2.084) 4.492 8.972 ( 1.455 -1.964 10.765) 11.039 9.172 ( -0.460 -0.830 6.770) 6.836 9.470 ( 1.246 -8.096 1.691) 8.364 10.488 ( 8.054 -3.213 3.739) 9.443 10.875 ( 3.336 3.511 -3.858) 6.192 11.031 ( 8.519 -3.240 -1.763) 9.283 11.558 ( 4.548 7.349 1.506) 8.772 11.598 ( -6.181 6.844 -1.380) 9.325 11.906 ( 1.223 -5.733 -4.147) 7.180 12.326 ( -10.108 -16.690 -5.189) 20.190 12.652 ( -19.480 -1.571 1.333) 19.588 13.295 ( -3.497 -1.900 2.173) 4.534 13.899 ( 0.263 3.251 -1.812) 3.731 14.116 ( 2.138 1.218 -2.224) 3.317 14.456 ( 5.183 -2.097 -0.590) 5.622 14.724 ( -1.778 -6.882 2.183) 7.436 15.411 ( 0.156 0.569 0.201) 0.623 15.690 ( 7.024 -1.142 -1.781) 7.336 15.845 ( -0.444 -1.663 2.338) 2.903 16.347 ( -5.314 8.028 4.203) 10.505 16.712 ( -10.374 -6.089 5.680) 13.303 16.914 ( -7.703 -0.455 -5.094) 9.246 20.871 ( 2.214 -2.970 -1.157) 3.881 21.680 ( 4.661 5.819 -3.308) 8.157 22.179 ( 7.247 3.348 1.056) 8.053 22.554 ( -0.430 0.532 1.092) 1.288 ======================= Grid point 454 (222/227) ======================= q-point: (-0.40 0.30 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -3.208 1.102 -0.080) 3.393 2.084 ( -0.034 -2.686 5.008) 5.683 2.523 ( -0.326 0.688 -4.993) 5.050 2.823 ( -3.138 9.516 0.592) 10.037 3.084 ( 1.119 2.479 0.002) 2.720 3.554 ( -1.796 -1.482 -1.974) 3.052 3.802 ( 5.705 1.842 -2.206) 6.388 4.148 ( 1.693 3.414 -6.522) 7.553 4.383 ( -0.759 8.736 12.380) 15.171 4.593 ( 3.850 -3.566 -0.386) 5.261 4.718 ( -0.778 5.608 2.153) 6.057 5.111 ( -2.367 2.862 3.316) 4.979 5.543 ( 7.262 11.244 -1.292) 13.447 5.922 ( -3.435 12.743 -0.087) 13.198 6.235 ( -1.500 -10.153 -1.852) 10.429 7.320 ( 4.217 2.760 -1.057) 5.149 7.517 ( 0.747 4.679 -6.765) 8.259 8.042 ( 4.189 4.821 2.466) 6.846 8.277 ( -1.514 -2.868 1.349) 3.513 8.992 ( -1.639 0.837 4.671) 5.021 9.246 ( 2.630 -7.453 5.113) 9.414 9.607 ( 4.095 -11.787 0.606) 12.492 10.571 ( -2.759 -6.144 3.101) 7.414 10.939 ( 9.464 6.688 0.506) 11.600 11.242 ( 10.688 -2.974 -1.267) 11.167 11.423 ( -5.824 3.330 -7.047) 9.730 11.622 ( 8.039 0.844 3.328) 8.741 11.969 ( -1.644 -3.607 -2.510) 4.692 12.316 ( -11.823 -18.171 -3.243) 21.920 12.409 ( -12.049 -4.943 0.716) 13.043 13.275 ( -0.470 0.030 2.499) 2.543 13.860 ( 0.079 4.709 -0.776) 4.773 14.118 ( 0.295 1.600 -1.852) 2.465 14.529 ( 2.029 -0.879 0.472) 2.261 14.815 ( -0.016 -13.793 0.193) 13.795 15.424 ( 2.093 1.180 0.947) 2.583 15.810 ( 5.185 -0.822 -1.309) 5.411 15.823 ( -3.050 -0.322 0.745) 3.156 16.269 ( 0.979 -0.100 0.452) 