----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 18:37:03]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmc2_1 (36) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.920420115000000 -2.314810539999999 0.000000000000000 b 3.920420115000000 2.314810539999999 0.000000000000000 c 0.000000000000000 0.000000000000000 4.138277690000000 Atomic positions (fractional): *1 B 0.00640087194502 0.32414018681223 0.56761436756629 10.811 2 B 0.99359912805498 0.67585981318777 0.06761436756629 10.811 3 B 0.32414018681223 0.00640087194502 0.06761436756629 10.811 4 B 0.67585981318777 0.99359912805498 0.56761436756629 10.811 *5 O 0.75633836989839 0.24366163010161 0.50079222578166 15.999 6 O 0.24366163010161 0.75633836989839 0.00079222578166 15.999 *7 O 0.91998997943796 0.66014908161776 0.41828951954288 15.999 8 O 0.08001002056204 0.33985091838224 0.91828951954288 15.999 9 O 0.66014908161776 0.91998997943796 0.91828951954288 15.999 10 O 0.33985091838224 0.08001002056204 0.41828951954288 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.840840230000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.629621079999999 0.000000000000000 c 0.000000000000000 0.000000000000000 4.138277690000000 Atomic positions (fractional): *1 B 0.16527052937862 0.15886965743360 0.56761436756629 10.811 > 1 2 B 0.83472947062138 0.84113034256640 0.06761436756629 10.811 > 2 3 B 0.16527052937862 0.84113034256640 0.06761436756629 10.811 > 3 4 B 0.83472947062138 0.15886965743360 0.56761436756629 10.811 > 4 5 B 0.66527052937862 0.65886965743360 0.56761436756629 10.811 > 1 6 B 0.33472947062137 0.34113034256640 0.06761436756629 10.811 > 2 7 B 0.66527052937862 0.34113034256640 0.06761436756629 10.811 > 3 8 B 0.33472947062137 0.65886965743360 0.56761436756629 10.811 > 4 *9 O 0.50000000000000 0.74366163010161 0.50079222578166 15.999 > 5 10 O 0.50000000000000 0.25633836989839 0.00079222578166 15.999 > 6 *11 O 0.79006953052786 0.87007955108990 0.41828951954288 15.999 > 7 12 O 0.20993046947214 0.12992044891010 0.91828951954288 15.999 > 8 13 O 0.79006953052786 0.12992044891010 0.91828951954288 15.999 > 9 14 O 0.20993046947214 0.87007955108990 0.41828951954288 15.999 > 10 15 O 0.00000000000000 0.24366163010161 0.50079222578166 15.999 > 5 16 O 0.00000000000000 0.75633836989839 0.00079222578166 15.999 > 6 17 O 0.29006953052786 0.37007955108990 0.41828951954288 15.999 > 7 18 O 0.70993046947214 0.62992044891010 0.91828951954288 15.999 > 8 19 O 0.29006953052786 0.62992044891010 0.91828951954288 15.999 > 9 20 O 0.70993046947214 0.37007955108990 0.41828951954288 15.999 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 7.840840230000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.259242159999998 0.000000000000000 c 0.000000000000000 0.000000000000000 8.276555380000000 Atomic positions (fractional): *1 B 0.16527052937862 0.07943482871680 0.28380718378315 10.811 > 1 2 B 0.16527052937862 0.57943482871680 0.28380718378315 10.811 > 1 3 B 0.16527052937862 0.07943482871680 0.78380718378315 10.811 > 1 4 B 0.16527052937862 0.57943482871680 0.78380718378315 10.811 > 1 5 B 0.83472947062138 0.42056517128320 0.03380718378315 10.811 > 2 6 B 0.83472947062138 0.92056517128320 0.03380718378315 10.811 > 2 7 B 0.83472947062138 0.42056517128320 0.53380718378315 10.811 > 2 8 B 0.83472947062138 0.92056517128320 0.53380718378315 10.811 > 2 9 B 0.16527052937862 0.42056517128320 0.03380718378315 10.811 > 3 10 B 0.16527052937862 0.92056517128320 0.03380718378315 10.811 > 3 11 B 0.16527052937862 0.42056517128320 0.53380718378315 10.811 > 3 12 B 0.16527052937862 0.92056517128320 0.53380718378315 10.811 > 3 13 B 0.83472947062138 0.07943482871680 0.28380718378315 10.811 > 4 14 B 0.83472947062138 0.57943482871680 0.28380718378315 10.811 > 4 15 B 0.83472947062138 0.07943482871680 0.78380718378315 10.811 > 4 16 B 0.83472947062138 0.57943482871680 0.78380718378315 10.811 > 4 17 B 0.66527052937862 0.32943482871680 0.28380718378315 10.811 > 1 18 B 0.66527052937862 0.82943482871680 0.28380718378315 10.811 > 1 19 B 0.66527052937862 0.32943482871680 0.78380718378315 10.811 > 1 20 B 0.66527052937862 0.82943482871680 0.78380718378315 10.811 > 1 21 B 0.33472947062137 0.17056517128320 0.03380718378315 10.811 > 2 22 B 0.33472947062137 0.67056517128320 0.03380718378315 10.811 > 2 23 B 0.33472947062137 0.17056517128320 0.53380718378315 10.811 > 2 24 B 0.33472947062137 0.67056517128320 0.53380718378315 10.811 > 2 25 B 0.66527052937862 0.17056517128320 0.03380718378315 10.811 > 3 26 B 0.66527052937862 0.67056517128320 0.03380718378315 10.811 > 3 27 B 0.66527052937862 0.17056517128320 0.53380718378315 10.811 > 3 28 B 0.66527052937862 0.67056517128320 0.53380718378315 10.811 > 3 29 B 0.33472947062137 0.32943482871680 0.28380718378315 10.811 > 4 30 B 0.33472947062137 0.82943482871680 0.28380718378315 10.811 > 4 31 B 0.33472947062137 0.32943482871680 0.78380718378315 10.811 > 4 32 B 0.33472947062137 0.82943482871680 0.78380718378315 10.811 > 4 *33 O 0.50000000000000 0.37183081505081 0.25039611289083 15.999 > 5 34 O 0.50000000000000 0.87183081505081 0.25039611289083 15.999 > 5 35 O 0.50000000000000 0.37183081505081 0.75039611289083 15.999 > 5 36 O 0.50000000000000 0.87183081505081 0.75039611289083 15.999 > 5 37 O 0.50000000000000 0.12816918494919 0.00039611289083 15.999 > 6 38 O 0.50000000000000 0.62816918494919 0.00039611289083 15.999 > 6 39 O 0.50000000000000 0.12816918494919 0.50039611289083 15.999 > 6 40 O 0.50000000000000 0.62816918494919 0.50039611289083 15.999 > 6 *41 O 0.79006953052786 0.43503977554495 0.20914475977144 15.999 > 7 42 O 0.79006953052786 0.93503977554495 0.20914475977144 15.999 > 7 43 O 0.79006953052786 0.43503977554495 0.70914475977144 15.999 > 7 44 O 0.79006953052786 0.93503977554495 0.70914475977144 15.999 > 7 45 O 0.20993046947214 0.06496022445505 0.45914475977144 15.999 > 8 46 O 0.20993046947214 0.56496022445505 0.45914475977144 15.999 > 8 47 O 0.20993046947214 0.06496022445505 0.95914475977144 15.999 > 8 48 O 0.20993046947214 0.56496022445505 0.95914475977144 15.999 > 8 49 O 0.79006953052786 0.06496022445505 0.45914475977144 15.999 > 9 50 O 0.79006953052786 0.56496022445505 0.45914475977144 15.999 > 9 51 O 0.79006953052786 0.06496022445505 0.95914475977144 15.999 > 9 52 O 0.79006953052786 0.56496022445505 0.95914475977144 15.999 > 9 53 O 0.20993046947214 0.43503977554495 0.20914475977144 15.999 > 10 54 O 0.20993046947214 0.93503977554495 0.20914475977144 15.999 > 10 55 O 0.20993046947214 0.43503977554495 0.70914475977144 15.999 > 10 56 O 0.20993046947214 0.93503977554495 0.70914475977144 15.999 > 10 57 O 0.00000000000000 0.12183081505081 0.25039611289083 15.999 > 5 58 O 0.00000000000000 0.62183081505081 0.25039611289083 15.999 > 5 59 O 0.00000000000000 0.12183081505081 0.75039611289083 15.999 > 5 60 O 0.00000000000000 0.62183081505081 0.75039611289083 15.999 > 5 61 O 0.00000000000000 0.37816918494919 0.00039611289083 15.999 > 6 62 O 0.00000000000000 0.87816918494919 0.00039611289083 15.999 > 6 63 O 0.00000000000000 0.37816918494919 0.50039611289083 15.999 > 6 64 O 0.00000000000000 0.87816918494919 0.50039611289083 15.999 > 6 65 O 0.29006953052786 0.18503977554495 0.20914475977144 15.999 > 7 66 O 0.29006953052786 0.68503977554495 0.20914475977144 15.999 > 7 67 O 0.29006953052786 0.18503977554495 0.70914475977144 15.999 > 7 68 O 0.29006953052786 0.68503977554495 0.70914475977144 15.999 > 7 69 O 0.70993046947214 0.31496022445505 0.45914475977144 15.999 > 8 70 O 0.70993046947214 0.81496022445505 0.45914475977144 15.999 > 8 71 O 0.70993046947214 0.31496022445505 0.95914475977144 15.999 > 8 72 O 0.70993046947214 0.81496022445505 0.95914475977144 15.999 > 8 73 O 0.29006953052786 0.31496022445505 0.45914475977144 15.999 > 9 74 O 0.29006953052786 0.81496022445505 0.45914475977144 15.999 > 9 75 O 0.29006953052786 0.31496022445505 0.95914475977144 15.999 > 9 76 O 0.29006953052786 0.81496022445505 0.95914475977144 15.999 > 9 77 O 0.70993046947214 0.18503977554495 0.20914475977144 15.999 > 10 78 O 0.70993046947214 0.68503977554495 0.20914475977144 15.999 > 10 79 O 0.70993046947214 0.18503977554495 0.70914475977144 15.999 > 10 80 O 0.70993046947214 0.68503977554495 0.70914475977144 15.999 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1119289 0.0000000 0.0000000 0.0000000 2.9580461 0.0000000 0.0000000 0.0000000 3.0078923 -------------------------- Born effective charges -------------------------- 1 B 2.8786474 -0.1805381 0.1075840 0.1457392 2.3948134 -0.0509892 -0.0576432 -0.0216683 2.4619210 2 B 2.8786474 -0.1805381 -0.1075840 0.1457392 2.3948134 0.0509892 0.0576432 0.0216683 2.4619210 3 B 2.8786474 0.1805381 0.1075840 -0.1457392 2.3948134 0.0509892 -0.0576432 0.0216683 2.4619210 4 B 2.8786474 0.1805381 -0.1075840 -0.1457392 2.3948134 -0.0509892 0.0576432 -0.0216683 2.4619210 5 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 0.0377200 0.0000000 0.0201542 -1.0853974 6 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 -0.0377200 0.0000000 -0.0201542 -1.0853974 7 O -1.3913883 -0.5084198 0.3901944 -0.5225831 -1.8459601 -0.0978193 0.2463950 -0.1585531 -1.9192222 8 O -1.3913883 -0.5084198 -0.3901944 -0.5225831 -1.8459601 0.0978193 -0.2463950 0.1585531 -1.9192222 9 O -1.3913883 0.5084198 0.3901944 0.5225831 -1.8459601 0.0978193 0.2463950 0.1585531 -1.9192222 10 O -1.3913883 0.5084198 -0.3901944 0.5225831 -1.8459601 -0.0978193 -0.2463950 -0.1585531 -1.9192222 ---------------------------------------------------------------------------- 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: 240/240 Permutation basis: 4656/4656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 934 Number of blocks in projector: 934 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: 208 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 114 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 114 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 114 Use standard eigh solver. Tree of FC basis block matrices: - (934, 911), data: False |-- (114, 111), data: True |-- (114, 111), data: True |-- (114, 111), data: True |-- (192, 188), data: True |-- (192, 188), data: True |-- (208, 202), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 320 - Time: 0.292 Solver_block: 200 / 320 - Time: 0.292 Solver_block: 300 / 320 - Time: 0.292 Solver_block: 320 / 320 - Time: 0.090 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.981 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 240/240 Permutation basis: 4656/4656 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 934 Number of blocks in projector: 934 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: 208 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 192 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 114 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 114 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 114 Use standard eigh solver. Tree of FC basis block matrices: - (934, 911), data: False |-- (114, 111), data: True |-- (114, 111), data: True |-- (114, 111), data: True |-- (192, 188), data: True |-- (192, 188), data: True |-- (208, 202), data: True Max drift after symmetrization by symfc projector: -0.00000000 (zz) -0.00000000 (zz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 18:37:16]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:37:16]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmc2_1 (36) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.920420115000000 -2.314810539999999 0.000000000000000 b 3.920420115000000 2.314810539999999 0.000000000000000 c 0.000000000000000 0.000000000000000 4.138277690000000 Atomic positions (fractional): 1 B 0.00640087194502 0.32414018681223 0.56761436756629 10.811 2 B 0.99359912805498 0.67585981318777 0.06761436756629 10.811 3 B 0.32414018681223 0.00640087194502 0.06761436756629 10.811 4 B 0.67585981318777 0.99359912805498 0.56761436756629 10.811 5 O 0.75633836989839 0.24366163010161 0.50079222578166 15.999 6 O 0.24366163010161 0.75633836989839 0.00079222578166 15.999 7 O 0.91998997943796 0.66014908161776 0.41828951954288 15.999 8 O 0.08001002056204 0.33985091838224 0.91828951954288 15.999 9 O 0.66014908161776 0.91998997943796 0.91828951954288 15.999 10 O 0.33985091838224 0.08001002056204 0.41828951954288 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.840840230000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.259242159999998 0.000000000000000 c 0.000000000000000 0.000000000000000 8.276555380000000 Atomic positions (fractional): 1 B 0.16527052937862 0.07943482871680 0.28380718378315 10.811 > 1 2 B 0.16527052937862 0.57943482871680 0.28380718378315 10.811 > 1 3 B 0.16527052937862 0.07943482871680 0.78380718378315 10.811 > 1 4 B 0.16527052937862 0.57943482871680 0.78380718378315 10.811 > 1 5 B 0.83472947062138 0.42056517128320 0.03380718378315 10.811 > 5 6 B 0.83472947062138 0.92056517128320 0.03380718378315 10.811 > 5 7 B 0.83472947062138 0.42056517128320 0.53380718378315 10.811 > 5 8 B 0.83472947062138 0.92056517128320 0.53380718378315 10.811 > 5 9 B 0.16527052937862 0.42056517128320 0.03380718378315 10.811 > 9 10 B 0.16527052937862 0.92056517128320 0.03380718378315 10.811 > 9 11 B 0.16527052937862 0.42056517128320 0.53380718378315 10.811 > 9 12 B 0.16527052937862 0.92056517128320 0.53380718378315 10.811 > 9 13 B 0.83472947062138 0.07943482871680 0.28380718378315 10.811 > 13 14 B 0.83472947062138 0.57943482871680 0.28380718378315 10.811 > 13 15 B 0.83472947062138 0.07943482871680 0.78380718378315 10.811 > 13 16 B 0.83472947062138 0.57943482871680 0.78380718378315 10.811 > 13 17 B 0.66527052937862 0.32943482871680 0.28380718378315 10.811 > 1 18 B 0.66527052937862 0.82943482871680 0.28380718378315 10.811 > 1 19 B 0.66527052937862 0.32943482871680 0.78380718378315 10.811 > 1 20 B 0.66527052937862 0.82943482871680 0.78380718378315 10.811 > 1 21 B 0.33472947062137 0.17056517128320 0.03380718378315 10.811 > 5 22 B 0.33472947062137 0.67056517128320 0.03380718378315 10.811 > 5 23 B 0.33472947062137 0.17056517128320 0.53380718378315 10.811 > 5 24 B 0.33472947062137 0.67056517128320 0.53380718378315 10.811 > 5 25 B 0.66527052937862 0.17056517128320 0.03380718378315 10.811 > 9 26 B 0.66527052937862 0.67056517128320 0.03380718378315 10.811 > 9 27 B 0.66527052937862 0.17056517128320 0.53380718378315 10.811 > 9 28 B 0.66527052937862 0.67056517128320 0.53380718378315 10.811 > 9 29 B 0.33472947062137 0.32943482871680 0.28380718378315 10.811 > 13 30 B 0.33472947062137 0.82943482871680 0.28380718378315 10.811 > 13 31 B 0.33472947062137 0.32943482871680 0.78380718378315 10.811 > 13 32 B 0.33472947062137 0.82943482871680 0.78380718378315 10.811 > 13 33 O 0.50000000000000 0.37183081505081 0.25039611289083 15.999 > 33 34 O 0.50000000000000 0.87183081505081 0.25039611289083 15.999 > 33 35 O 0.50000000000000 0.37183081505081 0.75039611289083 15.999 > 33 36 O 0.50000000000000 0.87183081505081 0.75039611289083 15.999 > 33 37 O 0.50000000000000 0.12816918494919 0.00039611289083 15.999 > 37 38 O 0.50000000000000 0.62816918494919 0.00039611289083 15.999 > 37 39 O 0.50000000000000 0.12816918494919 0.50039611289083 15.999 > 37 40 O 0.50000000000000 0.62816918494919 0.50039611289083 15.999 > 37 41 O 0.79006953052786 0.43503977554495 0.20914475977144 15.999 > 41 42 O 0.79006953052786 0.93503977554495 0.20914475977144 15.999 > 41 43 O 0.79006953052786 0.43503977554495 0.70914475977144 15.999 > 41 44 O 0.79006953052786 0.93503977554495 0.70914475977144 15.999 > 41 45 O 0.20993046947214 0.06496022445505 0.45914475977144 15.999 > 45 46 O 0.20993046947214 0.56496022445505 0.45914475977144 15.999 > 45 47 O 0.20993046947214 0.06496022445505 0.95914475977144 15.999 > 45 48 O 0.20993046947214 0.56496022445505 0.95914475977144 15.999 > 45 49 O 0.79006953052786 0.06496022445505 0.45914475977144 15.999 > 49 50 O 0.79006953052786 0.56496022445505 0.45914475977144 15.999 > 49 51 O 0.79006953052786 0.06496022445505 0.95914475977144 15.999 > 49 52 O 0.79006953052786 0.56496022445505 0.95914475977144 15.999 > 49 53 O 0.20993046947214 0.43503977554495 0.20914475977144 15.999 > 53 54 O 0.20993046947214 0.93503977554495 0.20914475977144 15.999 > 53 55 O 0.20993046947214 0.43503977554495 0.70914475977144 15.999 > 53 56 O 0.20993046947214 0.93503977554495 0.70914475977144 15.999 > 53 57 O 0.00000000000000 0.12183081505081 0.25039611289083 15.999 > 33 58 O 0.00000000000000 0.62183081505081 0.25039611289083 15.999 > 33 59 O 0.00000000000000 0.12183081505081 0.75039611289083 15.999 > 33 60 O 0.00000000000000 0.62183081505081 0.75039611289083 15.999 > 33 61 O 0.00000000000000 0.37816918494919 0.00039611289083 15.999 > 37 62 O 0.00000000000000 0.87816918494919 0.00039611289083 15.999 > 37 63 O 0.00000000000000 0.37816918494919 0.50039611289083 15.999 > 37 64 O 0.00000000000000 0.87816918494919 0.50039611289083 15.999 > 37 65 O 0.29006953052786 0.18503977554495 0.20914475977144 15.999 > 41 66 O 0.29006953052786 0.68503977554495 0.20914475977144 15.999 > 41 67 O 0.29006953052786 0.18503977554495 0.70914475977144 15.999 > 41 68 O 0.29006953052786 0.68503977554495 0.70914475977144 15.999 > 41 69 O 0.70993046947214 0.31496022445505 0.45914475977144 15.999 > 45 70 O 0.70993046947214 0.81496022445505 0.45914475977144 15.999 > 45 71 O 0.70993046947214 0.31496022445505 0.95914475977144 15.999 > 45 72 O 0.70993046947214 0.81496022445505 0.95914475977144 15.999 > 45 73 O 0.29006953052786 0.31496022445505 0.45914475977144 15.999 > 49 74 O 0.29006953052786 0.81496022445505 0.45914475977144 15.999 > 49 75 O 0.29006953052786 0.31496022445505 0.95914475977144 15.999 > 49 76 O 0.29006953052786 0.81496022445505 0.95914475977144 15.999 > 49 77 O 0.70993046947214 0.18503977554495 0.20914475977144 15.999 > 53 78 O 0.70993046947214 0.68503977554495 0.20914475977144 15.999 > 53 79 O 0.70993046947214 0.18503977554495 0.70914475977144 15.999 > 53 80 O 0.70993046947214 0.68503977554495 0.70914475977144 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.1119289 0.0000000 0.0000000 0.0000000 2.9580461 0.0000000 0.0000000 0.0000000 3.0078923 -------------------------- Born effective charges -------------------------- 1 B 2.8786474 -0.1805381 0.1075840 0.1457392 2.3948134 -0.0509892 -0.0576432 -0.0216683 2.4619210 2 B 2.8786474 -0.1805381 -0.1075840 0.1457392 2.3948134 0.0509892 0.0576432 0.0216683 2.4619210 3 B 2.8786474 0.1805381 0.1075840 -0.1457392 2.3948134 0.0509892 -0.0576432 0.0216683 2.4619210 4 B 2.8786474 0.1805381 -0.1075840 -0.1457392 2.3948134 -0.0509892 0.0576432 -0.0216683 2.4619210 5 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 0.0377200 0.0000000 0.0201542 -1.0853974 6 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 -0.0377200 0.0000000 -0.0201542 -1.0853974 7 O -1.3913883 -0.5084198 0.3901944 -0.5225831 -1.8459601 -0.0978193 0.2463950 -0.1585531 -1.9192222 8 O -1.3913883 -0.5084198 -0.3901944 -0.5225831 -1.8459601 0.0978193 -0.2463950 0.1585531 -1.9192222 9 O -1.3913883 0.5084198 0.3901944 0.5225831 -1.8459601 0.0978193 0.2463950 0.1585531 -1.9192222 10 O -1.3913883 0.5084198 -0.3901944 0.5225831 -1.8459601 -0.0978193 -0.2463950 -0.1585531 -1.9192222 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 41, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000014 (yyy) -0.00000014 (yyy) -0.00000014 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000006 (zx) -0.00000006 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:37:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:37:25]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmc2_1 (36) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.920420115000000 -2.314810539999999 0.000000000000000 b 3.920420115000000 2.314810539999999 0.000000000000000 c 0.000000000000000 0.000000000000000 4.138277690000000 Atomic positions (fractional): 1 B 0.00640087194502 0.32414018681223 0.56761436756629 10.811 2 B 0.99359912805498 0.67585981318777 0.06761436756629 10.811 3 B 0.32414018681223 0.00640087194502 0.06761436756629 10.811 4 B 0.67585981318777 0.99359912805498 0.56761436756629 10.811 5 O 0.75633836989839 0.24366163010161 0.50079222578166 15.999 6 O 0.24366163010161 0.75633836989839 0.00079222578166 15.999 7 O 0.91998997943796 0.66014908161776 0.41828951954288 15.999 8 O 0.08001002056204 0.33985091838224 0.91828951954288 15.999 9 O 0.66014908161776 0.91998997943796 0.91828951954288 15.999 10 O 0.33985091838224 0.08001002056204 0.41828951954288 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.840840230000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.259242159999998 0.000000000000000 c 0.000000000000000 0.000000000000000 8.276555380000000 Atomic positions (fractional): 1 B 0.16527052937862 0.07943482871680 0.28380718378315 10.811 > 1 2 B 0.16527052937862 0.57943482871680 0.28380718378315 10.811 > 1 3 B 0.16527052937862 0.07943482871680 0.78380718378315 10.811 > 1 4 B 0.16527052937862 0.57943482871680 0.78380718378315 10.811 > 1 5 B 0.83472947062138 0.42056517128320 0.03380718378315 10.811 > 5 6 B 0.83472947062138 0.92056517128320 0.03380718378315 10.811 > 5 7 B 0.83472947062138 0.42056517128320 0.53380718378315 10.811 > 5 8 B 0.83472947062138 0.92056517128320 0.53380718378315 10.811 > 5 9 B 0.16527052937862 0.42056517128320 0.03380718378315 10.811 > 9 10 B 0.16527052937862 0.92056517128320 0.03380718378315 10.811 > 9 11 B 0.16527052937862 0.42056517128320 0.53380718378315 10.811 > 9 12 B 0.16527052937862 0.92056517128320 0.53380718378315 10.811 > 9 13 B 0.83472947062138 0.07943482871680 0.28380718378315 10.811 > 13 14 B 0.83472947062138 0.57943482871680 0.28380718378315 10.811 > 13 15 B 0.83472947062138 0.07943482871680 0.78380718378315 10.811 > 13 16 B 0.83472947062138 0.57943482871680 0.78380718378315 10.811 > 13 17 B 0.66527052937862 0.32943482871680 0.28380718378315 10.811 > 1 18 B 0.66527052937862 0.82943482871680 0.28380718378315 10.811 > 1 19 B 0.66527052937862 0.32943482871680 0.78380718378315 10.811 > 1 20 B 0.66527052937862 0.82943482871680 0.78380718378315 10.811 > 1 21 B 0.33472947062137 0.17056517128320 0.03380718378315 10.811 > 5 22 B 0.33472947062137 0.67056517128320 0.03380718378315 10.811 > 5 23 B 0.33472947062137 0.17056517128320 0.53380718378315 10.811 > 5 24 B 0.33472947062137 0.67056517128320 0.53380718378315 10.811 > 5 25 B 0.66527052937862 0.17056517128320 0.03380718378315 10.811 > 9 26 B 0.66527052937862 0.67056517128320 0.03380718378315 10.811 > 9 27 B 0.66527052937862 0.17056517128320 0.53380718378315 10.811 > 9 28 B 0.66527052937862 0.67056517128320 0.53380718378315 10.811 > 9 29 B 0.33472947062137 0.32943482871680 0.28380718378315 10.811 > 13 30 B 0.33472947062137 0.82943482871680 0.28380718378315 10.811 > 13 31 B 0.33472947062137 0.32943482871680 0.78380718378315 10.811 > 13 32 B 0.33472947062137 0.82943482871680 0.78380718378315 10.811 > 13 33 O 0.50000000000000 0.37183081505081 0.25039611289083 15.999 > 33 34 O 0.50000000000000 0.87183081505081 0.25039611289083 15.999 > 33 35 O 0.50000000000000 0.37183081505081 0.75039611289083 15.999 > 33 36 O 0.50000000000000 0.87183081505081 0.75039611289083 15.999 > 33 37 O 0.50000000000000 0.12816918494919 0.00039611289083 15.999 > 37 38 O 0.50000000000000 0.62816918494919 0.00039611289083 15.999 > 37 39 O 0.50000000000000 0.12816918494919 0.50039611289083 15.999 > 37 40 O 0.50000000000000 0.62816918494919 0.50039611289083 15.999 > 37 41 O 0.79006953052786 0.43503977554495 0.20914475977144 15.999 > 41 42 O 0.79006953052786 0.93503977554495 0.20914475977144 15.999 > 41 43 O 0.79006953052786 0.43503977554495 0.70914475977144 15.999 > 41 44 O 0.79006953052786 0.93503977554495 0.70914475977144 15.999 > 41 45 O 0.20993046947214 0.06496022445505 0.45914475977144 15.999 > 45 46 O 0.20993046947214 0.56496022445505 0.45914475977144 15.999 > 45 47 O 0.20993046947214 0.06496022445505 0.95914475977144 15.999 > 45 48 O 0.20993046947214 0.56496022445505 0.95914475977144 15.999 > 45 49 O 0.79006953052786 0.06496022445505 0.45914475977144 15.999 > 49 50 O 0.79006953052786 0.56496022445505 0.45914475977144 15.999 > 49 51 O 0.79006953052786 0.06496022445505 0.95914475977144 15.999 > 49 52 O 0.79006953052786 0.56496022445505 0.95914475977144 15.999 > 49 53 O 0.20993046947214 0.43503977554495 0.20914475977144 15.999 > 53 54 O 0.20993046947214 0.93503977554495 0.20914475977144 15.999 > 53 55 O 0.20993046947214 0.43503977554495 0.70914475977144 15.999 > 53 56 O 0.20993046947214 0.93503977554495 0.70914475977144 15.999 > 53 57 O 0.00000000000000 0.12183081505081 0.25039611289083 15.999 > 33 58 O 0.00000000000000 0.62183081505081 0.25039611289083 15.999 > 33 59 O 0.00000000000000 0.12183081505081 0.75039611289083 15.999 > 33 60 O 0.00000000000000 0.62183081505081 0.75039611289083 15.999 > 33 61 O 0.00000000000000 0.37816918494919 0.00039611289083 15.999 > 37 62 O 0.00000000000000 0.87816918494919 0.00039611289083 15.999 > 37 63 O 0.00000000000000 0.37816918494919 0.50039611289083 15.999 > 37 64 O 0.00000000000000 0.87816918494919 0.50039611289083 15.999 > 37 65 O 0.29006953052786 0.18503977554495 0.20914475977144 15.999 > 41 66 O 0.29006953052786 0.68503977554495 0.20914475977144 15.999 > 41 67 O 0.29006953052786 0.18503977554495 0.70914475977144 15.999 > 41 68 O 0.29006953052786 0.68503977554495 0.70914475977144 15.999 > 41 69 O 0.70993046947214 0.31496022445505 0.45914475977144 15.999 > 45 70 O 0.70993046947214 0.81496022445505 0.45914475977144 15.999 > 45 71 O 0.70993046947214 0.31496022445505 0.95914475977144 15.999 > 45 72 O 0.70993046947214 0.81496022445505 0.95914475977144 15.999 > 45 73 O 0.29006953052786 0.31496022445505 0.45914475977144 15.999 > 49 74 O 0.29006953052786 0.81496022445505 0.45914475977144 15.999 > 49 75 O 0.29006953052786 0.31496022445505 0.95914475977144 15.999 > 49 76 O 0.29006953052786 0.81496022445505 0.95914475977144 15.999 > 49 77 O 0.70993046947214 0.18503977554495 0.20914475977144 15.999 > 53 78 O 0.70993046947214 0.68503977554495 0.20914475977144 15.999 > 53 79 O 0.70993046947214 0.18503977554495 0.70914475977144 15.999 > 53 80 O 0.70993046947214 0.68503977554495 0.70914475977144 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.1119289 0.0000000 0.0000000 0.0000000 2.9580461 0.0000000 0.0000000 0.0000000 3.0078923 -------------------------- Born effective charges -------------------------- 1 B 2.8786474 -0.1805381 0.1075840 0.1457392 2.3948134 -0.0509892 -0.0576432 -0.0216683 2.4619210 2 B 2.8786474 -0.1805381 -0.1075840 0.1457392 2.3948134 0.0509892 0.0576432 0.0216683 2.4619210 3 B 2.8786474 0.1805381 0.1075840 -0.1457392 2.3948134 0.0509892 -0.0576432 0.0216683 2.4619210 4 B 2.8786474 0.1805381 -0.1075840 -0.1457392 2.3948134 -0.0509892 0.0576432 -0.0216683 2.4619210 5 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 0.0377200 0.0000000 0.0201542 -1.0853974 6 O -2.9745181 0.0000000 0.0000000 0.0000000 -1.0977064 -0.0377200 0.0000000 -0.0201542 -1.0853974 7 O -1.3913883 -0.5084198 0.3901944 -0.5225831 -1.8459601 -0.0978193 0.2463950 -0.1585531 -1.9192222 8 O -1.3913883 -0.5084198 -0.3901944 -0.5225831 -1.8459601 0.0978193 -0.2463950 0.1585531 -1.9192222 9 O -1.3913883 0.5084198 0.3901944 0.5225831 -1.8459601 0.0978193 0.2463950 0.1585531 -1.9192222 10 O -1.3913883 0.5084198 -0.3901944 0.5225831 -1.8459601 -0.0978193 -0.2463950 -0.1585531 -1.9192222 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000014 (yyy) -0.00000014 (yyy) -0.00000014 (yyy) Max drift of fc2: -0.00000000 (zz) -0.00000000 (zz) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 13 13 12 ] 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: 0.98, Number of G-points: 287, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/343) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 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 8.246 ( 0.000 0.000 0.000) 0.000 8.557 ( 0.000 0.000 0.000) 0.000 9.624 ( 0.000 0.000 0.000) 0.000 11.209 ( 0.000 0.000 0.000) 0.000 13.030 ( 0.000 0.000 0.000) 0.000 15.159 ( 0.000 0.000 0.000) 0.000 16.122 ( 0.000 0.000 0.000) 0.000 17.043 ( 0.000 0.000 0.000) 0.000 17.220 ( 0.000 0.000 0.000) 0.000 19.816 ( 0.000 0.000 0.000) 0.000 20.627 ( 0.000 0.000 0.000) 0.000 20.785 ( 0.000 0.000 0.000) 0.000 23.304 ( 0.000 0.000 0.000) 0.000 24.305 ( 0.000 0.000 0.000) 0.000 24.338 ( 0.000 0.000 0.000) 0.000 25.480 ( 0.000 0.000 0.000) 0.000 25.592 ( 0.000 0.000 0.000) 0.000 26.001 ( 0.000 0.000 0.000) 0.000 26.127 ( 0.000 0.000 0.000) 0.000 27.059 ( 0.000 0.000 0.000) 0.000 28.437 ( 0.000 0.000 0.000) 0.000 29.557 ( 0.000 0.000 0.000) 0.000 31.115 ( 0.000 0.000 0.000) 0.000 33.042 ( 0.000 0.000 0.000) 0.000 35.273 ( 0.000 0.000 0.000) 0.000 37.369 ( 0.000 0.000 0.000) 0.000 37.405 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/343) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( 34.153 -67.154 0.000) 75.339 1.509 ( 54.506 -53.791 0.000) 76.579 1.993 ( 55.087 -84.697 0.000) 101.036 8.177 ( 8.303 9.838 0.000) 12.874 8.690 ( -15.072 -17.153 0.000) 22.835 9.721 ( -0.200 -10.946 0.000) 10.948 11.333 ( 19.826 -2.947 0.000) 20.044 13.004 ( -8.129 -1.143 0.000) 8.209 15.201 ( -5.475 -8.144 0.000) 9.813 16.045 ( 2.123 10.213 0.000) 10.432 16.892 ( 2.092 19.209 0.000) 19.323 17.577 ( -24.628 -13.108 0.000) 27.899 19.726 ( 12.247 18.220 0.000) 21.954 20.731 ( -4.527 0.254 0.000) 4.534 20.898 ( 17.345 1.965 0.000) 17.456 23.335 ( -1.490 -4.235 0.000) 4.490 23.892 ( 0.199 26.793 0.000) 26.794 24.738 ( 1.333 -24.462 0.000) 24.498 25.604 ( -0.763 -1.307 0.000) 1.513 25.943 ( -14.032 -7.454 0.000) 15.889 26.118 ( 3.563 2.320 0.000) 4.252 27.063 ( 0.656 -0.827 0.000) 1.055 28.299 ( -21.001 0.303 0.000) 21.003 28.952 ( -86.294 -60.379 0.000) 105.320 31.053 ( 0.398 7.242 0.000) 7.253 32.058 ( -33.167 -15.067 0.000) 36.429 33.939 (-138.319 -73.678 0.000) 156.718 35.296 ( 12.414 5.345 0.000) 13.516 37.438 ( 0.084 -7.897 0.000) 7.897 41.108 ( 332.513 190.871 0.000) 383.401 ======================= Grid point 2 (3/343) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( 38.063 -61.149 0.000) 72.028 2.879 ( 45.131 -51.901 0.000) 68.778 3.879 ( 50.909 -78.282 0.000) 93.380 8.170 ( 13.615 2.384 0.000) 13.823 8.820 ( -16.438 -16.989 0.000) 23.640 9.954 ( -2.300 -17.917 0.000) 18.064 11.671 ( 32.642 -5.116 0.000) 33.041 12.907 ( -16.517 -1.459 0.000) 16.581 15.316 ( -10.913 -14.804 0.000) 18.391 15.846 ( 6.426 17.630 0.000) 18.765 16.500 ( 5.796 30.517 0.000) 31.062 17.537 ( -20.510 -8.369 0.000) 22.152 19.455 ( 13.101 28.791 0.000) 31.632 20.687 ( -10.891 -3.948 0.000) 11.585 21.071 ( 7.802 -7.604 0.000) 10.895 23.308 ( -7.086 15.526 0.000) 17.067 23.529 ( 3.081 5.808 0.000) 6.575 25.156 ( 1.963 -23.262 0.000) 23.344 25.590 ( -3.265 1.221 0.000) 3.486 25.922 ( -6.454 -2.708 0.000) 6.999 26.141 ( 3.390 -0.772 0.000) 3.476 27.080 ( 0.831 0.090 0.000) 0.836 28.098 ( -12.336 2.867 0.000) 12.665 29.090 ( -36.025 -27.870 0.000) 45.547 30.870 ( 0.023 15.138 0.000) 15.138 31.940 ( -40.719 -14.235 0.000) 43.136 33.824 ( -62.412 -32.870 0.000) 70.539 35.311 ( 19.192 12.000 0.000) 22.635 37.613 ( -0.174 -12.480 0.000) 12.481 41.230 ( 160.430 85.953 0.000) 182.004 ======================= Grid point 3 (4/343) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.009 ( 46.191 -33.399 0.000) 57.001 4.219 ( 27.502 -65.687 0.000) 71.212 5.538 ( 42.424 -64.385 0.000) 77.105 8.359 ( 4.039 -11.545 0.000) 12.231 9.003 ( 6.045 -16.489 0.000) 17.562 10.249 ( -5.912 -21.517 0.000) 22.315 12.050 ( 31.589 1.459 0.000) 31.623 12.729 ( -23.841 -1.758 0.000) 23.906 15.411 ( -10.855 -5.524 0.000) 12.180 15.656 ( 10.398 12.514 0.000) 16.270 16.089 ( 12.484 25.154 0.000) 28.082 17.444 ( -23.962 -6.591 0.000) 24.852 19.048 ( 9.844 33.107 0.000) 34.539 20.645 ( -13.553 -5.315 0.000) 14.557 21.288 ( 7.578 -8.979 0.000) 11.749 22.802 ( -6.622 30.071 0.000) 30.791 23.644 ( 0.356 -11.134 0.000) 11.139 25.425 ( -6.278 -2.062 0.000) 6.608 25.600 ( 2.358 -11.829 0.000) 12.061 25.914 ( 0.304 -0.187 0.000) 0.357 26.189 ( 0.936 -1.646 0.000) 1.894 27.068 ( 0.647 2.327 0.000) 2.415 27.994 ( -4.808 -1.193 0.000) 4.954 29.170 ( -22.755 -16.737 0.000) 28.247 30.554 ( -0.423 22.282 0.000) 22.286 31.745 ( -44.358 -13.432 0.000) 46.347 33.838 ( -32.940 -25.105 0.000) 41.416 35.263 ( 21.591 17.925 0.000) 28.063 37.828 ( -0.743 -13.340 0.000) 13.361 41.383 ( 98.297 48.915 0.000) 109.795 ======================= Grid point 4 (5/343) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.841 ( 32.914 -20.280 0.000) 38.660 5.544 ( 25.704 -61.540 0.000) 66.692 6.782 ( 34.947 -37.350 0.000) 51.150 8.542 ( -20.040 -22.786 0.000) 30.345 9.633 ( 44.458 -27.329 0.000) 52.186 10.513 ( -11.831 -19.321 0.000) 22.655 12.075 ( 2.830 17.852 0.000) 18.075 12.567 ( -11.240 -0.204 0.000) 11.241 15.295 ( 2.129 12.705 0.000) 12.882 15.577 ( 20.726 12.091 0.000) 23.995 16.044 ( 3.300 -6.411 0.000) 7.211 17.290 ( -29.547 -7.108 0.000) 30.390 18.567 ( 8.125 34.867 0.000) 35.801 20.590 ( -15.590 -4.938 0.000) 16.353 21.501 ( 7.881 -6.947 0.000) 10.506 22.258 ( -5.120 26.649 0.000) 27.137 23.867 ( 0.004 -15.308 0.000) 15.308 25.308 ( -4.436 6.010 0.000) 7.470 25.714 ( -2.257 3.712 0.000) 4.344 26.022 ( 4.440 -11.046 0.000) 11.905 26.199 ( -0.615 0.612 0.000) 0.867 27.014 ( 0.407 4.676 0.000) 4.694 28.061 ( -1.618 -10.812 0.000) 10.933 29.214 ( -15.257 -11.388 0.000) 19.039 30.136 ( -0.809 26.877 0.000) 26.890 31.545 ( -36.576 -11.001 0.000) 38.194 33.993 ( -21.465 -24.915 0.000) 32.886 35.141 ( 21.759 22.317 0.000) 31.169 38.027 ( -1.170 -11.476 0.000) 11.535 41.521 ( 61.993 29.393 0.000) 68.608 ======================= Grid point 5 (6/343) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.352 ( 19.760 -10.854 0.000) 22.545 6.718 ( 19.145 -50.037 0.000) 53.575 7.413 ( 21.639 -7.819 0.000) 23.008 8.869 ( -7.872 -33.284 0.000) 34.202 10.511 ( 8.334 -13.405 0.000) 15.784 10.679 ( 19.540 -21.665 0.000) 29.175 11.678 ( -17.231 15.007 0.000) 22.850 12.426 ( -0.530 10.989 0.000) 11.002 15.074 ( 7.216 16.785 0.000) 18.270 15.759 ( 27.709 -2.146 0.000) 27.792 16.164 ( -6.674 -6.910 0.000) 9.607 17.143 ( -32.536 -13.523 0.000) 35.234 18.070 ( 9.502 34.415 0.000) 35.703 20.493 ( -14.528 -1.217 0.000) 14.579 21.643 ( 5.135 -0.560 0.000) 5.166 21.890 ( -0.294 11.820 0.000) 11.824 24.154 ( 0.645 -18.889 0.000) 18.900 25.151 ( 0.066 11.295 0.000) 11.295 25.531 ( -5.727 10.484 0.000) 11.946 26.171 ( -1.157 1.163 0.000) 1.641 26.251 ( 2.778 -10.554 0.000) 10.914 26.929 ( 0.268 5.617 0.000) 5.624 28.311 ( -0.791 -20.055 0.000) 20.071 29.254 ( -7.979 -6.999 0.000) 10.613 29.663 ( -1.153 28.267 0.000) 28.290 31.406 ( -22.672 -7.306 0.000) 23.820 34.222 ( -18.527 -25.730 0.000) 31.706 34.955 ( 20.948 24.998 0.000) 32.615 38.178 ( -1.074 -7.710 0.000) 7.785 41.617 ( 34.830 16.231 0.000) 38.426 ======================= Grid point 6 (7/343) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.603 ( 6.878 -3.649 0.000) 7.786 7.318 ( 1.645 -7.889 0.000) 8.059 7.780 ( 13.668 -16.158 0.000) 21.164 9.311 ( 2.527 -15.957 0.000) 16.156 10.343 ( -11.088 7.601 0.000) 13.443 11.303 ( 22.636 6.147 0.000) 23.456 11.443 ( -15.527 -19.498 0.000) 24.925 12.241 ( 2.150 9.795 0.000) 10.028 14.929 ( 4.331 6.998 0.000) 8.230 16.006 ( 7.616 -0.012 0.000) 7.616 16.188 ( 1.718 -3.865 0.000) 4.229 17.112 ( -22.238 -13.542 0.000) 26.037 17.674 ( 9.634 21.094 0.000) 23.190 20.381 ( -6.153 0.794 0.000) 6.204 21.616 ( 0.722 2.976 0.000) 3.062 21.849 ( 1.852 -0.352 0.000) 1.885 24.506 ( 1.213 -22.145 0.000) 22.178 24.885 ( 0.337 21.188 0.000) 21.191 25.357 ( -3.603 3.183 0.000) 4.807 26.148 ( -0.479 0.469 0.000) 0.670 26.402 ( 0.834 -4.814 0.000) 4.886 26.851 ( 0.110 3.210 0.000) 3.212 28.682 ( -0.444 -23.747 0.000) 23.751 29.174 ( 1.088 24.734 0.000) 24.758 29.302 ( -3.756 -1.036 0.000) 3.897 31.341 ( -7.540 -2.574 0.000) 7.968 34.471 ( -18.138 -25.370 0.000) 31.187 34.730 ( 19.206 25.280 0.000) 31.748 38.258 ( -0.434 -2.716 0.000) 2.750 41.665 ( 11.280 5.251 0.000) 12.442 ======================= Grid point 14 (8/343) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 62.314 -0.000 0.000) 62.314 1.284 ( 62.867 -0.000 0.000) 62.867 2.506 ( 125.876 -0.000 0.000) 125.876 8.254 ( -25.790 0.000 0.000) 25.790 8.478 ( 23.079 -0.000 0.000) 23.079 9.643 ( 2.204 -0.000 0.000) 2.204 11.560 ( 30.966 -0.000 0.000) 30.966 12.883 ( -14.385 0.000 0.000) 14.385 15.063 ( -9.725 0.000 0.000) 9.725 16.140 ( 0.212 -0.000 0.000) 0.212 17.099 ( 0.594 -0.000 0.000) 0.594 17.139 ( -6.696 0.000 0.000) 6.696 19.906 ( 8.869 -0.000 0.000) 8.869 20.685 ( -9.819 0.000 0.000) 9.819 21.336 ( -2.359 0.000 0.000) 2.359 23.283 ( -2.035 0.000 0.000) 2.035 24.306 ( -3.439 0.000 0.000) 3.439 24.316 ( 0.995 -0.000 0.000) 0.995 25.331 ( -8.978 0.000 0.000) 8.978 25.711 ( 6.364 -0.000 0.000) 6.364 26.066 ( -7.049 0.000 0.000) 7.049 26.964 ( -9.907 0.000 0.000) 9.907 27.076 ( 1.526 -0.000 0.000) 1.526 28.503 ( 6.567 -0.000 0.000) 6.567 31.122 ( 0.582 -0.000 0.000) 0.582 31.709 ( -11.757 0.000 0.000) 11.757 33.021 ( -1.875 0.000 0.000) 1.875 35.531 ( 24.496 -0.000 0.000) 24.496 37.349 ( -2.051 0.000 0.000) 2.051 45.485 ( -4.786 0.000 0.000) 4.786 ======================= Grid point 15 (9/343) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( 50.437 -43.945 0.000) 66.896 2.475 ( 48.488 -58.567 0.000) 76.034 3.874 ( 110.065 -19.642 0.000) 111.804 8.051 ( -24.162 -6.399 0.000) 24.995 8.767 ( 30.466 -1.954 0.000) 30.529 9.737 ( 2.619 -7.577 0.000) 8.017 11.928 ( 35.630 -4.336 0.000) 35.893 12.715 ( -20.040 0.180 0.000) 20.041 15.006 ( -14.130 -7.438 0.000) 15.968 16.071 ( -2.595 6.109 0.000) 6.637 16.937 ( 1.950 16.520 0.000) 16.635 17.202 ( -11.616 -8.767 0.000) 14.553 19.949 ( 11.278 11.609 0.000) 16.185 20.552 ( -12.994 1.267 0.000) 13.056 21.137 ( 5.510 9.003 0.000) 10.555 23.282 ( -3.627 -2.344 0.000) 4.319 23.865 ( -3.589 25.037 0.000) 25.293 24.766 ( 0.936 -26.838 0.000) 26.854 25.481 ( -11.392 -14.641 0.000) 18.551 25.715 ( -7.318 -0.035 0.000) 7.318 26.142 ( -1.430 -9.430 0.000) 9.537 27.076 ( -1.657 -3.503 0.000) 3.875 27.265 ( -38.090 -42.553 0.000) 57.111 28.580 ( 4.733 -1.661 0.000) 5.016 31.060 ( 0.032 7.871 0.000) 7.871 31.579 ( -15.062 0.584 0.000) 15.073 33.124 ( -9.469 -14.172 0.000) 17.045 35.735 ( 30.073 8.688 0.000) 31.303 37.399 ( -3.371 -8.631 0.000) 9.266 44.279 ( 58.603 110.989 0.000) 125.510 ======================= Grid point 16 (10/343) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.528 ( 39.999 -55.226 0.000) 68.189 3.917 ( 51.485 -51.450 0.000) 72.786 5.218 ( 77.285 -30.529 0.000) 83.096 7.991 ( -20.745 -11.997 0.000) 23.965 9.176 ( 44.684 -4.709 0.000) 44.931 9.920 ( -0.265 -12.433 0.000) 12.436 12.360 ( 33.613 -4.927 0.000) 33.972 12.475 ( -25.056 2.431 0.000) 25.174 15.031 ( -17.720 -14.037 0.000) 22.606 15.919 ( -3.341 7.438 0.000) 8.154 16.626 ( 6.597 23.934 0.000) 24.827 17.175 ( -12.339 -2.100 0.000) 12.516 19.687 ( 10.084 30.013 0.000) 31.662 20.434 ( -14.784 -3.175 0.000) 15.122 21.208 ( 6.163 -7.700 0.000) 9.863 23.148 ( -9.355 18.298 0.000) 20.550 23.541 ( -2.026 2.704 0.000) 3.379 25.184 ( 0.041 -20.186 0.000) 20.186 25.525 ( -2.392 -1.180 0.000) 2.667 25.696 ( -15.581 -12.595 0.000) 20.035 26.244 ( 5.133 -0.430 0.000) 5.151 27.098 ( 0.820 0.198 0.000) 0.844 27.544 ( -39.771 -37.485 0.000) 54.653 28.622 ( -7.986 -4.965 0.000) 9.403 30.861 ( -1.162 15.404 0.000) 15.447 31.427 ( -9.652 1.790 0.000) 9.817 33.277 ( -11.262 -16.781 0.000) 20.210 35.819 ( 30.938 17.115 0.000) 35.356 37.546 ( -5.626 -13.685 0.000) 14.797 43.334 ( 62.897 77.811 0.000) 100.053 ======================= Grid point 17 (11/343) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.830 ( 33.608 -57.013 0.000) 66.181 5.058 ( 58.357 -18.561 0.000) 61.238 6.447 ( 44.971 -47.311 0.000) 65.275 7.997 ( -18.128 -10.676 0.000) 21.039 9.836 ( 55.987 -14.403 0.000) 57.810 10.122 ( -4.925 -14.233 0.000) 15.061 12.136 ( -27.632 7.133 0.000) 28.537 12.680 ( 24.669 2.755 0.000) 24.822 15.097 ( -19.785 -14.600 0.000) 24.589 15.797 ( -3.361 2.127 0.000) 3.977 16.348 ( 14.187 19.409 0.000) 24.041 17.030 ( -13.618 4.157 0.000) 14.238 19.235 ( 9.368 34.333 0.000) 35.588 20.350 ( -16.098 -4.910 0.000) 16.830 21.432 ( 7.017 -9.857 0.000) 12.099 22.621 ( -12.079 27.149 0.000) 29.715 23.631 ( -1.935 -11.680 0.000) 11.839 25.288 ( -8.358 -1.280 0.000) 8.456 25.638 ( -1.404 -6.524 0.000) 6.674 25.802 ( -7.087 -16.631 0.000) 18.078 26.266 ( 5.140 3.401 0.000) 6.163 27.082 ( 0.633 2.711 0.000) 2.784 27.758 ( -22.910 -25.836 0.000) 34.531 28.612 ( -23.336 -13.867 0.000) 27.145 30.532 ( -1.915 21.951 0.000) 22.034 31.357 ( 2.591 2.152 0.000) 3.369 33.466 ( -11.019 -18.981 0.000) 21.948 35.778 ( 29.729 23.397 0.000) 37.832 37.724 ( -8.725 -15.728 0.000) 17.986 42.812 ( 49.171 53.704 0.000) 72.814 ======================= Grid point 18 (12/343) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.654 ( 47.446 4.276 0.000) 47.639 6.087 ( 29.477 -53.237 0.000) 60.853 7.590 ( 46.067 -20.447 0.000) 50.401 8.070 ( -20.159 -35.447 0.000) 40.778 10.250 ( -14.496 -12.135 0.000) 18.905 10.640 ( 41.609 -17.081 0.000) 44.979 11.731 ( -17.211 11.524 0.000) 20.713 12.732 ( 15.435 13.671 0.000) 20.619 15.055 ( -24.122 -4.526 0.000) 24.543 15.844 ( 0.736 -11.355 0.000) 11.379 16.291 ( 19.691 8.883 0.000) 21.602 16.779 ( -17.862 6.881 0.000) 19.141 18.761 ( 12.012 34.747 0.000) 36.764 20.283 ( -15.106 -5.526 0.000) 16.085 21.638 ( 6.074 -6.318 0.000) 8.764 22.100 ( -11.549 19.679 0.000) 22.817 23.851 ( -1.702 -16.709 0.000) 16.796 25.220 ( -6.436 -0.446 0.000) 6.452 25.566 ( -11.785 5.411 0.000) 12.967 26.062 ( 1.674 -13.720 0.000) 13.822 26.249 ( 4.594 3.616 0.000) 5.846 27.021 ( 0.105 4.949 0.000) 4.950 27.975 ( -9.786 -20.469 0.000) 22.688 28.664 ( -30.944 -24.658 0.000) 39.567 30.109 ( -1.933 26.226 0.000) 26.297 31.404 ( 16.501 3.751 0.000) 16.923 33.686 ( -11.454 -20.607 0.000) 23.576 35.634 ( 27.585 27.513 0.000) 38.960 37.887 ( -11.995 -15.937 0.000) 19.947 42.453 ( 33.186 39.428 0.000) 51.535 ======================= Grid point 19 (13/343) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.894 ( 33.442 13.338 0.000) 36.003 7.112 ( 22.306 -33.881 0.000) 40.564 7.811 ( 15.657 4.321 0.000) 16.242 8.949 ( 20.315 -42.885 0.000) 47.453 10.207 ( -19.016 -3.042 0.000) 19.258 10.902 ( -30.659 -10.215 0.000) 32.315 11.675 ( 31.259 5.182 0.000) 31.686 12.589 ( 11.786 18.058 0.000) 21.564 14.811 ( -29.800 -0.705 0.000) 29.808 16.148 ( 11.256 -11.139 0.000) 15.835 16.364 ( 24.944 9.948 0.000) 26.855 16.500 ( -32.493 -8.215 0.000) 33.515 18.337 ( 17.374 32.976 0.000) 37.273 20.250 ( -9.853 -6.088 0.000) 11.582 21.691 ( -1.636 5.894 0.000) 6.117 21.830 ( -4.623 -0.035 0.000) 4.623 24.149 ( -1.118 -20.687 0.000) 20.717 25.180 ( 1.969 5.399 0.000) 5.747 25.273 ( -18.690 7.552 0.000) 20.159 26.192 ( 3.285 1.380 0.000) 3.563 26.314 ( 3.455 -7.108 0.000) 7.903 26.927 ( -0.742 5.723 0.000) 5.771 28.268 ( -5.222 -23.785 0.000) 24.351 28.804 ( -28.867 -26.642 0.000) 39.282 29.638 ( -1.476 27.935 0.000) 27.974 31.546 ( 29.605 6.682 0.000) 30.349 33.921 ( -12.221 -21.555 0.000) 24.778 35.416 ( 25.074 29.554 0.000) 38.758 38.011 ( -14.980 -14.722 0.000) 21.003 42.125 ( 16.877 30.104 0.000) 34.512 ======================= Grid point 20 (14/343) ======================= q-point: (-0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.883 ( 21.245 20.125 0.000) 29.264 7.488 ( 15.494 5.169 0.000) 16.334 7.919 ( 0.965 5.706 0.000) 5.787 9.490 ( 11.116 1.150 0.000) 11.175 10.143 ( -7.814 -13.881 0.000) 15.929 10.859 ( -27.612 -21.862 0.000) 35.219 11.796 ( 15.566 10.719 0.000) 18.899 12.389 ( 9.295 16.435 0.000) 18.881 14.575 ( -29.973 -8.060 0.000) 31.038 15.997 ( -20.705 12.543 0.000) 24.208 16.469 ( 28.346 10.468 0.000) 30.217 16.764 ( -7.881 -36.067 0.000) 36.918 18.020 ( 22.368 28.280 0.000) 36.057 20.325 ( 0.085 -9.480 0.000) 9.481 21.582 ( -4.625 1.104 0.000) 4.755 21.812 ( -4.825 -0.053 0.000) 4.825 24.507 ( -0.822 -23.071 0.000) 23.085 24.841 ( -6.436 20.832 0.000) 21.804 25.241 ( -5.135 -7.274 0.000) 8.904 26.190 ( 3.684 2.277 0.000) 4.331 26.435 ( 2.527 -2.269 0.000) 3.396 26.835 ( -1.808 2.707 0.000) 3.255 28.643 ( -5.955 -26.420 0.000) 27.083 28.966 ( -21.293 -22.388 0.000) 30.897 29.170 ( -1.020 25.827 0.000) 25.847 31.757 ( 41.936 10.262 0.000) 43.173 34.160 ( -12.628 -21.904 0.000) 25.284 35.155 ( 22.862 29.804 0.000) 37.563 38.077 ( -17.695 -12.331 0.000) 21.567 41.770 ( -0.212 22.861 0.000) 22.862 ======================= Grid point 21 (15/343) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.648 ( 12.323 27.938 0.000) 30.535 7.349 ( -3.088 38.149 0.000) 38.274 7.486 ( -7.624 18.457 0.000) 19.970 9.275 ( -9.655 18.186 0.000) 20.589 10.526 ( 1.977 -19.406 0.000) 19.506 10.740 ( -14.145 11.543 0.000) 18.257 11.694 ( 3.295 8.840 0.000) 9.434 12.418 ( 19.717 -5.100 0.000) 20.366 14.525 ( -27.830 -20.561 0.000) 34.601 15.530 ( -34.478 8.658 0.000) 35.549 16.535 ( 23.855 14.825 0.000) 28.086 17.306 ( -1.193 -32.710 0.000) 32.732 17.855 ( 24.630 18.444 0.000) 30.770 20.558 ( 11.157 -10.280 0.000) 15.171 21.561 ( -4.869 -3.454 0.000) 5.970 21.739 ( -8.520 -1.095 0.000) 8.590 24.452 ( -4.127 18.962 0.000) 19.405 24.878 ( 0.175 -20.721 0.000) 20.722 25.352 ( -2.696 -10.751 0.000) 11.084 26.192 ( 2.500 1.156 0.000) 2.755 26.400 ( 0.470 8.179 0.000) 8.192 26.836 ( -1.214 -4.441 0.000) 4.604 28.685 ( -0.015 22.992 0.000) 22.992 29.001 ( -18.061 -21.069 0.000) 27.751 29.230 ( -2.338 -24.449 0.000) 24.561 32.025 ( 53.157 13.843 0.000) 54.930 34.398 ( -12.405 -21.386 0.000) 24.723 34.888 ( 22.727 28.574 0.000) 36.510 38.069 ( -20.549 -9.259 0.000) 22.539 41.351 ( -19.095 16.522 0.000) 25.251 ======================= Grid point 22 (16/343) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.183 ( 2.897 37.856 0.000) 37.967 6.340 ( -18.293 59.124 0.000) 61.889 7.086 ( -11.105 28.943 0.000) 31.000 8.814 ( -26.846 15.639 0.000) 31.069 10.026 ( 2.004 39.000 0.000) 39.052 10.906 ( 13.938 6.897 0.000) 15.551 11.669 ( -14.099 -13.381 0.000) 19.438 12.765 ( 28.078 -2.869 0.000) 28.224 14.724 ( -22.739 -33.041 0.000) 40.109 15.132 ( -33.302 -4.410 0.000) 33.593 16.403 ( 12.349 21.905 0.000) 25.146 17.714 ( 20.579 0.484 0.000) 20.584 17.975 ( 2.575 -20.754 0.000) 20.913 20.796 ( 15.609 -0.178 0.000) 15.610 21.502 ( -9.079 3.179 0.000) 9.620 21.852 ( -3.362 -21.940 0.000) 22.196 24.129 ( -1.603 16.736 0.000) 16.813 25.182 ( 3.082 -13.950 0.000) 14.286 25.533 ( -3.643 -13.670 0.000) 14.147 26.180 ( -1.441 7.240 0.000) 7.382 26.224 ( 0.119 6.227 0.000) 6.228 26.923 ( -0.234 -5.905 0.000) 5.909 28.319 ( 0.193 19.444 0.000) 19.445 29.142 ( -12.307 -14.722 0.000) 19.189 29.677 ( 0.116 -28.406 0.000) 28.406 32.325 ( 59.018 17.206 0.000) 61.475 34.622 ( -12.521 -19.561 0.000) 23.225 34.686 ( 31.420 25.696 0.000) 40.589 37.979 ( -24.508 -6.406 0.000) 25.331 40.832 ( -40.905 11.002 0.000) 42.358 ======================= Grid point 23 (17/343) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.420 ( -10.221 49.961 0.000) 50.996 5.114 ( -16.685 66.691 0.000) 68.746 6.238 ( -20.282 54.769 0.000) 58.404 8.272 ( -33.163 9.483 0.000) 34.493 9.605 ( 28.442 31.376 0.000) 42.349 10.707 ( 7.723 24.499 0.000) 25.688 11.690 ( -26.092 -8.139 0.000) 27.332 12.998 ( 21.795 3.897 0.000) 22.141 15.050 ( -16.207 -23.843 0.000) 28.830 15.213 ( -14.469 -37.827 0.000) 40.499 16.099 ( 5.027 23.290 0.000) 23.826 17.810 ( 21.304 9.671 0.000) 23.397 18.427 ( -6.264 -31.753 0.000) 32.365 20.870 ( 12.400 6.319 0.000) 13.917 21.334 ( -8.825 5.793 0.000) 10.556 22.319 ( 1.547 -32.308 0.000) 32.345 23.859 ( -0.577 14.609 0.000) 14.620 25.414 ( 6.301 -8.642 0.000) 10.695 25.690 ( -4.061 -8.312 0.000) 9.251 25.913 ( -4.912 15.195 0.000) 15.970 26.223 ( 0.740 -0.369 0.000) 0.826 27.009 ( -0.118 -4.336 0.000) 4.337 28.077 ( 0.346 9.118 0.000) 9.125 29.264 ( -4.024 -9.777 0.000) 10.573 30.143 ( -0.021 -26.980 0.000) 26.980 32.560 ( 48.774 20.051 0.000) 52.734 34.688 ( 42.462 14.432 0.000) 44.847 34.840 ( 6.787 -9.712 0.000) 11.848 37.799 ( -32.309 -5.339 0.000) 32.747 40.161 ( -66.135 7.504 0.000) 66.560 ======================= Grid point 24 (18/343) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.347 ( -18.578 60.307 0.000) 63.104 3.821 ( -11.235 71.857 0.000) 72.730 4.921 ( -17.529 78.533 0.000) 80.466 7.962 ( -15.277 -1.163 0.000) 15.321 9.400 ( 20.882 26.022 0.000) 33.365 10.343 ( 3.392 24.468 0.000) 24.702 11.465 ( -22.016 2.675 0.000) 22.178 13.084 ( 10.217 4.092 0.000) 11.006 15.382 ( -5.807 -27.378 0.000) 27.987 15.688 ( 8.223 6.611 0.000) 10.551 15.870 ( -9.468 -25.539 0.000) 27.238 17.830 ( 12.400 7.688 0.000) 14.590 18.871 ( -6.553 -29.086 0.000) 29.815 20.866 ( 8.154 5.790 0.000) 10.001 21.144 ( -6.244 8.103 0.000) 10.229 22.885 ( 1.933 -32.497 0.000) 32.554 23.631 ( -0.552 12.004 0.000) 12.017 25.512 ( 1.353 18.696 0.000) 18.744 25.597 ( 2.732 -0.717 0.000) 2.825 25.818 ( -5.937 -8.953 0.000) 10.743 26.214 ( 1.543 3.397 0.000) 3.731 27.059 ( -0.238 -1.903 0.000) 1.918 28.042 ( 0.977 -4.013 0.000) 4.130 29.390 ( 3.221 -5.930 0.000) 6.749 30.555 ( -0.117 -22.311 0.000) 22.312 32.584 ( 23.729 19.343 0.000) 30.614 34.929 ( 1.375 -11.127 0.000) 11.212 35.277 ( 105.430 14.483 0.000) 106.420 37.501 ( -56.699 -9.313 0.000) 57.458 39.253 ( -86.396 12.115 0.000) 87.241 ======================= Grid point 25 (19/343) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( 0.000 65.473 0.000) 65.473 2.530 ( 0.000 75.685 0.000) 75.685 3.380 ( 0.000 93.872 0.000) 93.872 7.975 ( -0.000 -7.924 0.000) 7.924 9.098 ( 0.000 22.285 0.000) 22.285 9.987 ( 0.000 19.751 0.000) 19.751 11.287 ( 0.000 4.008 0.000) 4.008 13.076 ( 0.000 2.620 0.000) 2.620 15.431 ( 0.000 15.998 0.000) 15.998 15.771 ( -0.000 -20.871 0.000) 20.871 16.434 ( -0.000 -33.513 0.000) 33.513 17.794 ( 0.000 4.617 0.000) 4.617 19.278 ( -0.000 -24.769 0.000) 24.769 20.837 ( 0.000 3.351 0.000) 3.351 20.944 ( 0.000 11.425 0.000) 11.425 23.417 ( -0.000 -29.980 0.000) 29.980 23.453 ( 0.000 8.753 0.000) 8.753 25.133 ( 0.000 23.912 0.000) 23.912 25.626 ( 0.000 0.654 0.000) 0.654 25.952 ( -0.000 -9.217 0.000) 9.217 26.136 ( 0.000 6.472 0.000) 6.472 27.071 ( 0.000 0.151 0.000) 0.151 28.190 ( -0.000 -11.058 0.000) 11.058 29.511 ( -0.000 -4.117 0.000) 4.117 30.868 ( -0.000 -15.086 0.000) 15.086 32.421 ( 0.000 13.599 0.000) 13.599 35.100 ( -0.000 -9.827 0.000) 9.827 36.342 ( -0.000 -3.087 0.000) 3.087 36.902 ( -0.000 -9.711 0.000) 9.711 38.258 ( 0.000 32.024 0.000) 32.024 ======================= Grid point 28 (20/343) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( 49.778 -0.000 0.000) 49.778 2.424 ( 57.515 -0.000 0.000) 57.515 4.899 ( 116.773 -0.000 0.000) 116.773 7.758 ( -20.415 0.000 0.000) 20.415 9.088 ( 35.000 -0.000 0.000) 35.000 9.758 ( 13.097 -0.000 0.000) 13.097 12.207 ( 24.312 -0.000 0.000) 24.312 12.540 ( -11.818 0.000 0.000) 11.818 14.787 ( -18.057 0.000 0.000) 18.057 16.011 ( -16.316 0.000 0.000) 16.316 17.072 ( 2.758 -0.000 0.000) 2.758 17.113 ( 0.713 -0.000 0.000) 0.713 20.141 ( 14.369 -0.000 0.000) 14.369 20.418 ( -16.860 0.000 0.000) 16.860 21.255 ( -6.009 0.000 0.000) 6.009 23.229 ( -3.454 0.000 0.000) 3.454 24.198 ( -7.307 0.000 0.000) 7.307 24.335 ( 0.506 -0.000 0.000) 0.506 25.192 ( -4.904 0.000 0.000) 4.904 25.783 ( -23.628 0.000 0.000) 23.628 25.806 ( 3.551 -0.000 0.000) 3.551 26.752 ( -9.401 0.000 0.000) 9.401 27.110 ( 1.790 -0.000 0.000) 1.790 28.678 ( 10.676 -0.000 0.000) 10.676 31.126 ( -0.541 0.000 0.000) 0.541 31.473 ( -10.398 0.000 0.000) 10.398 32.982 ( -1.652 0.000 0.000) 1.652 36.140 ( 35.407 -0.000 0.000) 35.407 37.290 ( -3.873 0.000 0.000) 3.873 45.348 ( -8.988 0.000 0.000) 8.988 ======================= Grid point 29 (21/343) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.229 ( 47.278 -32.133 0.000) 57.164 3.371 ( 40.833 -54.009 0.000) 67.708 5.962 ( 98.733 4.206 0.000) 98.823 7.683 ( -7.325 -8.186 0.000) 10.985 9.456 ( 26.656 -7.856 0.000) 27.789 9.960 ( 31.058 1.843 0.000) 31.113 12.193 ( -24.356 -1.492 0.000) 24.401 12.678 ( 31.498 -0.728 0.000) 31.507 14.658 ( -20.934 -7.728 0.000) 22.315 15.810 ( -24.830 -1.054 0.000) 24.852 16.981 ( 3.492 13.306 0.000) 13.757 17.151 ( 5.186 0.904 0.000) 5.264 20.168 ( 7.129 15.102 0.000) 16.700 20.250 ( -13.838 -0.557 0.000) 13.849 21.172 ( -0.672 -1.088 0.000) 1.278 23.200 ( -4.689 0.258 0.000) 4.696 23.742 ( -9.051 24.739 0.000) 26.342 24.765 ( -1.034 -30.221 0.000) 30.238 25.287 ( -9.244 -13.284 0.000) 16.184 25.480 ( -19.101 1.178 0.000) 19.137 26.052 ( -6.183 -21.382 0.000) 22.258 26.729 ( -13.221 -9.303 0.000) 16.167 27.127 ( 1.153 0.014 0.000) 1.153 28.720 ( 8.470 7.387 0.000) 11.239 31.044 ( -1.828 8.328 0.000) 8.527 31.395 ( -4.202 -0.497 0.000) 4.232 33.026 ( -2.187 -6.747 0.000) 7.093 36.397 ( 35.784 11.471 0.000) 37.577 37.313 ( -5.274 -7.399 0.000) 9.086 44.799 ( 7.127 49.849 0.000) 50.356 ======================= Grid point 30 (22/343) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.319 ( 39.234 -46.280 0.000) 60.672 4.814 ( 37.254 -69.272 0.000) 78.654 6.599 ( 56.167 9.410 0.000) 56.950 7.883 ( 18.733 -6.630 0.000) 19.872 9.797 ( 3.540 -12.510 0.000) 13.001 10.368 ( 56.864 -0.042 0.000) 56.864 11.930 ( -26.411 1.538 0.000) 26.456 12.983 ( 27.472 1.543 0.000) 27.515 14.633 ( -22.391 -14.471 0.000) 26.660 15.581 ( -30.002 -4.518 0.000) 30.340 16.775 ( 9.157 16.816 0.000) 19.148 17.129 ( 5.290 8.552 0.000) 10.056 19.847 ( 5.898 27.727 0.000) 28.347 20.123 ( -16.017 -2.028 0.000) 16.145 21.320 ( 5.537 -10.984 0.000) 12.300 22.926 ( -14.077 24.763 0.000) 28.484 23.456 ( -6.133 -3.465 0.000) 7.044 25.116 ( -10.731 -6.937 0.000) 12.778 25.325 ( -18.294 -23.839 0.000) 30.049 25.523 ( 1.832 -10.347 0.000) 10.508 26.297 ( -0.717 -9.235 0.000) 9.263 26.845 ( -24.971 -29.150 0.000) 38.383 27.125 ( 0.171 1.129 0.000) 1.141 28.595 ( 2.185 12.958 0.000) 13.141 30.821 ( -2.834 15.524 0.000) 15.780 31.436 ( 7.698 -2.634 0.000) 8.136 33.150 ( -3.066 -10.981 0.000) 11.401 36.468 ( 33.868 20.706 0.000) 39.697 37.406 ( -8.492 -11.208 0.000) 14.062 44.063 ( 18.160 51.780 0.000) 54.873 ======================= Grid point 31 (23/343) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.494 ( 33.188 -51.237 0.000) 61.046 6.216 ( 56.095 -30.856 0.000) 64.022 6.965 ( 7.346 -30.351 0.000) 31.227 8.158 ( 36.585 7.494 0.000) 37.345 9.946 ( -8.321 -9.187 0.000) 12.395 10.868 ( 26.957 2.799 0.000) 27.102 11.746 ( 4.129 -1.067 0.000) 4.265 13.108 ( 17.865 10.819 0.000) 20.885 14.647 ( -25.602 -12.382 0.000) 28.439 15.425 ( -29.953 -15.185 0.000) 33.582 16.659 ( 16.647 12.040 0.000) 20.544 16.964 ( 3.488 15.998 0.000) 16.374 19.426 ( 10.091 31.231 0.000) 32.821 20.033 ( -15.506 -6.124 0.000) 16.672 21.564 ( 6.445 -9.797 0.000) 11.727 22.312 ( -20.034 24.887 0.000) 31.949 23.569 ( -4.124 -13.627 0.000) 14.238 25.016 ( -21.152 -6.109 0.000) 22.017 25.491 ( -6.785 -5.925 0.000) 9.008 25.813 ( 4.684 -18.269 0.000) 18.860 26.349 ( 2.944 2.195 0.000) 3.672 27.087 ( -0.207 2.919 0.000) 2.927 27.184 ( -29.071 -40.562 0.000) 49.904 28.396 ( -2.962 8.279 0.000) 8.793 30.483 ( -2.928 21.409 0.000) 21.608 31.626 ( 20.563 -3.049 0.000) 20.788 33.323 ( -3.966 -13.855 0.000) 14.411 36.385 ( 30.938 27.249 0.000) 41.227 37.504 ( -13.308 -13.320 0.000) 18.829 43.438 ( 17.790 45.422 0.000) 48.782 ======================= Grid point 32 (24/343) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.547 ( 37.688 -8.221 0.000) 38.574 6.744 ( 39.576 -16.963 0.000) 43.058 7.874 ( 3.089 -38.249 0.000) 38.373 8.513 ( 44.361 -19.720 0.000) 48.547 9.943 ( -16.635 -5.087 0.000) 17.396 10.655 ( -25.540 13.817 0.000) 29.038 12.045 ( 33.413 0.397 0.000) 33.415 12.996 ( 9.523 17.609 0.000) 20.019 14.477 ( -29.925 -1.966 0.000) 29.990 15.571 ( -23.077 -32.154 0.000) 39.579 16.548 ( -2.905 17.526 0.000) 17.765 16.824 ( 26.454 10.754 0.000) 28.556 19.031 ( 14.250 30.281 0.000) 33.466 20.023 ( -10.645 -7.942 0.000) 13.281 21.741 ( 4.332 -3.639 0.000) 5.658 21.787 ( -20.421 11.889 0.000) 23.629 23.802 ( -3.153 -18.415 0.000) 18.683 24.932 ( -22.005 -8.838 0.000) 23.713 25.425 ( -1.013 8.161 0.000) 8.223 26.127 ( 4.699 -12.950 0.000) 13.776 26.329 ( 3.030 2.989 0.000) 4.257 27.010 ( -1.427 5.205 0.000) 5.398 27.586 ( -25.796 -39.353 0.000) 47.054 28.324 ( -5.522 -5.650 0.000) 7.900 30.065 ( -2.292 25.342 0.000) 25.446 31.925 ( 31.937 -1.484 0.000) 31.971 33.528 ( -4.527 -15.683 0.000) 16.323 36.181 ( 26.995 31.066 0.000) 41.156 37.581 ( -18.681 -14.584 0.000) 23.699 42.877 ( 11.862 40.297 0.000) 42.007 ======================= Grid point 33 (25/343) ======================= q-point: ( 0.54 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.600 ( 37.801 27.600 0.000) 46.804 7.617 ( 28.342 -24.710 0.000) 37.601 8.073 ( 14.288 9.636 0.000) 17.233 9.494 ( 17.074 -22.274 0.000) 28.066 9.913 ( 1.932 -17.891 0.000) 17.995 10.149 ( -41.383 -2.638 0.000) 41.467 12.168 ( 14.939 12.875 0.000) 19.721 12.724 ( -3.235 18.714 0.000) 18.992 14.235 ( -20.553 -0.492 0.000) 20.559 15.822 ( -33.819 -14.096 0.000) 36.639 16.270 ( 0.457 -3.979 0.000) 4.005 16.980 ( 34.690 10.595 0.000) 36.272 18.711 ( 19.616 27.986 0.000) 34.177 20.098 ( -6.524 -12.260 0.000) 13.888 21.501 ( -15.891 0.168 0.000) 15.892 21.795 ( 0.001 1.223 0.000) 1.223 24.114 ( -2.247 -22.158 0.000) 22.271 24.846 ( -20.880 -4.474 0.000) 21.354 25.261 ( 4.337 10.784 0.000) 11.623 26.270 ( 3.700 2.171 0.000) 4.290 26.382 ( 3.618 -7.124 0.000) 7.990 26.892 ( -2.831 6.145 0.000) 6.766 27.978 ( -22.264 -36.052 0.000) 42.373 28.470 ( -5.007 -17.309 0.000) 18.018 29.608 ( -1.480 27.139 0.000) 27.179 32.292 ( 41.550 0.893 0.000) 41.560 33.755 ( -4.154 -16.735 0.000) 17.243 35.899 ( 23.113 31.916 0.000) 39.406 37.614 ( -24.777 -14.802 0.000) 28.862 42.312 ( 3.482 37.194 0.000) 37.357 ======================= Grid point 34 (26/343) ======================= q-point: (-0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.436 ( 34.901 35.508 0.000) 49.788 7.842 ( 9.485 23.491 0.000) 25.334 7.905 ( 7.764 23.163 0.000) 24.429 9.351 ( -28.146 14.460 0.000) 31.643 9.977 ( -14.054 -31.603 0.000) 34.587 10.737 ( 21.560 -20.602 0.000) 29.821 12.001 ( 6.779 18.561 0.000) 19.761 12.457 ( -5.097 -2.537 0.000) 5.693 14.078 ( -16.381 -1.642 0.000) 16.463 15.379 ( -35.514 13.498 0.000) 37.993 16.684 ( -1.294 -33.448 0.000) 33.473 17.067 ( 25.996 16.337 0.000) 30.703 18.490 ( 24.755 24.938 0.000) 35.139 20.341 ( -0.252 -21.510 0.000) 21.511 21.428 ( -9.987 -5.276 0.000) 11.295 21.709 ( -4.774 5.713 0.000) 7.446 24.481 ( -1.647 -22.895 0.000) 22.954 24.648 ( -10.744 7.459 0.000) 13.079 25.214 ( 1.356 -1.424 0.000) 1.967 26.246 ( 1.453 2.829 0.000) 3.180 26.503 ( 4.288 0.003 0.000) 4.288 26.778 ( -3.893 1.577 0.000) 4.200 28.338 ( -19.032 -31.520 0.000) 36.820 28.777 ( -1.719 -22.689 0.000) 22.754 29.148 ( -1.100 26.031 0.000) 26.054 32.698 ( 47.783 3.599 0.000) 47.919 34.001 ( -2.664 -16.870 0.000) 17.079 35.600 ( 22.301 29.657 0.000) 37.106 37.576 ( -32.630 -14.129 0.000) 35.557 