1.083 16.601 ( -7.825 -2.181 3.071) 8.684 16.798 ( -6.386 -0.302 -1.019) 6.474 20.925 ( 0.814 -2.858 -0.619) 3.035 21.658 ( 2.216 9.722 -1.560) 10.093 22.253 ( 5.850 3.194 2.115) 6.993 22.525 ( -1.709 2.069 -1.333) 2.997 ======================= Grid point 455 (223/227) ======================= q-point: (-0.30 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 0.000 -1.791 0.000) 1.791 2.109 ( -0.000 -2.461 0.000) 2.461 2.486 ( 0.000 6.563 0.000) 6.563 2.689 ( 0.000 10.853 0.000) 10.853 3.086 ( -0.000 -1.147 0.000) 1.147 3.552 ( -0.000 -0.995 0.000) 0.995 3.855 ( 0.000 -0.560 -0.000) 0.560 4.107 ( 0.000 5.136 0.000) 5.136 4.290 ( -0.000 10.124 0.000) 10.124 4.608 ( 0.000 11.470 0.000) 11.470 4.682 ( -0.000 -5.528 0.000) 5.528 5.039 ( -0.000 6.387 0.000) 6.387 5.480 ( 0.000 14.260 0.000) 14.260 5.740 ( -0.000 13.867 0.000) 13.867 6.332 ( 0.000 -11.205 0.000) 11.205 7.326 ( 0.000 3.225 -0.000) 3.225 7.473 ( 0.000 4.466 0.000) 4.466 8.036 ( -0.000 3.707 0.000) 3.707 8.308 ( 0.000 -4.407 0.000) 4.407 8.945 ( 0.000 3.115 0.000) 3.115 9.335 ( 0.000 -5.169 0.000) 5.169 9.804 ( -0.000 -15.484 0.000) 15.484 10.603 ( -0.000 -7.624 0.000) 7.624 10.961 ( 0.000 5.998 0.000) 5.998 11.291 ( -0.000 6.302 0.000) 6.302 11.418 ( 0.000 -5.403 0.000) 5.403 11.806 ( 0.000 -10.518 0.000) 10.518 11.887 ( -0.000 3.369 0.000) 3.369 12.378 ( -0.000 -7.825 0.000) 7.825 12.391 ( 0.000 -18.031 0.000) 18.031 13.269 ( 0.000 0.757 0.000) 0.757 13.809 ( 0.000 5.369 0.000) 5.369 14.102 ( 0.000 1.629 0.000) 1.629 14.548 ( 0.000 0.222 0.000) 0.222 14.990 ( 0.000 -20.282 0.000) 20.282 15.431 ( 0.000 1.919 0.000) 1.919 15.788 ( -0.000 -0.780 0.000) 0.780 15.865 ( -0.000 -0.434 0.000) 0.434 16.322 ( -0.000 -3.825 0.000) 3.825 16.531 ( 0.000 2.597 0.000) 2.597 16.744 ( 0.000 -2.711 0.000) 2.711 20.960 ( -0.000 -3.227 0.000) 3.227 21.559 ( 0.000 13.290 0.000) 13.290 22.288 ( 0.000 2.583 0.000) 2.583 22.465 ( 0.000 4.645 0.000) 4.645 ======================= Grid point 463 (224/227) ======================= q-point: ( 0.40 -0.60 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 227 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.525 ( -7.111 -0.000 -2.009) 7.389 1.996 ( 0.831 0.000 7.696) 7.741 2.516 ( -1.764 -0.000 -7.709) 7.909 3.014 ( -4.660 -0.000 -0.531) 4.690 3.126 ( 4.267 0.000 4.074) 5.899 3.586 ( -4.780 -0.000 -2.519) 5.403 3.770 ( 6.405 0.000 0.291) 6.411 4.158 ( 3.263 0.000 -7.214) 7.918 4.372 ( 5.871 0.000 0.725) 5.915 4.623 ( -1.712 -0.000 13.450) 13.559 4.776 ( 2.186 0.000 4.219) 4.752 5.118 ( 1.332 0.000 7.389) 7.508 5.552 ( 13.479 0.000 0.909) 13.509 5.999 ( -0.391 -0.000 -2.899) 2.925 6.207 ( 0.814 0.000 -5.445) 5.505 7.276 ( 5.732 0.000 -13.166) 14.360 7.614 ( 0.670 0.000 -3.252) 3.321 8.035 ( 7.317 0.000 0.837) 7.365 8.232 ( 0.231 0.000 0.993) 1.020 8.961 ( -1.305 -0.000 13.919) 13.980 9.195 ( -1.766 -0.000 8.014) 8.206 9.347 ( 0.404 0.000 0.404) 0.571 10.455 ( 6.426 0.000 2.594) 6.930 10.924 ( 7.830 0.000 -6.574) 10.224 10.989 ( 5.803 0.000 -0.262) 5.809 11.651 ( -1.923 -0.000 13.095) 13.235 11.713 ( 6.178 0.000 -3.370) 7.038 11.857 ( -7.171 -0.000 -7.068) 10.069 12.078 ( -11.002 -0.000 -9.331) 14.426 12.640 ( -20.051 -0.000 1.036) 20.077 13.274 ( -1.697 -0.000 1.296) 2.135 13.934 ( 0.562 0.000 -2.005) 2.082 14.129 ( 2.257 0.000 -2.167) 3.129 14.431 ( 5.895 0.000 -1.274) 6.031 14.657 ( -3.143 -0.000 3.042) 4.374 15.417 ( 0.286 0.000 0.764) 0.816 15.678 ( 7.153 0.000 -1.768) 7.368 15.827 ( 0.006 0.000 2.476) 2.476 16.504 ( -14.443 -0.000 7.097) 16.093 16.561 ( -4.890 -0.000 5.673) 7.490 16.926 ( -5.902 -0.000 -7.612) 9.632 20.841 ( 3.109 0.000 -1.119) 3.304 21.741 ( 5.490 0.000 -4.067) 6.832 22.206 ( 5.936 0.000 -0.434) 5.952 22.562 ( 0.166 0.000 3.312) 3.316 ======================= Grid point 465 (225/227) ======================= q-point: (-0.50 0.40 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 400 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -4.312 2.268 -0.668) 4.918 2.037 ( 1.842 -1.652 5.404) 5.943 2.473 ( -3.553 -2.927 -5.628) 7.271 2.955 ( -1.339 3.566 0.159) 3.813 3.171 ( 2.957 3.493 2.695) 5.311 3.525 ( -2.617 -0.980 -1.432) 3.140 3.833 ( 2.398 1.017 -1.192) 2.864 4.199 ( 3.019 1.449 -6.334) 7.165 4.468 ( 3.655 -0.424 1.688) 4.048 4.573 ( -1.486 2.256 8.573) 8.989 4.792 ( 0.484 1.499 1.102) 1.923 5.133 ( -0.213 -0.015 4.721) 4.725 5.739 ( 11.385 7.001 2.086) 13.527 6.012 ( 0.173 -4.068 -0.560) 4.110 6.165 ( -3.680 3.342 -5.089) 7.114 7.360 ( 4.799 0.978 -9.389) 10.590 7.601 ( 0.095 2.915 0.043) 2.917 8.115 ( 3.701 1.743 1.061) 4.226 8.240 ( -0.625 -0.667 1.249) 1.548 8.983 ( 2.521 -1.384 5.752) 6.431 9.148 ( -3.132 -1.221 6.005) 6.882 9.400 ( 0.678 -7.287 0.787) 7.361 10.494 ( -1.277 -1.699 1.371) 2.529 11.077 ( 13.013 5.643 -0.761) 14.204 11.158 ( 10.919 -3.709 -1.802) 11.672 11.537 ( -9.808 6.227 1.556) 11.722 11.685 ( 1.952 5.552 2.307) 6.321 11.870 ( -1.147 -8.901 -2.704) 9.373 11.993 ( -5.878 -9.724 -6.644) 