41.697 ( -5.760 35.752 0.000) 36.213 ======================= Grid point 35 (27/343) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.073 ( 28.555 47.285 0.000) 55.238 7.110 ( -12.007 50.475 0.000) 51.884 7.566 ( 5.997 31.823 0.000) 32.383 8.733 ( -39.025 16.533 0.000) 42.383 10.487 ( 3.035 -19.450 0.000) 19.685 10.881 ( 13.185 7.069 0.000) 14.960 11.693 ( -0.969 20.879 0.000) 20.902 12.876 ( 24.152 -24.952 0.000) 34.726 13.993 ( -24.703 -15.393 0.000) 29.106 14.838 ( -31.963 8.333 0.000) 33.032 16.905 ( 12.868 22.396 0.000) 25.830 17.265 ( -2.012 -34.517 0.000) 34.576 18.348 ( 21.765 20.454 0.000) 29.868 20.770 ( 8.785 -21.901 0.000) 23.597 21.439 ( -5.897 -2.204 0.000) 6.296 21.563 ( -8.467 -1.290 0.000) 8.564 24.368 ( -3.683 14.037 0.000) 14.512 24.888 ( 0.510 -23.153 0.000) 23.158 25.302 ( -1.789 -8.670 0.000) 8.852 26.211 ( -0.380 1.837 0.000) 1.876 26.413 ( 0.585 11.737 0.000) 11.752 26.813 ( -0.886 -6.639 0.000) 6.698 28.640 ( -9.467 -13.740 0.000) 16.685 28.712 ( -3.590 12.594 0.000) 13.095 29.207 ( -0.708 -27.319 0.000) 27.328 33.071 ( 44.429 7.888 0.000) 45.124 34.253 ( -1.814 -15.523 0.000) 15.628 35.414 ( 33.005 22.416 0.000) 39.897 37.429 ( -43.869 -12.859 0.000) 45.715 41.004 ( -13.944 36.075 0.000) 38.676 ======================= Grid point 36 (28/343) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.375 ( 11.037 60.346 0.000) 61.347 6.067 ( -8.104 61.467 0.000) 61.999 6.945 ( -3.906 44.518 0.000) 44.690 8.152 ( -25.172 11.851 0.000) 27.822 10.401 ( 22.102 31.257 0.000) 38.281 11.098 ( 3.392 -4.701 0.000) 5.797 11.330 ( -15.009 8.191 0.000) 17.098 13.296 ( 21.186 6.674 0.000) 22.213 14.299 ( -17.556 -48.465 0.000) 51.547 14.599 ( -16.448 -11.034 0.000) 19.806 16.574 ( 4.557 26.252 0.000) 26.645 17.816 ( -0.725 -32.734 0.000) 32.742 18.216 ( 10.585 14.860 0.000) 18.245 21.077 ( 12.695 0.822 0.000) 12.721 21.303 ( -10.732 3.153 0.000) 11.185 21.791 ( -2.120 -28.864 0.000) 28.941 24.103 ( -0.792 15.141 0.000) 15.162 25.254 ( 3.373 -17.978 0.000) 18.292 25.447 ( -3.802 -11.471 0.000) 12.085 26.147 ( -1.245 11.191 0.000) 11.260 26.221 ( -0.275 4.254 0.000) 4.263 26.921 ( 0.010 -6.187 0.000) 6.187 28.321 ( 0.008 19.318 0.000) 19.318 28.947 ( -5.691 -20.040 0.000) 20.833 29.674 ( -0.175 -28.778 0.000) 28.778 33.228 ( 24.502 15.790 0.000) 29.149 34.468 ( -3.491 -13.952 0.000) 14.382 35.612 ( 62.143 8.368 0.000) 62.704 37.119 ( -60.184 -10.449 0.000) 61.084 40.232 ( -16.296 38.398 0.000) 41.712 ======================= Grid point 37 (29/343) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.349 ( 0.000 65.804 0.000) 65.804 4.942 ( 0.000 68.442 0.000) 68.442 6.023 ( 0.000 62.618 0.000) 62.618 7.901 ( 0.000 4.263 0.000) 4.263 9.997 ( 0.000 31.116 0.000) 31.116 10.800 ( 0.000 27.408 0.000) 27.408 11.334 ( -0.000 -5.794 0.000) 5.794 13.239 ( 0.000 8.068 0.000) 8.068 14.866 ( -0.000 -27.634 0.000) 27.634 15.057 ( -0.000 -47.821 0.000) 47.821 16.156 ( 0.000 25.896 0.000) 25.896 18.046 ( 0.000 11.108 0.000) 11.108 18.345 ( -0.000 -30.878 0.000) 30.878 21.031 ( 0.000 8.726 0.000) 8.726 21.205 ( 0.000 3.300 0.000) 3.300 22.332 ( -0.000 -34.434 0.000) 34.434 23.852 ( 0.000 14.436 0.000) 14.436 25.520 ( -0.000 -9.738 0.000) 9.738 25.601 ( -0.000 -10.957 0.000) 10.957 25.864 ( 0.000 19.151 0.000) 19.151 26.227 ( -0.000 -1.650 0.000) 1.650 27.008 ( -0.000 -4.162 0.000) 4.162 28.080 ( 0.000 8.748 0.000) 8.748 29.210 ( -0.000 -14.571 0.000) 14.571 30.141 ( -0.000 -27.004 0.000) 27.004 33.032 ( 0.000 20.592 0.000) 20.592 34.681 ( -0.000 -14.217 0.000) 14.217 36.181 ( -0.000 -6.045 0.000) 6.045 36.693 ( -0.000 -3.448 0.000) 3.448 39.469 ( 0.000 39.965 0.000) 39.965 ======================= Grid point 42 (30/343) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.172 ( 27.255 -0.000 0.000) 27.255 3.482 ( 49.819 -0.000 0.000) 49.819 7.028 ( 98.265 -0.000 0.000) 98.265 7.578 ( 3.794 -0.000 0.000) 3.794 9.560 ( 13.555 -0.000 0.000) 13.555 10.434 ( 55.228 -0.000 0.000) 55.228 11.931 ( -26.325 0.000 0.000) 26.325 12.976 ( 30.311 -0.000 0.000) 30.311 14.372 ( -23.684 0.000 0.000) 23.684 15.499 ( -33.886 0.000 0.000) 33.886 17.123 ( 0.297 -0.000 0.000) 0.297 17.244 ( 12.806 -0.000 0.000) 12.806 20.041 ( -21.079 0.000 0.000) 21.079 20.445 ( 16.089 -0.000 0.000) 16.089 21.100 ( -9.805 0.000 0.000) 9.805 23.151 ( -4.365 0.000 0.000) 4.365 24.042 ( -7.939 0.000 0.000) 7.939 24.292 ( -7.738 0.000 0.000) 7.738 25.128 ( -2.137 0.000 0.000) 2.137 25.168 ( -34.584 0.000 0.000) 34.584 25.861 ( 2.333 -0.000 0.000) 2.333 26.636 ( -2.872 0.000 0.000) 2.872 27.141 ( 1.283 -0.000 0.000) 1.283 28.897 ( 11.060 -0.000 0.000) 11.060 31.094 ( -2.701 0.000 0.000) 2.701 31.335 ( -3.591 0.000 0.000) 3.591 32.970 ( 0.616 -0.000 0.000) 0.616 36.856 ( 36.278 -0.000 0.000) 36.278 37.201 ( -5.110 0.000 0.000) 5.110 45.141 ( -11.877 0.000 0.000) 11.877 ======================= Grid point 43 (31/343) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.875 ( 17.997 -52.322 0.000) 55.330 4.185 ( 41.783 -29.767 0.000) 51.302 7.426 ( 40.021 21.377 0.000) 45.373 8.090 ( 56.900 -11.077 0.000) 57.968 9.722 ( 9.948 -3.799 0.000) 10.648 10.995 ( 62.405 3.745 0.000) 62.517 11.689 ( -22.425 -1.422 0.000) 22.470 13.257 ( 25.273 0.086 0.000) 25.273 14.207 ( -24.106 -8.742 0.000) 25.642 15.169 ( -38.100 -3.078 0.000) 38.225 17.053 ( 3.276 8.245 0.000) 8.872 17.331 ( 11.181 5.486 0.000) 12.454 19.854 ( -19.739 -2.727 0.000) 19.926 20.370 ( 6.109 22.178 0.000) 23.004 21.151 ( -0.544 -13.618 0.000) 13.629 23.095 ( -6.337 5.071 0.000) 8.116 23.501 ( -15.938 25.169 0.000) 29.791 24.658 ( -19.062 -33.115 0.000) 38.210 24.893 ( -16.132 -3.764 0.000) 16.565 25.272 ( -3.280 -16.718 0.000) 17.037 25.974 ( -1.692 -11.776 0.000) 11.897 26.607 ( -1.872 0.739 0.000) 2.013 27.146 ( 0.651 0.678 0.000) 0.940 28.885 ( 7.841 13.011 0.000) 15.191 30.990 ( -3.481 8.447 0.000) 9.136 31.390 ( 2.915 -7.858 0.000) 8.382 33.020 ( 1.300 -4.485 0.000) 4.669 37.076 ( 28.379 11.443 0.000) 30.599 37.210 ( -0.905 -3.753 0.000) 3.861 44.784 ( -6.085 27.231 0.000) 27.902 ======================= Grid point 44 (32/343) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.993 ( 26.165 -50.908 0.000) 57.238 5.340 ( 20.137 -72.292 0.000) 75.044 7.450 ( 39.043 21.293 0.000) 44.472 8.686 ( 49.947 3.258 0.000) 50.053 9.824 ( 2.358 -0.480 0.000) 2.406 11.183 ( -0.590 14.937 0.000) 14.949 11.849 ( 40.504 -8.922 0.000) 41.475 13.422 ( 16.609 6.195 0.000) 17.727 14.186 ( -21.371 -14.489 0.000) 25.819 14.879 ( -38.053 -8.757 0.000) 39.048 16.977 ( 11.247 8.218 0.000) 13.929 17.252 ( 4.987 13.358 0.000) 14.258 19.773 ( -14.019 -7.265 0.000) 15.790 19.972 ( 1.428 26.585 0.000) 26.623 21.429 ( 5.377 -14.250 0.000) 15.230 22.560 ( -23.729 31.652 0.000) 39.559 23.325 ( -6.647 -9.059 0.000) 11.236 24.643 ( -28.342 -9.127 0.000) 29.776 25.184 ( -1.494 -23.211 0.000) 23.259 25.568 ( 1.888 -18.827 0.000) 18.921 26.196 ( -7.655 -19.324 0.000) 20.785 26.590 ( -3.682 -3.253 0.000) 4.914 27.127 ( -0.336 2.001 0.000) 2.029 28.654 ( 3.207 19.288 0.000) 19.553 30.757 ( -3.378 15.220 0.000) 15.590 31.649 ( 12.434 -13.440 0.000) 18.310 33.137 ( 1.483 -7.844 0.000) 7.983 37.095 ( 25.820 18.098 0.000) 31.531 37.233 ( -5.550 -2.461 0.000) 6.071 44.219 ( 0.633 36.018 0.000) 36.024 ======================= Grid point 45 (33/343) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.095 ( 26.853 -50.730 0.000) 57.399 6.796 ( 6.137 -79.304 0.000) 79.541 7.517 ( 49.588 19.074 0.000) 53.130 8.973 ( 36.888 12.694 0.000) 39.011 9.786 ( -7.469 1.952 0.000) 7.720 10.796 ( -10.159 22.091 0.000) 24.315 12.333 ( 27.834 -1.930 0.000) 27.901 13.349 ( 5.715 15.793 0.000) 16.795 14.193 ( -14.183 -6.085 0.000) 15.433 14.820 ( -28.555 -25.882 0.000) 38.539 16.858 ( -0.086 20.844 0.000) 20.845 17.175 ( 21.150 2.247 0.000) 21.269 19.524 ( -7.795 19.032 0.000) 20.567 19.853 ( 4.097 -3.516 0.000) 5.399 21.682 ( 5.428 -8.985 0.000) 10.498 21.823 ( -29.339 22.923 0.000) 37.232 23.481 ( -4.495 -15.401 0.000) 16.044 24.546 ( -23.114 -9.716 0.000) 25.073 25.437 ( 0.106 -7.528 0.000) 7.528 25.917 ( 5.507 -17.878 0.000) 18.707 26.365 ( -2.222 -4.524 0.000) 5.041 26.738 ( -15.398 -27.555 0.000) 31.565 27.071 ( -1.449 3.609 0.000) 3.889 28.385 ( 0.694 13.142 0.000) 13.160 30.427 ( -2.562 20.773 0.000) 20.930 32.052 ( 20.642 -14.693 0.000) 25.337 33.306 ( 2.170 -10.320 0.000) 10.545 36.949 ( 25.466 29.486 0.000) 38.960 37.219 ( -14.994 -8.094 0.000) 17.039 43.617 ( 2.747 38.433 0.000) 38.531 ======================= Grid point 46 (34/343) ======================= q-point: ( 0.54 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.160 ( 26.855 -38.459 0.000) 46.907 7.437 ( 27.931 2.418 0.000) 28.035 8.273 ( 34.345 -32.296 0.000) 47.145 9.089 ( 5.737 -10.897 0.000) 12.315 9.603 ( -16.928 6.049 0.000) 17.977 10.322 ( 1.763 25.366 0.000) 25.427 12.379 ( -7.966 6.209 0.000) 10.100 13.027 ( -2.061 23.859 0.000) 23.948 14.166 ( 1.719 1.483 0.000) 2.271 15.097 ( -23.430 -32.770 0.000) 40.285 16.428 ( -7.594 21.197 0.000) 22.516 17.453 ( 35.669 3.172 0.000) 35.810 19.205 ( -0.540 12.706 0.000) 12.717 19.925 ( 2.891 0.976 0.000) 3.051 21.305 ( -27.105 3.695 0.000) 27.356 21.816 ( 3.003 -1.722 0.000) 3.462 23.737 ( -3.152 -19.741 0.000) 19.991 24.511 ( -18.239 -10.246 0.000) 20.920 25.457 ( 2.966 5.899 0.000) 6.602 26.232 ( 5.633 -12.754 0.000) 13.942 26.361 ( 0.194 2.086 0.000) 2.095 26.961 ( -3.610 4.134 0.000) 5.488 27.144 ( -17.306 -35.959 0.000) 39.907 28.287 ( -0.144 -1.806 0.000) 1.812 30.026 ( -1.577 24.691 0.000) 24.741 32.520 ( 25.485 -13.813 0.000) 28.988 33.524 ( 4.677 -12.035 0.000) 12.912 36.646 ( 19.102 32.242 0.000) 37.476 37.188 ( -19.769 -8.151 0.000) 21.384 42.990 ( 1.401 39.722 0.000) 39.747 ======================= Grid point 47 (35/343) ======================= q-point: (-0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.372 ( 40.635 27.231 0.000) 48.916 8.128 ( 20.315 -19.271 0.000) 28.002 8.426 ( 20.668 27.632 0.000) 34.507 9.243 ( -26.313 10.356 0.000) 28.278 9.340 ( -35.917 -17.314 0.000) 39.872 10.517 ( 37.509 -34.117 0.000) 50.704 12.107 ( -24.640 2.242 0.000) 24.741 12.573 ( -1.260 27.353 0.000) 27.382 14.125 ( 4.859 8.723 0.000) 9.985 15.194 ( -27.847 -2.481 0.000) 27.958 16.248 ( -1.781 -11.977 0.000) 12.108 17.610 ( 26.206 17.276 0.000) 31.388 19.100 ( 20.835 15.861 0.000) 26.185 19.926 ( -13.261 -13.682 0.000) 19.054 21.178 ( -14.069 -10.321 0.000) 17.449 21.795 ( -0.099 5.805 0.000) 5.805 24.071 ( -1.842 -23.237 0.000) 23.310 24.514 ( -11.983 -7.162 0.000) 13.960 25.343 ( 3.517 10.074 0.000) 10.670 26.309 ( 0.368 3.461 0.000) 3.481 26.464 ( 4.417 -8.822 0.000) 9.866 26.825 ( -3.474 7.268 0.000) 8.056 27.601 ( -13.988 -36.486 0.000) 39.075 28.436 ( -0.277 -15.566 0.000) 15.568 29.585 ( -0.825 26.742 0.000) 26.755 32.986 ( 23.908 -12.159 0.000) 26.822 33.800 ( 9.692 -12.484 0.000) 15.804 36.292 ( 16.630 30.069 0.000) 34.361 37.087 ( -26.931 -6.795 0.000) 27.775 42.319 ( -1.357 41.136 0.000) 41.159 ======================= Grid point 48 (36/343) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.195 ( 38.392 44.397 0.000) 58.695 7.770 ( -9.067 40.614 0.000) 41.614 8.210 ( 10.284 33.342 0.000) 34.892 8.652 ( -32.022 17.819 0.000) 36.646 9.748 ( -6.916 -50.646 0.000) 51.116 11.295 ( 25.252 5.428 0.000) 25.829 12.088 ( 2.203 12.670 0.000) 12.860 12.207 ( -15.727 -37.902 0.000) 41.035 13.957 ( 1.028 14.777 0.000) 14.813 14.785 ( -20.143 15.316 0.000) 25.304 16.665 ( -0.579 -33.187 0.000) 33.192 17.417 ( 8.963 24.352 0.000) 25.949 18.923 ( 15.459 26.659 0.000) 30.817 20.272 ( -5.298 -36.098 0.000) 36.484 21.278 ( -3.817 -10.385 0.000) 11.064 21.637 ( -2.187 11.099 0.000) 11.312 24.455 ( -0.592 -14.850 0.000) 14.861 24.490 ( -4.628 -8.114 0.000) 9.341 25.248 ( 1.288 2.833 0.000) 3.112 26.251 ( -0.309 3.276 0.000) 3.291 26.592 ( 4.296 4.866 0.000) 6.491 26.696 ( -4.038 -2.604 0.000) 4.805 28.069 ( -7.249 -32.189 0.000) 32.995 28.767 ( -0.020 -23.584 0.000) 23.584 29.131 ( -0.464 26.736 0.000) 26.740 33.360 ( 15.001 -8.754 0.000) 17.368 34.097 ( 9.818 -9.680 0.000) 13.787 36.045 ( 22.885 20.144 0.000) 30.488 36.877 ( -33.671 -3.831 0.000) 33.889 41.599 ( -3.097 42.636 0.000) 42.748 ======================= Grid point 49 (37/343) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.490 ( 0.000 61.701 0.000) 61.701 6.960 ( 0.000 50.173 0.000) 50.173 7.629 ( 0.000 39.430 0.000) 39.430 8.221 ( 0.000 13.450 0.000) 13.450 10.535 ( -0.000 -43.230 0.000) 43.230 11.040 ( 0.000 28.244 0.000) 28.244 11.687 ( 0.000 25.237 0.000) 25.237 13.208 ( -0.000 -63.892 0.000) 63.892 13.671 ( 0.000 17.506 0.000) 17.506 14.474 ( 0.000 6.626 0.000) 6.626 17.034 ( 0.000 25.969 0.000) 25.969 17.240 ( -0.000 -35.160 0.000) 35.160 18.584 ( 0.000 22.007 0.000) 22.007 20.855 ( -0.000 -32.018 0.000) 32.018 21.412 ( 0.000 13.235 0.000) 13.235 21.436 ( -0.000 -12.069 0.000) 12.069 24.329 ( 0.000 11.954 0.000) 11.954 24.892 ( -0.000 -25.165 0.000) 25.165 25.286 ( -0.000 -6.207 0.000) 6.207 26.202 ( 0.000 2.278 0.000) 2.278 26.418 ( 0.000 13.225 0.000) 13.225 26.805 ( -0.000 -7.697 0.000) 7.697 28.521 ( -0.000 -25.572 0.000) 25.572 28.699 ( 0.000 23.748 0.000) 23.748 29.199 ( -0.000 -27.777 0.000) 27.777 33.510 ( 0.000 2.416 0.000) 2.416 34.275 ( -0.000 -8.049 0.000) 8.049 36.062 ( 0.000 2.422 0.000) 2.422 36.647 ( 0.000 0.415 0.000) 0.415 40.862 ( 0.000 43.232 0.000) 43.232 ======================= Grid point 56 (38/343) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.503 ( 8.608 -0.000 0.000) 8.608 4.358 ( 38.916 -0.000 0.000) 38.916 7.882 ( 24.331 -0.000 0.000) 24.331 8.653 ( 63.804 -0.000 0.000) 63.804 9.857 ( 21.224 -0.000 0.000) 21.224 11.448 ( -20.798 0.000 0.000) 20.798 11.687 ( 67.876 -0.000 0.000) 67.876 13.478 ( 19.244 -0.000 0.000) 19.244 13.895 ( -23.196 0.000 0.000) 23.196 14.762 ( -38.889 0.000 0.000) 38.889 17.120 ( -0.740 0.000 0.000) 0.740 17.509 ( 13.031 -0.000 0.000) 13.031 19.621 ( -20.601 0.000 0.000) 20.601 20.752 ( 14.649 -0.000 0.000) 14.649 20.857 ( -15.724 0.000 0.000) 15.724 23.060 ( -4.828 0.000 0.000) 4.828 23.828 ( -38.953 0.000 0.000) 38.953 23.908 ( -5.438 0.000 0.000) 5.438 24.725 ( -8.228 0.000 0.000) 8.228 25.089 ( -2.059 0.000 0.000) 2.059 25.907 ( 2.466 -0.000 0.000) 2.466 26.612 ( -0.132 0.000 0.000) 0.132 27.158 ( 0.362 -0.000 0.000) 0.362 29.094 ( 8.656 -0.000 0.000) 8.656 31.028 ( -3.726 0.000 0.000) 3.726 31.318 ( 1.195 -0.000 0.000) 1.195 33.005 ( 2.751 -0.000 0.000) 2.751 37.097 ( -5.298 0.000 0.000) 5.298 37.525 ( 31.156 -0.000 0.000) 31.156 44.897 ( -12.503 0.000 0.000) 12.503 ======================= Grid point 57 (39/343) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.074 ( 5.086 -56.430 0.000) 56.659 4.912 ( 31.278 -24.326 0.000) 39.624 8.055 ( 29.977 9.449 0.000) 31.431 9.169 ( 39.377 -0.497 0.000) 39.380 10.030 ( 24.410 9.662 0.000) 26.253 11.264 ( -10.341 3.358 0.000) 10.873 12.294 ( 53.977 2.519 0.000) 54.035 13.617 ( 9.356 0.699 0.000) 9.382 13.787 ( -14.910 -10.247 0.000) 18.092 14.425 ( -32.526 -2.845 0.000) 32.650 17.110 ( 2.569 -0.035 0.000) 2.569 17.526 ( 7.664 11.645 0.000) 13.941 19.502 ( -14.713 -7.484 0.000) 16.507 20.358 ( -8.813 23.902 0.000) 25.475 21.178 ( 3.339 -20.317 0.000) 20.590 22.872 ( -20.573 28.067 0.000) 34.800 23.166 ( -12.778 3.160 0.000) 13.163 24.164 ( -19.958 -18.727 0.000) 27.368 24.820 ( 0.320 -17.152 0.000) 17.155 25.220 ( -2.599 -17.339 0.000) 17.533 25.971 ( 1.058 -5.025 0.000) 5.135 26.599 ( 0.358 1.606 0.000) 1.646 27.149 ( -0.373 1.128 0.000) 1.189 29.017 ( 5.501 16.885 0.000) 17.759 30.919 ( -3.394 8.239 0.000) 8.910 31.476 ( 5.050 -15.079 0.000) 15.902 33.067 ( 3.178 -3.832 0.000) 4.978 37.061 ( -5.969 -1.855 0.000) 6.251 37.701 ( 26.545 12.922 0.000) 29.523 44.624 ( -9.008 18.005 0.000) 20.133 ======================= Grid point 58 (40/343) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.279 ( 6.783 -75.029 0.000) 75.335 5.765 ( 20.997 -47.979 0.000) 52.373 8.183 ( 31.928 11.255 0.000) 33.854 9.444 ( 21.967 3.981 0.000) 22.325 9.967 ( 13.992 19.793 0.000) 24.240 11.107 ( 6.404 14.491 0.000) 15.843 12.534 ( 6.258 6.271 0.000) 8.859 13.640 ( 11.170 10.033 0.000) 15.015 13.915 ( -10.052 -18.976 0.000) 21.474 14.280 ( -12.687 -8.001 0.000) 14.999 17.206 ( 8.919 10.652 0.000) 13.893 17.308 ( 4.389 3.451 0.000) 5.583 19.502 ( -13.376 -0.340 0.000) 13.380 19.969 ( -2.382 7.871 0.000) 8.224 21.513 ( 2.229 -15.665 0.000) 15.822 22.042 ( -25.391 35.534 0.000) 43.674 23.213 ( -4.516 -11.194 0.000) 12.071 24.188 ( -16.814 -9.163 0.000) 19.148 25.182 ( 0.786 -21.453 0.000) 21.467 25.575 ( -1.282 -26.419 0.000) 26.450 26.087 ( -2.807 -10.049 0.000) 10.434 26.572 ( 0.311 1.640 0.000) 1.669 27.111 ( -1.186 2.664 0.000) 2.916 28.709 ( 2.267 22.239 0.000) 22.354 30.699 ( -2.392 14.739 0.000) 14.931 31.875 ( 9.651 -22.631 0.000) 24.603 33.194 ( 3.832 -7.419 0.000) 8.350 37.025 ( -8.529 -1.872 0.000) 8.732 37.627 ( 21.044 23.582 0.000) 31.606 44.169 ( -4.302 28.224 0.000) 28.550 ======================= Grid point 59 (41/343) ======================= q-point: ( 0.54 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.503 ( 14.091 -58.741 0.000) 60.407 6.939 ( 8.755 -71.447 0.000) 71.981 8.326 ( 25.941 4.802 0.000) 26.381 9.433 ( 11.144 17.963 0.000) 21.139 9.706 ( 2.563 19.536 0.000) 19.703 10.871 ( 16.658 28.056 0.000) 32.629 12.283 ( -27.696 6.243 0.000) 28.390 13.452 ( 6.745 22.587 0.000) 23.573 14.189 ( 1.681 -15.828 0.000) 15.917 14.407 ( -7.224 -17.373 0.000) 18.815 16.773 ( -5.672 27.637 0.000) 28.213 17.711 ( 31.561 -14.747 0.000) 34.836 19.168 ( -24.513 9.547 0.000) 26.307 20.098 ( 15.800 -5.326 0.000) 16.673 21.221 ( -29.331 24.928 0.000) 38.493 21.771 ( 3.306 -7.552 0.000) 8.244 23.406 ( -2.858 -16.199 0.000) 16.449 24.193 ( -12.147 -9.200 0.000) 15.238 25.461 ( 1.734 -9.223 0.000) 9.385 26.014 ( 3.897 -22.239 0.000) 22.578 26.254 ( -7.041 -15.094 0.000) 16.655 26.581 ( -2.600 -6.731 0.000) 7.215 27.037 ( -1.688 4.422 0.000) 4.733 28.401 ( 0.756 14.504 0.000) 14.524 30.388 ( -1.323 20.295 0.000) 20.338 32.371 ( 10.974 -23.656 0.000) 26.078 33.393 ( 5.640 -11.147 0.000) 12.492 36.944 ( -11.214 0.122 0.000) 11.215 37.356 ( 14.647 29.153 0.000) 32.626 43.616 ( -1.541 34.727 0.000) 34.761 ======================= Grid point 60 (42/343) ======================= q-point: ( 0.62 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.559 ( 11.714 -52.105 0.000) 53.406 7.972 ( 28.021 -21.348 0.000) 35.227 8.569 ( -20.278 -26.796 0.000) 33.604 9.118 ( 13.659 29.642 0.000) 32.637 9.369 ( -4.135 21.530 0.000) 21.923 10.583 ( 12.738 14.537 0.000) 19.329 11.925 ( -22.472 5.109 0.000) 23.045 13.063 ( 2.415 28.451 0.000) 28.554 14.327 ( 8.604 5.364 0.000) 10.139 14.715 ( -13.337 -27.571 0.000) 30.627 16.304 ( -3.813 19.202 0.000) 19.577 18.141 ( 29.891 12.692 0.000) 32.474 18.984 ( -17.631 -24.217 0.000) 29.955 20.101 ( 10.444 30.008 0.000) 31.774 20.819 ( -18.328 -12.964 0.000) 22.449 21.857 ( 1.084 0.163 0.000) 1.096 23.690 ( -1.331 -20.351 0.000) 20.395 24.265 ( -6.375 -10.351 0.000) 12.156 25.510 ( 1.752 4.777 0.000) 5.088 26.325 ( 2.933 -11.235 0.000) 11.611 26.348 ( -0.790 -1.121 0.000) 1.371 26.861 ( -4.874 -21.026 0.000) 21.583 26.954 ( -3.047 -6.186 0.000) 6.896 28.290 ( 0.194 -1.144 0.000) 1.161 30.006 ( -0.520 24.385 0.000) 24.390 32.838 ( 7.076 -20.984 0.000) 22.145 33.676 ( 7.240 -14.728 0.000) 16.412 36.799 ( -5.814 6.993 0.000) 9.094 36.980 ( 2.827 25.246 0.000) 25.404 42.988 ( -0.626 39.457 0.000) 39.462 ======================= Grid point 61 (43/343) ======================= q-point: (-0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.112 ( 0.000 14.293 0.000) 14.293 8.131 ( 0.000 20.387 0.000) 20.387 8.751 ( 0.000 25.687 0.000) 25.687 8.831 ( -0.000 -46.445 0.000) 46.445 8.899 ( 0.000 29.863 0.000) 29.863 11.022 ( -0.000 -53.657 0.000) 53.657 11.679 ( 0.000 10.600 0.000) 10.600 12.587 ( 0.000 29.446 0.000) 29.446 14.217 ( 0.000 12.385 0.000) 12.385 14.874 ( 0.000 2.268 0.000) 2.268 16.227 ( -0.000 -14.424 0.000) 14.424 17.886 ( 0.000 25.727 0.000) 25.727 19.534 ( 0.000 35.040 0.000) 35.040 19.561 ( -0.000 -41.616 0.000) 41.616 21.034 ( -0.000 -16.199 0.000) 16.199 21.793 ( 0.000 7.551 0.000) 7.551 24.052 ( -0.000 -23.696 0.000) 23.696 24.394 ( -0.000 -7.942 0.000) 7.942 25.380 ( 0.000 10.039 0.000) 10.039 26.307 ( 0.000 3.338 0.000) 3.338 26.517 ( -0.000 -9.647 0.000) 9.647 26.784 ( 0.000 8.694 0.000) 8.694 27.461 ( -0.000 -36.180 0.000) 36.180 28.435 ( -0.000 -15.341 0.000) 15.341 29.577 ( 0.000 26.648 0.000) 26.648 33.191 ( -0.000 -16.999 0.000) 16.999 33.970 ( -0.000 -13.863 0.000) 13.863 36.534 ( 0.000 25.077 0.000) 25.077 36.707 ( 0.000 2.987 0.000) 2.987 42.300 ( 0.000 42.480 0.000) 42.480 ======================= Grid point 70 (44/343) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.599 ( 2.773 -0.000 0.000) 2.773 4.988 ( 24.737 -0.000 0.000) 24.737 8.379 ( 22.435 -0.000 0.000) 22.435 9.449 ( 21.648 -0.000 0.000) 21.648 10.475 ( 37.036 -0.000 0.000) 37.036 11.194 ( -3.539 0.000 0.000) 3.539 12.764 ( 23.813 -0.000 0.000) 23.813 13.555 ( -19.324 0.000 0.000) 19.324 13.694 ( 17.870 -0.000 0.000) 17.870 14.197 ( -9.059 0.000 0.000) 9.059 17.087 ( -2.852 0.000 0.000) 2.852 17.726 ( 8.691 -0.000 0.000) 8.691 19.291 ( -11.275 0.000 0.000) 11.275 20.448 ( -26.424 0.000 0.000) 26.424 21.002 ( 10.382 -0.000 0.000) 10.382 22.931 ( -14.227 0.000 0.000) 14.227 23.097 ( -23.561 0.000 0.000) 23.561 23.831 ( -2.538 0.000 0.000) 2.538 24.669 ( -0.283 0.000 0.000) 0.283 25.046 ( -2.222 0.000 0.000) 2.222 25.957 ( 2.542 -0.000 0.000) 2.542 26.617 ( 0.475 -0.000 0.000) 0.475 27.154 ( -0.647 0.000 0.000) 0.647 29.233 ( 5.496 -0.000 0.000) 5.496 30.958 ( -3.133 0.000 0.000) 3.133 31.359 ( 2.408 -0.000 0.000) 2.408 33.066 ( 3.046 -0.000 0.000) 3.046 37.002 ( -4.083 0.000 0.000) 4.083 38.048 ( 21.366 -0.000 0.000) 21.366 44.671 ( -9.878 0.000 0.000) 9.878 ======================= Grid point 71 (45/343) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.141 ( 2.319 -57.735 0.000) 57.782 5.386 ( 16.557 -23.058 0.000) 28.387 8.532 ( 16.288 3.746 0.000) 16.713 9.612 ( 11.369 0.347 0.000) 11.374 10.564 ( 23.158 23.621 0.000) 33.079 11.304 ( 14.320 -4.786 0.000) 15.098 12.668 ( -14.236 14.716 0.000) 20.475 13.421 ( -23.690 -14.914 0.000) 27.994 13.961 ( 24.678 7.108 0.000) 25.681 14.223 ( 11.666 -4.339 0.000) 12.447 17.151 ( 1.476 -11.428 0.000) 11.523 17.623 ( 2.731 19.041 0.000) 19.236 19.337 ( -0.662 -10.435 0.000) 10.456 20.013 ( -24.741 13.606 0.000) 28.235 21.255 ( 3.580 -16.191 0.000) 16.582 22.419 ( -18.854 31.782 0.000) 36.954 23.031 ( -3.433 -5.747 0.000) 6.695 23.920 ( -6.561 -8.982 0.000) 11.123 24.835 ( 0.880 -18.411 0.000) 18.432 25.170 ( -2.197 -16.901 0.000) 17.043 26.001 ( 1.575 -2.485 0.000) 2.942 26.608 ( 0.471 1.531 0.000) 1.602 27.135 ( -0.887 1.449 0.000) 1.699 29.100 ( 2.923 19.287 0.000) 19.507 30.865 ( -2.004 7.740 0.000) 7.995 31.563 ( 3.353 -19.760 0.000) 20.043 33.128 ( 2.623 -4.223 0.000) 4.971 36.962 ( -3.799 0.636 0.000) 3.852 38.115 ( 14.887 13.186 0.000) 19.887 44.467 ( -6.238 14.211 0.000) 15.520 ======================= Grid point 72 (46/343) ======================= q-point: ( 0.54 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.364 ( 2.303 -80.782 0.000) 80.815 6.062 ( 8.060 -43.615 0.000) 44.353 8.583 ( 8.794 4.983 0.000) 10.108 9.640 ( 3.104 5.202 0.000) 6.058 10.278 ( 12.524 29.776 0.000) 32.303 11.482 ( 28.201 12.744 0.000) 30.946 12.127 ( -34.046 16.035 0.000) 37.633 13.625 ( -10.598 -28.363 0.000) 30.278 13.864 ( 5.907 18.161 0.000) 19.098 14.430 ( 12.000 -0.606 0.000) 12.015 17.211 ( -1.917 28.304 0.000) 28.369 17.547 ( 11.497 -27.408 0.000) 29.722 19.250 ( -10.229 20.575 0.000) 22.978 19.903 ( -2.766 -21.346 0.000) 21.525 21.460 ( -5.759 5.607 0.000) 8.038 21.751 ( -3.846 19.633 0.000) 20.006 23.152 ( -1.583 -11.494 0.000) 11.602 23.980 ( -4.994 -6.490 0.000) 8.189 25.201 ( 0.760 -21.548 0.000) 21.561 25.539 ( -1.526 -28.812 0.000) 28.852 26.068 ( 0.025 -4.795 0.000) 4.795 26.580 ( 0.260 2.169 0.000) 2.185 27.089 ( -0.742 3.121 0.000) 3.208 28.740 ( 0.826 23.552 0.000) 23.566 30.667 ( -0.814 14.369 0.000) 14.392 32.006 ( 3.415 -27.268 0.000) 27.481 33.260 ( 2.132 -8.918 0.000) 9.169 36.900 ( -3.536 2.408 0.000) 4.278 37.915 ( 7.662 23.660 0.000) 24.870 44.096 ( -2.274 25.107 0.000) 25.209 ======================= Grid point 73 (47/343) ======================= q-point: (-0.38 -0.62 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.643 ( -0.000 -65.009 0.000) 65.009 7.046 ( -0.000 -71.612 0.000) 71.612 8.528 ( 0.000 7.076 0.000) 7.076 9.501 ( 0.000 13.307 0.000) 13.307 9.841 ( 0.000 30.259 0.000) 30.259 11.155 ( 0.000 39.725 0.000) 39.725 11.835 ( -0.000 -1.287 0.000) 1.287 13.527 ( 0.000 24.984 0.000) 24.984 14.105 ( -0.000 -34.063 0.000) 34.063 14.458 ( 0.000 3.262 0.000) 3.262 16.708 ( 0.000 29.256 0.000) 29.256 18.200 ( -0.000 -38.655 0.000) 38.655 18.757 ( 0.000 26.613 0.000) 26.613 20.327 ( -0.000 -25.468 0.000) 25.468 20.849 ( 0.000 41.759 0.000) 41.759 21.804 ( -0.000 -7.074 0.000) 7.074 23.377 ( -0.000 -16.357 0.000) 16.357 24.074 ( -0.000 -8.477 0.000) 8.477 25.482 ( -0.000 -9.944 0.000) 9.944 26.055 ( -0.000 -31.205 0.000) 31.205 26.174 ( -0.000 -8.738 0.000) 8.738 26.563 ( -0.000 -2.064 0.000) 2.064 27.018 ( 0.000 4.840 0.000) 4.840 28.409 ( 0.000 14.842 0.000) 14.842 30.375 ( 0.000 20.125 0.000) 20.125 32.476 ( -0.000 -26.008 0.000) 26.008 33.462 ( -0.000 -13.681 0.000) 13.681 36.825 ( 0.000 3.709 0.000) 3.709 37.503 ( 0.000 29.535 0.000) 29.535 43.595 ( 0.000 33.632 0.000) 33.632 ======================= Grid point 85 (48/343) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.637 ( 1.089 -0.000 0.000) 1.089 5.315 ( 8.438 -0.000 0.000) 8.438 8.670 ( 6.902 -0.000 0.000) 6.902 9.706 ( 6.282 -0.000 0.000) 6.282 11.050 ( 17.171 -0.000 0.000) 17.171 11.283 ( 8.130 -0.000 0.000) 8.130 12.723 ( -8.388 0.000 0.000) 8.388 13.027 ( -21.246 0.000 0.000) 21.246 14.214 ( 2.718 -0.000 0.000) 2.718 14.359 ( 26.662 -0.000 0.000) 26.662 17.017 ( -3.140 0.000 0.000) 3.140 17.841 ( 2.953 -0.000 0.000) 2.953 19.237 ( 5.150 -0.000 0.000) 5.150 19.893 ( -24.359 0.000 0.000) 24.359 21.144 ( 3.780 -0.000 0.000) 3.780 22.568 ( -10.978 0.000 0.000) 10.978 22.958 ( -1.751 0.000 0.000) 1.751 23.801 ( -0.641 0.000 0.000) 0.641 24.672 ( 0.200 -0.000 0.000) 0.200 25.012 ( -1.017 0.000 0.000) 1.017 25.997 ( 1.175 -0.000 0.000) 1.175 26.625 ( 0.237 -0.000 0.000) 0.237 27.140 ( -0.538 0.000 0.000) 0.538 29.307 ( 1.990 -0.000 0.000) 1.990 30.913 ( -1.279 0.000 0.000) 1.279 31.396 ( 1.093 -0.000 0.000) 1.093 33.111 ( 1.315 -0.000 0.000) 1.315 36.945 ( -1.548 0.000 0.000) 1.548 38.338 ( 7.683 -0.000 0.000) 7.683 44.532 ( -3.821 0.000 0.000) 3.821 ======================= Grid point 86 (49/343) ======================= q-point: (-0.46 -0.54 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.165 ( -0.000 -58.258 0.000) 58.258 5.550 ( -0.000 -22.891 0.000) 22.891 8.683 ( 0.000 2.376 0.000) 2.376 9.719 ( 0.000 2.194 0.000) 2.194 10.812 ( 0.000 26.097 0.000) 26.097 11.561 ( -0.000 -14.982 0.000) 14.982 12.377 ( 0.000 27.778 0.000) 27.778 13.155 ( -0.000 -20.836 0.000) 20.836 14.137 ( 0.000 10.517 0.000) 10.517 14.500 ( -0.000 -0.225 0.000) 0.225 17.164 ( -0.000 -18.897 0.000) 18.897 17.650 ( 0.000 21.807 0.000) 21.807 19.478 ( -0.000 -21.104 0.000) 21.104 19.579 ( 0.000 19.085 0.000) 19.085 21.293 ( -0.000 -13.152 0.000) 13.152 22.233 ( 0.000 29.741 0.000) 29.741 22.999 ( -0.000 -5.940 0.000) 5.940 23.861 ( -0.000 -5.586 0.000) 5.586 24.845 ( -0.000 -18.809 0.000) 18.809 25.146 ( -0.000 -16.439 0.000) 16.439 26.018 ( -0.000 -1.907 0.000) 1.907 26.613 ( 0.000 1.479 0.000) 1.479 27.124 ( 0.000 1.564 0.000) 1.564 29.129 ( 0.000 20.156 0.000) 20.156 30.845 ( 0.000 7.421 0.000) 7.421 31.597 ( -0.000 -21.297 0.000) 21.297 33.156 ( -0.000 -4.591 0.000) 4.591 36.923 ( 0.000 1.729 0.000) 1.729 38.264 ( 0.000 13.210 0.000) 13.210 44.403 ( 0.000 13.170 0.000) 13.170 ======================= Grid point 173 (50/343) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.290 ( 0.000 0.000 63.982) 63.982 1.511 ( 0.000 0.000 74.214) 74.214 2.533 ( 0.000 0.000 122.922) 122.922 8.218 ( 0.000 0.000 -2.679) 2.679 8.507 ( 0.000 0.000 -4.885) 4.885 9.706 ( 0.000 0.000 0.902) 0.902 11.047 ( 0.000 0.000 -15.652) 15.652 13.012 ( 0.000 0.000 -1.748) 1.748 15.510 ( 0.000 0.000 3.079) 3.079 16.204 ( 0.000 0.000 7.118) 7.118 16.862 ( 0.000 0.000 -17.291) 17.291 17.274 ( 0.000 0.000 5.289) 5.289 19.484 ( 0.000 0.000 -29.486) 29.486 20.567 ( 0.000 0.000 -5.675) 5.675 20.796 ( 0.000 0.000 -6.417) 6.417 23.523 ( 0.000 0.000 5.220) 5.220 24.411 ( 0.000 0.000 9.163) 9.163 24.611 ( 0.000 0.000 23.887) 23.887 25.426 ( 0.000 0.000 -5.939) 5.939 25.456 ( 0.000 0.000 -12.120) 12.120 25.909 ( 0.000 0.000 -7.849) 7.849 26.662 ( 0.000 0.000 -36.119) 36.119 28.620 ( 0.000 0.000 17.277) 17.277 29.710 ( 0.000 0.000 14.315) 14.315 31.379 ( 0.000 0.000 22.963) 22.963 33.106 ( 0.000 0.000 6.891) 6.891 33.534 ( 0.000 0.000 -3.589) 3.589 37.369 ( 0.000 0.000 -0.037) 0.037 37.398 ( 0.000 0.000 -0.655) 0.655 37.769 ( 0.000 0.000 -4.860) 4.860 ======================= Grid point 174 (51/343) ======================= q-point: ( 0.08 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( 50.916 -33.972 43.461) 75.070 2.150 ( 28.311 -46.576 52.489) 75.670 3.090 ( 22.506 -52.051 94.623) 110.315 8.146 ( 7.705 9.305 -2.783) 12.397 8.619 ( -13.302 -17.232 -5.826) 22.535 9.774 ( -1.573 -9.954 3.155) 10.559 11.178 ( 20.798 -3.282 -14.836) 25.758 12.989 ( -7.267 -1.276 -1.476) 7.524 15.357 ( -8.966 0.862 9.496) 13.088 16.113 ( 1.397 11.441 5.278) 12.677 16.723 ( 1.751 17.199 -15.395) 23.149 17.476 ( -10.623 -17.172 -2.523) 20.349 19.446 ( 7.148 8.280 -24.341) 26.686 20.576 ( -5.018 -2.902 -12.151) 13.463 20.842 ( 11.377 3.469 -6.332) 13.475 23.466 ( -2.956 0.425 8.935) 9.421 24.067 ( -0.212 27.186 15.458) 31.274 24.876 ( 0.820 -17.614 10.929) 20.745 25.451 ( -4.256 -3.698 -13.192) 14.347 25.654 ( 1.137 -12.026 -18.294) 21.922 25.976 ( -1.724 -8.722 -4.112) 9.796 26.676 ( 0.846 -1.016 -35.301) 35.326 28.546 ( -1.306 8.676 18.849) 20.791 29.483 ( -42.530 -11.410 30.058) 53.315 31.323 ( 0.219 6.562 23.691) 24.584 32.511 ( -35.389 11.676 27.340) 46.219 33.766 ( -64.951 -43.814 -10.140) 79.001 35.766 ( -69.354 2.833 29.230) 75.315 37.444 ( -0.376 -8.266 0.420) 8.285 39.980 ( 248.817 62.881 -64.207) 264.550 ======================= Grid point 175 (52/343) ======================= q-point: ( 0.15 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.123 ( 47.785 -40.738 27.304) 68.473 3.291 ( 33.068 -51.743 36.577) 71.475 4.448 ( 36.880 -67.976 54.918) 94.852 8.143 ( 11.188 0.825 -2.652) 11.527 8.767 ( -13.336 -16.694 -4.770) 21.892 9.989 ( -3.113 -17.792 3.140) 18.333 11.535 ( 33.302 -5.969 -12.725) 36.147 12.908 ( -14.578 -1.895 -0.089) 14.701 15.358 ( -11.804 -10.927 3.784) 16.524 15.873 ( 5.690 20.202 -0.025) 20.988 16.382 ( 5.207 25.839 -8.588) 27.722 17.556 ( -17.551 -10.467 2.557) 20.595 19.314 ( 10.690 19.327 -13.570) 25.922 20.578 ( -8.903 -6.008 -13.254) 17.059 20.894 ( 6.481 -0.077 -12.823) 14.368 23.417 ( -7.688 9.800 9.376) 15.590 23.644 ( 2.452 14.816 11.214) 18.743 25.129 ( -0.414 -11.671 -4.717) 12.595 25.451 ( -3.795 -1.311 -12.052) 12.704 25.784 ( 4.470 -1.848 -15.374) 16.117 26.139 ( -3.189 -13.084 5.016) 14.371 26.701 ( 0.707 -0.650 -33.398) 33.412 28.360 ( -4.449 7.732 22.317) 24.034 29.383 ( -28.573 -15.751 24.748) 40.951 31.159 ( -0.966 12.962 25.407) 28.539 32.113 ( -44.987 -7.331 14.989) 47.982 33.783 ( -46.248 -27.908 -2.952) 54.097 35.416 ( 0.284 9.575 8.812) 13.016 37.622 ( 0.196 -12.525 0.747) 12.549 40.812 ( 147.851 57.927 -34.767) 162.555 ======================= Grid point 176 (53/343) ======================= q-point: ( 0.23 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.177 ( 42.597 -30.560 16.109) 54.844 4.496 ( 29.189 -56.104 25.233) 68.091 5.883 ( 35.013 -58.378 33.178) 75.727 8.320 ( -1.833 -13.417 -3.985) 14.116 8.999 ( 13.335 -16.546 0.052) 21.251 10.278 ( -6.139 -21.664 3.046) 22.722 11.930 ( 29.442 -0.193 -10.539) 31.272 12.775 ( -18.924 -2.757 3.359) 19.417 15.362 ( -7.042 3.639 -5.529) 9.665 15.670 ( 5.898 7.597 -0.433) 9.628 16.043 ( 10.869 21.002 -1.197) 23.678 17.505 ( -23.002 -7.606 5.721) 24.893 19.011 ( 8.827 27.901 -4.034) 29.541 20.590 ( -10.836 -6.382 -7.216) 14.499 20.996 ( 5.258 -5.452 -24.999) 26.121 22.922 ( -7.472 30.996 10.978) 33.721 23.689 ( 0.165 -9.321 4.348) 10.286 25.212 ( -5.523 -1.478 -17.510) 18.420 25.466 ( -0.962 -3.895 -10.014) 10.788 25.835 ( 9.191 3.173 -13.860) 16.931 26.309 ( -3.576 -9.910 10.874) 15.141 26.702 ( 0.477 1.346 -30.826) 30.859 28.261 ( -2.275 -0.867 24.262) 24.384 29.381 ( -19.358 -11.593 19.272) 29.674 30.871 ( -2.676 19.343 27.599) 33.809 31.819 ( -45.701 -10.718 7.045) 47.467 33.850 ( -26.853 -23.621 1.437) 35.792 35.295 ( 14.809 15.611 2.925) 21.715 37.842 ( -0.111 -13.332 1.310) 13.397 41.167 ( 94.530 39.944 -19.848) 104.525 ======================= Grid point 177 (54/343) ======================= q-point: ( 0.31 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.944 ( 30.352 -18.824 9.759) 37.025 5.699 ( 27.642 -53.953 14.988) 62.447 6.974 ( 28.489 -32.769 17.856) 46.950 8.496 ( -20.445 -24.146 -4.315) 31.932 9.681 ( 46.524 -26.873 4.821) 53.944 10.553 ( -11.060 -20.526 4.157) 23.684 11.979 ( 3.455 14.419 -7.058) 16.421 12.674 ( -9.269 -1.286 8.283) 12.497 15.204 ( 8.091 13.181 -9.414) 18.106 15.584 ( 12.061 11.905 0.672) 16.960 16.020 ( 3.506 -6.440 -0.646) 7.360 17.369 ( -28.892 -7.255 7.017) 30.604 18.592 ( 7.729 31.280 2.102) 32.289 20.565 ( -13.425 -4.660 -3.142) 14.554 21.163 ( 5.999 -7.192 -30.683) 32.081 22.346 ( -6.161 28.524 7.457) 30.120 23.885 ( -0.257 -14.031 1.725) 14.139 25.129 ( -4.884 3.748 -16.977) 18.059 25.498 ( -0.976 0.850 -12.988) 13.053 25.875 ( 9.361 2.678 -15.478) 18.285 26.366 ( -4.469 -1.845 8.142) 9.469 26.664 ( 0.359 3.590 -27.976) 28.208 28.362 ( -0.756 -12.904 27.162) 30.081 29.386 ( -12.563 -8.070 16.220) 22.046 30.479 ( -4.137 23.285 29.571) 37.865 31.583 ( -36.177 -9.580 3.949) 37.631 34.029 ( -18.193 -23.867 3.523) 30.216 35.163 ( 18.226 20.042 2.149) 27.175 38.047 ( -0.557 -11.448 1.926) 11.622 41.377 ( 60.428 25.890 -13.781) 67.169 ======================= Grid point 178 (55/343) ======================= q-point: ( 0.38 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.418 ( 18.322 -10.276 6.375) 21.953 6.767 ( 21.909 -41.370 5.049) 47.085 7.499 ( 14.092 -9.810 7.819) 18.867 8.833 ( -6.863 -30.888 -3.114) 31.794 10.472 ( 15.255 -9.249 -0.878) 17.861 10.833 ( 13.765 -26.446 11.696) 32.026 11.662 ( -11.896 12.249 0.452) 17.081 12.562 ( -2.896 8.318 11.949) 14.844 15.044 ( 7.713 14.972 -3.219) 17.147 15.681 ( 24.070 -1.208 -7.907) 25.364 16.142 ( -5.168 -6.364 -0.163) 8.200 17.209 ( -31.387 -10.122 5.087) 33.369 18.161 ( 9.000 29.046 8.850) 31.670 20.476 ( -13.366 -0.718 -2.683) 13.652 21.329 ( 5.285 -5.497 -27.919) 28.942 21.910 ( -2.597 17.525 0.414) 17.721 24.147 ( 0.289 -17.496 -0.858) 17.519 25.005 ( -1.392 7.945 -14.180) 16.314 25.402 ( -2.142 8.026 -9.827) 12.868 25.923 ( 5.807 0.953 -18.489) 19.403 26.320 ( -4.792 0.395 -0.370) 4.822 26.599 ( 0.190 4.136 -25.600) 25.933 28.651 ( -0.289 -21.539 29.256) 36.331 29.403 ( -4.722 -3.991 14.670) 15.920 30.035 ( -5.221 24.050 31.599) 40.052 31.431 ( -22.032 -6.473 2.834) 23.138 34.265 ( -16.056 -24.357 4.149) 29.466 34.986 ( 18.433 22.720 3.066) 29.417 38.202 ( -0.648 -7.678 2.409) 8.074 41.501 ( 34.127 14.795 -11.257) 38.862 ======================= Grid point 179 (56/343) ======================= q-point: ( 0.46 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.655 ( 6.444 -3.506 5.012) 8.885 7.274 ( 3.519 -5.836 -3.725) 7.767 7.861 ( 10.571 -16.336 7.601) 20.890 9.190 ( -0.616 -11.351 -9.902) 15.075 10.425 ( -4.555 4.992 7.030) 9.752 11.275 ( 3.814 0.731 -2.103) 4.416 11.641 ( 3.714 -17.168 18.880) 25.787 12.372 ( -0.502 10.163 12.033) 15.758 14.915 ( 3.858 6.393 -1.276) 7.575 15.944 ( 13.666 -2.678 -11.829) 18.272 16.132 ( -4.781 -1.264 2.107) 5.376 17.102 ( -18.037 -6.297 -1.661) 19.177 17.867 ( 6.291 13.453 17.753) 23.146 20.364 ( -5.901 1.021 -3.095) 6.741 21.430 ( 2.220 -1.915 -18.598) 18.827 21.716 ( -0.410 4.852 -11.146) 12.164 24.463 ( 0.649 -18.949 -5.259) 19.676 24.805 ( 0.249 15.707 -7.261) 17.306 25.260 ( -1.971 4.120 -8.044) 9.250 25.947 ( 1.671 0.459 -19.064) 19.143 26.289 ( -1.881 -0.565 -9.488) 9.689 26.545 ( 0.081 2.014 -23.174) 23.261 29.033 ( -0.923 -23.152 27.689) 36.105 29.395 ( 4.545 7.807 17.863) 20.018 29.622 ( -6.852 14.278 31.489) 35.247 31.361 ( -7.294 -2.282 2.370) 8.002 34.507 ( -14.946 -22.180 3.306) 26.950 34.779 ( 16.025 21.762 4.868) 27.460 38.284 ( -0.283 -2.702 2.667) 3.807 41.559 ( 11.073 4.853 -10.314) 15.892 ======================= Grid point 187 (57/343) ======================= q-point: ( 0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.984 ( 40.744 -0.000 56.608) 69.747 2.443 ( 59.078 -0.000 59.534) 83.872 3.092 ( 75.979 -0.000 76.264) 107.653 8.190 ( -26.622 0.000 -6.248) 27.346 8.456 ( 23.865 -0.000 -1.942) 23.944 9.684 ( 0.130 -0.000 2.592) 2.595 11.410 ( 31.549 -0.000 -14.163) 34.582 12.879 ( -12.760 0.000 -0.597) 12.773 15.239 ( -18.415 0.000 10.281) 21.091 16.206 ( -1.301 0.000 5.759) 5.904 16.895 ( 1.994 -0.000 -18.395) 18.503 17.199 ( -6.172 0.000 5.782) 8.457 19.570 ( 8.340 -0.000 -29.947) 31.087 20.493 ( -9.062 0.000 -12.912) 15.775 21.070 ( 14.622 -0.000 -13.753) 20.073 23.439 ( -6.435 0.000 8.693) 10.815 24.430 ( 1.534 -0.000 9.544) 9.666 24.584 ( -3.043 0.000 24.161) 24.352 25.263 ( -8.321 0.000 -6.846) 10.775 25.590 ( 6.027 -0.000 -11.017) 12.558 25.862 ( -5.559 0.000 -8.464) 10.126 26.684 ( 2.061 -0.000 -35.438) 35.498 28.599 ( -71.322 0.000 85.281) 111.174 28.670 ( 4.911 -0.000 15.526) 16.284 31.387 ( 0.605 -0.000 23.243) 23.251 32.056 ( -53.655 0.000 27.464) 60.275 33.086 ( -1.703 0.000 6.855) 7.064 35.599 ( 7.785 -0.000 5.719) 9.660 37.357 ( -1.250 0.000 0.791) 1.479 42.867 ( 151.766 -0.000 -149.516) 213.045 ======================= Grid point 188 (58/343) ======================= q-point: ( 0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( 41.755 -38.575 41.872) 70.603 3.206 ( 48.273 -30.022 57.585) 80.918 4.207 ( 88.504 -24.839 39.639) 100.106 7.978 ( -24.645 -6.358 -6.998) 26.396 8.758 ( 32.546 -2.169 -0.636) 32.624 9.764 ( 1.601 -7.658 2.365) 8.173 11.779 ( 33.870 -4.661 -13.572) 36.784 12.739 ( -15.913 -0.141 1.448) 15.979 15.088 ( -17.143 -4.643 6.835) 19.030 16.115 ( -3.988 6.850 3.598) 8.705 16.769 ( 2.540 15.616 -15.766) 22.336 17.240 ( -9.549 -8.622 4.383) 13.592 19.633 ( 10.612 5.999 -27.362) 29.955 20.403 ( -12.074 -2.893 -13.235) 18.147 21.055 ( 6.817 9.887 -8.026) 14.444 23.375 ( -5.658 -0.508 7.998) 9.810 24.043 ( -2.753 27.024 15.832) 31.441 24.890 ( -0.031 -18.442 8.694) 20.388 25.324 ( -7.158 -10.367 -12.186) 17.528 25.655 ( -2.542 -6.217 -6.484) 9.336 25.920 ( -3.688 -11.491 -8.735) 14.898 26.705 ( 1.921 0.044 -34.321) 34.375 28.170 ( -44.614 -14.579 61.357) 77.251 28.770 ( -5.129 -8.066 20.175) 22.324 31.315 ( -1.850 8.108 21.936) 23.460 31.689 ( -26.946 -0.646 10.770) 29.026 33.181 ( -8.056 -13.001 5.902) 16.394 35.713 ( 24.399 7.788 -2.048) 25.694 37.415 ( -2.318 -8.539 1.662) 9.002 43.245 ( 91.417 68.650 -81.031) 140.129 ======================= Grid point 189 (59/343) ======================= q-point: ( 0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.910 ( 38.406 -48.453 32.809) 69.994 4.275 ( 53.799 -33.241 30.636) 70.270 5.471 ( 62.846 -36.194 28.507) 77.925 7.915 ( -20.820 -12.016 -7.280) 25.117 9.201 ( 47.158 -5.555 2.517) 47.550 9.943 ( -0.866 -12.785 2.346) 13.028 12.138 ( 14.951 -3.712 -14.335) 21.043 12.612 ( -4.056 -0.318 6.118) 7.348 15.056 ( -18.527 -11.773 2.376) 22.080 15.935 ( -3.439 9.165 0.478) 9.801 16.489 ( 5.525 20.889 -11.681) 24.563 17.233 ( -11.605 -2.726 5.539) 13.145 19.506 ( 7.743 20.154 -16.326) 27.069 20.374 ( -11.371 -6.471 -9.495) 16.165 21.000 ( 4.033 1.286 -15.995) 16.545 23.249 ( -9.431 14.677 8.857) 19.566 23.646 ( -2.406 9.596 10.212) 14.218 25.084 ( -4.871 -7.223 -9.645) 12.997 25.388 ( -2.231 -4.571 -11.110) 12.219 25.812 ( -3.123 -14.266 1.281) 14.660 26.084 ( -1.602 -10.224 -3.356) 10.879 26.717 ( 0.840 0.196 -32.884) 32.895 28.083 ( -28.478 -16.350 41.230) 52.709 28.813 ( -17.442 -10.545 19.491) 28.201 31.095 ( -5.594 13.346 18.147) 23.211 31.496 ( -11.758 1.564 8.786) 14.761 33.338 ( -9.209 -16.151 6.052) 19.552 35.780 ( 28.295 15.643 -3.681) 32.540 37.571 ( -4.459 -13.470 2.489) 14.405 42.903 ( 68.739 61.894 -38.404) 100.154 ======================= Grid point 190 (60/343) ======================= q-point: ( 0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.082 ( 38.533 -43.003 21.855) 61.738 5.223 ( 52.167 -18.810 15.679) 57.628 6.653 ( 39.057 -46.585 20.975) 64.309 7.930 ( -17.466 -11.693 -6.170) 21.905 9.891 ( 57.324 -14.405 5.225) 59.337 10.149 ( -5.685 -15.320 3.013) 16.616 12.054 ( -20.295 5.553 -6.681) 22.076 12.737 ( 19.729 1.464 4.226) 20.230 15.084 ( -19.175 -12.598 -1.231) 22.976 15.780 ( -2.832 5.090 -2.827) 6.474 16.256 ( 11.846 15.091 -6.857) 20.374 17.102 ( -14.042 3.216 6.592) 15.842 19.167 ( 6.922 27.527 -6.615) 29.145 20.353 ( -12.732 -4.936 -1.511) 13.738 21.098 ( 5.044 -6.549 -29.189) 30.337 22.729 ( -12.272 28.489 9.465) 32.431 23.670 ( -2.207 -9.794 3.916) 10.777 25.073 ( -9.178 -1.800 -16.587) 19.042 25.455 ( -0.501 -3.790 -10.350) 11.034 25.975 ( 3.497 -3.942 -8.578) 10.068 26.219 ( -4.158 -8.703 8.930) 13.145 26.710 ( 0.238 1.436 -30.462) 30.497 28.130 ( -15.302 -15.109 30.874) 37.625 28.812 ( -28.317 -17.850 19.866) 38.925 30.775 ( -5.317 18.599 19.025) 27.132 31.409 ( 1.564 2.683 6.787) 7.464 33.537 ( -8.882 -18.409 7.019) 21.611 35.746 ( 28.156 21.681 -3.034) 35.666 37.755 ( -7.590 -15.383 3.159) 17.443 42.581 ( 50.377 47.422 -21.752) 72.525 ======================= Grid point 191 (61/343) ======================= q-point: ( 0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.714 ( 45.570 5.409 5.452) 46.213 6.269 ( 29.958 -47.604 17.403) 58.877 7.623 ( 32.158 -9.720 1.080) 33.612 8.105 ( -7.786 -41.387 5.388) 42.456 10.290 ( -12.697 -12.575 4.017) 18.316 10.698 ( 38.854 -18.388 5.867) 43.384 11.717 ( -14.107 10.085 -0.573) 17.351 12.805 ( 14.839 10.918 6.524) 19.544 15.036 ( -22.548 -4.258 -1.761) 23.014 15.762 ( 0.757 -6.552 -8.618) 10.853 16.246 ( 17.189 5.122 -2.417) 18.098 16.863 ( -18.622 5.452 7.092) 20.659 18.772 ( 10.902 29.538 0.792) 31.496 20.299 ( -12.919 -4.081 0.725) 13.568 21.270 ( 4.732 -7.204 -32.488) 33.612 22.172 ( -11.893 22.375 4.986) 25.825 23.863 ( -1.997 -15.401 1.057) 15.566 25.007 ( -8.877 -1.439 -17.106) 19.326 25.457 ( -2.821 2.788 -7.731) 8.690 26.024 ( 4.233 1.899 -15.813) 16.479 26.268 ( -3.240 -2.087 6.888) 7.893 26.669 ( -0.019 3.649 -27.858) 28.095 28.296 ( -8.891 -19.490 27.725) 35.036 28.882 ( -29.463 -24.740 21.155) 43.905 30.379 ( -4.467 22.904 22.120) 32.153 31.436 ( 15.064 4.023 4.181) 16.143 33.767 ( -9.311 -19.718 7.795) 23.158 35.618 ( 26.470 25.756 -1.498) 36.964 37.922 ( -11.058 -15.479 3.516) 19.345 42.298 ( 33.460 36.662 -14.867) 51.814 ======================= Grid point 192 (62/343) ======================= q-point: ( 0.46 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.936 ( 32.253 12.910 3.941) 34.963 7.192 ( 22.701 -25.186 7.142) 34.651 7.789 ( 13.275 -2.427 -1.282) 13.556 8.930 ( 19.491 -31.979 -1.580) 37.484 10.286 ( -17.304 -4.929 6.792) 19.231 11.005 ( -25.721 -14.293 10.174) 31.135 11.681 ( 26.975 3.845 1.868) 27.312 12.706 ( 12.814 16.111 10.693) 23.197 14.807 ( -27.946 -0.739 -0.388) 27.959 15.970 ( 3.050 -9.795 -15.962) 18.975 16.329 ( 18.689 8.458 1.411) 20.563 16.637 ( -20.849 -7.445 7.360) 23.330 18.425 ( 17.377 28.474 8.294) 34.373 20.256 ( -8.568 -4.521 -0.494) 9.700 21.399 ( 1.428 -3.967 -26.695) 27.025 21.796 ( -8.893 10.057 -3.896) 13.979 24.135 ( -1.466 -19.137 -1.796) 19.277 24.940 ( -7.585 0.921 -16.740) 18.401 25.300 ( -5.811 9.160 -1.367) 10.933 26.011 ( 2.338 3.070 -18.538) 18.936 26.272 ( 1.175 -0.699 -3.815) 4.053 26.599 ( -0.296 4.107 -25.532) 25.862 28.590 ( -9.122 -25.457 26.122) 37.598 29.043 ( -22.501 -24.897 23.630) 41.043 29.938 ( -3.616 25.136 25.074) 35.687 31.561 ( 27.729 6.536 2.102) 28.567 34.004 ( -10.074 -20.201 7.950) 23.932 35.418 ( 24.180 27.918 0.296) 36.935 38.046 ( -14.340 -14.222 3.492) 20.497 42.005 ( 17.062 28.826 -11.703) 35.482 ======================= Grid point 193 (63/343) ======================= q-point: (-0.46 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.928 ( 20.996 19.330 4.351) 28.869 7.437 ( 12.692 8.618 -4.505) 15.989 7.999 ( 3.902 2.299 7.619) 8.863 9.354 ( 14.780 -0.156 -10.613) 18.197 10.194 ( -17.652 -9.886 4.413) 20.707 11.083 ( -15.877 -19.410 18.876) 31.387 11.772 ( 7.316 8.509 0.172) 11.223 12.550 ( 12.393 14.807 14.329) 24.045 14.589 ( -28.100 -7.632 1.187) 29.142 15.865 ( -22.539 8.544 -12.709) 27.249 16.417 ( 25.968 7.567 -1.626) 27.097 16.830 ( -5.322 -27.561 3.248) 28.257 18.173 ( 21.772 24.862 14.564) 36.114 20.320 ( 1.061 -8.383 -2.042) 8.694 21.417 ( -4.057 -0.139 -16.461) 16.955 21.649 ( -5.705 0.190 -14.177) 15.283 24.453 ( -1.365 -19.551 -6.614) 20.685 24.760 ( -6.319 12.305 -6.719) 15.378 25.165 ( -5.086 -1.620 -6.263) 8.229 25.977 ( 1.383 3.226 -20.394) 20.694 26.314 ( 3.490 -0.989 -9.909) 10.552 26.541 ( -0.686 1.870 -22.564) 22.652 28.911 ( -15.049 -25.674 19.165) 35.397 29.277 ( -10.151 -23.277 31.142) 40.183 29.485 ( -2.542 25.079 27.069) 36.988 31.758 ( 39.561 9.599 0.556) 40.713 34.238 ( -10.460 -19.892 7.251) 23.616 35.175 ( 22.101 28.247 2.078) 35.926 38.108 ( -17.350 -11.852 3.149) 21.247 41.666 ( 0.186 22.388 -10.106) 24.564 ======================= Grid point 194 (64/343) ======================= q-point: (-0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.712 ( 13.091 26.804 6.133) 30.454 7.195 ( -7.943 29.124 -7.108) 31.013 7.720 ( -0.014 23.121 15.074) 27.601 9.237 ( -4.719 17.453 -3.733) 18.461 10.349 ( -8.191 -11.824 -7.795) 16.361 11.044 ( -9.990 8.086 20.086) 23.846 11.639 ( 1.606 7.208 -3.274) 8.078 12.610 ( 19.984 -2.961 16.916) 26.349 14.538 ( -26.614 -19.039 0.778) 32.732 15.432 ( -34.367 6.450 -8.752) 36.046 16.489 ( 22.172 13.945 -3.303) 26.400 17.304 ( 2.041 -28.618 -0.636) 28.698 18.039 ( 21.539 16.116 16.893) 31.766 20.542 ( 11.378 -8.974 -3.434) 14.892 21.343 ( -6.333 2.798 -20.610) 21.742 21.661 ( -5.830 -9.470 -6.805) 13.037 24.417 ( -4.088 15.913 -4.141) 16.944 24.796 ( -0.114 -16.618 -7.642) 18.291 25.225 ( -4.160 -9.819 -11.588) 15.747 25.924 ( -0.512 3.946 -21.504) 21.869 26.357 ( 3.404 0.009 -6.395) 7.245 26.538 ( -0.656 -2.467 -22.835) 22.978 29.028 ( -0.921 21.774 27.448) 35.048 29.142 ( -17.927 -17.616 15.295) 29.422 29.645 ( -0.883 -25.533 35.352) 43.617 32.015 ( 50.144 12.529 -0.516) 51.688 34.449 ( -9.988 -16.775 4.615) 20.061 34.936 ( 21.891 25.154 4.802) 33.690 38.095 ( -20.409 -8.819 2.593) 22.384 41.256 ( -18.236 16.677 -9.268) 26.392 ======================= Grid point 195 (65/343) ======================= q-point: (-0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.283 ( 4.785 36.174 9.629) 37.738 6.346 ( -19.427 50.936 2.580) 54.576 7.296 ( -6.831 28.839 18.187) 34.772 8.816 ( -22.848 15.965 -0.117) 27.874 9.994 ( -1.612 34.736 -2.472) 34.861 10.970 ( 11.068 11.385 6.106) 17.012 11.624 ( -13.031 -11.736 -3.238) 17.833 12.881 ( 24.905 0.866 10.376) 26.994 14.688 ( -22.876 -26.038 -5.952) 35.167 15.112 ( -30.629 -11.863 0.954) 32.860 16.362 ( 11.907 20.855 -3.195) 24.227 17.734 ( 16.815 -8.157 1.157) 18.725 18.101 ( 5.702 -9.851 11.943) 16.498 20.749 ( 13.377 0.494 -5.998) 14.669 21.207 ( -6.576 5.537 -26.434) 27.797 21.909 ( -2.174 -25.818 4.739) 26.339 24.126 ( -1.651 15.215 -0.331) 15.308 25.041 ( 2.600 -11.239 -14.018) 18.154 25.372 ( -4.320 -11.607 -14.305) 18.921 25.831 ( -3.093 5.078 -19.681) 20.560 26.388 ( 1.214 -1.174 2.131) 2.719 26.596 ( -0.029 -4.189 -26.048) 26.383 28.645 ( -0.710 20.581 28.669) 35.299 29.283 ( -10.845 -14.703 13.740) 22.860 30.081 ( 0.309 -26.505 34.462) 43.477 32.312 ( 55.662 14.965 -0.883) 57.645 34.521 ( 0.879 4.067 -3.835) 5.658 34.875 ( 19.296 3.865 12.324) 23.220 37.999 ( -24.371 -5.983 1.951) 25.170 40.741 ( -39.136 11.886 -8.837) 41.845 ======================= Grid point 196 (66/343) ======================= q-point: (-0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.577 ( -7.571 47.500 15.121) 50.421 5.235 ( -18.013 58.922 12.881) 62.946 6.538 ( -16.047 49.538 27.258) 58.775 8.289 ( -32.654 10.426 1.604) 34.315 9.561 ( 26.796 31.635 -3.999) 41.651 10.740 ( 7.873 24.471 3.301) 25.917 11.606 ( -26.808 -5.662 -7.499) 28.407 13.035 ( 19.058 5.909 3.171) 20.204 14.916 ( -14.790 -27.432 -13.299) 33.884 15.314 ( -13.569 -33.259 10.239) 37.352 16.075 ( 5.094 22.245 -1.758) 22.889 17.880 ( 21.273 9.845 6.299) 24.272 18.454 ( -6.619 -28.740 2.251) 29.578 20.796 ( 9.503 6.113 -9.129) 14.527 21.045 ( -5.661 6.332 -25.422) 26.803 22.426 ( 2.305 -33.912 10.099) 35.458 23.880 ( -0.555 13.190 2.056) 13.361 25.226 ( 5.120 -6.147 -18.137) 19.823 25.487 ( -2.401 -5.442 -15.824) 16.905 25.708 ( -6.372 3.131 -14.423) 16.075 26.408 ( 0.116 0.349 8.067) 8.075 26.660 ( -0.015 -3.224 -28.761) 28.941 28.365 ( -0.129 11.534 26.742) 29.124 29.419 ( -3.505 -10.228 14.606) 18.172 30.513 ( 0.241 -24.680 32.003) 40.415 32.566 ( 46.680 16.553 0.777) 49.534 34.462 ( 15.945 9.628 -11.211) 21.740 35.125 ( 31.846 -3.081 16.983) 36.223 37.815 ( -31.634 -4.871 1.457) 32.040 40.073 ( -62.346 9.421 -8.445) 63.617 ======================= Grid point 197 (67/343) ======================= q-point: (-0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.583 ( -16.020 56.092 22.521) 62.531 4.074 ( -11.981 62.153 24.612) 67.914 5.378 ( -14.288 69.036 42.005) 82.064 7.960 ( -15.539 -0.179 -0.149) 15.541 9.343 ( 21.035 26.586 -5.212) 34.299 10.384 ( 4.384 24.419 3.976) 25.126 11.335 ( -23.655 4.000 -12.234) 26.930 13.081 ( 9.153 4.830 -0.343) 10.355 15.338 ( -3.831 -31.611 -8.170) 32.874 15.708 ( 5.957 7.133 2.807) 9.708 15.850 ( -8.090 -21.645 1.449) 23.153 17.875 ( 11.836 10.119 4.364) 16.172 18.848 ( -6.141 -25.490 -2.853) 26.374 20.766 ( 7.078 6.733 -15.720) 18.508 20.893 ( -5.200 5.315 -16.976) 18.533 23.021 ( 2.515 -33.740 12.824) 36.182 23.678 ( -0.556 10.331 4.411) 11.247 25.289 ( 2.106 5.130 -17.156) 18.030 25.510 ( 3.720 1.947 -9.527) 10.411 25.657 ( -7.829 -6.337 -15.767) 18.710 26.349 ( 0.773 7.774 9.029) 11.940 26.695 ( -0.170 -1.050 -31.183) 31.201 28.284 ( 0.485 -1.632 23.163) 23.225 29.553 ( 2.244 -6.569 15.147) 16.662 30.889 ( 0.077 -19.964 29.058) 35.255 32.646 ( 22.828 14.361 5.839) 27.595 34.523 ( 17.690 5.047 -22.565) 29.113 35.678 ( 81.156 -1.007 22.372) 84.189 37.525 ( -52.697 -8.656 2.030) 53.442 39.182 ( -78.399 14.658 -6.730) 80.041 ======================= Grid point 198 (68/343) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( 0.000 56.282 32.980) 65.233 2.977 ( 0.000 61.078 39.493) 72.734 4.086 ( 0.000 74.100 63.962) 97.888 7.957 ( -0.000 -7.120 -1.637) 7.306 9.033 ( 0.000 22.976 -5.751) 23.685 10.035 ( 0.000 19.538 4.093) 19.962 11.133 ( 0.000 4.583 -14.749) 15.445 13.060 ( 0.000 2.928 -1.504) 3.291 15.485 ( 0.000 11.641 4.777) 12.583 15.805 ( -0.000 -24.231 0.045) 24.231 16.322 ( -0.000 -28.565 -7.668) 29.577 17.766 ( 0.000 10.859 -0.828) 10.890 19.178 ( -0.000 -18.170 -10.543) 21.008 20.697 ( 0.000 6.865 -21.473) 22.544 20.792 ( 0.000 2.313 -4.953) 5.466 23.531 ( 0.000 6.306 6.878) 9.332 23.578 ( -0.000 -31.305 14.865) 34.655 25.129 ( 0.000 13.304 -2.536) 13.544 25.501 ( 0.000 1.649 -10.914) 11.038 25.719 ( -0.000 -2.933 -19.934) 20.149 26.175 ( 0.000 12.669 4.310) 13.382 26.693 ( 0.000 0.998 -33.512) 33.527 28.395 ( -0.000 -9.532 19.635) 21.827 29.667 ( -0.000 -3.982 14.546) 15.081 31.164 ( -0.000 -12.875 25.867) 28.894 32.588 ( 0.000 4.339 13.942) 14.602 34.526 ( 0.000 10.643 -33.283) 34.944 36.862 ( -0.000 -22.089 27.158) 35.007 36.920 ( -0.000 -9.032 1.749) 9.200 38.235 ( 0.000 31.442 -2.259) 31.523 ======================= Grid point 201 (69/343) ======================= q-point: ( 0.15 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.840 ( 41.716 -0.000 39.223) 57.260 3.366 ( 45.544 -0.000 75.594) 88.254 5.057 ( 105.936 -0.000 18.136) 107.477 7.689 ( -19.979 0.000 -6.727) 21.081 9.099 ( 37.880 -0.000 1.159) 37.897 9.771 ( 11.719 -0.000 1.322) 11.793 12.017 ( 19.080 -0.000 -15.055) 24.304 12.622 ( -4.360 0.000 4.498) 6.264 14.860 ( -20.989 0.000 6.295) 21.913 16.048 ( -17.211 0.000 3.532) 17.570 16.932 ( 1.873 -0.000 -17.112) 17.214 17.135 ( 2.065 -0.000 5.841) 6.195 19.788 ( 13.269 -0.000 -31.388) 34.078 20.235 ( -16.625 0.000 -14.251) 21.897 21.193 ( -0.981 0.000 -7.468) 7.532 23.314 ( -6.156 0.000 7.568) 9.755 24.459 ( 1.139 -0.000 10.282) 10.345 24.484 ( -6.918 0.000 24.335) 25.300 25.140 ( -3.985 0.000 -5.097) 6.470 25.645 ( -17.908 0.000 -6.354) 19.002 25.681 ( 3.512 -0.000 -11.561) 12.083 26.733 ( 2.664 -0.000 -33.842) 33.947 27.591 ( -35.086 0.000 66.818) 75.470 28.803 ( 8.284 -0.000 11.384) 14.079 31.385 ( -1.368 0.000 22.965) 23.006 31.471 ( -16.192 0.000 -0.127) 16.192 33.057 ( -0.765 0.000 7.491) 7.530 36.073 ( 32.830 -0.000 -6.324) 33.433 37.320 ( -2.461 0.000 3.050) 3.919 44.399 ( 32.416 -0.000 -78.561) 84.986 ======================= Grid point 202 (70/343) ======================= q-point: ( 0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.566 ( 35.690 -37.349 30.924) 60.208 4.091 ( 43.418 -32.761 62.150) 82.589 6.038 ( 89.956 2.767 9.232) 90.470 7.618 ( -6.251 -7.747 -6.229) 11.743 9.502 ( 29.583 -8.206 4.510) 31.030 9.963 ( 30.336 1.517 0.491) 30.378 12.059 ( -15.358 -2.495 -11.165) 19.151 12.731 ( 24.639 -0.441 3.169) 24.846 14.698 ( -22.403 -6.691 3.823) 23.691 15.839 ( -24.972 -0.686 2.879) 25.147 16.827 ( 3.831 13.344 -15.147) 20.547 17.193 ( 4.512 0.145 4.366) 6.280 19.816 ( 4.622 10.799 -26.483) 28.971 20.149 ( -10.372 -7.519 -15.360) 20.001 21.091 ( -2.572 5.974 -7.177) 9.686 23.258 ( -6.167 0.179 5.910) 8.543 23.948 ( -7.066 28.364 18.100) 34.381 24.854 ( -4.013 -17.506 3.925) 18.384 25.212 ( -4.494 -11.337 -7.506) 14.320 25.483 ( -15.662 -8.778 4.915) 18.615 25.855 ( -2.130 -14.308 -12.362) 19.028 26.743 ( 1.827 1.436 -32.197) 32.281 27.417 ( -28.451 -14.055 53.397) 62.115 28.826 ( 6.018 6.750 9.710) 13.269 31.229 ( -5.375 9.218 9.456) 14.258 31.430 ( -4.616 -2.734 9.857) 11.223 33.110 ( -0.612 -6.554 8.277) 10.575 36.319 ( 34.451 10.604 -7.357) 36.789 37.355 ( -3.757 -7.148 4.286) 9.142 44.254 ( 23.922 39.896 -48.644) 67.307 ======================= Grid point 203 (71/343) ======================= q-point: ( 0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.629 ( 32.844 -47.290 27.059) 63.618 5.234 ( 42.172 -50.878 38.588) 76.525 6.640 ( 49.111 5.147 5.896) 49.731 7.821 ( 19.535 -6.604 -5.494) 21.341 9.849 ( 3.161 -11.671 4.876) 13.037 10.390 ( 57.725 -1.026 2.472) 57.787 11.872 ( -23.005 0.019 -5.179) 23.581 13.003 ( 26.719 1.292 1.287) 26.781 14.645 ( -22.965 -13.211 1.171) 26.520 15.601 ( -29.717 -3.604 2.028) 30.003 16.636 ( 9.920 15.720 -13.012) 22.690 17.171 ( 3.334 7.690 3.848) 9.223 19.581 ( -1.025 16.812 -19.033) 25.415 20.171 ( -8.064 -3.317 -4.751) 9.930 21.055 ( 1.823 -3.169 -21.018) 21.333 23.038 ( -12.651 21.737 9.534) 26.897 23.554 ( -6.544 3.518 9.943) 12.412 24.910 ( -13.778 -3.798 -12.250) 18.823 25.353 ( -2.010 -8.593 -8.343) 12.145 25.683 ( -7.597 -23.377 13.731) 28.156 26.063 ( -1.377 -11.669 -10.229) 15.578 26.728 ( 0.140 1.284 -30.584) 30.611 27.459 ( -27.310 -23.345 43.829) 56.672 28.700 ( 0.509 10.905 9.955) 14.774 30.999 ( -3.986 13.655 12.150) 18.707 31.471 ( 5.290 -2.844 6.359) 8.747 33.249 ( -0.970 -10.770 9.603) 14.461 36.398 ( 33.004 19.403 -6.592) 38.848 37.457 ( -6.964 -10.791 5.188) 13.851 43.755 ( 23.787 45.482 -28.764) 58.837 ======================= Grid point 204 (72/343) ======================= q-point: ( 0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.738 ( 29.883 -48.121 22.371) 60.902 6.363 ( 59.192 -10.636 11.246) 61.182 7.077 ( 4.070 -39.900 12.692) 42.067 8.126 ( 37.760 4.169 -1.837) 38.034 9.987 ( -7.842 -8.908 4.092) 12.554 10.879 ( 22.261 2.180 1.274) 22.404 11.750 ( 8.494 -1.790 0.614) 8.702 13.144 ( 18.476 9.059 3.225) 20.829 14.641 ( -25.290 -12.051 -0.528) 28.020 15.420 ( -29.761 -12.444 -0.582) 32.263 16.553 ( 17.318 10.124 -9.451) 22.175 16.999 ( 0.765 14.803 3.060) 15.135 19.282 ( 4.478 20.444 -11.536) 23.897 20.119 ( -10.221 -2.681 4.255) 11.392 21.192 ( 4.515 -7.586 -32.260) 33.446 22.427 ( -18.968 27.197 9.654) 34.535 23.605 ( -4.194 -11.677 3.664) 12.937 24.818 ( -17.116 -4.638 -13.631) 22.367 25.444 ( -0.316 -3.049 -6.969) 7.613 25.946 ( -3.791 -12.908 -1.367) 13.522 26.204 ( 1.166 -5.664 -0.923) 5.856 26.705 ( -0.953 1.282 -29.559) 29.602 27.640 ( -26.900 -29.909 35.115) 53.396 28.549 ( -3.161 3.287 14.994) 15.673 30.688 ( -4.019 18.881 16.279) 25.252 31.636 ( 17.729 -3.129 2.338) 18.155 33.439 ( -1.541 -13.346 11.035) 17.386 36.332 ( 30.226 25.647 -5.018) 39.957 37.561 ( -11.864 -12.597 5.701) 18.220 43.241 ( 19.752 42.084 -18.811) 50.151 ======================= Grid point 205 (73/343) ======================= q-point: ( 0.46 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.583 ( 37.680 7.280 2.312) 38.447 6.904 ( 36.872 -29.450 16.448) 49.974 7.845 ( 8.351 -21.484 -3.422) 23.303 8.629 ( 42.237 -27.134 11.227) 51.441 10.000 ( -16.194 -6.975 5.600) 18.500 10.685 ( -25.647 9.234 3.849) 27.529 12.035 ( 30.590 2.574 -0.573) 30.703 13.083 ( 10.917 14.688 8.079) 20.005 14.484 ( -28.598 -2.536 0.598) 28.717 15.506 ( -22.866 -27.342 -6.382) 36.210 16.518 ( 0.346 12.564 -2.914) 12.902 16.817 ( 20.138 11.167 -0.238) 23.028 19.011 ( 12.227 21.625 -1.628) 24.895 20.088 ( -7.617 -4.520 4.666) 10.011 21.337 ( 1.466 -4.735 -32.174) 32.553 21.871 ( -18.472 15.266 2.738) 24.120 23.811 ( -3.130 -16.932 0.747) 17.235 24.740 ( -17.825 -6.452 -13.872) 23.491 25.421 ( -0.083 6.089 -2.912) 6.750 26.039 ( -0.294 -2.100 -15.761) 15.903 26.281 ( 2.532 -1.654 0.650) 3.093 26.657 ( -1.430 3.178 -27.620) 27.839 27.909 ( -25.016 -32.779 26.848) 49.204 28.581 ( -4.075 -11.590 24.397) 27.316 30.304 ( -3.473 22.623 19.795) 30.261 31.907 ( 28.591 -1.787 -0.740) 28.656 33.657 ( -1.727 -14.651 12.076) 19.065 36.149 ( 26.472 29.406 -2.994) 39.679 37.637 ( -17.534 -13.643 5.592) 22.910 42.735 ( 12.664 38.469 -13.815) 42.792 ======================= Grid point 206 (74/343) ======================= q-point: ( 0.54 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.620 ( 36.756 25.741 1.873) 44.912 7.699 ( 28.095 -11.472 6.121) 30.959 8.036 ( 14.133 -1.112 -0.920) 14.206 9.446 ( 21.160 -12.530 -3.147) 24.792 9.923 ( -17.967 -0.889 0.869) 18.010 10.428 ( -22.063 -25.751 25.038) 42.152 12.093 ( 11.364 13.798 -5.133) 18.597 12.869 ( -2.032 16.063 12.350) 20.364 14.268 ( -18.780 -0.776 2.958) 19.027 15.651 ( -29.994 -9.555 -14.295) 34.573 16.339 ( -3.629 -7.460 4.453) 9.415 16.945 ( 31.381 9.690 -3.105) 32.989 18.807 ( 20.709 22.605 9.017) 31.956 20.138 ( -4.182 -9.576 2.496) 10.743 21.334 ( -10.456 -1.113 -18.516) 21.293 21.612 ( -6.924 2.272 -14.170) 15.934 24.097 ( -2.217 -20.301 -2.246) 20.545 24.672 ( -17.134 -5.438 -13.050) 22.214 25.262 ( 1.373 11.941 -1.437) 12.105 26.044 ( 1.751 2.065 -20.530) 20.707 26.328 ( 3.068 -1.210 -6.283) 7.096 26.580 ( -1.898 3.717 -24.434) 24.788 28.222 ( -22.397 -32.357 21.048) 44.628 28.826 ( -2.890 -20.998 32.017) 38.397 29.879 ( -2.509 24.636 23.010) 33.804 32.246 ( 37.280 0.159 -3.517) 37.446 33.891 ( -0.768 -15.005 12.535) 19.567 35.889 ( 22.767 30.428 -0.879) 38.013 37.664 ( -23.925 -13.844 4.987) 28.088 42.199 ( 3.992 36.111 -11.010) 37.963 ======================= Grid point 207 (75/343) ======================= q-point: (-0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.480 ( 35.114 33.765 4.333) 48.906 7.643 ( 4.756 27.322 -9.420) 29.289 8.150 ( 14.054 17.040 14.355) 26.343 9.352 ( -26.097 14.319 0.065) 29.768 9.933 ( -3.818 -26.805 -2.476) 27.189 10.931 ( 5.984 -16.971 16.428) 24.365 11.918 ( 7.675 15.162 -4.684) 17.628 12.662 ( -3.692 -3.850 17.233) 18.040 14.118 ( -15.495 -0.733 3.585) 15.921 15.245 ( -35.382 11.382 -12.016) 39.062 16.701 ( 0.924 -28.689 0.894) 28.717 17.023 ( 21.251 12.476 -3.714) 24.921 18.650 ( 25.754 24.188 14.880) 38.337 20.366 ( 1.905 -19.578 0.827) 19.688 21.262 ( -10.665 -3.653 -15.431) 19.110 21.535 ( -5.269 1.549 -16.331) 17.230 24.414 ( -2.622 -16.873 -8.438) 19.046 24.572 ( -10.369 -1.661 -5.173) 11.706 25.127 ( 0.671 3.841 -7.646) 8.583 26.005 ( 1.396 4.465 -21.805) 22.301 26.381 ( 2.799 -1.035 -10.687) 11.096 26.512 ( -2.245 1.171 -20.479) 20.635 28.533 ( -18.198 -28.866 17.304) 38.260 29.191 ( -1.165 -23.915 35.744) 43.022 29.448 ( -1.602 23.822 25.962) 35.272 32.622 ( 42.317 2.158 -6.230) 42.827 34.137 ( 1.306 -14.014 12.128) 18.579 35.612 ( 22.173 28.171 1.242) 35.871 37.618 ( -31.865 -13.247 4.216) 34.765 41.604 ( -5.179 35.067 -9.126) 36.603 ======================= Grid point 208 (76/343) ======================= q-point: (-0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.157 ( 29.912 45.182 8.144) 54.794 6.999 ( -9.475 44.800 -5.772) 46.153 7.803 ( 4.515 32.236 18.116) 37.252 8.759 ( -37.201 16.211 2.509) 40.657 10.399 ( 10.701 -11.657 -6.779) 17.215 10.953 ( -0.952 1.934 5.459) 5.869 11.692 ( 3.593 20.419 0.946) 20.754 13.045 ( 22.601 -20.128 15.349) 33.934 14.025 ( -23.677 -14.833 2.213) 28.027 14.741 ( -32.293 5.336 -7.857) 33.661 16.839 ( 12.551 20.778 -5.447) 24.878 17.291 ( -1.809 -33.470 1.854) 33.570 18.499 ( 21.006 21.836 13.920) 33.345 20.755 ( 8.182 -16.382 -4.864) 18.947 21.227 ( -3.014 1.609 -18.600) 18.911 21.505 ( -9.559 -11.694 -4.635) 15.799 24.326 ( -4.228 10.745 -4.392) 12.354 24.801 ( 0.283 -19.430 -8.230) 21.103 25.151 ( -2.596 -7.014 -14.280) 16.120 25.922 ( 0.108 6.414 -21.851) 22.774 26.388 ( -0.209 1.079 -5.430) 5.540 26.527 ( -0.177 -3.855 -22.471) 22.800 28.818 ( -12.123 -21.690 14.636) 28.838 29.025 ( -0.206 21.373 29.187) 36.177 29.630 ( -0.651 -26.976 36.006) 44.995 32.973 ( 39.128 5.146 -8.186) 40.305 34.356 ( 0.929 -9.659 8.771) 13.080 35.461 ( 33.315 19.483 4.616) 38.869 37.466 ( -42.810 -12.085 3.637) 44.632 40.928 ( -13.117 35.592 -7.543) 38.674 ======================= Grid point 209 (77/343) ======================= q-point: (-0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.512 ( 12.738 58.071 13.397) 60.942 6.062 ( -8.420 55.210 2.379) 55.899 7.203 ( -3.018 41.192 21.790) 46.698 8.183 ( -25.175 12.796 3.267) 28.429 10.343 ( 22.455 29.747 -5.452) 37.667 11.079 ( -4.193 -9.465 -2.605) 10.675 11.340 ( -8.733 16.898 2.243) 19.153 13.347 ( 17.779 9.954 4.683) 20.907 14.296 ( -13.619 -35.149 -6.741) 38.293 14.605 ( -17.140 -24.726 7.240) 30.945 16.529 ( 4.483 25.008 -3.763) 25.684 17.836 ( -0.041 -32.176 1.528) 32.212 18.332 ( 9.587 16.497 10.677) 21.865 20.941 ( 4.540 0.222 -18.159) 18.719 21.112 ( -1.834 8.135 -14.978) 17.143 21.856 ( -2.172 -33.958 7.685) 34.885 24.097 ( -0.946 13.308 -0.542) 13.353 25.102 ( 2.961 -14.341 -14.530) 20.629 25.277 ( -4.110 -11.065 -16.914) 20.625 25.797 ( -0.696 8.157 -19.022) 20.709 26.380 ( -0.919 -1.337 2.264) 2.785 26.599 ( 0.230 -4.171 -25.954) 26.288 28.629 ( -0.660 19.464 27.169) 33.428 29.120 ( -4.478 -18.670 16.643) 25.409 30.078 ( -0.219 -27.115 34.565) 43.932 33.154 ( 22.806 11.504 -6.504) 26.359 34.456 ( -2.301 -4.762 -0.635) 5.326 35.718 ( 59.568 3.784 9.467) 60.434 37.159 ( -58.207 -9.946 3.840) 59.176 40.172 ( -15.315 37.895 -5.891) 41.295 ======================= Grid point 210 (78/343) ======================= q-point: (-0.15 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.538 ( 0.000 62.906 18.247) 65.499 5.048 ( 0.000 60.889 12.214) 62.102 6.368 ( 0.000 56.555 30.625) 64.315 7.912 ( 0.000 5.258 1.300) 5.416 9.949 ( 0.000 31.264 -4.413) 31.574 10.849 ( 0.000 27.438 4.901) 27.872 11.219 ( -0.000 -3.679 -10.777) 11.388 13.245 ( 0.000 9.227 0.688) 9.252 14.757 ( -0.000 -32.304 -12.753) 34.730 15.160 ( -0.000 -41.039 12.336) 42.853 16.132 ( 0.000 24.515 -1.828) 24.583 18.126 ( 0.000 13.055 7.452) 15.032 18.358 ( -0.000 -29.752 0.729) 29.761 20.919 ( 0.000 4.910 -27.310) 27.748 20.958 ( 0.000 7.681 -7.268) 10.575 22.447 ( -0.000 -36.148 11.259) 37.861 23.873 ( 0.000 12.920 2.047) 13.081 25.300 ( -0.000 -5.861 -19.549) 20.408 25.433 ( -0.000 -11.094 -17.419) 20.652 25.649 ( 0.000 8.512 -12.399) 15.040 26.403 ( -0.000 -0.644 7.534) 7.561 26.661 ( -0.000 -2.961 -28.861) 29.013 28.363 ( 0.000 11.033 26.497) 28.703 29.374 ( -0.000 -14.063 15.425) 20.874 30.513 ( -0.000 -24.886 32.087) 40.606 33.023 ( 0.000 16.671 -0.835) 16.692 34.529 ( -0.000 -5.312 -11.723) 12.871 36.346 ( -0.000 -11.742 12.951) 17.481 36.735 ( -0.000 -2.671 4.176) 4.957 39.426 ( 0.000 39.297 -4.288) 39.530 ======================= Grid point 215 (79/343) ======================= q-point: ( 0.23 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.495 ( 23.537 -0.000 30.103) 38.213 4.258 ( 44.191 -0.000 67.674) 80.825 7.014 ( 90.604 -0.000 -0.230) 90.604 7.533 ( 5.628 -0.000 -4.299) 7.082 9.625 ( 15.466 -0.000 6.134) 16.638 10.440 ( 56.483 -0.000 0.822) 56.489 11.838 ( -23.580 0.000 -8.288) 24.994 13.002 ( 29.594 -0.000 1.581) 29.636 14.406 ( -24.961 0.000 3.346) 25.185 15.530 ( -33.994 0.000 3.240) 34.148 16.969 ( 1.868 -0.000 -14.909) 15.026 17.277 ( 10.708 -0.000 2.918) 11.099 19.860 ( -21.021 0.000 -15.036) 25.845 20.067 ( 14.640 -0.000 -33.540) 36.596 21.073 ( -10.628 0.000 -4.733) 11.634 23.197 ( -5.883 0.000 5.136) 7.810 24.340 ( -6.895 0.000 25.058) 25.989 24.446 ( -4.513 0.000 12.032) 12.850 25.092 ( -1.522 0.000 -3.612) 3.920 25.147 ( -30.284 0.000 0.862) 30.296 25.737 ( 2.366 -0.000 -11.610) 11.848 26.781 ( 2.119 -0.000 -32.220) 32.290 27.110 ( -15.586 0.000 43.123) 45.853 28.978 ( 9.072 -0.000 7.163) 11.559 31.283 ( -4.270 0.000 -5.025) 6.594 31.323 ( -4.844 0.000 20.350) 20.919 33.071 ( 2.323 -0.000 9.845) 10.115 36.761 ( 35.576 -0.000 -9.052) 36.710 37.262 ( -3.392 0.000 6.181) 7.051 44.682 ( 2.442 -0.000 -41.906) 41.977 ======================= Grid point 216 (80/343) ======================= q-point: ( 0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.081 ( 16.394 -43.913 22.740) 52.099 4.902 ( 38.732 -27.460 61.346) 77.573 7.401 ( 40.643 20.370 -2.039) 45.508 8.014 ( 51.778 -11.351 -6.507) 53.406 9.800 ( 11.994 -2.766 6.960) 14.140 11.006 ( 60.376 4.217 1.238) 60.536 11.633 ( -18.733 -3.494 -4.926) 19.683 13.279 ( 25.966 0.613 1.584) 26.021 14.227 ( -24.746 -8.206 2.019) 26.149 15.197 ( -38.318 -2.965 3.050) 38.554 16.916 ( 5.004 8.088 -13.172) 16.247 17.345 ( 9.053 5.213 1.131) 10.507 19.639 ( -17.499 2.004 -17.767) 25.018 20.169 ( 6.981 4.224 -23.155) 24.551 20.979 ( -8.163 -3.791 -12.662) 15.535 23.133 ( -6.749 2.590 4.503) 8.516 23.752 ( -13.662 30.716 22.030) 40.193 24.667 ( -17.925 -8.489 -2.703) 20.017 25.053 ( -9.997 -20.179 11.594) 25.329 25.241 ( -4.200 -18.071 1.930) 18.653 25.837 ( -0.003 -9.438 -11.158) 14.614 26.770 ( 0.707 2.867 -27.485) 27.643 27.046 ( -10.840 -6.783 33.064) 35.451 28.954 ( 6.444 12.231 6.239) 15.167 31.144 ( -3.923 8.615 8.972) 13.042 31.393 ( 0.549 -8.868 4.510) 9.964 33.139 ( 3.207 -4.580 11.524) 12.809 36.993 ( 32.505 12.107 -8.436) 35.697 37.275 ( -3.724 -4.822 7.046) 9.315 44.465 ( 1.458 24.236 -29.993) 38.589 ======================= Grid point 217 (81/343) ======================= q-point: ( 0.38 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.121 ( 16.566 -57.402 15.640) 61.758 5.909 ( 28.535 -53.212 48.942) 77.724 7.448 ( 39.934 20.374 0.142) 44.831 8.592 ( 46.289 0.399 -7.829) 46.948 9.897 ( 4.552 1.410 6.340) 7.931 11.130 ( -3.160 13.278 -4.562) 14.391 11.889 ( 42.291 -8.563 3.587) 43.298 13.447 ( 17.180 5.858 2.164) 18.280 14.189 ( -21.533 -13.534 0.352) 25.435 14.900 ( -38.282 -8.103 2.263) 39.195 16.864 ( 13.064 7.718 -10.712) 18.573 17.252 ( 2.988 12.789 -0.228) 13.135 19.463 ( -9.726 3.769 -20.029) 22.582 20.068 ( -3.837 6.086 -2.056) 7.482 21.080 ( 0.920 -10.580 -29.192) 31.063 22.723 ( -19.919 31.137 14.019) 39.532 23.410 ( -7.486 -3.909 9.057) 12.384 24.553 ( -20.241 -4.430 -6.494) 21.714 25.310 ( -1.561 -13.610 -0.222) 13.701 25.584 ( -2.779 -24.032 6.504) 25.051 26.023 ( -2.249 -13.443 -7.793) 15.701 26.719 ( -0.969 2.537 -24.035) 24.188 27.097 ( -10.686 -11.897 28.976) 33.096 28.739 ( 2.605 16.651 8.202) 18.744 30.919 ( -4.199 13.690 12.658) 19.112 31.633 ( 10.058 -13.258 -0.155) 16.642 33.278 ( 3.466 -7.992 13.343) 15.935 37.021 ( 28.738 20.255 -7.264) 35.902 37.309 ( -7.165 -5.169 7.888) 11.844 43.999 ( 3.990 33.444 -21.110) 39.750 ======================= Grid point 218 (82/343) ======================= q-point: ( 0.46 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.224 ( 19.011 -52.990 12.435) 57.654 7.130 ( 14.067 -58.639 29.746) 67.240 7.551 ( 51.190 14.610 3.890) 53.376 8.923 ( 34.165 5.812 -3.005) 34.786 9.847 ( -5.302 3.811 5.409) 8.479 10.769 ( -10.209 19.784 -2.080) 22.360 12.339 ( 25.617 0.612 0.631) 25.632 13.400 ( 5.775 13.552 4.881) 15.519 14.196 ( -13.584 -7.165 0.165) 15.359 14.808 ( -29.106 -22.906 -1.108) 37.055 16.795 ( 1.584 18.291 -6.162) 19.366 17.143 ( 19.066 3.530 -2.934) 19.611 19.290 ( -5.860 7.658 -15.086) 17.905 20.004 ( -0.198 -1.496 5.735) 5.931 21.267 ( 2.689 -7.431 -34.535) 35.428 21.981 ( -25.690 26.413 12.281) 38.839 23.519 ( -4.269 -13.612 3.885) 14.785 24.448 ( -18.386 -5.872 -7.242) 20.615 25.457 ( 1.768 -3.550 -2.921) 4.926 25.897 ( -1.558 -14.977 -7.664) 16.896 26.207 ( -0.943 -9.698 -1.635) 9.880 26.670 ( -2.406 1.579 -25.938) 26.097 27.241 ( -13.564 -20.137 30.032) 38.619 28.537 ( 0.644 7.253 15.018) 16.691 30.612 ( -3.516 18.485 15.431) 24.335 32.004 ( 17.933 -14.116 -3.479) 23.086 33.469 ( 4.258 -10.394 15.018) 18.754 36.885 ( 24.972 27.614 -5.947) 37.703 37.307 ( -13.309 -6.707 8.573) 17.193 43.455 ( 4.190 36.651 -15.726) 40.102 ======================= Grid point 219 (83/343) ======================= q-point: ( 0.54 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.155 ( 23.737 -23.822 0.646) 33.636 7.625 ( 32.318 -7.155 16.912) 37.171 8.269 ( 32.233 -12.361 -1.756) 34.566 9.234 ( 7.437 -25.940 14.933) 30.841 9.664 ( -15.457 5.547 5.410) 17.290 10.347 ( 2.406 21.001 3.337) 21.400 12.318 ( -8.571 9.167 -4.468) 13.321 13.113 ( -4.754 20.616 7.258) 22.367 14.202 ( 2.783 0.253 3.273) 4.303 15.019 ( -24.476 -28.662 -7.294) 38.391 16.405 ( -7.884 17.940 -2.358) 19.737 17.393 ( 33.546 4.269 -5.655) 34.286 19.159 ( 0.216 2.184 -2.562) 3.374 20.051 ( 5.207 1.750 7.966) 9.676 21.217 ( -18.515 6.661 -12.825) 23.488 21.563 ( -7.132 -0.239 -17.451) 18.854 23.751 ( -2.679 -18.114 1.274) 18.355 24.389 ( -15.799 -7.188 -9.167) 19.629 25.452 ( 2.690 6.776 -2.356) 7.662 26.050 ( 0.948 -4.389 -18.505) 19.042 26.315 ( 0.904 -3.764 -2.369) 4.538 26.609 ( -3.238 2.620 -26.422) 26.748 27.507 ( -14.921 -28.404 27.489) 42.250 28.554 ( -0.101 -8.999 25.198) 26.756 30.244 ( -2.417 22.049 18.559) 28.921 32.432 ( 22.276 -13.045 -6.873) 26.714 33.708 ( 6.896 -11.942 16.322) 21.368 36.611 ( 19.470 30.789 -3.444) 36.591 37.265 ( -19.044 -7.015 7.772) 21.732 42.863 ( 2.068 38.441 -12.429) 40.453 ======================= Grid point 220 (84/343) ======================= q-point: (-0.38 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.375 ( 39.879 23.415 0.622) 46.249 8.131 ( 12.689 11.162 -2.789) 17.128 8.447 ( 26.444 -3.957 6.714) 27.568 9.214 ( -31.013 10.780 1.140) 32.853 9.552 ( -22.781 -5.016 14.447) 27.438 10.658 ( 34.696 -34.891 13.350) 50.984 12.027 ( -20.850 2.313 -4.747) 21.508 12.682 ( -7.305 22.296 8.746) 25.039 14.180 ( 5.337 8.517 5.016) 11.234 15.046 ( -28.033 -1.120 -13.324) 31.059 16.281 ( -2.444 -13.663 2.271) 14.065 17.511 ( 23.048 16.540 -8.625) 29.651 19.229 ( 22.675 8.336 11.480) 26.748 20.030 ( -9.243 -7.384 8.855) 14.777 21.032 ( -15.700 -7.631 -13.676) 22.175 21.546 ( -1.390 1.649 -23.488) 23.587 24.060 ( -1.258 -21.069 -1.540) 21.162 24.374 ( -11.592 -7.062 -11.000) 17.471 25.309 ( 2.526 12.177 -3.685) 12.971 26.079 ( 1.450 1.957 -20.608) 20.752 26.375 ( 1.860 -2.401 -9.221) 9.709 26.526 ( -3.178 3.233 -22.942) 23.386 27.873 ( -12.144 -31.088 22.845) 40.445 28.804 ( -0.299 -20.100 32.678) 38.366 29.840 ( -1.384 24.137 22.023) 32.703 32.853 ( 21.055 -11.345 -10.207) 26.004 34.000 ( 11.193 -12.054 16.773) 23.493 36.281 ( 16.784 28.871 -1.105) 33.414 37.154 ( -26.004 -5.832 6.861) 27.519 42.216 ( -0.970 40.111 -10.135) 41.383 ======================= Grid point 221 (85/343) ======================= q-point: (-0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.247 ( 38.739 41.089 4.845) 56.679 7.648 ( -3.490 40.574 -7.335) 41.379 8.364 ( -5.766 29.285 10.429) 31.617 8.713 ( -19.542 17.987 6.668) 27.384 9.821 ( -6.179 -44.130 7.493) 45.186 11.237 ( 15.680 10.277 -6.183) 19.741 12.088 ( 10.478 7.117 3.476) 13.134 12.420 ( -17.219 -36.929 17.438) 44.321 14.016 ( 2.252 15.362 5.404) 16.440 14.645 ( -21.054 13.615 -12.608) 28.065 16.695 ( -0.437 -32.629 2.259) 32.710 17.325 ( 7.994 22.379 -7.860) 25.030 19.102 ( 16.184 28.437 16.174) 36.499 20.331 ( -4.606 -33.846 4.418) 34.443 21.100 ( -3.972 -10.344 -16.173) 19.605 21.453 ( -2.654 6.987 -18.049) 19.535 24.353 ( -2.793 -3.713 -10.826) 11.781 24.438 ( -2.760 -20.576 -3.678) 21.084 25.151 ( 0.983 7.207 -8.635) 11.290 26.025 ( 0.546 5.258 -21.078) 21.731 26.419 ( 1.088 1.556 -13.812) 13.942 26.467 ( -1.705 -1.897 -17.843) 18.024 28.285 ( -6.486 -29.108 18.930) 35.322 29.183 ( -0.011 -24.946 35.827) 43.656 29.424 ( -0.725 24.416 25.562) 35.356 33.196 ( 13.625 -8.445 -12.594) 20.386 34.287 ( 9.789 -7.913 15.198) 19.734 36.054 ( 22.070 18.480 0.876) 28.799 36.942 ( -31.822 -2.923 6.569) 32.624 41.515 ( -2.831 41.729 -8.283) 42.637 ======================= Grid point 222 (86/343) ======================= q-point: (-0.23 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.605 ( 0.000 59.789 11.236) 60.835 6.872 ( 0.000 46.919 -4.723) 47.157 7.812 ( 0.000 33.001 12.967) 35.457 8.287 ( 0.000 17.068 7.639) 18.700 10.531 ( -0.000 -39.033 0.223) 39.034 10.957 ( 0.000 26.057 -7.534) 27.124 11.742 ( 0.000 25.715 4.953) 26.188 13.357 ( -0.000 -60.074 12.943) 61.453 13.725 ( 0.000 18.734 5.258) 19.457 14.363 ( 0.000 3.664 -9.186) 9.890 16.967 ( 0.000 24.472 -5.791) 25.148 17.266 ( -0.000 -34.992 2.083) 35.054 18.728 ( 0.000 24.166 13.211) 27.541 20.817 ( -0.000 -19.991 -9.333) 22.062 21.279 ( 0.000 10.528 -13.125) 16.826 21.333 ( -0.000 -22.641 -4.442) 23.073 24.280 ( 0.000 8.497 -4.920) 9.819 24.803 ( -0.000 -21.652 -8.502) 23.262 25.127 ( -0.000 -4.034 -15.137) 15.665 25.924 ( 0.000 7.117 -21.338) 22.494 26.378 ( 0.000 1.721 -6.033) 6.274 26.528 ( -0.000 -4.409 -21.894) 22.333 28.696 ( -0.000 -22.641 15.471) 27.422 29.024 ( 0.000 21.418 29.089) 36.124 29.622 ( -0.000 -27.232 36.077) 45.201 33.355 ( -0.000 -0.605 -12.385) 12.400 34.403 ( -0.000 -1.750 10.000) 10.152 36.096 ( -0.000 -0.336 3.143) 3.161 36.716 ( 0.000 1.245 6.854) 6.967 40.794 ( 0.000 42.397 -6.716) 42.925 ======================= Grid point 229 (87/343) ======================= q-point: ( 0.31 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.782 ( 7.836 -0.000 26.227) 27.373 5.058 ( 36.429 -0.000 63.216) 72.962 7.873 ( 25.766 -0.000 -0.751) 25.777 8.505 ( 58.666 -0.000 -12.670) 60.019 9.969 ( 23.503 -0.000 9.471) 25.339 11.380 ( -20.302 0.000 -6.290) 21.254 11.704 ( 66.866 -0.000 1.669) 66.887 13.522 ( 21.387 -0.000 3.524) 21.675 13.914 ( -23.328 0.000 2.020) 23.415 14.784 ( -39.991 0.000 2.625) 40.077 17.006 ( 1.893 -0.000 -11.260) 11.418 17.497 ( 10.733 -0.000 -1.255) 10.806 19.439 ( -20.873 0.000 -15.997) 26.298 20.345 ( 13.199 -0.000 -35.765) 38.123 20.776 ( -20.089 0.000 -8.334) 21.749 23.084 ( -5.579 0.000 3.927) 6.823 24.071 ( -34.557 0.000 18.840) 39.359 24.235 ( -3.670 0.000 27.309) 27.554 24.749 ( -6.482 0.000 4.293) 7.774 25.062 ( -1.776 0.000 -2.712) 3.242 25.782 ( 2.464 -0.000 -11.872) 12.125 26.812 ( 0.868 -0.000 -31.315) 31.327 26.918 ( -5.447 0.000 29.199) 29.703 29.143 ( 7.533 -0.000 4.465) 8.757 31.208 ( -6.406 0.000 15.786) 17.036 31.263 ( 1.421 -0.000 -5.254) 5.442 33.141 ( 4.460 -0.000 13.114) 13.851 37.192 ( -3.631 0.000 9.501) 10.171 37.423 ( 30.999 -0.000 -9.833) 32.521 44.623 ( -6.576 0.000 -26.025) 26.843 ======================= Grid point 230 (88/343) ======================= q-point: ( 0.38 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.276 ( 5.828 -48.191 20.779) 52.802 5.582 ( 29.720 -23.415 60.060) 70.984 8.056 ( 30.788 9.337 0.247) 32.174 9.002 ( 37.971 -1.567 -14.042) 40.515 10.146 ( 24.342 10.145 9.254) 27.948 11.197 ( -9.611 3.472 -6.092) 11.897 12.310 ( 51.053 0.510 1.237) 51.070 13.648 ( 6.816 2.353 2.892) 7.770 13.824 ( -9.673 -9.070 3.462) 13.705 14.437 ( -34.164 -3.616 1.587) 34.392 17.023 ( 5.974 0.203 -8.536) 10.421 17.495 ( 5.518 11.236 -3.082) 12.891 19.301 ( -14.967 -5.213 -17.598) 23.683 20.209 ( -7.104 15.541 -16.487) 23.745 20.822 ( -5.293 -17.684 -28.838) 34.240 22.974 ( -10.534 12.560 8.084) 18.277 23.399 ( -19.938 19.793 22.288) 35.861 24.299 ( -13.989 -4.780 7.859) 16.743 24.967 ( -0.754 -23.213 13.257) 26.742 25.189 ( -2.494 -17.232 -0.605) 17.422 25.853 ( 1.602 -5.647 -10.748) 12.247 26.770 ( -0.505 3.881 -19.415) 19.806 26.923 ( -3.224 -4.123 15.248) 16.122 29.066 ( 4.839 15.789 4.649) 17.156 31.059 ( -4.541 8.258 10.947) 14.445 31.443 ( 3.836 -15.498 -2.210) 16.118 33.220 ( 4.612 -4.055 14.648) 15.883 37.167 ( -4.269 -1.253 10.500) 11.404 37.605 ( 26.278 12.034 -9.203) 30.332 44.408 ( -5.549 16.887 -20.841) 27.391 ======================= Grid point 231 (89/343) ======================= q-point: ( 0.46 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.336 ( 7.399 -66.615 11.613) 68.023 6.405 ( 21.450 -44.991 53.990) 73.479 8.195 ( 31.867 10.526 1.240) 33.583 9.284 ( 20.952 3.223 -12.651) 24.687 10.083 ( 14.294 18.907 8.650) 25.231 11.056 ( 7.289 13.307 -4.640) 15.866 12.552 ( 5.386 6.485 1.436) 8.551 13.647 ( 7.745 7.396 0.697) 10.732 13.919 ( -10.657 -14.245 0.644) 17.801 14.308 ( -10.766 -8.508 2.618) 13.969 17.113 ( 7.480 11.058 -8.185) 15.659 17.306 ( 8.091 2.902 -1.341) 8.700 19.244 ( -12.513 0.779 -19.757) 23.399 19.958 ( -8.063 -0.451 -5.068) 9.534 21.090 ( -0.024 -15.615 -36.920) 40.086 22.294 ( -21.199 37.741 22.148) 48.624 23.283 ( -5.135 -8.948 7.210) 12.586 24.220 ( -12.374 -2.626 1.497) 12.738 25.308 ( 1.321 -16.497 3.558) 16.928 25.529 ( -3.549 -23.865 0.928) 24.145 25.998 ( 0.040 -10.888 -5.033) 11.995 26.697 ( -1.201 3.778 -18.721) 19.136 26.971 ( -3.613 -5.901 16.205) 17.620 28.786 ( 2.001 19.218 7.725) 20.809 30.843 ( -3.288 13.184 11.998) 18.126 31.822 ( 8.367 -21.710 -4.321) 23.665 33.365 ( 4.851 -7.870 16.007) 18.485 37.134 ( -6.878 -0.951 10.822) 12.858 37.546 ( 20.641 22.244 -7.697) 31.306 43.997 ( -2.607 26.995 -16.687) 31.843 ======================= Grid point 232 (90/343) ======================= q-point: ( 0.54 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.506 ( 10.410 -61.395 6.385) 62.598 7.448 ( 16.177 -53.913 41.392) 69.868 8.355 ( 24.058 1.692 3.165) 24.325 9.275 ( 5.318 13.490 -10.132) 17.689 9.854 ( 7.037 20.264 9.940) 23.642 10.870 ( 19.773 25.268 -0.266) 32.086 12.261 ( -29.485 9.143 -1.456) 30.905 13.476 ( 5.501 20.900 1.868) 21.693 14.149 ( -4.800 -21.204 -3.965) 22.099 14.429 ( -2.198 -10.568 2.325) 11.042 16.708 ( -6.283 25.916 -6.287) 27.398 17.690 ( 33.654 -10.761 -2.824) 35.445 19.006 ( -22.789 1.623 -11.559) 25.604 20.095 ( 7.403 -11.859 -4.395) 14.655 21.242 ( -8.401 5.397 -21.070) 23.316 21.541 ( -13.193 18.600 3.712) 23.104 23.450 ( -2.547 -14.857 4.305) 15.677 24.164 ( -9.835 -4.066 -2.425) 10.915 25.509 ( 3.185 -4.010 0.099) 5.122 25.853 ( -3.169 -18.631 -14.100) 23.579 26.192 ( 0.010 -10.950 1.594) 11.066 26.623 ( -2.104 3.163 -23.116) 23.426 27.071 ( -4.807 -12.276 24.170) 27.532 28.552 ( 0.670 8.429 15.093) 17.301 30.557 ( -1.957 18.000 14.408) 23.139 32.286 ( 9.990 -22.122 -6.973) 25.255 33.581 ( 5.994 -11.760 16.918) 21.458 37.052 ( -9.378 1.638 10.485) 14.162 37.296 ( 13.852 27.235 -5.624) 31.068 43.475 ( -0.816 33.595 -13.751) 36.310 ======================= Grid point 233 (91/343) ======================= q-point: ( 0.62 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.539 ( 13.012 -47.133 2.312) 48.951 8.186 ( 25.423 -3.144 12.512) 28.509 8.689 ( -5.613 -23.661 10.429) 26.460 9.005 ( -7.799 12.858 -1.099) 15.079 9.553 ( 2.820 21.920 12.885) 25.582 10.695 ( 19.794 9.569 10.824) 24.506 11.833 ( -26.662 6.127 -7.594) 28.391 13.101 ( 1.409 27.062 3.059) 27.271 14.367 ( 9.188 2.251 2.976) 9.917 14.616 ( -14.871 -22.048 -8.514) 27.924 16.278 ( -3.855 15.615 -2.757) 16.319 18.006 ( 23.665 15.334 -12.279) 30.757 19.018 ( -10.743 -30.242 4.503) 32.408 20.284 ( 16.860 17.907 10.390) 26.699 20.742 ( -24.403 2.223 -3.340) 24.731 21.524 ( -0.101 -3.855 -30.276) 30.520 23.714 ( -0.934 -18.840 2.300) 19.003 24.171 ( -5.795 -6.196 -7.335) 11.215 25.502 ( 1.754 7.200 -2.213) 7.734 26.057 ( -0.146 -7.151 -20.446) 21.661 26.329 ( 0.603 -5.196 -2.316) 5.721 26.550 ( -2.035 3.048 -26.306) 26.560 27.321 ( -4.467 -23.704 27.904) 36.885 28.556 ( 0.123 -8.377 25.250) 26.603 30.212 ( -0.839 21.715 17.777) 28.076 32.720 ( 6.982 -19.341 -9.376) 22.599 33.871 ( 6.641 -15.115 16.862) 23.599 36.866 ( 4.488 19.964 2.760) 20.648 36.975 ( -6.738 11.952 3.536) 14.169 42.870 ( -0.375 38.387 -11.562) 40.092 ======================= Grid point 234 (92/343) ======================= q-point: (-0.31 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.075 ( 0.000 23.697 -4.953) 24.209 8.109 ( 0.000 6.436 1.448) 6.597 8.604 ( 0.000 21.111 -6.897) 22.209 9.056 ( -0.000 -32.340 20.371) 38.221 9.128 ( 0.000 28.607 14.614) 32.123 11.244 ( -0.000 -54.231 21.405) 58.302 11.551 ( 0.000 10.530 -11.607) 15.672 12.638 ( 0.000 28.490 4.194) 28.797 14.283 ( 0.000 11.985 6.263) 13.522 14.712 ( 0.000 2.975 -14.860) 15.155 16.255 ( -0.000 -15.942 1.852) 16.049 17.751 ( 0.000 23.097 -11.509) 25.806 19.640 ( -0.000 -41.152 7.243) 41.784 19.758 ( 0.000 37.505 19.864) 42.441 20.863 ( -0.000 -15.216 -16.255) 22.265 21.533 ( 0.000 2.767 -24.999) 25.151 24.050 ( -0.000 -21.760 -0.172) 21.761 24.254 ( -0.000 -6.899 -11.702) 13.585 25.337 ( 0.000 12.340 -4.384) 13.095 26.093 ( 0.000 1.876 -19.937) 20.025 26.398 ( -0.000 -3.384 -10.314) 10.855 26.485 ( 0.000 3.531 -23.003) 23.272 27.754 ( -0.000 -30.063 23.854) 38.377 28.802 ( -0.000 -19.919 32.683) 38.274 29.826 ( 0.000 23.991 21.671) 32.330 33.047 ( -0.000 -15.350 -11.264) 19.039 34.164 ( -0.000 -13.950 16.080) 21.287 36.508 ( 0.000 23.909 -2.446) 24.034 36.804 ( 0.000 3.834 9.632) 10.367 42.201 ( 0.000 41.454 -9.757) 42.587 ======================= Grid point 243 (93/343) ======================= q-point: ( 0.38 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.884 ( 3.740 -0.000 26.883) 27.142 5.655 ( 23.707 -0.000 61.293) 65.718 8.382 ( 22.246 -0.000 0.390) 22.249 9.293 ( 24.679 -0.000 -13.883) 28.316 10.570 ( 33.861 -0.000 7.805) 34.749 11.134 ( -2.971 0.000 -5.547) 6.293 12.709 ( 19.450 -0.000 -5.185) 20.130 13.654 ( -19.056 0.000 9.539) 21.310 13.737 ( 18.649 -0.000 4.086) 19.091 14.184 ( -8.406 0.000 -1.299) 8.506 17.041 ( 1.543 -0.000 -4.703) 4.949 17.673 ( 6.867 -0.000 -5.222) 8.627 19.101 ( -11.484 0.000 -17.549) 20.972 20.265 ( -31.923 0.000 -15.451) 35.465 20.569 ( 9.275 -0.000 -37.513) 38.643 22.979 ( -5.254 0.000 6.227) 8.148 23.395 ( -28.815 0.000 23.304) 37.059 24.194 ( -0.708 0.000 30.386) 30.394 24.713 ( 0.206 -0.000 5.375) 5.379 25.021 ( -2.283 0.000 -2.426) 3.332 25.835 ( 2.752 -0.000 -11.851) 12.166 26.814 ( -0.534 0.000 -31.400) 31.404 26.855 ( -1.616 0.000 22.933) 22.990 29.267 ( 4.975 -0.000 3.322) 5.982 31.090 ( -5.189 0.000 11.325) 12.457 31.309 ( 2.655 -0.000 -4.764) 5.454 33.229 ( 4.104 -0.000 15.679) 16.208 37.126 ( -2.848 0.000 12.302) 12.628 37.944 ( 21.374 -0.000 -9.984) 23.591 44.477 ( -7.354 0.000 -18.900) 20.280 ======================= Grid point 244 (94/343) ======================= q-point: ( 0.46 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.364 ( 3.450 -50.001 22.425) 54.908 6.037 ( 16.035 -22.341 59.437) 65.490 8.532 ( 15.547 3.536 0.033) 15.945 9.479 ( 13.870 1.084 -11.950) 18.340 10.632 ( 20.589 22.292 5.529) 30.845 11.256 ( 15.354 -4.517 -4.336) 16.581 12.651 ( -13.365 10.324 -2.295) 17.043 13.444 ( -25.279 -9.393 3.079) 27.143 13.978 ( 21.120 7.394 1.386) 22.420 14.245 ( 12.834 -5.527 1.961) 14.111 17.143 ( 5.547 -9.992 -1.073) 11.479 17.564 ( 2.372 17.375 -5.701) 18.440 19.119 ( -1.924 -6.336 -20.252) 21.308 19.834 ( -27.781 6.515 -14.689) 32.094 20.810 ( 2.110 -16.047 -38.567) 41.825 22.709 ( -13.401 28.415 23.576) 39.279 23.130 ( -6.989 -2.205 10.401) 12.723 24.138 ( -3.926 2.955 15.405) 16.170 24.977 ( 1.251 -23.251 13.316) 26.824 25.134 ( -2.826 -16.146 -1.695) 16.479 25.892 ( 1.972 -3.947 -10.245) 11.155 26.757 ( -0.721 4.116 -17.256) 17.755 26.884 ( -1.165 -3.040 8.197) 8.820 29.140 ( 2.635 18.021 4.111) 18.671 30.982 ( -2.929 7.108 9.774) 12.436 31.515 ( 2.965 -19.314 -4.417) 20.033 33.302 ( 3.260 -4.403 16.509) 17.394 37.093 ( -2.865 0.997 13.008) 13.357 38.017 ( 14.874 12.537 -9.451) 21.627 44.296 ( -4.854 13.668 -16.645) 22.078 ======================= Grid point 245 (95/343) ======================= q-point: ( 0.54 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.442 ( 3.067 -70.545 12.639) 71.734 6.706 ( 8.216 -43.740 55.857) 71.419 8.579 ( 7.799 4.721 -0.434) 9.127 9.502 ( 4.441 7.406 -11.769) 14.597 10.373 ( 11.619 26.314 7.548) 29.738 11.449 ( 28.478 9.376 -3.494) 30.185 12.142 ( -33.736 18.841 1.851) 38.685 13.575 ( -10.557 -25.811 -4.475) 28.244 13.875 ( 5.284 17.391 0.812) 18.194 14.456 ( 10.639 -1.646 2.349) 11.019 17.106 ( -2.375 24.971 -9.336) 26.765 17.627 ( 16.038 -24.063 6.460) 29.631 18.971 ( -12.773 16.637 -23.119) 31.216 19.799 ( -5.556 -21.540 -10.415) 24.563 21.083 ( -0.386 -14.454 -38.711) 41.323 21.996 ( -7.809 40.310 26.806) 49.035 23.215 ( -1.776 -10.656 6.010) 12.362 24.068 ( -3.549 0.434 5.843) 6.850 25.355 ( 3.137 -18.295 7.216) 19.915 25.448 ( -4.187 -22.823 -2.967) 23.393 26.012 ( 0.776 -9.319 -3.554) 10.004 26.677 ( -0.634 4.532 -18.965) 19.509 26.928 ( -1.013 -3.995 12.387) 13.055 28.814 ( 0.737 20.385 7.627) 21.778 30.798 ( -1.191 12.696 11.095) 16.903 31.938 ( 3.100 -26.029 -5.946) 26.879 33.442 ( 2.311 -9.225 16.956) 19.441 37.031 ( -2.953 2.990 12.962) 13.626 37.831 ( 7.612 22.600 -8.094) 25.183 43.946 ( -1.758 24.316 -14.715) 28.476 ======================= Grid point 246 (96/343) ======================= q-point: (-0.38 -0.62 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.616 ( -0.000 -65.669 6.005) 65.943 7.636 ( -0.000 -61.054 47.926) 77.617 8.518 ( 0.000 7.220 -1.022) 7.292 9.322 ( 0.000 16.463 -13.029) 20.995 9.998 ( 0.000 25.694 11.127) 28.000 11.250 ( 0.000 37.158 9.492) 38.351 11.734 ( 0.000 0.256 -9.441) 9.445 13.544 ( 0.000 24.215 1.250) 24.248 14.026 ( -0.000 -32.283 -7.547) 33.153 14.497 ( 0.000 2.115 3.696) 4.258 16.636 ( 0.000 27.194 -6.968) 28.072 18.290 ( -0.000 -38.185 8.515) 39.123 18.520 ( 0.000 23.211 -20.098) 30.703 20.192 ( -0.000 -24.426 -12.984) 27.662 21.080 ( 0.000 29.353 7.236) 30.232 21.459 ( 0.000 3.843 -18.486) 18.881 23.424 ( -0.000 -15.309 4.492) 15.954 24.068 ( -0.000 -2.825 -0.769) 2.927 25.551 ( -0.000 -3.206 2.708) 4.197 25.808 ( -0.000 -21.298 -17.140) 27.338 26.198 ( -0.000 -10.807 3.169) 11.262 26.600 ( 0.000 4.105 -23.333) 23.692 27.027 ( -0.000 -10.032 22.303) 24.456 28.559 ( 0.000 8.757 15.117) 17.470 30.538 ( 0.000 17.805 13.946) 22.617 32.384 ( -0.000 -24.505 -7.744) 25.700 33.650 ( -0.000 -13.964 16.914) 21.934 36.949 ( 0.000 4.426 12.225) 13.002 37.439 ( 0.000 28.318 -6.278) 29.006 43.462 ( 0.000 32.670 -13.086) 35.193 ======================= Grid point 258 (97/343) ======================= q-point: ( 0.46 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.940 ( 1.724 -0.000 28.739) 28.791 5.970 ( 8.136 -0.000 60.529) 61.073 8.661 ( 6.321 -0.000 -0.834) 6.376 9.599 ( 7.711 -0.000 -9.978) 12.611 11.102 ( 16.314 -0.000 4.638) 16.960 11.234 ( 8.432 -0.000 -4.573) 9.592 12.642 ( -8.847 0.000 -7.800) 11.794 13.111 ( -21.505 0.000 8.220) 23.022 14.232 ( 3.545 -0.000 1.610) 3.894 14.353 ( 23.986 -0.000 -0.758) 23.998 17.059 ( 0.305 -0.000 3.900) 3.912 17.763 ( 2.249 -0.000 -7.702) 8.023 19.079 ( 10.483 -0.000 -16.598) 19.631 19.596 ( -31.995 0.000 -23.301) 39.581 20.695 ( 3.354 -0.000 -38.473) 38.619 22.866 ( -5.234 