13.162 12.344 ( -15.911 -1.496 0.170) 15.982 13.275 ( 0.976 -0.008 1.515) 1.803 13.931 ( 0.417 1.992 -0.880) 2.217 14.143 ( 0.190 0.673 -1.864) 1.990 14.507 ( 2.772 -0.852 -0.551) 2.952 14.636 ( -1.889 -4.257 1.463) 4.882 15.441 ( 2.545 0.482 2.011) 3.280 15.799 ( 6.262 -0.252 -1.718) 6.499 15.816 ( -1.649 -0.309 -0.322) 1.708 16.296 ( -6.646 2.073 3.616) 7.845 16.502 ( -6.456 -4.663 4.390) 9.094 16.836 ( -3.582 1.796 -4.051) 5.698 20.886 ( 1.641 -0.981 -0.633) 2.014 21.795 ( 3.194 3.674 -2.592) 5.515 22.280 ( 3.340 0.120 0.132) 3.345 22.559 ( -0.156 1.035 1.754) 2.043 ======================= Grid point 466 (226/227) ======================= q-point: (-0.40 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 207 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( 0.000 2.124 0.000) 2.124 2.068 ( -0.000 -1.440 0.000) 1.440 2.484 ( 0.000 -4.831 0.000) 4.831 2.884 ( 0.000 7.797 0.000) 7.797 3.149 ( -0.000 5.587 0.000) 5.587 3.520 ( -0.000 -1.883 0.000) 1.883 3.849 ( 0.000 -0.058 0.000) 0.058 4.198 ( 0.000 3.689 -0.000) 3.689 4.456 ( -0.000 5.846 0.000) 5.846 4.586 ( 0.000 -3.413 0.000) 3.413 4.765 ( 0.000 4.348 -0.000) 4.348 5.119 ( -0.000 1.901 0.000) 1.901 5.744 ( 0.000 11.430 0.000) 11.430 6.015 ( -0.000 11.531 0.000) 11.531 6.117 ( 0.000 -9.526 0.000) 9.526 7.382 ( 0.000 2.305 -0.000) 2.305 7.569 ( 0.000 4.049 0.000) 4.049 8.119 ( -0.000 3.774 0.000) 3.774 8.239 ( 0.000 -1.713 0.000) 1.713 9.003 ( -0.000 2.369 0.000) 2.369 9.183 ( 0.000 -8.726 0.000) 8.726 9.508 ( -0.000 -12.466 0.000) 12.466 10.497 ( 0.000 -2.869 0.000) 2.869 11.148 ( 0.000 12.110 0.000) 12.110 11.292 ( 0.000 -5.553 0.000) 5.553 11.382 ( -0.000 2.201 0.000) 2.201 11.713 ( 0.000 0.260 0.000) 0.260 11.895 ( 0.000 -7.249 0.000) 7.249 12.060 ( 0.000 -9.610 0.000) 9.610 12.229 ( -0.000 -6.519 0.000) 6.519 13.283 ( 0.000 0.584 0.000) 0.584 13.905 ( 0.000 3.789 0.000) 3.789 14.133 ( 0.000 1.180 0.000) 1.180 14.537 ( 0.000 -0.922 0.000) 0.922 14.690 ( 0.000 -9.630 0.000) 9.630 15.463 ( 0.000 1.132 0.000) 1.132 15.786 ( -0.000 0.410 0.000) 0.410 15.860 ( -0.000 -0.070 0.000) 0.070 16.260 ( 0.000 -2.233 0.000) 2.233 16.483 ( 0.000 -4.580 0.000) 4.580 16.776 ( 0.000 3.433 0.000) 3.433 20.912 ( 0.000 -1.593 0.000) 1.593 21.765 ( -0.000 7.288 0.000) 7.288 22.311 ( 0.000 -0.076 0.000) 0.076 22.538 ( 0.000 2.574 0.000) 2.574 ======================= Grid point 477 (227/227) ======================= q-point: (-0.50 0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.10e-05 6.10e-05 6.10e-05 1.46e-03 1.46e-03 1.46e-03 1.46e-03 5.87e-04 5.87e-04 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 Number of triplets: 116 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 0.000 -0.000 0.000) 0.000 2.054 ( 0.000 -0.000 0.000) 0.000 2.414 ( 0.000 -0.000 0.000) 0.000 2.969 ( 0.000 -0.000 0.000) 0.000 3.218 ( 0.000 -0.000 0.000) 0.000 3.496 ( 0.000 -0.000 0.000) 0.000 3.849 ( 0.000 -0.000 0.000) 0.000 4.239 ( 0.000 -0.000 -0.000) 0.000 4.507 ( 0.000 -0.000 0.000) 0.000 4.560 ( -0.000 -0.000 0.000) 0.000 4.803 ( 0.000 -0.000 -0.000) 0.000 5.134 ( 0.000 -0.000 0.000) 0.000 5.906 ( 0.000 0.000 0.000) 0.000 5.976 ( 0.000 -0.000 0.000) 0.000 6.139 ( -0.000 -0.000 0.000) 0.000 7.408 ( 0.000 -0.000 -0.000) 0.000 7.611 ( -0.000 -0.000 0.000) 0.000 8.151 ( 0.000 -0.000 0.000) 0.000 8.241 ( -0.000 -0.000 0.000) 0.000 9.030 ( -0.000 -0.000 0.000) 0.000 9.073 ( 0.000 -0.000 0.000) 0.000 9.370 ( 0.000 -0.000 0.000) 0.000 10.472 ( 0.000 -0.000 0.000) 0.000 11.232 ( -0.000 -0.000 0.000) 0.000 11.348 ( 0.000 -0.000 -0.000) 0.000 11.398 ( -0.000 -0.000 0.000) 0.000 11.688 ( 0.000 -0.000 0.000) 0.000 11.735 ( 0.000 -0.000 0.000) 0.000 12.019 ( 0.000 -0.000 0.000) 0.000 12.153 ( -0.000 -0.000 0.000) 0.000 13.290 ( 0.000 -0.000 0.000) 0.000 13.946 ( 0.000 -0.000 0.000) 0.000 14.145 ( -0.000 -0.000 0.000) 0.000 14.526 ( 0.000 -0.000 0.000) 0.000 14.596 ( 0.000 -0.000 0.000) 0.000 15.474 ( 0.000 -0.000 0.000) 0.000 15.793 ( -0.000 -0.000 0.000) 0.000 15.860 ( -0.000 -0.000 0.000) 0.000 16.236 ( -0.000 -0.000 0.000) 0.000 16.429 ( 0.000 -0.000 0.000) 0.000 16.816 ( 0.000 -0.000 0.000) 0.000 20.896 ( 0.000 -0.000 0.000) 0.000 21.841 ( -0.000 -0.000 0.000) 0.000 22.305 ( 0.000 -0.000 0.000) 0.000 22.564 ( 0.000 -0.000 0.000) 0.000 =================== 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 3/36000 10.0 499.305 386.107 397.698 -0.000 -54.543 -0.000 3/36000 20.0 89.234 88.395 82.579 -0.000 -10.150 -0.000 3/36000 30.0 39.708 37.422 35.659 -0.000 -4.716 -0.000 3/36000 40.0 24.293 21.907 21.078 -0.000 -2.803 -0.000 3/36000 50.0 17.304 15.105 14.666 -0.000 -1.913 -0.000 3/36000 60.0 13.384 11.436 11.207 -0.000 -1.428 -0.000 3/36000 70.0 10.880 9.170 9.072 -0.000 -1.132 -0.000 3/36000 80.0 9.142 7.636 7.628 -0.000 -0.935 -0.000 3/36000 90.0 7.866 6.529 6.584 -0.000 -0.796 -0.000 3/36000 100.0 6.891 5.695 5.795 -0.000 -0.693 -0.000 3/36000 110.0 6.125 5.044 5.176 -0.000 -0.613 -0.000 