0.000 22.642) 23.239 23.051 ( -6.476 0.000 10.503) 12.339 24.193 ( 0.183 -0.000 32.808) 32.808 24.721 ( 0.297 -0.000 5.583) 5.591 24.984 ( -1.142 0.000 -2.744) 2.972 25.879 ( 1.362 -0.000 -11.325) 11.407 26.800 ( -0.581 0.000 -31.977) 31.982 26.838 ( -0.322 0.000 20.605) 20.607 29.335 ( 1.818 -0.000 2.961) 3.474 31.017 ( -2.017 0.000 8.704) 8.935 31.350 ( 1.183 -0.000 -4.438) 4.593 33.288 ( 1.644 -0.000 16.925) 17.004 37.086 ( -1.087 0.000 13.924) 13.966 38.235 ( 7.701 -0.000 -9.971) 12.599 44.368 ( -3.109 0.000 -16.081) 16.379 ======================= Grid point 259 (98/343) ======================= q-point: (-0.46 -0.54 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.401 ( -0.000 -50.654 23.565) 55.867 6.196 ( -0.000 -22.323 59.287) 63.351 8.672 ( 0.000 2.316 -1.094) 2.561 9.613 ( 0.000 3.061 -9.853) 10.318 10.859 ( 0.000 24.195 3.881) 24.504 11.518 ( -0.000 -13.437 -3.913) 13.995 12.381 ( 0.000 23.312 -0.356) 23.315 13.151 ( -0.000 -16.595 0.640) 16.608 14.150 ( 0.000 11.119 0.967) 11.161 14.495 ( -0.000 -1.598 -0.450) 1.660 17.202 ( -0.000 -14.226 2.697) 14.479 17.598 ( 0.000 16.400 -4.315) 16.958 19.230 ( 0.000 16.325 -29.793) 33.972 19.376 ( -0.000 -20.200 -9.689) 22.404 20.838 ( -0.000 -13.299 -39.491) 41.670 22.567 ( 0.000 29.829 28.454) 41.224 23.068 ( -0.000 -5.609 6.652) 8.701 24.105 ( 0.000 5.742 17.648) 18.559 24.996 ( -0.000 -24.942 15.804) 29.527 25.099 ( -0.000 -14.109 -4.409) 14.782 25.914 ( -0.000 -3.560 -9.798) 10.425 26.748 ( 0.000 4.137 -18.599) 19.053 26.872 ( -0.000 -2.699 7.893) 8.342 29.167 ( 0.000 18.835 3.983) 19.252 30.952 ( 0.000 6.533 9.026) 11.143 31.546 ( -0.000 -20.553 -4.873) 21.123 33.335 ( -0.000 -4.699 17.062) 17.698 37.064 ( 0.000 2.023 13.905) 14.051 38.166 ( 0.000 12.602 -9.469) 15.763 44.245 ( 0.000 12.761 -15.424) 20.018 ======================= Grid point 346 (99/343) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( 0.000 0.000 63.480) 63.480 2.973 ( 0.000 0.000 70.557) 70.557 4.873 ( 0.000 0.000 106.683) 106.683 8.158 ( 0.000 0.000 -2.558) 2.558 8.366 ( 0.000 0.000 -8.830) 8.830 9.752 ( 0.000 0.000 4.671) 4.671 10.609 ( 0.000 0.000 -26.993) 26.993 12.964 ( 0.000 0.000 -2.975) 2.975 15.612 ( 0.000 0.000 7.469) 7.469 16.325 ( 0.000 0.000 1.833) 1.833 16.390 ( 0.000 0.000 -28.186) 28.186 17.423 ( 0.000 0.000 9.208) 9.208 18.825 ( 0.000 0.000 -30.578) 30.578 20.416 ( 0.000 0.000 -8.938) 8.938 20.617 ( 0.000 0.000 -10.868) 10.868 23.670 ( 0.000 0.000 9.107) 9.107 24.574 ( 0.000 0.000 3.929) 3.929 24.974 ( 0.000 0.000 -5.769) 5.769 25.144 ( 0.000 0.000 -29.072) 29.072 25.345 ( 0.000 0.000 17.402) 17.402 25.782 ( 0.000 0.000 -1.821) 1.821 25.832 ( 0.000 0.000 -36.702) 36.702 29.080 ( 0.000 0.000 27.037) 27.037 30.080 ( 0.000 0.000 21.035) 21.035 31.875 ( 0.000 0.000 22.809) 22.809 33.358 ( 0.000 0.000 19.260) 19.260 33.430 ( 0.000 0.000 -6.605) 6.605 37.368 ( 0.000 0.000 -0.120) 0.120 37.380 ( 0.000 0.000 -1.060) 1.060 37.621 ( 0.000 0.000 -9.860) 9.860 ======================= Grid point 347 (100/343) ======================= q-point: ( 0.08 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( 34.709 -21.806 52.819) 66.858 3.337 ( 14.216 -32.181 62.173) 71.436 5.128 ( 13.089 -23.230 99.136) 102.659 8.073 ( 4.581 8.179 -4.400) 10.356 8.478 ( -11.627 -16.583 -7.496) 21.596 9.850 ( -1.476 -11.717 5.659) 13.095 10.768 ( 24.508 -4.432 -24.938) 35.245 12.946 ( -6.134 -1.488 -2.699) 6.864 15.535 ( -8.640 1.319 9.181) 12.676 16.063 ( 1.761 23.101 -17.376) 28.960 16.448 ( 0.153 1.505 -5.862) 6.054 17.531 ( -5.633 -12.984 6.667) 15.644 18.861 ( 3.943 -1.593 -29.685) 29.988 20.325 ( -6.707 4.345 -12.153) 14.545 20.661 ( 7.694 2.170 -11.100) 13.679 23.655 ( -2.531 -0.290 10.000) 10.319 24.383 ( -0.169 21.396 11.348) 24.220 24.987 ( -3.958 -1.326 -7.811) 8.856 25.146 ( -3.060 -0.768 -23.236) 23.449 25.279 ( 6.233 3.733 -12.243) 14.237 25.878 ( -0.238 -5.542 -32.157) 32.631 26.015 ( 1.799 -19.409 6.809) 20.647 29.023 ( -0.920 5.941 27.582) 28.230 30.016 ( -12.235 -1.055 24.389) 27.306 31.842 ( 0.933 4.621 24.368) 24.820 32.952 ( -27.575 13.587 16.898) 35.079 33.648 ( -20.382 -21.481 0.405) 29.614 36.190 ( -87.148 3.714 13.274) 88.231 37.450 ( 0.378 -8.296 0.110) 8.306 39.040 ( 158.950 13.617 -33.118) 162.934 ======================= Grid point 348 (101/343) ======================= q-point: ( 0.15 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.789 ( 39.569 -28.476 37.182) 61.311 4.174 ( 23.595 -42.577 48.774) 68.909 5.860 ( 23.453 -39.877 77.306) 90.091 8.059 ( 1.760 -3.566 -6.032) 7.225 8.661 ( -3.160 -15.366 -4.751) 16.391 10.083 ( -3.649 -18.751 6.889) 20.307 11.200 ( 37.067 -8.876 -19.559) 42.840 12.894 ( -11.864 -2.953 -1.461) 12.312 15.435 ( -12.084 2.195 0.761) 12.306 15.696 ( 6.135 19.962 -13.970) 25.125 16.339 ( 1.375 11.612 3.794) 12.293 17.654 ( -13.692 -12.149 7.039) 19.612 18.920 ( 7.186 2.735 -24.532) 25.709 20.195 ( -5.397 2.744 -20.378) 21.258 20.659 ( 2.582 3.987 -11.562) 12.500 23.627 ( -6.718 1.548 10.829) 12.838 23.940 ( -0.420 26.302 15.610) 30.589 24.907 ( -5.948 3.133 -20.593) 21.662 25.173 ( -0.931 -3.910 -13.762) 14.337 25.319 ( 9.141 2.343 -28.935) 30.435 25.976 ( -0.468 -5.877 -29.555) 30.137 26.343 ( 2.219 -15.796 10.909) 19.324 28.901 ( -2.560 4.939 30.149) 30.658 29.921 ( -13.629 -3.158 26.417) 29.893 31.727 ( -2.548 8.835 27.370) 28.873 32.452 ( -46.199 1.682 17.101) 49.291 33.768 ( -20.766 -19.216 3.198) 28.473 35.600 ( -25.555 5.543 8.366) 27.454 37.640 ( 2.251 -12.280 1.042) 12.528 40.082 ( 120.513 24.550 -34.693) 127.788 ======================= Grid point 349 (102/343) ======================= q-point: ( 0.23 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.596 ( 32.380 -24.240 23.977) 47.021 5.148 ( 28.152 -42.979 37.658) 63.701 6.761 ( 22.065 -37.076 49.299) 65.513 8.195 ( -13.349 -17.696 -7.978) 23.558 9.035 ( 29.463 -18.019 4.159) 34.785 10.386 ( -5.682 -22.572 8.387) 24.741 11.684 ( 31.127 -5.082 -12.914) 34.081 12.828 ( -13.953 -5.536 1.646) 15.101 15.138 ( 5.211 22.627 -16.662) 28.579 15.642 ( -6.453 -6.776 0.374) 9.364 16.135 ( 5.802 14.819 8.630) 18.104 17.656 ( -21.217 -8.704 8.716) 24.533 18.857 ( 6.922 13.934 -12.240) 19.796 20.178 ( -0.607 -5.177 -32.065) 32.486 20.591 ( -4.236 2.964 -12.893) 13.891 23.203 ( -10.370 32.351 15.570) 37.370 23.808 ( -0.469 -4.674 6.886) 8.336 24.800 ( -4.330 3.519 -25.152) 25.763 25.216 ( 1.246 -0.532 -16.289) 16.346 25.374 ( 8.480 1.369 -26.665) 28.014 26.048 ( -0.630 -3.239 -26.584) 26.788 26.533 ( 1.687 -3.699 7.185) 8.256 28.864 ( -2.490 -4.660 33.278) 33.695 29.852 ( -10.590 -2.765 25.266) 27.535 31.487 ( -10.697 12.222 29.698) 33.849 32.023 ( -42.679 -3.259 13.413) 44.856 33.918 ( -14.298 -19.859 6.087) 25.216 35.369 ( 0.730 10.199 4.123) 11.026 37.879 ( 2.327 -13.120 2.375) 13.535 40.669 ( 84.543 23.735 -27.789) 92.104 ======================= Grid point 350 (103/343) ======================= q-point: ( 0.31 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.201 ( 22.662 -16.043 14.780) 31.455 6.118 ( 29.550 -38.317 25.399) 54.649 7.409 ( 11.001 -19.361 22.072) 31.353 8.400 ( -15.369 -26.849 -3.567) 31.142 9.825 ( 49.074 -25.148 9.271) 55.916 10.699 ( -8.019 -23.227 11.061) 26.947 11.864 ( 8.660 7.155 -3.554) 11.782 12.837 ( -7.129 -7.201 7.324) 12.503 14.927 ( 17.736 15.123 -16.874) 28.775 15.602 ( -6.726 4.862 1.387) 8.415 16.077 ( 6.614 -1.410 6.396) 9.308 17.531 ( -27.587 -5.137 7.986) 29.175 18.626 ( 6.374 19.643 0.362) 20.655 20.327 ( 4.162 -6.950 -37.078) 37.953 20.496 ( -9.457 -2.098 -16.334) 18.991 22.538 ( -10.338 33.527 11.320) 36.866 23.929 ( -1.519 -10.200 2.261) 10.558 24.710 ( -2.028 3.372 -24.220) 24.537 25.213 ( 4.023 3.950 -19.425) 20.227 25.434 ( 5.762 0.130 -21.756) 22.507 26.074 ( -0.427 -0.742 -23.881) 23.897 26.491 ( -1.723 8.076 0.650) 8.283 29.014 ( -1.793 -15.275 34.438) 37.716 29.809 ( -5.121 -1.548 24.003) 24.592 31.131 ( -16.338 13.784 31.220) 37.836 31.727 ( -29.416 -3.368 11.338) 31.705 34.138 ( -10.631 -20.804 7.505) 24.539 35.224 ( 9.765 14.243 3.801) 17.682 38.104 ( 1.618 -11.282 3.759) 12.001 41.001 ( 55.998 18.212 -22.496) 63.035 ======================= Grid point 351 (104/343) ======================= q-point: ( 0.38 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.588 ( 14.230 -9.283 9.885) 19.657 6.909 ( 21.673 -21.582 7.770) 31.557 7.698 ( 1.554 -15.758 11.890) 19.801 8.775 ( -2.647 -24.073 -1.721) 24.280 10.513 ( 21.318 -6.661 5.142) 22.919 11.070 ( 5.189 -22.910 10.910) 25.900 11.782 ( 3.172 -0.092 12.476) 12.873 12.845 ( -5.404 0.827 15.047) 16.009 14.921 ( 15.700 9.571 -9.626) 20.754 15.499 ( 5.301 2.098 -7.618) 9.515 16.198 ( 2.130 -5.124 5.307) 7.678 17.293 ( -28.860 -0.368 2.559) 28.975 18.400 ( 6.812 13.750 13.562) 20.479 20.277 ( -7.854 5.184 -23.086) 24.931 20.654 ( 2.706 -14.854 -32.204) 35.568 21.936 ( -8.054 26.885 3.457) 28.278 24.101 ( -1.625 -11.818 -4.304) 12.682 24.654 ( 0.250 2.127 -19.028) 19.148 25.166 ( 5.170 7.153 -15.983) 18.258 25.470 ( 2.882 0.889 -21.451) 21.662 26.071 ( 0.011 0.590 -21.190) 21.198 26.285 ( -5.351 10.250 -6.472) 13.251 29.298 ( -2.558 -19.876 31.415) 37.263 29.811 ( 3.693 0.093 24.444) 24.721 30.732 ( -15.845 14.540 34.188) 40.389 31.548 ( -17.294 -2.427 9.706) 19.979 34.383 ( -9.953 -20.287 7.403) 23.779 35.076 ( 12.045 16.558 5.643) 21.239 38.275 ( 0.822 -7.560 4.853) 9.022 41.184 ( 32.091 11.322 -19.568) 39.255 ======================= Grid point 352 (105/343) ======================= q-point: ( 0.46 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.791 ( 5.238 -3.285 7.969) 10.086 7.180 ( 3.044 -1.898 -5.715) 6.748 8.074 ( 7.922 -15.770 13.538) 22.242 8.999 ( -3.198 -5.554 -7.533) 9.890 10.602 ( 2.745 2.312 10.564) 11.156 11.261 ( -1.501 -1.581 1.725) 2.780 12.131 ( 14.154 -20.215 27.492) 36.943 12.680 ( -7.164 10.617 17.748) 21.887 14.881 ( 4.354 4.950 -2.032) 6.898 15.607 ( 6.580 -2.824 -18.533) 19.868 16.265 ( 1.573 -1.263 9.070) 9.291 17.038 ( -15.211 1.900 -4.565) 15.994 18.312 ( 3.404 3.701 24.553) 25.063 20.131 ( -4.522 3.083 -23.837) 24.458 20.913 ( 3.102 -10.303 -30.522) 32.363 21.522 ( -4.106 13.867 -4.666) 15.196 24.252 ( -1.039 -6.254 -14.955) 16.243 24.648 ( 0.954 -0.365 -8.190) 8.253 25.086 ( 2.724 5.817 -9.288) 11.292 25.466 ( 0.370 0.908 -24.713) 24.732 26.062 ( 0.623 0.760 -15.403) 15.434 26.116 ( -3.569 3.491 -16.031) 16.790 29.549 ( -3.845 -11.157 22.388) 25.308 29.895 ( 10.410 -1.647 28.612) 30.492 30.370 ( -11.294 10.479 39.192) 42.111 31.463 ( -5.774 -0.905 8.556) 10.361 34.595 ( -7.753 -14.208 5.353) 17.048 34.921 ( 8.797 13.020 8.872) 18.045 38.366 ( 0.233 -2.659 5.447) 6.065 41.265 ( 10.471 3.847 -18.312) 21.442 ======================= Grid point 360 (106/343) ======================= q-point: ( 0.08 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.240 ( 24.957 -0.000 64.785) 69.426 3.319 ( 63.253 -0.000 41.362) 75.576 5.129 ( 27.271 -0.000 104.285) 107.792 8.007 ( -29.022 0.000 -11.704) 31.293 8.416 ( 26.030 -0.000 -1.543) 26.076 9.750 ( 0.515 -0.000 5.099) 5.125 11.027 ( 35.086 -0.000 -22.944) 41.923 12.851 ( -10.551 0.000 -2.246) 10.788 15.425 ( -17.052 0.000 9.340) 19.442 16.306 ( -3.056 0.000 1.687) 3.491 16.415 ( 2.323 -0.000 -27.919) 28.015 17.356 ( -5.668 0.000 9.296) 10.888 18.894 ( 6.644 -0.000 -32.010) 32.693 20.252 ( -12.681 0.000 -11.440) 17.079 20.806 ( 12.141 -0.000 -13.335) 18.034 23.620 ( -4.766 0.000 9.779) 10.879 24.590 ( 1.290 -0.000 3.187) 3.438 24.920 ( -4.474 0.000 -10.278) 11.210 25.104 ( -4.181 0.000 -14.170) 14.774 25.378 ( 3.143 -0.000 5.223) 6.096 25.770 ( -1.970 0.000 1.334) 2.379 25.887 ( 5.009 -0.000 -33.310) 33.685 29.077 ( -0.065 0.000 23.650) 23.650 29.772 ( -31.128 0.000 39.031) 49.924 31.904 ( 2.224 -0.000 24.763) 24.862 32.534 ( -72.093 0.000 17.413) 74.166 33.325 ( -2.802 0.000 17.585) 17.807 35.712 ( -19.709 0.000 4.588) 20.236 37.383 ( 1.487 -0.000 1.906) 2.417 40.739 ( 142.792 -0.000 -70.772) 159.368 ======================= Grid point 361 (107/343) ======================= q-point: ( 0.15 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.776 ( 31.811 -28.511 54.677) 69.386 4.058 ( 62.051 -10.843 31.155) 70.274 5.645 ( 39.055 -20.493 89.626) 99.891 7.779 ( -26.046 -6.555 -12.452) 29.605 8.754 ( 37.571 -2.890 0.516) 37.685 9.836 ( 0.933 -8.589 5.667) 10.332 11.435 ( 35.622 -6.018 -19.616) 41.109 12.744 ( -11.862 -0.692 -1.172) 11.940 15.246 ( -19.450 -1.729 8.742) 21.394 16.099 ( -0.038 16.835 -11.670) 20.485 16.432 ( -2.187 2.124 -11.165) 11.574 17.374 ( -7.815 -7.357 8.249) 13.537 18.991 ( 8.479 -1.827 -32.705) 33.835 20.113 ( -14.244 -0.157 -14.275) 20.167 20.835 ( 7.211 8.020 -13.160) 17.014 23.565 ( -6.214 -0.119 10.411) 12.125 24.368 ( -1.542 23.934 11.598) 26.641 24.889 ( -5.143 0.802 -15.875) 16.706 25.078 ( -3.852 -3.458 -12.188) 13.241 25.400 ( 4.642 -1.037 -14.058) 14.841 25.869 ( -1.146 -7.494 -21.730) 23.014 26.064 ( 2.757 -16.473 2.328) 16.864 28.988 ( -3.298 8.106 25.400) 26.865 29.532 ( -35.515 -12.171 45.085) 58.670 31.760 ( -26.187 8.515 19.014) 33.463 32.017 ( -26.203 -3.367 21.226) 33.889 33.379 ( -5.585 -9.609 14.275) 18.092 35.657 ( 11.556 5.501 -3.487) 13.265 37.469 ( 1.266 -8.028 3.822) 8.981 41.697 ( 102.984 27.297 -66.722) 125.709 ======================= Grid point 362 (108/343) ======================= q-point: ( 0.23 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.691 ( 40.014 -34.501 40.551) 66.602 4.840 ( 49.994 -17.520 25.092) 58.617 6.451 ( 33.973 -29.856 63.080) 77.619 7.720 ( -19.350 -12.763 -10.688) 25.525 9.279 ( 52.657 -7.953 5.254) 53.513 10.030 ( -1.311 -14.429 7.309) 16.227 11.842 ( 18.935 -6.732 -14.670) 24.881 12.677 ( -2.312 -1.775 0.437) 2.947 15.121 ( -19.501 -5.951 3.850) 20.749 15.823 ( 4.517 17.434 -13.763) 22.666 16.316 ( -4.427 6.567 -2.204) 8.221 17.382 ( -11.235 -3.844 8.672) 14.704 19.064 ( 6.571 3.919 -26.977) 28.041 20.025 ( -10.947 -5.963 -21.210) 24.602 20.710 ( 1.441 10.986 -13.043) 17.114 23.463 ( -9.453 8.200 11.656) 17.102 23.906 ( -3.184 21.615 13.021) 25.434 24.800 ( -5.421 2.489 -20.099) 20.966 25.135 ( -2.405 -5.749 -14.425) 15.714 25.479 ( 5.689 -1.279 -24.441) 25.127 25.963 ( -0.901 -5.358 -28.652) 29.163 26.377 ( 0.771 -15.955 15.169) 22.029 28.826 ( -6.227 3.456 29.947) 30.783 29.438 ( -34.253 -16.277 39.763) 54.948 31.356 ( -27.503 4.776 8.477) 29.174 31.875 ( -5.973 5.272 25.733) 26.938 33.526 ( -4.939 -14.159 12.780) 19.703 35.684 ( 21.616 11.891 -5.565) 25.291 37.649 ( -0.605 -12.564 5.476) 13.719 41.999 ( 72.916 36.252 -47.301) 94.172 ======================= Grid point 363 (109/343) ======================= q-point: ( 0.31 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.433 ( 50.538 -2.567 12.181) 52.049 5.772 ( 33.039 -41.530 35.860) 64.049 7.216 ( 19.524 -26.682 26.065) 42.102 7.829 ( -6.773 -18.641 2.961) 20.053 10.028 ( 54.114 -14.711 7.731) 56.609 10.280 ( -1.287 -18.709 11.487) 21.992 11.924 ( -10.059 0.876 -5.330) 11.418 12.801 ( 15.983 -2.528 1.543) 16.255 15.048 ( -15.277 -5.829 -2.578) 16.553 15.629 ( 1.791 10.426 -11.197) 15.404 16.193 ( 0.705 3.613 1.563) 3.999 17.267 ( -15.692 1.808 9.151) 18.255 18.963 ( 3.855 13.206 -14.332) 19.867 20.124 ( -4.685 -14.166 -26.618) 30.514 20.528 ( -1.985 9.747 -18.654) 21.141 22.969 ( -13.227 31.870 13.604) 37.090 23.774 ( -2.865 -4.485 5.519) 7.667 24.715 ( -5.079 1.443 -19.619) 20.317 25.201 ( -1.406 -4.104 -17.509) 18.038 25.537 ( 6.138 1.401 -25.855) 26.611 26.028 ( -1.517 -3.778 -26.137) 26.452 26.535 ( -1.533 -2.144 10.087) 10.426 28.789 ( -6.816 -7.199 31.747) 33.259 29.403 ( -32.460 -19.743 36.995) 53.028 31.057 ( -15.455 7.062 7.599) 18.614 31.725 ( 0.019 8.165 23.570) 24.944 33.742 ( -4.068 -16.657 13.060) 21.554 35.667 ( 24.010 17.261 -4.518) 29.914 37.853 ( -3.940 -14.179 6.736) 16.184 42.009 ( 51.273 34.462 -33.222) 70.145 ======================= Grid point 364 (110/343) ======================= q-point: ( 0.38 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.843 ( 40.005 5.924 6.630) 40.981 6.734 ( 31.439 -33.518 26.285) 52.941 7.565 ( 4.799 -6.503 -5.516) 9.785 8.337 ( 15.047 -31.499 16.254) 38.507 10.415 ( -7.577 -12.790 8.529) 17.139 10.882 ( 32.380 -20.398 12.338) 40.209 11.757 ( -8.161 3.056 5.684) 10.404 12.957 ( 15.712 4.023 7.685) 17.947 14.990 ( -16.578 -3.226 -2.721) 17.107 15.516 ( 0.281 1.458 -14.014) 14.092 16.245 ( 9.622 -2.547 2.217) 10.197 17.021 ( -21.392 5.187 7.949) 23.404 18.768 ( 8.612 15.792 -2.145) 18.115 20.265 ( -8.800 -1.136 -4.951) 10.161 20.451 ( 3.626 -8.087 -46.035) 46.881 22.301 ( -13.936 30.350 8.419) 34.441 23.882 ( -3.044 -10.869 0.353) 11.293 24.655 ( -4.531 0.021 -17.415) 17.995 25.234 ( -0.278 -0.651 -18.309) 18.322 25.550 ( 3.945 3.230 -23.859) 24.398 26.060 ( -1.263 -1.848 -23.184) 23.292 26.422 ( -4.151 10.557 0.597) 11.359 28.923 ( -10.341 -18.021 31.641) 37.853 29.480 ( -22.992 -22.674 36.516) 48.746 30.778 ( -9.360 12.714 13.944) 21.064 31.639 ( 10.028 7.556 16.810) 20.982 33.985 ( -4.408 -17.253 13.412) 22.293 35.581 ( 23.457 21.120 -2.055) 31.631 38.031 ( -8.036 -14.000 7.412) 17.763 41.886 ( 33.531 30.093 -25.196) 51.621 ======================= Grid point 365 (111/343) ======================= q-point: ( 0.46 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.038 ( 29.268 11.200 5.794) 31.869 7.293 ( 18.565 -0.121 -0.786) 18.583 7.868 ( 15.171 -21.783 12.609) 29.388 8.904 ( 16.943 -13.759 -0.613) 21.835 10.444 ( -18.114 -5.870 8.856) 21.001 11.267 ( -2.328 -11.983 13.499) 18.200 11.833 ( 9.004 -8.466 15.296) 19.665 12.974 ( 14.928 11.806 14.876) 24.157 14.799 ( -24.124 -0.549 -0.211) 24.131 15.601 ( 1.819 -5.426 -19.363) 20.191 16.395 ( 14.285 1.071 4.184) 14.924 16.745 ( -21.760 -2.255 3.614) 22.173 18.638 ( 16.781 15.125 11.397) 25.304 20.134 ( -5.544 3.558 -15.627) 16.959 20.713 ( 2.344 -15.328 -37.130) 40.238 21.736 ( -12.450 20.996 0.166) 24.410 24.053 ( -2.961 -12.626 -6.619) 14.560 24.629 ( -4.013 -1.982 -13.300) 14.032 25.195 ( -1.459 5.489 -11.411) 12.747 25.505 ( 0.132 3.841 -25.510) 25.797 26.071 ( -0.636 -0.799 -20.293) 20.318 26.199 ( -1.661 9.876 -8.873) 13.380 29.139 ( -16.012 -22.302 27.093) 38.572 29.703 ( -9.853 -23.241 38.714) 46.217 30.446 ( -7.496 16.958 21.882) 28.680 31.673 ( 21.976 7.533 9.992) 25.289 34.220 ( -5.205 -16.605 12.942) 21.687 35.431 ( 21.719 23.391 0.990) 31.935 38.154 ( -12.222 -12.604 7.360) 19.037 41.673 ( 17.288 25.498 -20.724) 37.129 ======================= Grid point 366 (112/343) ======================= q-point: (-0.46 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.047 ( 20.526 17.109 7.018) 27.628 7.326 ( 11.213 10.392 -6.225) 16.507 8.218 ( 6.934 1.440 13.973) 15.665 9.154 ( 17.815 1.020 -8.059) 19.580 10.321 ( -25.115 -8.619 8.680) 27.936 11.428 ( 10.816 -1.309 11.888) 16.125 11.938 ( -19.741 -5.213 18.303) 27.420 12.908 ( 17.096 10.727 20.318) 28.638 14.610 ( -24.511 -6.038 0.473) 25.248 15.546 ( -18.163 3.672 -17.034) 25.170 16.444 ( 15.604 7.726 3.845) 17.832 16.840 ( -2.495 -21.187 -2.252) 21.452 18.559 ( 19.851 17.068 22.017) 34.207 20.109 ( 2.277 -3.524 -22.824) 23.206 20.930 ( -1.584 -6.499 -30.648) 31.369 21.407 ( -7.538 3.157 -5.007) 9.584 24.211 ( -2.949 -8.557 -15.758) 18.173 24.640 ( -3.054 -2.894 -5.736) 7.113 25.024 ( -7.048 7.289 -7.750) 12.762 25.465 ( 0.398 1.030 -26.756) 26.779 26.066 ( -0.623 0.787 -17.793) 17.821 26.120 ( 3.300 0.539 -14.861) 15.233 29.329 ( -17.746 -20.329 22.300) 35.007 30.017 ( 2.580 -5.406 33.404) 33.937 30.104 ( -10.075 0.735 35.480) 36.890 31.811 ( 33.183 8.671 5.466) 34.730 34.428 ( -5.614 -14.534 11.117) 19.140 35.240 ( 19.979 23.569 4.366) 31.205 38.206 ( -16.170 -10.241 6.604) 20.247 41.377 ( 1.106 21.014 -18.151) 27.789 ======================= Grid point 367 (113/343) ======================= q-point: (-0.38 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.881 ( 15.399 23.895 10.135) 30.180 7.118 ( -5.725 21.215 -0.739) 21.986 8.034 ( 5.730 20.696 15.876) 26.706 9.138 ( 3.466 15.769 -5.464) 17.045 10.294 ( -18.547 -8.232 2.354) 20.427 11.409 ( 0.369 14.187 12.828) 19.130 11.675 ( -15.232 4.276 10.368) 18.916 13.020 ( 20.605 1.789 22.341) 30.445 14.512 ( -26.727 -11.544 -4.891) 29.522 15.258 ( -27.959 -2.391 -5.884) 28.671 16.447 ( 16.029 12.559 -0.422) 20.368 17.267 ( 6.198 -25.361 -3.224) 26.306 18.459 ( 16.888 15.740 22.788) 32.439 20.262 ( 7.379 -6.307 -28.419) 30.031 20.833 ( -3.896 9.731 -27.033) 28.994 21.563 ( -0.117 -22.374 0.226) 22.376 24.241 ( -2.394 2.510 -13.810) 14.239 24.629 ( -0.860 0.979 -7.825) 7.932 24.937 ( -10.192 -7.673 -16.065) 20.515 25.461 ( 0.405 0.625 -21.763) 21.775 26.063 ( 0.457 -0.378 -20.383) 20.391 26.197 ( 3.079 -5.508 -11.412) 13.040 29.462 ( -13.039 -12.440 20.344) 27.178 29.711 ( -4.010 16.088 32.025) 36.062 30.450 ( 0.096 -24.513 41.216) 47.955 32.030 ( 42.633 9.834 2.656) 43.833 34.564 ( -4.878 -6.196 6.605) 10.287 35.080 ( 19.828 16.870 9.182) 27.606 38.174 ( -19.962 -7.277 5.286) 21.895 40.991 ( -16.048 16.869 -16.604) 28.597 ======================= Grid point 368 (114/343) ======================= q-point: (-0.31 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.549 ( 10.413 31.925 16.030) 37.210 6.498 ( -18.318 36.368 12.575) 42.618 7.718 ( 1.066 23.758 22.102) 32.467 8.795 ( -12.578 17.306 -2.211) 21.508 9.964 ( -12.543 26.706 0.327) 29.506 11.136 ( 3.555 17.427 9.931) 20.370 11.599 ( -13.017 -5.835 1.885) 14.389 13.127 ( 19.312 9.909 12.944) 25.272 14.442 ( -27.138 -14.031 -16.508) 34.726 15.246 ( -18.210 -23.955 11.361) 32.164 16.314 ( 9.507 18.185 -0.877) 20.539 17.735 ( 13.431 -17.372 -1.428) 22.005 18.403 ( 7.680 4.573 16.343) 18.628 20.350 ( -1.871 1.469 -39.390) 39.462 20.680 ( 6.167 7.480 -18.625) 20.997 22.057 ( 4.404 -33.205 10.374) 35.066 24.108 ( -1.005 9.644 -2.107) 9.923 24.654 ( 0.880 -4.060 -23.310) 23.677 25.001 ( -10.198 -10.199 -21.558) 25.938 25.439 ( -0.227 2.223 -17.499) 17.641 26.077 ( 0.571 -0.487 -22.418) 22.431 26.346 ( 0.408 -9.441 -6.081) 11.237 29.301 ( -2.058 17.042 32.836) 37.052 29.662 ( -7.348 -11.684 22.965) 26.793 30.856 ( 0.731 -23.553 39.131) 45.678 32.311 ( 47.448 10.090 1.262) 48.525 34.496 ( -0.211 9.839 1.558) 9.964 35.138 ( 22.793 1.680 13.314) 26.450 38.055 ( -24.193 -4.489 3.623) 24.871 40.491 ( -34.632 13.755 -15.529) 40.370 ======================= Grid point 369 (115/343) ======================= q-point: (-0.23 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.996 ( 0.503 41.553 25.498) 48.756 5.641 ( -17.787 43.540 26.498) 53.984 7.202 ( -9.388 34.039 35.365) 49.975 8.330 ( -28.017 12.944 2.219) 30.942 9.470 ( 19.526 32.054 -4.175) 37.765 10.842 ( 5.797 23.438 6.703) 25.057 11.439 ( -29.154 2.541 -7.670) 30.253 13.108 ( 14.616 10.849 3.803) 18.595 14.570 ( -15.126 -27.712 -19.117) 36.908 15.586 ( -6.375 -27.828 15.281) 32.381 16.064 ( 3.675 18.056 1.630) 18.499 18.018 ( 20.817 5.544 5.897) 22.335 18.500 ( -6.870 -16.177 2.091) 17.699 20.236 ( -4.114 5.076 -41.679) 42.188 20.671 ( 7.111 3.758 -13.387) 15.617 22.702 ( 6.127 -36.714 16.497) 40.713 23.939 ( -0.240 9.378 3.724) 10.093 24.763 ( 3.829 -5.769 -28.935) 29.752 25.055 ( -10.146 -8.375 -25.976) 29.118 25.383 ( -0.366 4.017 -15.638) 16.150 26.083 ( 0.464 0.675 -24.479) 24.493 26.481 ( -1.921 -6.580 -0.771) 6.898 29.030 ( 0.071 12.987 36.136) 38.398 29.802 ( -2.153 -10.055 22.009) 24.293 31.233 ( 0.312 -20.775 35.891) 41.471 32.598 ( 41.030 8.715 2.526) 42.021 34.316 ( 4.355 12.533 -2.567) 13.514 35.446 ( 40.189 -2.011 14.488) 42.768 37.851 ( -30.651 -3.313 1.946) 30.891 39.839 ( -53.267 13.231 -14.171) 56.686 ======================= Grid point 370 (116/343) ======================= q-point: (-0.15 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.199 ( -8.898 47.373 37.141) 60.851 4.748 ( -11.085 45.917 39.891) 61.827 6.423 ( -10.506 45.396 56.463) 73.207 7.962 ( -15.619 2.854 0.583) 15.889 9.213 ( 21.790 27.645 -7.063) 35.901 10.501 ( 6.714 24.485 7.458) 26.462 11.015 ( -29.696 8.844 -18.011) 35.840 13.070 ( 7.487 6.882 -0.713) 10.194 15.019 ( -4.084 -35.059 -20.739) 40.938 15.776 ( 4.884 13.940 4.434) 15.422 16.019 ( -4.439 -22.406 12.756) 26.162 17.999 ( 11.208 13.772 7.595) 19.312 18.718 ( -5.644 -14.457 -11.112) 19.088 20.169 ( -0.763 -0.713 -33.744) 33.760 20.665 ( 2.414 2.721 -11.366) 11.934 23.357 ( 4.595 -34.889 19.046) 40.014 23.799 ( -0.784 6.674 7.419) 10.010 24.905 ( 6.585 -4.599 -24.771) 26.041 25.086 ( -9.325 -7.253 -31.444) 33.590 25.304 ( -0.284 4.911 -15.511) 16.273 26.057 ( 0.272 3.102 -26.922) 27.101 26.492 ( -1.679 3.942 4.348) 6.104 28.898 ( 0.901 3.162 35.341) 35.493 29.941 ( 1.270 -6.947 21.943) 23.052 31.538 ( -0.054 -15.268 31.496) 35.002 32.797 ( 21.253 4.180 8.443) 23.247 34.186 ( 7.184 10.598 -9.579) 15.991 36.044 ( 74.823 -4.064 14.005) 76.231 37.560 ( -46.340 -6.551 0.988) 46.811 39.002 ( -61.669 18.878 -10.681) 65.372 ======================= Grid point 371 (117/343) ======================= q-point: (-0.08 0.08 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.369 ( 0.000 42.288 48.727) 64.518 3.931 ( 0.000 44.568 52.115) 68.573 5.616 ( 0.000 41.673 79.965) 90.172 7.918 ( -0.000 -5.134 -1.982) 5.503 8.896 ( 0.000 23.631 -7.245) 24.717 10.148 ( 0.000 21.539 7.987) 22.972 10.724 ( 0.000 6.392 -25.131) 25.931 13.020 ( 0.000 3.716 -2.432) 4.441 15.579 ( -0.000 -32.593 -21.596) 39.099 15.612 ( 0.000 6.730 8.072) 10.509 16.317 ( -0.000 -13.827 5.654) 14.939 17.810 ( 0.000 15.140 5.159) 15.995 18.835 ( -0.000 -3.438 -22.484) 22.745 20.240 ( -0.000 -7.059 -20.871) 22.033 20.635 ( 0.000 1.710 -10.313) 10.454 23.700 ( 0.000 3.889 9.511) 10.276 23.939 ( -0.000 -31.071 18.205) 36.011 25.006 ( -0.000 -2.253 -7.344) 7.682 25.138 ( -0.000 -4.819 -41.639) 41.917 25.227 ( 0.000 3.366 -15.842) 16.195 25.982 ( 0.000 5.972 -29.990) 30.579 26.316 ( 0.000 15.579 8.743) 17.865 28.928 ( -0.000 -5.015 31.622) 32.017 30.043 ( -0.000 -3.638 21.335) 21.643 31.733 ( -0.000 -8.549 26.860) 28.188 32.901 ( -0.000 -5.094 15.870) 16.668 34.045 ( 0.000 13.418 -13.687) 19.167 36.974 ( -0.000 -6.969 3.628) 7.857 37.170 ( -0.000 -19.396 4.712) 19.960 38.168 ( 0.000 29.715 -4.393) 30.038 ======================= Grid point 374 (118/343) ======================= q-point: ( 0.15 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.813 ( 29.469 -0.000 54.015) 61.531 4.610 ( 61.935 -0.000 34.647) 70.967 5.965 ( 56.537 -0.000 77.062) 95.578 7.496 ( -18.192 0.000 -12.036) 21.813 9.141 ( 45.055 -0.000 3.220) 45.170 9.820 ( 9.157 -0.000 4.227) 10.085 11.678 ( 22.103 -0.000 -17.855) 28.413 12.661 ( -2.037 0.000 -0.827) 2.198 15.014 ( -23.883 0.000 9.025) 25.531 16.130 ( -16.730 0.000 3.460) 17.084 16.475 ( 3.679 -0.000 -26.744) 26.996 17.276 ( -0.706 0.000 7.147) 7.182 19.065 ( 10.298 -0.000 -35.772) 37.225 19.944 ( -18.643 0.000 -14.127) 23.391 20.962 ( 2.418 -0.000 -14.343) 14.546 23.500 ( -7.103 0.000 10.390) 12.585 24.607 ( 0.099 -0.000 1.177) 1.182 24.828 ( -4.499 0.000 -7.259) 8.540 25.007 ( -4.733 0.000 -9.047) 10.210 25.442 ( 2.840 -0.000 -4.505) 5.325 25.661 ( -10.119 0.000 9.622) 13.964 25.999 ( 5.740 -0.000 -27.940) 28.524 28.965 ( -45.522 0.000 63.029) 77.749 29.091 ( 1.848 -0.000 16.293) 16.398 31.483 ( -31.462 0.000 2.082) 31.531 31.915 ( -2.296 0.000 26.908) 27.006 33.288 ( 0.161 -0.000 15.461) 15.461 35.906 ( 26.259 -0.000 -9.794) 28.026 37.420 ( 2.058 -0.000 7.061) 7.354 42.781 ( 68.575 -0.000 -74.592) 101.324 ======================= Grid point 375 (119/343) ======================= q-point: ( 0.23 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.366 ( 25.455 -32.347 45.652) 61.469 5.254 ( 56.667 -7.801 36.535) 67.873 6.578 ( 51.583 -3.876 52.706) 73.850 7.456 ( -0.852 -7.831 -8.158) 11.340 9.630 ( 36.475 -8.693 7.792) 38.298 9.995 ( 28.482 -0.063 3.670) 28.718 11.810 ( -5.064 -4.531 -12.694) 14.398 12.748 ( 19.461 -0.543 -2.021) 19.573 14.806 ( -24.823 -4.503 7.029) 26.189 15.910 ( -21.796 2.162 2.859) 22.089 16.428 ( 3.682 9.005 -22.081) 24.129 17.302 ( 0.830 -0.832 5.465) 5.590 19.167 ( 8.639 0.887 -35.526) 36.572 19.788 ( -17.946 -4.960 -17.536) 25.577 20.883 ( -2.947 8.105 -13.261) 15.819 23.427 ( -7.442 0.345 10.266) 12.684 24.321 ( -3.131 27.732 13.655) 31.070 24.777 ( -7.342 2.203 -12.733) 14.863 25.008 ( -2.813 -5.574 -13.927) 15.263 25.426 ( -2.252 -4.016 -12.616) 13.429 25.812 ( -4.491 -15.403 -6.578) 17.340 26.119 ( 2.732 -10.567 -5.942) 12.427 28.603 ( -37.793 -7.227 58.219) 69.785 29.085 ( -2.332 2.411 16.453) 16.791 31.231 ( -14.286 3.006 -3.267) 14.960 31.871 ( -6.224 0.651 25.756) 26.505 33.354 ( 2.591 -5.919 15.670) 16.950 36.123 ( 30.771 8.346 -11.522) 33.900 37.492 ( 0.978 -6.219 9.616) 11.493 43.112 ( 45.956 23.749 -59.426) 78.788 ======================= Grid point 376 (120/343) ======================= q-point: ( 0.31 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.293 ( 22.359 -47.782 36.814) 64.330 5.958 ( 57.583 -7.320 20.995) 61.727 7.013 ( 20.716 -8.710 31.348) 38.571 7.750 ( 27.423 -9.286 5.487) 29.468 9.978 ( 2.512 -10.378 7.776) 13.209 10.485 ( 57.776 -3.896 7.478) 58.388 11.756 ( -15.892 -3.912 -5.582) 17.293 13.003 ( 26.724 -0.248 -1.871) 26.791 14.687 ( -24.243 -9.966 3.386) 26.429 15.648 ( -25.546 1.311 1.493) 25.623 16.318 ( 8.574 9.128 -16.033) 20.344 17.265 ( -1.777 5.646 4.908) 7.689 19.143 ( 0.327 6.980 -25.612) 26.548 19.821 ( -8.254 -14.119 -25.784) 30.534 20.682 ( -4.738 10.135 -15.207) 18.879 23.267 ( -10.442 14.580 12.591) 21.912 23.818 ( -5.655 18.723 13.750) 23.908 24.660 ( -9.838 0.804 -13.380) 16.627 25.098 ( -0.934 -6.460 -18.738) 19.842 25.517 ( -1.404 -7.084 -19.753) 21.032 