3/36000 120.0 5.509 4.524 4.678 -0.000 -0.550 -0.000 3/36000 130.0 5.004 4.099 4.269 -0.000 -0.498 -0.000 3/36000 140.0 4.584 3.748 3.927 -0.000 -0.455 -0.000 3/36000 150.0 4.230 3.452 3.636 -0.000 -0.418 -0.000 3/36000 160.0 3.928 3.200 3.387 -0.000 -0.387 -0.000 3/36000 170.0 3.668 2.984 3.171 -0.000 -0.360 -0.000 3/36000 180.0 3.441 2.796 2.982 -0.000 -0.337 -0.000 3/36000 190.0 3.243 2.632 2.815 -0.000 -0.316 -0.000 3/36000 200.0 3.067 2.487 2.667 -0.000 -0.298 -0.000 3/36000 210.0 2.910 2.358 2.534 -0.000 -0.282 -0.000 3/36000 220.0 2.769 2.242 2.414 -0.000 -0.267 -0.000 3/36000 230.0 2.642 2.138 2.305 -0.000 -0.254 -0.000 3/36000 240.0 2.527 2.044 2.206 -0.000 -0.242 -0.000 3/36000 250.0 2.423 1.959 2.116 -0.000 -0.231 -0.000 3/36000 260.0 2.327 1.880 2.033 -0.000 -0.221 -0.000 3/36000 270.0 2.238 1.808 1.957 -0.000 -0.212 -0.000 3/36000 280.0 2.157 1.742 1.886 -0.000 -0.204 -0.000 3/36000 290.0 2.082 1.681 1.821 -0.000 -0.196 -0.000 3/36000 300.0 2.012 1.624 1.760 -0.000 -0.189 -0.000 3/36000 310.0 1.946 1.571 1.703 -0.000 -0.182 -0.000 3/36000 320.0 1.885 1.522 1.650 -0.000 -0.176 -0.000 3/36000 330.0 1.828 1.475 1.600 -0.000 -0.170 -0.000 3/36000 340.0 1.775 1.432 1.553 -0.000 -0.164 -0.000 3/36000 350.0 1.724 1.391 1.509 -0.000 -0.159 -0.000 3/36000 360.0 1.677 1.353 1.467 -0.000 -0.154 -0.000 3/36000 370.0 1.632 1.316 1.428 -0.000 -0.150 -0.000 3/36000 380.0 1.589 1.282 1.390 -0.000 -0.146 -0.000 3/36000 390.0 1.549 1.249 1.355 -0.000 -0.141 -0.000 3/36000 400.0 1.511 1.219 1.321 -0.000 -0.138 -0.000 3/36000 410.0 1.474 1.189 1.290 -0.000 -0.134 -0.000 3/36000 420.0 1.440 1.161 1.259 -0.000 -0.131 -0.000 3/36000 430.0 1.407 1.135 1.230 -0.000 -0.127 -0.000 3/36000 440.0 1.375 1.109 1.203 -0.000 -0.124 -0.000 3/36000 450.0 1.345 1.085 1.176 -0.000 -0.121 -0.000 3/36000 460.0 1.316 1.062 1.151 -0.000 -0.119 -0.000 3/36000 470.0 1.289 1.039 1.127 -0.000 -0.116 -0.000 3/36000 480.0 1.262 1.018 1.103 -0.000 -0.113 -0.000 3/36000 490.0 1.237 0.998 1.081 -0.000 -0.111 -0.000 3/36000 500.0 1.213 0.978 1.060 -0.000 -0.108 -0.000 3/36000 510.0 1.189 0.959 1.039 -0.000 -0.106 -0.000 3/36000 520.0 1.167 0.941 1.020 -0.000 -0.104 -0.000 3/36000 530.0 1.145 0.924 1.001 -0.000 -0.102 -0.000 3/36000 540.0 1.124 0.907 0.982 -0.000 -0.100 -0.000 3/36000 550.0 1.104 0.891 0.965 -0.000 -0.098 -0.000 3/36000 560.0 1.085 0.875 0.948 -0.000 -0.096 -0.000 3/36000 570.0 1.066 0.860 0.931 -0.000 -0.094 -0.000 3/36000 580.0 1.048 0.845 0.915 -0.000 -0.093 -0.000 3/36000 590.0 1.031 0.831 0.900 -0.000 -0.091 -0.000 3/36000 600.0 1.014 0.818 0.885 -0.000 -0.090 -0.000 3/36000 610.0 0.997 0.804 0.871 -0.000 -0.088 -0.000 3/36000 620.0 0.981 0.792 0.857 -0.000 -0.087 -0.000 3/36000 630.0 0.966 0.779 0.844 -0.000 -0.085 -0.000 3/36000 640.0 0.951 0.767 0.831 -0.000 -0.084 -0.000 3/36000 650.0 0.937 0.756 0.818 -0.000 -0.082 -0.000 3/36000 660.0 0.923 0.744 0.806 -0.000 -0.081 -0.000 3/36000 670.0 0.909 0.733 0.794 -0.000 -0.080 -0.000 3/36000 680.0 0.896 0.723 0.782 -0.000 -0.079 -0.000 3/36000 690.0 0.883 0.713 0.771 -0.000 -0.077 -0.000 3/36000 700.0 0.871 0.703 0.760 -0.000 -0.076 -0.000 3/36000 710.0 0.859 0.693 0.750 -0.000 -0.075 -0.000 3/36000 720.0 0.847 0.683 0.739 -0.000 -0.074 -0.000 3/36000 730.0 0.836 0.674 0.729 -0.000 -0.073 -0.000 3/36000 740.0 0.824 0.665 0.720 -0.000 -0.072 -0.000 3/36000 750.0 0.814 0.656 0.710 -0.000 -0.071 -0.000 3/36000 760.0 0.803 0.648 0.701 -0.000 -0.070 -0.000 3/36000 770.0 0.793 0.640 0.692 -0.000 -0.069 -0.000 3/36000 780.0 0.783 0.631 0.683 -0.000 -0.068 -0.000 3/36000 790.0 0.773 0.624 0.674 -0.000 -0.067 -0.000 3/36000 800.0 0.763 0.616 0.666 -0.000 -0.066 -0.000 3/36000 810.0 0.754 0.608 0.658 -0.000 -0.066 -0.000 3/36000 820.0 0.745 0.601 0.650 -0.000 -0.065 -0.000 3/36000 830.0 0.736 0.594 0.642 -0.000 -0.064 -0.000 3/36000 840.0 0.728 0.587 0.635 -0.000 -0.063 -0.000 3/36000 850.0 0.719 0.580 0.627 -0.000 -0.062 -0.000 3/36000 860.0 0.711 0.573 0.620 -0.000 -0.062 -0.000 3/36000 870.0 0.703 0.567 0.613 -0.000 -0.061 -0.000 3/36000 880.0 0.695 0.561 0.606 -0.000 -0.060 -0.000 3/36000 890.0 0.687 0.554 0.599 -0.000 -0.060 -0.000 3/36000 900.0 0.680 0.548 0.593 -0.000 -0.059 -0.000 3/36000 910.0 0.672 0.542 0.586 -0.000 -0.058 -0.000 3/36000 920.0 0.665 0.536 0.580 -0.000 -0.058 -0.000 3/36000 930.0 0.658 0.531 0.574 -0.000 -0.057 -0.000 3/36000 940.0 0.651 0.525 0.568 -0.000 -0.056 -0.000 3/36000 950.0 0.644 0.520 0.562 -0.000 -0.056 -0.000 3/36000 960.0 0.638 0.514 0.556 -0.000 -0.055 -0.000 3/36000 970.0 0.631 0.509 0.550 -0.000 -0.055 -0.000 3/36000 980.0 0.625 0.504 0.545 -0.000 -0.054 -0.000 3/36000 990.0 0.618 0.499 0.539 -0.000 -0.053 -0.000 3/36000 1000.0 0.612 0.494 0.534 -0.000 -0.053 -0.000 3/36000 Thermal conductivity related properties were written into "kappa-m10108.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 17:44:36]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|