25.940 ( -1.482 -4.898 -27.080) 27.559 26.372 ( -1.172 -14.872 15.525) 21.531 28.446 ( -32.094 -14.275 49.404) 60.618 28.993 ( -5.522 1.703 20.319) 21.125 31.088 ( -3.249 5.176 -2.114) 6.467 31.793 ( -4.242 1.198 22.105) 22.540 33.521 ( 3.630 -9.959 16.876) 19.929 36.222 ( 30.625 15.971 -10.388) 36.067 37.620 ( -2.399 -9.300 11.197) 14.752 43.010 ( 33.218 32.816 -42.619) 63.219 ======================= Grid point 377 (121/343) ======================= q-point: ( 0.38 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.255 ( 21.136 -33.656 22.104) 45.476 6.561 ( 55.260 -3.288 11.886) 56.620 7.408 ( 11.394 -19.570 12.521) 25.876 8.240 ( 38.322 -11.904 19.055) 44.422 10.116 ( -7.160 -9.865 9.195) 15.269 10.939 ( 12.231 -1.045 5.476) 13.441 11.784 ( 16.565 -3.953 3.072) 17.305 13.216 ( 21.579 3.940 3.309) 22.184 14.635 ( -24.810 -10.968 0.494) 27.130 15.389 ( -26.899 -3.404 -2.979) 27.277 16.341 ( 15.578 2.572 -9.710) 18.536 17.071 ( -5.806 12.615 3.725) 14.378 19.014 ( 1.406 7.506 -15.679) 17.439 20.022 ( -5.180 -15.207 -19.741) 25.451 20.498 ( -1.550 6.560 -27.885) 28.688 22.682 ( -16.208 33.459 15.380) 40.233 23.705 ( -3.906 -5.450 5.369) 8.590 24.564 ( -10.856 -1.501 -11.587) 15.949 25.188 ( 0.611 -4.301 -21.672) 22.103 25.593 ( 0.175 -2.107 -21.939) 22.041 25.988 ( -2.511 -3.701 -26.979) 27.348 26.489 ( -2.819 -0.401 9.088) 9.524 28.428 ( -27.712 -18.959 39.859) 52.117 29.003 ( -5.538 -10.750 30.342) 32.663 30.939 ( -1.566 11.112 5.878) 12.668 31.795 ( 6.621 -0.859 13.771) 15.304 33.740 ( 3.484 -11.873 18.104) 21.928 36.198 ( 28.346 21.569 -7.892) 36.483 37.738 ( -7.657 -10.465 11.964) 17.643 42.724 ( 23.522 34.348 -31.302) 52.085 ======================= Grid point 378 (122/343) ======================= q-point: ( 0.46 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.619 ( 34.925 12.538 1.331) 37.131 7.343 ( 33.433 -26.722 21.463) 47.880 7.768 ( 18.021 -6.844 0.359) 19.281 8.900 ( 37.558 -18.162 13.258) 43.775 10.155 ( -16.763 -7.400 9.220) 20.512 10.876 ( -21.484 -7.715 16.932) 28.421 12.047 ( 24.591 4.829 2.386) 25.174 13.290 ( 13.923 8.828 11.713) 20.223 14.499 ( -26.235 -3.664 1.042) 26.510 15.325 ( -20.960 -16.461 -10.995) 28.831 16.440 ( 3.538 2.761 -4.460) 6.327 16.827 ( 7.370 11.239 1.172) 13.491 18.962 ( 10.388 5.179 -4.337) 12.391 20.117 ( -5.449 -1.741 -3.273) 6.591 20.516 ( 2.557 -8.540 -46.488) 47.335 21.982 ( -18.689 27.927 9.895) 35.030 23.820 ( -2.965 -11.317 -0.283) 11.702 24.496 ( -11.871 -3.741 -9.621) 15.732 25.237 ( 1.148 0.255 -19.701) 19.736 25.581 ( 0.300 3.667 -22.666) 22.963 26.020 ( -2.603 -3.286 -24.182) 24.543 26.362 ( -2.196 10.060 -2.744) 10.656 28.536 ( -24.041 -24.200 33.593) 47.876 29.232 ( -3.634 -21.163 37.981) 43.631 30.686 ( -2.951 16.134 14.958) 22.198 31.947 ( 19.115 -1.524 5.473) 19.941 33.975 ( 3.434 -12.173 18.593) 22.488 36.069 ( 24.978 25.074 -4.703) 35.703 37.810 ( -14.018 -10.909 11.783) 21.315 42.343 ( 14.331 33.797 -24.413) 44.087 ======================= Grid point 379 (123/343) ======================= q-point: ( 0.54 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.673 ( 34.995 21.387 3.321) 41.148 7.701 ( 21.629 13.403 -5.625) 26.060 8.226 ( 21.814 -18.092 19.637) 34.479 9.385 ( 27.314 -0.497 -3.126) 27.497 9.971 ( -28.216 0.921 4.738) 28.626 11.045 ( -12.919 -31.592 33.738) 47.992 12.035 ( 7.393 13.214 0.552) 15.152 13.165 ( -2.757 10.899 16.600) 20.048 14.335 ( -14.939 -1.199 2.958) 15.277 15.327 ( -27.448 -5.321 -16.435) 32.432 16.393 ( -6.898 -10.279 0.350) 12.384 16.878 ( 24.227 7.901 -3.011) 25.660 19.025 ( 21.832 8.360 10.289) 25.542 20.079 ( -0.091 -0.300 -12.188) 12.192 20.727 ( -1.200 -13.373 -37.412) 39.748 21.441 ( -17.609 14.517 0.069) 22.822 23.997 ( -2.489 -12.322 -7.723) 14.754 24.461 ( -12.606 -6.837 -6.807) 15.874 25.160 ( -0.587 10.143 -10.579) 14.668 25.514 ( 1.328 3.699 -27.831) 28.107 26.045 ( -1.434 -2.067 -21.456) 21.603 26.202 ( 0.221 6.417 -11.337) 13.029 28.736 ( -20.667 -25.659 28.621) 43.642 29.598 ( -1.844 -25.230 41.493) 48.596 30.363 ( -2.727 18.837 21.962) 29.062 32.201 ( 28.106 -0.680 -0.152) 28.115 34.209 ( 4.498 -11.278 18.007) 21.718 35.867 ( 21.679 26.241 -1.162) 34.058 37.820 ( -21.126 -10.862 10.692) 26.050 41.882 ( 5.133 33.141 -20.011) 39.052 ======================= Grid point 380 (124/343) ======================= q-point: (-0.38 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.602 ( 35.894 29.212 7.443) 46.874 7.508 ( 5.295 25.357 -3.639) 26.158 8.457 ( 18.139 14.743 15.973) 28.311 9.349 ( -16.957 15.211 -0.636) 22.789 9.935 ( 0.960 -20.308 3.502) 20.630 11.285 ( -19.810 -6.074 16.645) 26.578 11.908 ( 14.164 11.919 5.050) 19.188 13.081 ( -1.994 -10.536 23.534) 25.862 14.187 ( -14.115 2.962 1.711) 14.524 14.978 ( -33.741 5.548 -11.790) 36.170 16.691 ( 4.710 -19.327 -2.124) 20.006 16.946 ( 12.751 3.315 -3.529) 13.639 19.021 ( 25.608 21.461 19.380) 38.625 20.192 ( 4.542 -9.448 -23.550) 25.778 20.859 ( -4.606 -3.417 -25.869) 26.497 21.228 ( -10.627 -9.175 -4.544) 14.757 24.142 ( -3.835 -7.751 -16.007) 18.193 24.496 ( -10.041 -11.133 -3.476) 15.390 24.937 ( -0.949 13.195 -11.051) 17.238 25.491 ( 1.812 1.652 -26.263) 26.377 26.062 ( 0.313 -0.721 -19.833) 19.849 26.160 ( 0.027 -0.690 -14.078) 14.095 28.970 ( -16.076 -23.884 24.845) 38.028 29.994 ( -1.938 -3.996 35.882) 36.156 30.039 ( -0.424 -2.230 34.399) 34.473 32.506 ( 32.613 0.320 -4.350) 32.904 34.429 ( 6.086 -8.198 15.737) 18.759 35.653 ( 21.697 23.624 2.839) 32.201 37.750 ( -29.327 -10.280 9.070) 32.373 41.340 ( -3.794 33.071 -16.811) 37.292 ======================= Grid point 381 (125/343) ======================= q-point: (-0.31 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.385 ( 33.662 39.346 13.913) 53.617 6.979 ( -6.462 36.229 4.391) 37.062 8.187 ( 3.227 28.243 19.129) 34.264 8.826 ( -29.902 15.578 3.802) 33.931 10.268 ( 15.413 -0.504 -5.624) 16.415 11.068 ( -20.282 -2.034 6.093) 21.275 11.769 ( 9.306 20.013 7.123) 23.192 13.412 ( 17.512 -8.937 18.597) 27.063 13.992 ( -21.920 -3.836 -7.350) 23.435 14.671 ( -28.624 -11.905 4.863) 31.380 16.730 ( 11.079 18.287 -4.612) 21.873 17.307 ( -0.602 -32.603 -0.904) 32.621 18.844 ( 18.524 24.457 18.211) 35.678 20.334 ( -1.228 -2.362 -37.178) 37.273 20.828 ( 4.124 3.703 -21.235) 21.947 21.520 ( -3.745 -31.505 8.845) 32.937 24.167 ( -4.271 -0.225 -12.443) 13.157 24.605 ( -1.830 -7.187 -9.173) 11.796 24.781 ( -4.340 0.441 -20.714) 21.168 25.477 ( 0.942 1.882 -20.627) 20.735 26.078 ( 0.993 -0.344 -20.566) 20.593 26.211 ( -1.165 -5.937 -11.475) 12.973 29.201 ( -10.504 -18.550 22.360) 30.893 29.690 ( 0.185 17.354 33.419) 37.657 30.442 ( -0.526 -25.647 41.263) 48.587 32.807 ( 30.284 1.543 -7.292) 31.188 34.552 ( 3.333 0.850 10.027) 10.601 35.595 ( 33.102 12.481 8.298) 36.337 37.577 ( -39.560 -9.238 7.492) 41.309 40.708 ( -11.101 34.093 -14.023) 38.499 ======================= Grid point 382 (126/343) ======================= q-point: (-0.23 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.894 ( 18.133 51.796 23.741) 59.793 6.237 ( -7.855 42.755 15.168) 46.041 7.670 ( -6.376 29.326 21.644) 37.002 8.302 ( -20.589 16.370 9.197) 27.865 10.202 ( 22.656 26.969 -8.024) 36.125 10.992 ( -17.003 -6.054 -5.439) 18.850 11.452 ( -0.726 23.011 8.991) 24.716 13.468 ( 12.088 16.336 6.915) 21.466 14.010 ( -13.712 -21.188 -17.614) 30.776 14.928 ( -10.735 -37.575 21.507) 44.606 16.458 ( 4.108 22.077 -2.477) 22.592 17.849 ( 1.247 -31.097 -0.901) 31.135 18.599 ( 7.655 20.269 14.468) 26.053 20.279 ( -3.053 4.042 -43.137) 43.433 20.805 ( 4.293 4.889 -17.301) 18.484 22.112 ( 1.299 -38.543 17.090) 42.182 24.077 ( -1.311 6.993 -2.111) 7.421 24.699 ( 3.620 -5.073 -27.290) 27.993 24.821 ( -7.313 -9.005 -22.572) 25.378 25.443 ( 0.273 3.011 -16.284) 16.562 26.090 ( 0.531 -0.158 -22.321) 22.328 26.326 ( -1.301 -8.892 -6.500) 11.092 29.240 ( -2.594 9.212 30.205) 31.685 29.586 ( -1.121 -8.722 28.511) 29.836 30.854 ( -0.316 -24.229 38.890) 45.821 33.009 ( 18.739 4.277 -6.993) 20.453 34.470 ( -0.772 8.061 2.799) 8.568 35.937 ( 53.342 -1.852 11.081) 54.512 37.268 ( -52.408 -7.440 6.872) 53.378 39.999 ( -12.948 36.342 -11.123) 40.151 ======================= Grid point 383 (127/343) ======================= q-point: (-0.15 0.15 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.054 ( 0.000 55.955 32.132) 64.524 5.458 ( 0.000 45.462 27.503) 53.134 7.085 ( 0.000 38.465 36.252) 52.856 7.970 ( 0.000 9.448 5.355) 10.860 9.838 ( 0.000 31.212 -6.089) 31.800 10.930 ( 0.000 2.626 -17.380) 17.577 11.003 ( 0.000 27.551 10.849) 29.610 13.270 ( 0.000 12.606 1.790) 12.732 14.412 ( -0.000 -33.073 -19.223) 38.254 15.503 ( -0.000 -34.307 19.705) 39.563 16.112 ( 0.000 21.010 0.582) 21.018 18.319 ( 0.000 17.074 10.856) 20.233 18.342 ( -0.000 -25.831 -3.280) 26.039 20.192 ( 0.000 3.812 -42.046) 42.219 20.745 ( 0.000 4.690 -13.536) 14.325 22.765 ( -0.000 -38.198 19.406) 42.845 23.934 ( 0.000 8.947 3.865) 9.746 24.858 ( -0.000 -9.649 -39.475) 40.637 24.890 ( -0.000 -5.246 -19.096) 19.804 25.383 ( 0.000 4.338 -14.357) 14.998 26.089 ( 0.000 0.810 -24.486) 24.499 26.455 ( -0.000 -6.260 -1.484) 6.433 29.028 ( 0.000 11.534 36.448) 38.230 29.779 ( -0.000 -12.080 23.421) 26.353 31.232 ( -0.000 -21.037 35.546) 41.305 33.005 ( 0.000 7.256 -0.914) 7.313 34.337 ( 0.000 6.965 -5.074) 8.618 36.576 ( -0.000 -15.947 8.070) 17.873 36.863 ( -0.000 -0.295 8.574) 8.579 39.298 ( 0.000 37.364 -8.313) 38.278 ======================= Grid point 388 (128/343) ======================= q-point: ( 0.23 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.269 ( 15.533 -0.000 43.704) 46.382 5.688 ( 48.935 -0.000 57.095) 75.196 7.187 ( 62.775 -0.000 27.896) 68.694 7.422 ( 11.617 -0.000 -5.952) 13.053 9.784 ( 17.324 -0.000 8.907) 19.479 10.481 ( 60.219 -0.000 3.853) 60.342 11.642 ( -18.880 0.000 -10.177) 21.449 12.995 ( 29.502 -0.000 -3.117) 29.666 14.507 ( -27.245 0.000 7.011) 28.132 15.635 ( -32.764 0.000 7.142) 33.534 16.560 ( 5.102 -0.000 -24.350) 24.878 17.335 ( 5.561 -0.000 1.885) 5.872 19.282 ( 11.510 -0.000 -40.351) 41.961 19.532 ( -22.868 0.000 -16.479) 28.187 20.881 ( -10.803 0.000 -13.533) 17.316 23.357 ( -7.124 0.000 10.138) 12.390 24.568 ( -5.487 0.000 -2.305) 5.952 24.755 ( -2.596 0.000 5.203) 5.815 24.944 ( -1.415 0.000 -14.678) 14.746 25.366 ( -18.681 0.000 21.771) 28.687 25.477 ( 0.650 -0.000 -9.930) 9.952 26.092 ( 3.274 -0.000 -25.492) 25.702 28.175 ( -32.545 0.000 58.166) 66.652 29.155 ( 4.548 -0.000 9.912) 10.906 31.149 ( -6.678 0.000 -7.716) 10.204 31.790 ( -10.112 0.000 23.375) 25.469 33.354 ( 6.319 -0.000 17.776) 18.865 36.517 ( 33.429 -0.000 -14.455) 36.421 37.457 ( 1.670 -0.000 13.449) 13.553 43.649 ( 25.160 -0.000 -56.304) 61.670 ======================= Grid point 389 (129/343) ======================= q-point: ( 0.31 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.709 ( 10.395 -36.229 36.570) 52.516 6.253 ( 45.263 -12.614 58.406) 74.961 7.412 ( 33.851 14.640 7.060) 37.551 7.931 ( 43.613 -11.468 4.521) 45.321 9.962 ( 13.856 -1.041 8.383) 16.228 11.048 ( 50.010 5.791 2.939) 50.430 11.526 ( -6.154 -8.858 -4.731) 11.778 13.283 ( 28.383 0.816 -2.065) 28.470 14.295 ( -26.227 -6.518 5.197) 27.520 15.304 ( -37.635 -1.978 7.719) 38.469 16.556 ( 8.851 6.498 -21.211) 23.885 17.360 ( 3.548 4.065 -0.202) 5.400 19.218 ( -9.794 5.987 -25.276) 27.760 19.531 ( -1.575 -11.944 -33.155) 35.276 20.709 ( -14.888 3.908 -14.536) 21.171 23.285 ( -6.741 1.233 10.037) 12.154 24.231 ( -7.906 32.192 20.164) 38.800 24.565 ( -13.202 3.691 -6.081) 14.996 24.977 ( -0.507 -6.385 -15.134) 16.433 25.344 ( -4.087 -9.022 -9.047) 13.414 25.722 ( -4.149 -20.436 -1.299) 20.894 26.155 ( 0.412 -6.398 -13.556) 14.996 27.959 ( -25.151 -7.301 51.597) 57.863 29.118 ( 3.675 9.097 9.929) 13.959 31.120 ( 0.166 0.088 -7.072) 7.074 31.698 ( -10.559 -2.384 19.315) 22.141 33.462 ( 7.646 -4.414 19.924) 21.792 36.756 ( 32.173 10.067 -14.334) 36.632 37.504 ( 0.142 -3.689 15.781) 16.207 43.679 ( 15.437 18.038 -45.422) 51.252 ======================= Grid point 390 (130/343) ======================= q-point: ( 0.38 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.579 ( 9.327 -53.214 27.107) 60.444 6.979 ( 43.928 -20.721 42.654) 64.640 7.523 ( 34.964 11.827 13.089) 39.162 8.492 ( 38.990 -7.596 3.848) 39.909 10.044 ( 6.100 3.345 7.872) 10.506 11.038 ( -8.200 9.071 -3.567) 12.737 11.973 ( 43.474 -8.270 4.378) 44.469 13.490 ( 20.550 3.747 1.518) 20.944 14.208 ( -22.507 -11.035 2.062) 25.151 14.976 ( -38.584 -4.688 5.378) 39.238 16.583 ( 16.973 4.687 -15.857) 23.696 17.235 ( -2.587 11.297 -1.682) 11.711 19.056 ( -8.414 1.733 -20.836) 22.537 19.738 ( -0.898 -13.277 -30.077) 32.889 20.517 ( -11.958 1.703 -22.278) 25.341 23.050 ( -11.834 23.787 16.911) 31.494 23.681 ( -8.488 12.751 16.349) 22.404 24.419 ( -12.976 -0.471 -6.554) 14.545 25.106 ( 1.642 -7.432 -19.544) 20.974 25.475 ( -1.673 -9.082 -16.685) 19.070 25.904 ( -2.052 -5.401 -25.046) 25.704 26.329 ( -3.405 -13.505 10.086) 17.196 27.902 ( -20.850 -12.605 45.077) 51.240 28.983 ( 1.846 7.630 16.283) 18.077 31.084 ( 0.356 6.620 1.220) 6.741 31.726 ( -1.559 -9.569 9.774) 13.767 33.639 ( 7.616 -7.574 21.622) 24.143 36.818 ( 28.853 18.241 -12.320) 36.291 37.558 ( -3.776 -4.409 16.889) 17.859 43.418 ( 10.942 27.472 -35.153) 45.937 ======================= Grid point 391 (131/343) ======================= q-point: ( 0.46 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.538 ( 12.170 -45.693 16.401) 50.049 7.625 ( 47.674 5.347 10.378) 49.083 7.825 ( 29.779 -14.897 24.897) 41.576 8.999 ( 32.382 -14.146 15.132) 38.441 9.977 ( -5.523 4.749 7.448) 10.418 10.757 ( -11.046 11.627 2.584) 16.245 12.359 ( 21.719 4.157 1.368) 22.155 13.533 ( 5.647 8.587 7.858) 12.937 14.198 ( -12.796 -9.045 0.370) 15.674 14.780 ( -30.029 -14.715 -1.615) 33.479 16.624 ( 5.049 12.390 -10.205) 16.827 17.071 ( 12.355 5.185 -3.996) 13.982 19.005 ( -3.320 -2.903 -14.019) 14.696 19.932 ( -3.872 -12.512 -15.186) 20.054 20.456 ( -2.892 -3.372 -39.485) 39.734 22.335 ( -18.601 37.066 22.053) 46.970 23.630 ( -3.541 -7.584 6.527) 10.614 24.314 ( -13.024 -2.056 -5.642) 14.342 25.233 ( 3.903 -4.023 -22.054) 22.755 25.582 ( -0.844 -4.315 -18.434) 18.951 25.935 ( -2.667 -2.704 -29.192) 29.438 26.422 ( -4.173 -0.883 5.109) 6.656 27.965 ( -17.715 -17.777 39.347) 46.669 28.980 ( 0.821 -6.770 28.197) 29.010 30.902 ( -2.510 12.942 10.645) 16.945 31.967 ( 9.929 -12.883 0.536) 16.273 33.857 ( 7.705 -9.556 22.420) 25.561 36.726 ( 24.329 23.952 -9.535) 35.447 37.565 ( -9.413 -4.147 17.218) 20.056 43.009 ( 7.401 32.132 -27.791) 43.123 ======================= Grid point 392 (132/343) ======================= q-point: ( 0.54 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.194 ( 26.688 -8.111 2.964) 28.051 8.059 ( 32.108 -10.975 20.464) 39.625 8.203 ( 26.089 3.017 1.072) 26.284 9.592 ( 20.090 -11.680 15.172) 27.752 9.788 ( -14.195 1.528 6.027) 15.496 10.556 ( -2.222 -4.035 21.132) 21.628 12.265 ( -7.538 11.768 0.419) 13.982 13.283 ( -11.810 15.583 9.449) 21.716 14.271 ( 3.568 -3.058 2.563) 5.353 14.835 ( -24.869 -19.112 -9.696) 32.829 16.327 ( -9.233 11.212 -5.566) 15.554 17.251 ( 27.761 5.106 -7.584) 29.228 19.126 ( 5.022 -11.986 -2.481) 13.231 20.072 ( 1.250 -5.501 -6.635) 8.709 20.542 ( -0.141 -7.204 -46.618) 47.171 21.578 ( -21.395 27.974 15.796) 38.598 23.777 ( -1.172 -11.901 0.837) 11.988 24.233 ( -13.188 -3.878 -5.428) 14.779 25.291 ( 4.159 3.033 -17.584) 18.322 25.586 ( -0.076 2.588 -23.864) 24.004 25.970 ( -2.095 -4.428 -25.491) 25.957 26.312 ( -3.153 7.403 -6.099) 10.097 28.145 ( -14.804 -22.791 34.588) 43.987 29.212 ( 0.204 -19.330 37.600) 42.278 30.631 ( -2.545 16.307 17.098) 23.764 32.308 ( 16.004 -12.061 -4.657) 20.573 34.107 ( 9.176 -10.578 22.040) 26.113 36.514 ( 19.275 26.744 -6.033) 33.514 37.508 ( -15.787 -3.671 16.434) 23.082 42.505 ( 3.610 34.988 -22.694) 41.860 ======================= Grid point 393 (133/343) ======================= q-point: (-0.38 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.411 ( 39.480 18.213 3.094) 43.589 8.029 ( 11.049 25.706 -4.876) 28.402 8.733 ( 23.172 -16.930 19.404) 34.642 9.285 ( -27.377 18.317 5.481) 33.393 9.819 ( 0.604 1.263 10.961) 11.050 10.983 ( 11.488 -22.523 16.191) 30.023 12.047 ( -7.897 -5.566 9.276) 13.393 12.885 ( -16.547 12.534 11.768) 23.862 14.281 ( 3.989 7.686 2.502) 9.014 14.746 ( -26.733 0.750 -13.107) 29.783 16.296 ( -3.434 -16.811 -1.565) 17.229 17.319 ( 17.701 14.090 -9.449) 24.519 19.468 ( 22.318 -7.361 7.659) 24.718 20.114 ( 2.925 2.641 -6.729) 7.798 20.646 ( -8.081 -10.242 -28.433) 31.283 21.084 ( -16.096 6.492 -7.117) 18.759 23.971 ( 0.325 -10.374 -7.658) 12.898 24.204 ( -11.815 -8.880 -4.362) 15.411 25.181 ( 1.935 13.325 -9.690) 16.589 25.544 ( 1.160 2.409 -30.044) 30.162 26.029 ( -0.090 -3.594 -21.175) 21.478 26.180 ( -2.157 4.369 -13.177) 14.049 28.419 ( -10.997 -25.105 30.053) 40.674 29.585 ( -0.066 -24.545 41.734) 48.416 30.321 ( -1.524 18.263 22.942) 29.363 32.658 ( 16.538 -10.208 -8.320) 21.141 34.383 ( 11.385 -9.880 20.086) 25.114 36.247 ( 16.250 24.932 -2.264) 29.846 37.373 ( -22.387 -2.451 15.060) 27.092 41.921 ( -0.058 37.257 -18.860) 41.758 ======================= Grid point 394 (134/343) ======================= q-point: (-0.31 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.359 ( 29.754 32.597 5.294) 44.451 7.599 ( 12.843 37.560 4.033) 39.899 8.537 ( -34.303 22.964 7.211) 41.905 8.927 ( 6.619 19.219 13.494) 24.398 10.049 ( -0.107 -29.446 14.429) 32.791 11.066 ( -1.097 11.335 -9.409) 14.772 12.212 ( 13.897 16.981 7.857) 23.307 12.859 ( -14.994 -43.781 24.198) 52.222 14.116 ( 5.747 15.203 0.856) 16.275 14.395 ( -22.889 8.223 -6.330) 25.131 16.718 ( 0.069 -32.171 -0.761) 32.180 17.156 ( 6.033 18.437 -7.971) 20.973 19.479 ( 17.179 29.835 17.481) 38.611 20.204 ( -3.706 -12.409 -25.630) 28.716 20.832 ( 3.747 -14.866 -11.473) 19.148 21.008 ( -10.827 -12.535 -12.533) 20.771 24.076 ( -2.244 -4.530 -15.160) 15.981 24.344 ( -4.187 -15.844 -5.759) 17.370 24.944 ( 0.685 14.868 -11.089) 18.561 25.519 ( 0.787 2.026 -26.409) 26.498 26.083 ( 1.841 -1.352 -18.277) 18.420 26.129 ( -2.527 -1.315 -15.789) 16.044 28.751 ( -5.730 -24.350 26.154) 36.191 29.988 ( 0.926 2.183 33.958) 34.041 30.018 ( -1.508 -9.064 37.242) 38.359 32.949 ( 11.247 -7.665 -10.916) 17.447 34.609 ( 8.247 -3.365 15.823) 18.158 36.078 ( 19.276 13.530 1.344) 23.589 37.149 ( -26.264 0.280 14.212) 29.865 41.272 ( -2.197 39.173 -15.640) 42.237 ======================= Grid point 395 (135/343) ======================= q-point: (-0.23 0.23 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.871 ( 0.000 38.671 5.398) 39.046 6.932 ( 0.000 54.622 20.904) 58.486 8.002 ( 0.000 18.920 5.629) 19.739 8.555 ( 0.000 24.015 17.589) 29.767 10.570 ( -0.000 -26.806 3.859) 27.083 10.766 ( 0.000 21.903 -10.840) 24.438 11.874 ( 0.000 24.971 8.207) 26.285 13.538 ( -0.000 -32.363 -1.643) 32.405 13.873 ( 0.000 21.382 8.950) 23.179 14.297 ( -0.000 -21.679 9.535) 23.683 16.845 ( 0.000 21.386 -5.440) 22.067 17.292 ( -0.000 -34.947 -0.278) 34.948 19.051 ( 0.000 28.104 16.789) 32.737 20.294 ( -0.000 -1.154 -39.588) 39.605 20.900 ( 0.000 3.384 -23.268) 23.512 21.467 ( -0.000 -38.469 15.634) 41.524 24.117 ( -0.000 -1.181 -12.314) 12.371 24.579 ( -0.000 -13.861 -12.802) 18.868 24.749 ( 0.000 7.491 -19.254) 20.660 25.488 ( 0.000 2.243 -20.496) 20.619 26.092 ( 0.000 0.150 -19.997) 19.998 26.190 ( -0.000 -6.372 -11.919) 13.515 29.095 ( -0.000 -19.161 23.134) 30.039 29.694 ( 0.000 16.590 34.034) 37.862 30.436 ( -0.000 -25.663 41.239) 48.572 33.103 ( -0.000 -3.077 -11.485) 11.890 34.608 ( 0.000 7.039 9.977) 12.210 36.171 ( -0.000 -5.446 3.789) 6.635 36.925 ( 0.000 3.750 14.001) 14.494 40.595 ( 0.000 40.030 -12.840) 42.039 ======================= Grid point 402 (136/343) ======================= q-point: ( 0.31 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.464 ( 6.739 -0.000 38.834) 39.414 6.551 ( 38.802 -0.000 73.731) 83.318 7.869 ( 29.596 -0.000 1.038) 29.614 8.273 ( 45.690 -0.000 -4.289) 45.891 10.167 ( 24.561 -0.000 8.926) 26.132 11.226 ( -19.597 0.000 -8.241) 21.259 11.756 ( 62.705 -0.000 3.527) 62.804 13.567 ( 26.330 -0.000 -0.355) 26.332 13.988 ( -23.285 0.000 5.850) 24.008 14.895 ( -41.272 0.000 9.106) 42.264 16.685 ( 8.092 -0.000 -19.601) 21.206 17.448 ( 5.052 -0.000 -4.150) 6.538 19.070 ( -23.385 0.000 -19.152) 30.227 19.506 ( 10.948 -0.000 -43.929) 45.273 20.536 ( -24.441 0.000 -14.501) 28.419 23.232 ( -5.317 0.000 10.045) 11.366 24.309 ( -21.897 0.000 2.082) 21.995 24.736 ( 0.673 -0.000 14.580) 14.595 24.947 ( 1.201 -0.000 -13.259) 13.313 25.055 ( -9.889 0.000 26.908) 28.668 25.477 ( -0.130 0.000 -15.547) 15.548 26.117 ( -0.804 0.000 -28.014) 28.025 27.704 ( -16.278 0.000 46.373) 49.147 29.260 ( 5.809 -0.000 6.996) 9.094 31.118 ( 1.849 -0.000 -8.795) 8.988 31.555 ( -12.844 0.000 16.259) 20.720 33.507 ( 8.495 -0.000 22.437) 23.991 37.153 ( 30.303 -0.000 -16.220) 34.371 37.483 ( 0.900 -0.000 19.443) 19.464 43.921 ( 5.366 -0.000 -41.683) 42.027 ======================= Grid point 403 (137/343) ======================= q-point: ( 0.38 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.862 ( 7.096 -37.842 35.086) 52.091 7.025 ( 32.939 -14.575 74.071) 82.364 8.078 ( 32.106 8.852 2.617) 33.406 8.722 ( 32.502 -5.664 -9.407) 34.307 10.328 ( 22.700 11.121 7.814) 26.458 11.053 ( -8.572 2.684 -7.321) 11.587 12.326 ( 42.239 -2.980 0.130) 42.344 13.720 ( 9.087 4.505 3.621) 10.769 13.904 ( -3.355 -6.145 4.130) 8.129 14.522 ( -38.634 -3.949 7.726) 39.596 16.778 ( 14.036 -0.000 -15.106) 20.620 17.400 ( 0.094 9.967 -6.513) 11.906 18.897 ( -17.289 -4.550 -20.926) 27.523 19.624 ( 5.339 -2.828 -39.341) 39.802 20.304 ( -25.400 -4.470 -20.131) 32.717 23.173 ( -4.430 3.286 11.290) 12.565 23.903 ( -23.433 21.757 21.811) 38.706 24.412 ( -1.936 15.457 6.412) 16.846 24.975 ( -0.026 -7.874 -11.334) 13.801 25.320 ( 1.457 -11.668 -5.691) 13.064 25.659 ( -1.984 -19.967 -3.795) 20.421 26.125 ( -3.569 -4.271 -21.920) 22.616 27.610 ( -11.559 -4.497 41.971) 43.765 29.201 ( 4.334 12.032 8.827) 15.540 31.157 ( 2.044 0.793 -3.675) 4.279 31.502 ( -8.192 -9.437 8.759) 15.261 33.621 ( 7.866 -3.913 24.193) 25.739 37.334 ( 25.144 10.841 -13.680) 30.609 37.503 ( 0.423 -0.787 19.368) 19.389 43.828 ( 1.945 14.218 -35.449) 38.243 ======================= Grid point 404 (138/343) ======================= q-point: ( 0.46 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.752 ( 9.026 -56.010 27.496) 63.045 7.668 ( 27.617 -25.939 63.485) 73.932 8.240 ( 31.023 8.307 3.433) 32.299 9.059 ( 16.706 -5.024 -5.091) 18.173 10.242 ( 13.600 18.595 6.436) 23.919 10.953 ( 8.204 10.343 -4.476) 13.940 12.571 ( 4.538 4.160 -0.010) 6.156 13.672 ( -1.735 4.785 1.863) 5.420 13.962 ( -7.911 -5.593 4.342) 10.617 14.370 ( -9.956 -8.306 3.045) 13.318 16.899 ( 7.822 11.466 -12.659) 18.786 17.236 ( 11.259 1.678 -5.532) 12.657 18.847 ( -13.006 -5.162 -18.750) 23.396 19.699 ( -5.943 -8.830 -22.215) 24.633 20.258 ( -11.639 -11.522 -38.893) 42.201 22.810 ( -11.916 34.927 25.963) 45.121 23.502 ( -8.613 -0.251 14.197) 16.607 24.226 ( -6.097 4.582 -0.442) 7.639 25.149 ( 2.372 -10.599 -16.390) 19.662 25.466 ( 0.511 -6.468 -13.827) 15.274 25.875 ( -0.460 -4.859 -27.504) 27.933 26.236 ( -5.820 -13.582 4.703) 15.507 27.618 ( -9.166 -8.696 39.018) 41.012 29.028 ( 2.285 9.667 16.491) 19.251 31.061 ( -2.378 8.999 7.202) 11.769 31.744 ( 2.774 -20.031 -2.627) 20.392 33.789 ( 6.940 -7.461 24.856) 26.864 37.308 ( 19.618 18.377 -11.056) 29.066 37.485 ( -2.753 1.813 19.553) 19.829 43.522 ( 1.273 23.847 -29.702) 38.112 ======================= Grid point 405 (139/343) ======================= q-point: ( 0.54 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.790 ( 12.474 -53.526 20.211) 58.559 8.254 ( 22.051 -4.468 24.809) 33.491 8.500 ( 27.446 -8.972 12.372) 31.414 9.228 ( -7.620 -13.151 15.136) 21.450 10.039 ( 11.755 19.768 8.121) 24.391 10.864 ( 23.170 17.517 0.317) 29.048 12.271 ( -29.693 13.038 3.656) 32.635 13.508 ( 1.213 16.358 1.107) 16.440 14.042 ( -15.478 -20.568 -5.803) 26.388 14.495 ( 5.020 -5.363 3.721) 8.235 16.529 ( -8.168 22.074 -11.293) 26.105 17.573 ( 32.614 -2.710 -8.667) 33.855 18.828 ( -15.774 -13.911 -6.151) 21.913 19.870 ( -2.428 -16.438 -16.555) 23.456 20.392 ( -3.043 -11.298 -49.378) 50.745 22.006 ( -13.161 42.396 30.328) 53.762 23.571 ( -2.301 -10.855 7.355) 13.313 24.111 ( -6.896 1.706 -2.499) 7.531 25.332 ( 5.833 -5.177 -19.883) 21.358 25.550 ( -2.952 -4.504 -15.119) 16.049 25.899 ( -0.654 -1.451 -34.092) 34.129 26.333 ( -4.299 -2.198 2.908) 5.637 27.726 ( -7.328 -14.323 36.876) 40.233 29.001 ( 1.026 -5.519 28.605) 29.151 30.852 ( -2.196 13.031 12.556) 18.229 32.141 ( 6.906 -20.571 -6.784) 22.735 34.007 ( 6.510 -10.872 24.146) 27.269 37.113 ( 14.235 24.741 -9.880) 30.206 37.395 ( -7.134 3.029 21.153) 22.528 43.078 ( 0.899 30.548 -25.163) 39.587 ======================= Grid point 406 (140/343) ======================= q-point: ( 0.62 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.696 ( 21.199 -32.990 12.176) 41.060 8.335 ( -1.235 5.623 4.049) 7.038 8.701 ( 15.806 11.155 -3.472) 19.655 9.418 ( -8.063 -10.973 31.688) 34.490 9.830 ( 0.155 14.096 14.982) 20.572 10.968 ( 35.934 -2.137 12.713) 38.176 11.743 ( -38.418 4.412 4.349) 38.914 13.163 ( -0.802 24.114 2.902) 24.301 14.267 ( -7.264 -15.772 -14.347) 22.525 14.565 ( -0.715 0.792 5.154) 5.263 16.182 ( -4.325 8.157 -7.107) 11.652 17.718 ( 15.345 14.304 -14.735) 25.636 19.150 ( -1.217 -33.943 5.707) 34.441 20.152 ( 5.038 -14.692 -17.210) 23.182 20.506 ( -2.975 -2.181 -42.634) 42.794 21.232 ( -10.883 32.678 21.582) 40.646 23.775 ( 0.579 -14.167 3.295) 14.557 24.035 ( -5.931 -0.285 -5.516) 8.104 25.380 ( 3.857 6.717 -11.385) 13.770 25.562 ( -1.973 -1.114 -29.258) 29.346 25.950 ( -0.109 -4.902 -26.539) 26.988 26.252 ( -2.140 6.005 -7.152) 9.581 27.957 ( -4.633 -20.539 34.160) 40.128 29.219 ( 0.276 -18.662 37.978) 42.317 30.594 ( -1.021 15.951 17.661) 23.820 32.528 ( 5.825 -17.658 -9.031) 20.672 34.273 ( 5.673 -13.496 21.906) 26.347 36.792 ( 8.240 26.053 -6.941) 28.193 37.249 ( -8.591 4.940 20.616) 22.874 42.533 ( 0.225 35.436 -21.504) 41.451 ======================= Grid point 407 (141/343) ======================= q-point: (-0.31 0.31 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.973 ( 0.000 25.883 -3.994) 26.190 8.226 ( 0.000 2.755 10.652) 11.003 8.513 ( 0.000 14.505 -2.584) 14.734 9.417 ( 0.000 25.872 13.667) 29.260 9.580 ( -0.000 -15.769 30.250) 34.113 11.265 ( 0.000 9.735 -15.708) 18.480 11.840 ( -0.000 -51.471 36.233) 62.946 12.728 ( 0.000 26.384 4.602) 26.782 14.340 ( 0.000 3.378 -20.312) 20.591 14.447 ( 0.000 10.784 9.161) 14.150 16.260 ( -0.000 -19.312 -2.068) 19.422 17.500 ( 0.000 18.296 -12.085) 21.927 19.759 ( -0.000 -33.734 -2.198) 33.806 20.158 ( 0.000 34.095 8.951) 35.251 20.480 ( -0.000 -18.568 -14.674) 23.666 20.923 ( 0.000 1.121 -24.303) 24.329 24.013 ( -0.000 -1.921 -11.039) 11.205 24.044 ( -0.000 -16.659 -0.489) 16.666 25.205 ( 0.000 14.686 -8.485) 16.961 25.554 ( 0.000 1.383 -31.773) 31.803 26.034 ( -0.000 -4.618 -20.553) 21.066 26.149 ( 0.000 4.269 -13.865) 14.508 28.311 ( -0.000 -24.498 30.307) 38.970 29.585 ( -0.000 -24.332 41.942) 48.489 30.306 ( 0.000 17.985 23.197) 29.353 32.820 ( -0.000 -13.426 -10.456) 17.017 34.526 ( -0.000 -11.695 18.799) 22.140 36.441 ( 0.000 20.593 -4.071) 20.991 37.096 ( 0.000 6.245 19.329) 20.313 41.915 ( 0.000 38.600 -18.340) 42.735 ======================= Grid point 416 (142/343) ======================= q-point: ( 0.38 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.595 ( 6.959 -0.000 41.465) 42.045 7.183 ( 24.792 -0.000 83.009) 86.633 8.403 ( 21.022 -0.000 2.056) 21.123 8.970 ( 26.603 -0.000 -15.719) 30.900 10.728 ( 29.852 -0.000 6.861) 30.630 10.994 ( -1.782 0.000 -7.639) 7.844 12.575 ( 10.200 -0.000 -7.389) 12.595 13.847 ( 17.133 -0.000 6.538) 18.339 13.912 ( -8.525 0.000 14.275) 16.627 14.151 ( -15.756 0.000 -0.744) 15.774 16.893 ( 13.216 -0.000 -9.808) 16.458 17.518 ( 2.105 -0.000 -10.197) 10.412 18.668 ( -15.526 0.000 -23.341) 28.033 19.697 ( 8.115 -0.000 -45.711) 46.426 19.928 ( -36.764 0.000 -16.438) 40.272 23.161 ( -1.516 0.000 11.081) 11.184 23.816 ( -24.612 0.000 14.635) 28.635 24.778 ( 3.348 -0.000 16.407) 16.745 24.960 ( -1.746 0.000 20.548) 20.623 24.966 ( 0.033 -0.000 -0.313) 0.315 25.497 ( 2.637 -0.000 -21.401) 21.563 26.061 ( -4.637 0.000 -35.358) 35.661 27.490 ( -6.648 0.000 38.482) 39.052 29.368 ( 4.872 -0.000 6.839) 8.397 31.176 ( 3.280 -0.000 -8.158) 8.792 31.323 ( -10.061 0.000 9.813) 14.054 33.660 ( 6.551 -0.000 25.987) 26.800 37.494 ( 0.297 -0.000 23.988) 23.990 37.667 ( 21.202 -0.000 -16.883) 27.103 43.942 ( -1.655 0.000 -33.154) 33.195 ======================= Grid point 417 (143/343) ======================= q-point: ( 0.46 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.003 ( 6.552 -38.928 39.148) 55.595 7.523 ( 17.317 -16.293 81.642) 85.034 8.538 ( 12.924 2.891 0.767) 13.266 9.192 ( 16.422 0.413 -14.884) 22.167 10.732 ( 16.603 19.594 3.410) 25.907 11.159 ( 17.712 -3.084 -4.421) 18.514 12.557 ( -12.713 0.613 -6.663) 14.366 13.580 ( -27.118 3.339 10.698) 29.343 14.009 ( 13.083 7.277 1.716) 15.068 14.285 ( 14.208 -7.841 1.540) 16.301 17.080 ( 12.880 -2.555 -6.127) 14.491 17.409 ( 4.708 9.866 -9.164) 14.265 18.631 ( -8.727 -5.802 -25.449) 27.522 19.503 ( -24.205 0.247 -18.192) 30.280 19.925 ( -4.644 -14.307 -44.531) 47.003 23.125 ( -0.008 8.270 15.711) 17.754 23.472 ( -18.135 11.520 20.588) 29.757 24.414 ( 0.986 22.161 13.582) 26.011 24.973 ( -0.119 -9.380 -9.075) 13.052 25.362 ( 1.825 -13.163 4.674) 14.087 25.665 ( 2.898 -18.237 -8.008) 20.128 26.022 ( -6.392 -2.337 -33.633) 34.315 27.463 ( -4.216 -2.989 36.554) 36.918 29.274 ( 2.819 13.988 9.370) 17.071 31.154 ( -2.103 4.922 4.614) 7.066 31.416 ( -0.890 -18.266 -4.205) 18.765 33.749 ( 4.739 -4.048 26.718) 27.435 37.479 ( -0.392 2.011 24.886) 24.970 37.754 ( 14.577 10.726 -15.974) 24.139 43.819 ( -1.620 12.244 -30.007) 32.449 ======================= Grid point 418 (144/343) ======================= q-point: ( 0.54 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.904 ( 4.946 -58.803 31.692) 66.982 8.065 ( 11.688 -31.593 73.369) 80.732 8.571 ( 4.162 3.311 0.263) 5.324 9.237 ( 4.291 6.896 -12.950) 15.287 10.525 ( 11.669 21.919 6.926) 25.779 11.344 ( 25.215 5.504 -6.481) 26.610 12.212 ( -28.463 17.535 5.009) 33.804 13.484 ( -11.587 -16.597 -3.002) 20.463 13.883 ( 2.501 15.898 -0.185) 16.095 14.512 ( 8.837 -4.198 2.751) 10.163 16.861 ( -3.907 23.656 -14.761) 28.156 17.737 ( 30.156 -18.548 2.059) 35.463 18.501 ( -22.248 3.209 -20.066) 30.131 19.512 ( -8.290 -19.625 -16.630) 27.026 20.139 ( -1.664 -14.479 -50.751) 52.802 22.631 ( -5.099 40.698 32.501) 52.332 23.382 ( -3.183 -8.203 10.223) 13.489 24.162 ( -1.201 9.439 3.943) 10.299 25.185 ( 1.039 -14.515 -14.289) 20.395 25.478 ( 0.383 -2.634 -8.069) 8.497 25.895 ( 1.978 -0.700 -40.311) 40.365 26.123 ( -4.581 -17.315 8.427) 19.794 27.509 ( -2.496 -6.805 35.978) 36.700 29.061 ( 0.944 10.668 17.163) 20.230 31.018 ( -1.406 9.073 8.828) 12.737 31.797 ( 1.733 -24.689 -7.631) 25.899 33.888 ( 2.771 -8.304 26.130) 27.557 37.415 ( -1.270 4.593 24.719) 25.174 37.605 ( 7.196 19.656 -13.723) 25.029 43.520 ( -0.526 22.168 -26.995) 34.935 ======================= Grid point 419 (145/343) ======================= q-point: (-0.38 -0.62 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.935 ( -0.000 -59.101 24.480) 63.970 8.488 ( 0.000 7.691 -1.914) 7.925 8.782 ( -0.000 -42.864 62.315) 75.634 9.060 ( 0.000 14.977 -12.256) 19.352 10.216 ( 0.000 22.710 10.035) 24.829 11.491 ( 0.000 3.536 -13.747) 14.194 11.545 ( 0.000 28.155 20.322) 34.723 13.560 ( 0.000 22.419 0.182) 22.420 13.825 ( -0.000 -26.834 -11.452) 29.175 14.593 ( -0.000 -0.619 5.203) 5.240 16.435 ( 0.000 22.714 -12.757) 26.051 18.078 ( 0.000 16.584 -21.700) 27.312 18.503 ( -0.000 -37.205 10.818) 38.746 19.844 ( -0.000 -21.800 -19.655) 29.352 20.359 ( -0.000 -12.372 -52.040) 53.491 21.871 ( 0.000 45.293 33.646) 56.423 23.547 ( -0.000 -12.558 7.379) 14.566 24.045 ( 0.000 4.120 -1.238) 4.302 25.429 ( -0.000 -11.927 -22.997) 25.906 25.481 ( 0.000 1.919 -8.988) 9.191 25.898 ( -0.000 -0.904 -38.019) 38.030 26.284 ( -0.000 -2.941 3.385) 4.484 27.657 ( -0.000 -12.998 35.838) 38.122 29.012 ( -0.000 -5.132 28.934) 29.385 30.829 ( 0.000 12.839 12.783) 18.118 32.212 ( -0.000 -23.027 -8.760) 24.637 34.076 ( -0.000 -12.360 24.232) 27.202 37.262 ( 0.000 25.020 -10.922) 27.300 37.314 ( 0.000 6.307 23.800) 24.621 43.082 ( 0.000 30.027 -24.224) 38.580 ======================= Grid point 431 (146/343) ======================= q-point: ( 0.46 0.46 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.711 ( 3.676 -0.000 45.585) 45.733 7.506 ( 8.156 -0.000 85.851) 86.238 8.639 ( 4.351 -0.000 -1.325) 4.548 9.340 ( 10.378 -0.000 -14.763) 18.046 11.118 ( 9.001 -0.000 -6.414) 11.052 11.205 ( 15.208 -0.000 4.805) 15.949 12.434 ( -10.660 0.000 -11.703) 15.830 13.355 ( -21.569 0.000 15.983) 26.845 14.265 ( 5.573 -0.000 1.281) 5.719 14.320 ( 17.382 -0.000 -2.699) 17.590 17.151 ( 9.548 -0.000 4.146) 10.409 17.539 ( 0.347 -0.000 -14.263) 14.267 18.573 ( 8.145 -0.000 -30.442) 31.513 19.180 ( -34.627 0.000 -16.453) 38.338 19.809 ( 3.012 -0.000 -46.263) 46.361 23.184 ( 3.583 -0.000 12.235) 12.748 23.431 ( -13.274 0.000 19.448) 23.546 24.855 ( 4.104 -0.000 9.677) 10.511 24.935 ( -2.929 0.000 15.730) 16.001 24.945 ( -0.182 0.000 17.717) 17.718 25.571 ( 3.572 -0.000 -18.267) 18.613 25.962 ( -4.096 0.000 -46.984) 47.163 27.413 ( -1.746 0.000 35.043) 35.086 29.438 ( 1.948 -0.000 7.455) 7.705 31.182 ( -3.809 0.000 6.074) 7.170 31.225 ( 1.420 -0.000 -7.645) 7.775 33.750 ( 2.415 -0.000 27.707) 27.813 37.497 ( 0.044 -0.000 26.434) 26.434 37.956 ( 7.677 -0.000 -17.099) 18.743 43.904 ( -1.419 0.000 -29.336) 29.370 ======================= Grid point 432 (147/343) ======================= q-point: (-0.46 -0.54 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.076 ( -0.000 -39.520 41.684) 57.440 7.694 ( -0.000 -17.619 83.568) 85.406 8.641 ( 0.000 2.152 -1.969) 2.917 9.362 ( 0.000 3.765 -14.164) 14.656 10.931 ( 0.000 19.097 2.515) 19.262 11.427 ( -0.000 -8.086 -4.471) 9.239 12.324 ( 0.000 8.690 -5.590) 10.332 13.243 ( -0.000 -2.744 9.791) 10.168 14.154 ( 0.000 12.785 -1.023) 12.826 14.484 ( -0.000 -5.338 -0.712) 5.385 17.166 ( 0.000 11.053 -8.982) 14.243 17.564 ( -0.000 -11.044 2.591) 11.344 18.564 ( 0.000 10.556 -33.336) 34.967 19.122 ( -0.000 -17.434 -14.015) 22.369 19.919 ( -0.000 -10.458 -48.308) 49.427 23.164 ( 0.000 23.469 26.606) 35.478 23.251 ( -0.000 -4.754 10.966) 11.952 24.427 ( 0.000 23.824 15.477) 28.410 24.972 ( -0.000 -9.970 -8.778) 13.283 25.378 ( -0.000 -14.566 10.582) 18.004 25.724 ( -0.000 -19.467 0.404) 19.471 25.930 ( 0.000 1.135 -49.358) 49.371 27.424 ( -0.000 -2.546 34.921) 35.014 29.303 ( 0.000 14.746 9.763) 17.685 31.125 ( 0.000 4.630 6.429) 7.923 31.416 ( -0.000 -19.762 -7.680) 21.201 33.797 ( -0.000 -4.193 27.502) 27.820 37.474 ( 0.000 2.747 26.404) 26.546 37.901 ( 0.000 11.002 -16.301) 19.667 43.799 ( 0.000 11.645 -28.300) 30.602 ======================= Grid point 519 (148/343) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.843 ( 0.000 0.000 62.423) 62.423 4.337 ( 0.000 0.000 64.541) 64.541 6.645 ( 0.000 0.000 63.138) 63.138 8.157 ( 0.000 0.000 3.430) 3.430 8.163 ( 0.000 0.000 -11.021) 11.021 9.987 ( 0.000 0.000 -34.370) 34.370 9.987 ( 0.000 0.000 22.605) 22.605 12.894 ( 0.000 0.000 -3.942) 3.942 15.788 ( 0.000 0.000 -30.207) 30.207 15.833 ( 0.000 0.000 15.286) 15.286 16.149 ( 0.000 0.000 -20.450) 20.450 17.629 ( 0.000 0.000 10.789) 10.789 18.447 ( 0.000 0.000 -4.693) 4.693 20.214 ( 0.000 0.000 -11.095) 11.095 20.378 ( 0.000 0.000 -12.387) 12.387 23.880 ( 0.000 0.000 11.466) 11.466 24.118 ( 0.000 0.000 -65.085) 65.085 24.507 ( 0.000 0.000 -9.446) 9.446 24.655 ( 0.000 0.000 -18.098) 18.098 25.394 ( 0.000 0.000 -13.146) 13.146 25.846 ( 0.000 0.000 24.345) 24.345 25.892 ( 0.000 0.000 11.586) 11.586 29.662 ( 0.000 0.000 29.704) 29.704 30.505 ( 0.000 0.000 19.984) 19.984 32.229 ( 0.000 0.000 12.596) 12.596 33.275 ( 0.000 0.000 -8.618) 8.618 33.888 ( 0.000 0.000 32.229) 32.229 37.358 ( 0.000 0.000 -1.053) 1.053 37.364 ( 0.000 0.000 -0.269) 0.269 37.370 ( 0.000 0.000 -15.071) 15.071 ======================= Grid point 520 (149/343) ======================= q-point: ( 0.08 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.068 ( 14.999 -16.137 55.218) 59.450 4.577 ( 10.078 -21.667 59.863) 64.456 6.823 ( 15.621 -11.417 62.833) 65.744 7.956 ( -7.947 4.806 -7.998) 12.257 8.370 ( -4.534 -14.683 -1.636) 15.454 10.072 ( 1.411 -9.252 11.744) 15.017 10.225 ( 28.773 -10.020 -20.265) 36.592 12.881 ( -5.680 -1.835 -3.770) 7.060 15.542 ( -0.145 22.389 -26.072) 34.366 15.789 ( -5.346 1.428 14.086) 15.134 16.273 ( 0.362 -8.244 -17.409) 19.266 17.702 ( -4.894 -10.335 9.504) 14.869 18.444 ( 1.409 0.893 -8.203) 8.371 20.084 ( -8.062 8.026 -12.087) 16.599 20.416 ( 6.032 1.647 -12.632) 14.095 23.872 ( -2.345 -0.551 11.284) 11.538 24.090 ( -2.258 2.350 -63.494) 63.578 24.402 ( 0.479 10.344 -8.088) 13.139 24.743 ( 0.805 -6.881 -17.439) 18.765 25.409 ( -2.567 7.970 0.556) 8.391 25.477 ( 4.695 12.581 3.504) 13.878 26.260 ( 3.454 -18.891 13.260) 23.338 29.613 ( -4.449 2.621 29.897) 30.340 30.472 ( -5.940 0.063 20.361) 21.210 32.231 ( 3.628 2.523 14.295) 14.962 33.118 ( -22.460 4.531 -0.627) 22.921 33.913 ( -5.261 -5.725 25.854) 26.998 36.347 ( -81.076 2.314 3.231) 81.173 37.449 ( 4.852 -6.917 -0.132) 8.450 38.506 ( 113.099 1.848 -21.953) 115.224 ======================= Grid point 521 (150/343) ======================= q-point: ( 0.15 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.576 ( 17.991 -22.598 40.080) 49.404 5.185 ( 19.019 -31.966 50.213) 62.489 7.253 ( 17.245 -16.316 52.713) 57.812 7.905 ( -9.231 -10.543 -7.010) 15.669 8.615 ( 11.133 -14.189 0.518) 18.043 10.313 ( 1.248 -17.716 15.590) 23.632 10.801 ( 40.098 -15.757 -16.560) 46.155 12.850 ( -10.754 -4.426 -2.861) 11.976 15.140 ( 3.839 26.713 -21.743) 34.657 15.730 ( -9.351 -3.875 12.547) 16.121 16.345 ( 0.282 0.427 -7.395) 7.413 17.820 ( -11.911 -12.099 8.617) 19.040 18.458 ( 3.269 -0.198 -16.567) 16.888 19.835 ( -6.315 12.576 -15.730) 21.106 20.412 ( 1.604 3.362 -12.555) 13.096 23.837 ( -6.637 3.085 3.729) 8.214 23.968 ( -5.433 7.352 -38.209) 39.288 24.213 ( 2.838 11.775 -12.475) 17.387 24.847 ( 0.204 -3.401 -18.533) 18.843 25.124 ( 6.467 14.926 9.794) 18.988 25.538 ( -0.600 -5.800 -16.330) 17.340 26.536 ( 5.737 -7.865 6.888) 11.925 29.526 ( -6.951 -0.321 30.749) 31.527 30.400 ( -7.200 0.478 20.521) 21.753 32.181 ( -2.163 5.672 17.488) 18.512 32.741 ( -36.861 3.578 10.144) 38.398 33.978 ( -7.613 -10.330 18.399) 22.432 35.732 ( -39.639 1.589 4.524) 39.928 37.667 ( 7.504 -11.218 1.833) 13.620 39.449 ( 95.198 8.448 -28.403) 99.703 ======================= Grid point 522 (151/343) ======================= q-point: ( 0.23 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.101 ( 14.476 -20.093 25.501) 35.547 5.942 ( 25.615 -30.827 39.540) 56.301 7.566 ( -5.947 -15.048 18.046) 24.238 8.117 ( -1.810 -18.792 8.928) 20.884 9.175 ( 42.334 -21.992 9.569) 48.656 10.658 ( -0.723 -22.477 19.042) 29.467 11.436 ( 35.219 -13.004 -10.759) 39.054 12.842 ( -12.359 -9.502 -0.154) 15.591 14.776 ( 11.240 24.505 -16.850) 31.792 15.730 ( -13.009 -7.990 8.381) 17.416 16.282 ( 2.192 7.070 3.259) 8.088 17.827 ( -19.261 -6.526 7.297) 21.606 18.514 ( 3.520 -1.685 -19.534) 19.920 19.585 ( -1.524 11.105 -24.217) 26.686 20.345 ( -3.855 3.056 -11.838) 12.819 23.424 ( -13.191 29.040 -3.251) 32.060 23.921 ( -4.297 -4.101 1.924) 6.244 24.112 ( 4.794 5.795 -31.636) 32.517 24.830 ( 1.890 4.199 -15.558) 16.225 25.096 ( 7.030 -0.123 -3.502) 7.855 25.615 ( -0.854 -4.128 -17.854) 18.345 26.605 ( 4.400 5.898 -0.230) 7.362 29.526 ( -6.488 -8.136 31.052) 32.749 30.325 ( -4.227 1.613 20.337) 20.834 31.973 ( -24.247 3.419 18.749) 30.841 32.350 ( -25.093 5.583 17.237) 30.951 34.121 ( -5.688 -14.670 14.403) 21.331 35.449 ( -12.113 4.023 3.477) 13.229 37.942 ( 7.559 -12.280 4.146) 15.004 40.098 ( 72.019 11.418 -28.177) 78.173 ======================= Grid point 523 (152/343) ======================= q-point: ( 0.31 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.510 ( 11.064 -14.166 15.583) 23.789 6.636 ( 24.455 -20.254 22.936) 39.171 7.718 ( -14.328 -18.215 7.668) 24.410 8.454 ( 4.995 -19.339 10.054) 22.361 10.040 ( 48.843 -22.243 11.908) 54.974 11.017 ( -3.093 -22.304 20.220) 30.263 11.840 ( 19.026 -3.884 0.509) 19.425 12.962 ( -6.589 -15.654 5.111) 17.737 14.596 ( 21.290 15.149 -14.051) 29.668 15.662 ( -16.136 0.747 4.990) 16.906 16.236 ( 5.025 0.842 7.906) 9.406 17.651 ( -24.051 2.083 3.081) 24.337 18.552 ( 1.381 -0.343 -9.855) 9.957 19.485 ( 4.070 2.555 -37.759) 38.064 20.250 ( -7.313 1.059 -11.248) 13.458 22.745 ( -14.005 34.552 5.763) 37.726 23.953 ( -4.407 -3.822 -1.662) 6.066 24.111 ( 5.524 -0.156 -31.092) 31.580 24.799 ( 3.472 2.599 -15.038) 15.651 25.174 ( 5.603 -0.628 -7.113) 9.077 25.658 ( -0.476 -1.836 -18.330) 18.428 26.436 ( -0.581 15.701 -5.958) 16.804 29.662 ( -5.073 -14.163 28.777) 32.472 30.275 ( 2.035 2.626 20.460) 20.728 31.645 ( -36.219 -1.430 20.584) 41.685 32.058 ( -10.457 9.097 19.727) 24.109 34.337 ( -4.025 -16.328 12.277) 20.821 35.308 ( 0.490 7.128 4.207) 8.292 38.203 ( 5.958 -10.678 6.263) 13.739 40.507 ( 49.648 10.603 -25.943) 57.012 ======================= Grid point 524 (153/343) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.795 ( 8.323 -8.761 10.309) 15.884 6.999 ( 6.887 -4.686 -0.462) 8.343 7.996 ( 2.706 -22.549 17.784) 28.845 8.792 ( 2.215 -14.333 3.533) 14.927 10.679 ( 26.570 -7.055 11.371) 29.750 11.299 ( -3.991 -13.394 13.478) 19.416 12.115 ( 20.623 -12.751 17.649) 29.989 13.136 ( -6.625 -9.656 13.197) 17.643 14.682 ( 25.885 4.631 -12.029) 28.917 15.431 ( -13.658 6.354 0.904) 15.091 16.329 ( 4.635 -4.674 6.936) 9.562 17.304 ( -24.502 9.681 -1.397) 26.382 18.603 ( 2.351 -4.766 1.370) 5.489 19.498 ( 1.724 2.566 -43.915) 44.024 20.210 ( -4.586 -4.878 -14.955) 16.385 22.062 ( -11.867 30.436 8.001) 33.633 23.955 ( -1.900 -0.634 -10.968) 11.150 24.227 ( 3.607 -7.471 -22.696) 24.165 24.811 ( 4.665 0.694 -13.422) 14.227 25.201 ( 3.138 3.236 -7.964) 9.151 25.673 ( 0.212 -0.443 -18.398) 18.405 26.126 ( -5.202 16.009 -9.497) 19.327 29.853 ( -5.410 -13.550 23.718) 27.846 30.292 ( 10.095 2.250 20.515) 22.975 31.339 ( -30.073 -1.214 26.182) 39.892 31.841 ( -5.548 7.274 18.315) 20.473 34.562 ( -3.897 -14.826 10.380) 18.513 35.202 ( 4.818 8.911 6.538) 12.056 38.401 ( 3.661 -7.194 7.850) 11.259 40.740 ( 29.010 7.321 -23.990) 38.350 ======================= Grid point 525 (154/343) ======================= q-point: ( 0.46 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.957 ( 3.525 -3.220 8.180) 9.471 7.037 ( -0.931 0.086 -8.620) 8.671 8.395 ( 8.599 -12.950 17.488) 23.398 8.915 ( -3.732 -2.166 -0.722) 4.375 10.863 ( 6.400 0.425 15.653) 16.916 11.380 ( -2.675 -2.705 10.842) 11.490 12.646 ( 23.556 -18.912 20.710) 36.626 13.071 ( -14.364 6.273 20.956) 26.169 14.837 ( 12.137 2.025 -2.242) 12.507 15.273 ( -5.227 0.481 -12.751) 13.789 16.459 ( 5.749 -4.151 9.279) 11.678 16.927 ( -15.491 8.295 -6.076) 18.593 18.739 ( 2.809 -5.864 11.662) 13.352 19.407 ( -2.433 5.091 -43.773) 44.135 20.307 ( 0.319 -6.011 -24.579) 25.306 21.581 ( -5.352 14.222 8.936) 17.629 23.947 ( -0.465 -0.001 -13.735) 13.743 24.377 ( 1.162 -5.585 -20.647) 21.421 24.875 ( 4.935 -2.528 -9.916) 11.361 25.115 ( -1.503 6.733 -9.914) 12.078 25.684 ( 0.773 -0.354 -18.569) 18.588 25.881 ( -3.678 6.377 -10.622) 12.924 29.969 ( -3.071 -5.161 19.466) 20.371 30.379 ( 8.316 0.061 17.743) 19.595 31.121 ( -13.545 0.208 34.241) 36.823 31.719 ( -1.999 2.616 16.184) 16.516 34.728 ( -2.599 -7.808 8.000) 11.477 35.113 ( 3.343 5.798 9.535) 11.649 38.507 ( 1.218 -2.535 8.696) 9.139 40.844 ( 9.541 2.606 -22.954) 24.994 ======================= Grid point 533 (155/343) ======================= q-point: ( 0.08 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.186 ( 33.193 -0.000 44.045) 55.152 4.524 ( 17.588 -0.000 61.754) 64.209 6.948 ( 28.209 -0.000 70.271) 75.722 7.729 ( -32.527 0.000 -15.700) 36.118 8.414 ( 26.964 -0.000 1.433) 27.002 9.984 ( 0.021 -0.000 22.029) 22.029 10.516 ( 42.515 -0.000 -27.296) 50.523 12.789 ( -9.927 0.000 -3.904) 10.667 15.633 ( -15.169 0.000 5.947) 16.293 15.857 ( 2.541 -0.000 -19.622) 19.786 16.159 ( 0.294 -0.000 -17.925) 17.927 17.551 ( -7.341 0.000 9.772) 12.222 18.470 ( 2.163 -0.000 -7.492) 7.798 20.018 ( -14.890 0.000 -11.981) 19.111 20.529 ( 9.222 -0.000 -13.915) 16.693 23.835 ( -4.332 0.000 11.391) 12.187 24.086 ( -2.679 0.000 -63.065) 63.122 24.513 ( 0.328 -0.000 -9.316) 9.322 24.674 ( 1.570 -0.000 -18.192) 18.260 25.363 ( -2.783 0.000 -12.232) 12.545 25.919 ( 6.583 -0.000 23.150) 24.068 25.941 ( 3.983 -0.000 13.923) 14.482 29.580 ( -7.327 0.000 25.403) 26.438 30.372 ( -13.007 0.000 22.527) 26.013 32.314 ( 6.985 -0.000 15.815) 17.289 32.770 ( -53.034 0.000 7.248) 53.527 33.796 ( -8.049 0.000 28.170) 29.298 35.766 ( -37.546 0.000 0.654) 37.551 37.439 ( 7.135 -0.000 3.765) 8.068 39.671 ( 110.409 -0.000 -40.646) 117.653 ======================= Grid point 534 (156/343) ======================= q-point: ( 0.15 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.630 ( 40.689 -7.306 29.095) 50.552 4.922 ( 22.529 -22.927 55.234) 63.906 7.260 ( 13.624 -1.985 45.309) 47.354 7.552 ( -9.165 -12.745 7.918) 17.582 8.783 ( 42.426 -3.976 1.980) 42.658 10.073 ( 0.578 -9.970 21.268) 23.496 11.016 ( 42.191 -8.600 -21.558) 48.154 12.692 ( -11.417 -1.332 -3.839) 12.119 15.417 ( -15.774 6.375 2.299) 17.168 15.719 ( 2.017 12.631 -12.694) 18.020 16.263 ( -2.624 -7.757 -12.991) 15.356 17.540 ( -10.187 -7.623 7.760) 14.903 18.488 ( 2.729 0.446 -13.525) 13.805 19.836 ( -16.403 2.705 -13.530) 21.434 20.552 ( 5.746 6.296 -14.366) 16.705 23.786 ( -6.060 -0.175 11.254) 12.783 24.030 ( -2.846 4.036 -59.236) 59.441 24.415 ( 0.646 9.794 -7.999) 12.662 24.755 ( -0.180 -5.689 -16.786) 17.725 25.357 ( -2.883 -0.119 -7.235) 7.789 25.587 ( 5.418 18.592 10.455) 22.007 26.366 ( 6.070 -19.507 16.153) 26.044 29.473 ( -8.444 2.782 23.416) 25.047 30.252 ( -16.719 -3.787 25.741) 30.926 32.103 ( -47.741 6.237 16.354) 50.849 32.428 ( -9.478 -3.321 17.452) 20.135 33.761 ( -7.346 -5.474 23.023) 24.779 35.574 ( -2.097 2.498 -4.785) 5.791 37.578 ( 8.340 -6.807 7.237) 12.971 40.570 ( 90.436 11.223 -46.888) 102.485 ======================= Grid point 535 (157/343) ======================= q-point: ( 0.23 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.164 ( 41.183 -7.098 16.319) 44.863 5.661 ( 26.151 -35.043 46.443) 63.788 7.253 ( -13.851 -6.759 -5.280) 16.291 7.916 ( 19.583 -13.655 44.305) 50.328 9.409 ( 57.281 -12.122 7.863) 59.076 10.309 ( 0.488 -17.169 22.646) 28.423 11.554 ( 27.927 -11.620 -13.966) 33.317 12.642 ( -4.564 -3.823 -3.539) 6.926 15.148 ( -7.950 10.737 -5.533) 14.460 15.569 ( -2.358 4.892 -2.815) 6.117 16.300 ( -6.379 -2.303 -3.641) 7.698 17.551 ( -13.625 -6.243 7.267) 16.656 18.517 ( 2.424 -0.860 -23.020) 23.163 19.632 ( -13.701 2.959 -17.692) 22.571 20.446 ( 0.767 9.570 -12.966) 16.133 23.675 ( -8.899 10.181 2.048) 13.677 23.880 ( -3.473 7.146 -28.448) 29.537 24.260 ( 2.070 8.333 -14.738) 17.057 24.808 ( -4.179 -2.717 -15.372) 16.160 25.256 ( 5.119 8.008 3.445) 10.109 25.527 ( -0.634 -3.702 -14.671) 15.144 26.650 ( 4.656 -6.868 9.674) 12.745 29.366 ( -8.372 -1.392 24.952) 26.355 30.175 ( -18.038 -7.341 29.019) 34.948 31.563 ( -46.701 0.221 14.135) 48.794 32.359 ( -4.568 4.741 20.262) 21.305 33.850 ( -2.778 -11.084 19.034) 22.201 35.564 ( 13.309 6.933 -6.335) 16.289 37.801 ( 6.612 -10.513 9.890) 15.877 41.085 ( 68.419 19.523 -42.745) 83.003 ======================= Grid point 536 (158/343) ======================= q-point: ( 0.31 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.634 ( 38.136 -1.884 8.563) 39.131 6.516 ( 28.612 -32.000 34.653) 55.168 7.293 ( -8.835 -12.553 -7.975) 17.298 8.309 ( 19.134 -11.377 31.472) 38.549 10.206 ( 45.906 -16.517 10.914) 49.993 10.649 ( 7.405 -20.664 24.958) 33.238 11.854 ( 1.368 -7.332 -1.817) 7.677 12.791 ( 13.841 -8.277 -2.361) 16.299 14.949 ( 1.096 7.908 -7.619) 11.036 15.476 ( -9.666 1.213 -0.601) 9.760 16.260 ( -4.920 -1.650 2.958) 5.973 17.443 ( -18.425 0.925 7.497) 19.913 18.555 ( 1.133 -1.374 -25.518) 25.580 19.513 ( -5.402 -1.079 -27.475) 28.022 20.274 ( -3.590 8.675 -10.047) 13.751 23.183 ( -11.199 32.488 1.163) 34.384 23.827 ( -4.764 -3.338 -2.996) 6.544 24.198 ( 4.029 3.321 -26.495) 27.004 24.787 ( -5.396 -1.734 -15.502) 16.506 25.249 ( 6.464 1.417 -4.399) 7.947 25.591 ( -1.917 -4.793 -18.030) 18.754 26.651 ( -0.366 9.329 0.979) 9.387 29.384 ( -7.875 -10.299 27.381) 30.295 30.149 ( -17.408 -11.161 32.523) 38.541 31.198 ( -30.954 -1.584 9.810) 32.509 32.198 ( -3.923 8.584 20.550) 22.614 34.052 ( 0.251 -13.844 17.407) 22.243 35.572 ( 18.474 11.390 -4.936) 22.257 38.035 ( 2.628 -11.673 11.570) 16.644 41.303 ( 49.079 22.683 -35.941) 64.923 ======================= Grid point 537 (159/343) ======================= q-point: ( 0.38 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.967 ( 32.667 3.575 5.656) 33.345 7.065 ( 14.944 -4.466 -1.537) 15.673 7.641 ( 14.640 -28.180 20.429) 37.760 8.671 ( 16.605 -9.990 15.205) 24.632 10.640 ( -1.947 -11.485 14.019) 18.228 11.176 ( 25.848 -15.821 16.332) 34.427 11.969 ( -1.080 -11.891 14.592) 18.854 13.087 ( 18.812 -5.066 4.680) 20.037 14.913 ( 2.490 0.623 -5.373) 5.955 15.303 ( -15.252 3.083 -4.338) 16.154 16.308 ( 2.286 -5.667 3.224) 6.910 17.163 ( -23.479 7.167 5.760) 25.215 18.602 ( 4.219 -2.377 -17.680) 18.331 19.546 ( 1.935 -2.301 -40.201) 40.313 20.124 ( -5.175 2.381 -6.729) 8.816 22.488 ( -12.204 35.159 7.763) 38.018 23.855 ( -4.833 -5.123 -3.893) 8.047 24.220 ( 5.156 -0.498 -26.833) 27.328 24.782 ( -4.399 -3.628 -16.122) 17.100 25.283 ( 3.890 1.895 -7.046) 8.269 25.640 ( -1.766 -3.225 -18.584) 18.945 26.372 ( -5.323 18.712 -5.789) 20.297 29.521 ( -10.394 -15.570 27.361) 33.152 30.230 ( -9.974 -15.261 33.796) 38.400 30.974 ( -18.888 0.225 9.386) 21.093 32.032 ( 1.851 9.307 18.967) 21.208 34.290 ( 0.593 -13.692 16.470) 21.426 35.539 ( 19.279 14.860 -2.058) 24.428 38.227 ( -2.630 -11.175 12.284) 16.814 41.320 ( 32.288 22.672 -30.173) 49.668 ======================= Grid point 538 (160/343) ======================= q-point: ( 0.46 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.156 ( 25.916 8.347 5.659) 27.809 7.161 ( 13.781 5.649 -10.222) 18.064 8.267 ( 20.899 -19.993 23.679) 37.379 8.917 ( 12.304 -2.018 2.152) 12.653 10.668 ( -20.208 -7.473 14.290) 25.854 11.516 ( 18.150 -1.013 12.570) 22.101 12.267 ( -5.743 -22.781 24.040) 33.614 13.273 ( 18.772 5.467 14.135) 24.126 14.815 ( -20.854 0.800 2.594) 21.030 15.235 ( 1.311 -2.954 -15.696) 16.026 16.460 ( 5.578 -7.243 1.228) 9.224 16.807 ( -20.286 6.758 3.332) 21.640 18.746 ( 11.373 -5.303 -7.505) 14.622 19.520 ( 1.112 7.847 -39.741) 40.524 20.161 ( -0.575 -9.802 -14.188) 17.254 21.844 ( -10.637 26.679 9.560) 30.270 23.889 ( -3.925 -3.906 -8.843) 10.434 24.310 ( 3.783 -4.557 -22.248) 23.023 24.825 ( -2.635 -5.644 -15.083) 16.318 25.221 ( -2.001 7.763 -7.871) 11.235 25.666 ( -1.321 -1.889 -18.594) 18.737 26.021 ( -4.043 14.724 -9.873) 18.183 29.668 ( -14.245 -16.329 24.953) 33.049 30.444 ( 2.790 -12.571 29.396) 32.093 30.801 ( -16.268 -1.017 17.618) 24.002 31.948 ( 11.974 8.607 15.340) 21.279 34.506 ( -0.084 -11.777 15.069) 19.125 35.458 ( 18.267 17.002 1.543) 25.002 38.347 ( -8.307 -9.577 11.997) 17.454 41.196 ( 16.915 21.104 -26.024) 37.533 ======================= Grid point 539 (161/343) ======================= q-point: (-0.46 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.195 ( 20.492 14.167 7.438) 25.999 7.191 ( 15.374 8.340 -7.292) 18.949 8.539 ( 6.174 5.848 16.817) 18.844 9.050 ( 17.019 1.897 -2.093) 17.252 10.565 ( -26.591 -9.171 15.987) 32.354 11.633 ( 17.976 7.721 11.467) 22.676 12.382 ( -30.049 -7.077 21.431) 37.581 13.342 ( 21.260 5.910 21.850) 31.053 14.594 ( -25.983 -1.967 -2.034) 26.136 15.251 ( -7.967 -1.702 -10.558) 13.336 16.546 ( 1.939 5.291 5.180) 7.654 16.756 ( 1.949 -16.733 -5.127) 17.610 18.911 ( 12.969 4.595 4.447) 14.459 19.411 ( 3.190 3.165 -41.668) 41.909 20.323 ( 1.527 -5.042 -22.003) 22.625 21.491 ( -4.068 3.289 11.066) 12.241 23.907 ( -3.253 -2.581 -13.275) 13.909 24.409 ( 1.035 -3.010 -19.977) 20.229 24.863 ( -7.319 1.853 -6.732) 10.116 25.046 ( -2.462 1.955 -13.498) 13.860 25.675 ( -1.007 -0.480 -18.674) 18.707 25.872 ( 1.482 1.800 -11.874) 12.101 29.786 ( -14.286 -14.949 22.363) 30.458 30.482 ( 1.492 11.567 15.609) 19.485 30.876 ( -6.776 -22.116 36.547) 43.252 31.984 ( 23.035 7.806 10.973) 26.682 34.669 ( -0.575 -7.725 12.590) 14.783 35.345 ( 17.126 16.725 5.673) 24.601 38.379 ( -13.840 -7.158 10.717) 18.911 40.956 ( 1.903 18.836 -23.173) 29.923 ======================= Grid point 540 (162/343) ======================= q-point: (-0.38 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.100 ( 19.053 20.316 11.201) 30.020 7.133 ( 4.744 12.787 1.051) 13.679 8.353 ( 7.221 18.680 15.596) 25.384 9.051 ( 5.324 13.869 -2.357) 15.042 10.434 ( -26.741 -3.168 11.329) 29.214 11.605 ( 7.443 11.861 10.766) 17.663 12.008 ( -28.684 8.683 18.056) 34.988 13.454 ( 18.684 8.595 19.332) 28.226 14.337 ( -31.341 -1.539 -10.303) 33.027 15.253 ( -11.577 -14.083 4.810) 18.855 16.477 ( 8.218 10.010 3.203) 13.342 17.171 ( 7.680 -24.681 -6.222) 26.587 18.819 ( 9.932 15.904 5.815) 19.632 19.470 ( 2.549 -1.495 -44.361) 44.459 20.326 ( 3.023 4.039 -18.660) 19.330 21.700 ( 6.514 -24.219 11.751) 27.696 23.914 ( -3.837 -2.597 -17.196) 17.809 24.378 ( 1.029 8.774 -19.183) 21.120 24.690 ( -12.718 -0.721 -5.911) 14.043 25.116 ( -0.086 -5.227 -12.389) 13.447 25.673 ( 0.273 -0.025 -18.298) 18.300 25.956 ( 2.156 -8.876 -12.517) 15.496 29.884 ( -10.443 -10.987 20.788) 25.727 30.269 ( -1.259 11.910 22.252) 25.270 31.221 ( -0.123 -21.686 34.135) 40.442 32.134 ( 31.990 6.887 7.363) 33.541 34.721 ( -0.547 1.973 9.207) 9.432 35.281 ( 18.198 10.137 10.015) 23.113 38.312 ( -19.025 -4.252 8.568) 21.294 40.606 ( -13.476 16.569 -21.171) 30.072 ======================= Grid point 541 (163/343) ======================= q-point: (-0.31 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.898 ( 18.837 26.679 17.969) 37.276 6.809 ( -10.933 22.219 16.385) 29.694 8.137 ( 10.182 18.970 18.249) 28.224 8.743 ( -7.011 18.745 -1.628) 20.080 10.024 ( -26.028 20.502 5.729) 33.624 11.348 ( -10.579 14.952 10.137) 20.934 11.718 ( -10.603 6.788 10.015) 16.087 13.370 ( 13.742 19.039 10.485) 25.715 14.126 ( -27.252 -11.130 -12.499) 31.981 15.507 ( -4.812 -23.938 13.207) 27.760 16.347 ( 5.648 13.642 4.431) 15.415 17.660 ( 11.036 -21.362 -6.373) 24.875 18.664 ( 7.846 12.762 5.256) 15.876 19.437 ( -4.526 2.514 -45.325) 45.620 20.333 ( 7.135 1.369 -14.834) 16.518 22.304 ( 12.303 -34.577 12.494) 38.768 23.921 ( -5.489 -3.777 -22.698) 23.656 24.208 ( 1.734 10.796 -13.056) 17.030 24.646 ( -10.622 -5.954 -11.411) 16.688 25.153 ( -1.290 -0.100 -11.073) 11.148 25.678 ( 0.852 0.366 -17.942) 17.965 26.175 ( -0.329 -15.061 -10.588) 18.414 29.883 ( -2.939 5.298 24.786) 25.516 30.154 ( -1.801 -2.541 23.818) 24.021 31.568 ( 0.297 -19.516 30.261) 36.010 32.374 ( 36.221 4.801 4.929) 36.869 34.595 ( -0.095 11.455 8.505) 14.267 35.391 ( 25.145 2.432 11.263) 27.659 38.148 ( -24.139 -1.568 5.794) 24.874 40.134 ( -29.172 15.232 -19.466) 38.236 ======================= Grid point 542 (164/343) ======================= q-point: (-0.23 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.559 ( 13.825 34.218 29.322) 47.136 6.236 ( -14.947 29.509 30.723) 45.146 7.843 ( -6.784 18.698 25.266) 32.156 8.368 ( -11.933 15.765 2.235) 19.898 9.427 ( 1.815 30.776 0.363) 30.831 10.945 ( -18.304 16.489 -0.640) 24.644 11.400 ( -14.885 17.731 8.300) 24.594 13.182 ( 11.669 16.774 3.400) 20.714 14.224 ( -14.794 -24.974 -13.396) 31.969 15.862 ( 3.631 -16.141 10.669) 19.686 16.167 ( -0.496 8.784 8.352) 12.131 18.041 ( 14.523 -7.774 -5.211) 17.277 18.531 ( -0.874 8.004 0.163) 8.053 19.403 ( -3.719 -6.049 -36.822) 37.500 20.386 ( 5.740 0.657 -13.833) 14.991 23.022 ( 13.191 -35.087 11.248) 39.136 23.934 ( -6.642 -4.956 -26.662) 27.920 24.082 ( 2.853 7.059 -10.492) 12.963 24.660 ( -8.422 -7.145 -13.053) 17.099 25.109 ( -1.336 3.463 -10.904) 11.518 25.670 ( 0.826 1.756 -17.672) 17.778 26.403 ( -2.936 -13.078 -6.780) 15.020 29.728 ( 1.635 10.025 31.752) 33.337 30.253 ( 0.361 -7.840 21.584) 22.967 31.860 ( -0.615 -15.445 25.103) 29.481 32.665 ( 31.387 0.867 3.767) 31.624 34.385 ( 0.656 12.974 9.909) 16.339 35.696 ( 42.100 -0.132 10.072) 43.288 37.895 ( -30.495 -0.436 2.758) 30.623 39.520 ( -43.016 16.170 -17.163) 49.055 ======================= Grid point 543 (165/343) ======================= q-point: (-0.15 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.025 ( 2.519 38.596 43.727) 58.378 5.587 ( -9.609 32.933 41.577) 53.903 7.425 ( -12.143 19.549 36.640) 43.268 8.008 ( -10.249 10.362 5.796) 15.685 9.088 ( 21.835 27.900 -4.767) 35.748 10.470 ( -22.968 13.929 -19.053) 32.932 10.897 ( -8.879 25.969 16.729) 32.141 13.052 ( 6.524 9.955 -1.138) 11.956 14.608 ( -4.798 -30.739 -18.026) 35.956 15.923 ( 5.745 10.044 10.683) 15.749 16.222 ( -2.600 -12.689 3.964) 13.545 18.149 ( 12.267 12.202 5.408) 18.128 18.413 ( -6.325 -0.738 -15.477) 16.736 19.586 ( -0.527 -17.070 -22.677) 28.389 20.411 ( 2.183 1.043 -13.023) 13.246 23.679 ( 11.342 -27.712 3.338) 30.129 23.945 ( -4.257 -2.380 -5.413) 7.286 24.034 ( -0.936 -0.573 -32.375) 32.393 24.732 ( -4.875 -9.944 -10.603) 15.332 25.028 ( -0.906 4.242 -8.846) 9.852 25.630 ( 0.513 4.044 -17.272) 17.746 26.522 ( -2.893 -4.019 -1.430) 5.154 29.620 ( 2.629 5.170 34.660) 35.142 30.385 ( 1.883 -6.071 20.993) 21.934 32.059 ( -1.117 -9.419 19.527) 21.709 32.933 ( 17.066 -3.867 3.342) 17.815 34.200 ( 1.736 10.550 12.120) 16.162 36.252 ( 67.087 -3.098 6.674) 67.489 37.565 ( -43.415 -3.068 -0.049) 43.523 38.765 ( -45.469 21.244 -12.703) 51.770 ======================= Grid point 544 (166/343) ======================= q-point: (-0.08 0.08 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.417 ( 0.000 32.279 54.333) 63.198 4.990 ( 0.000 32.020 51.527) 60.666 7.015 ( 0.000 19.991 52.089) 55.793 7.892 ( -0.000 -1.309 -0.148) 1.317 8.779 ( 0.000 24.195 -3.239) 24.410 10.146 ( 0.000 9.183 -31.964) 33.257 10.430 ( 0.000 23.737 22.516) 32.717 12.964 ( 0.000 4.910 -3.154) 5.835 15.095 ( -0.000 -29.407 -23.588) 37.699 15.831 ( 0.000 3.672 14.441) 14.901 16.336 ( -0.000 -1.446 -8.346) 8.470 17.951 ( 0.000 15.358 8.048) 17.338 18.416 ( -0.000 -1.529 -13.994) 14.077 19.889 ( -0.000 -17.501 -14.725) 22.871 20.399 ( 0.000 1.230 -12.418) 12.478 23.903 ( 0.000 1.652 7.516) 7.695 24.055 ( -0.000 -3.211 -58.974) 59.062 24.163 ( -0.000 -19.032 1.461) 19.088 24.830 ( 0.000 1.331 -16.806) 16.859 25.058 ( -0.000 -15.065 9.621) 17.875 25.546 ( 0.000 6.195 -16.242) 17.384 26.472 ( 0.000 8.206 5.707) 9.995 29.601 ( -0.000 -0.645 33.694) 33.700 30.474 ( -0.000 -3.051 20.434) 20.661 32.161 ( -0.000 -4.305 15.494) 16.081 33.112 ( -0.000 -6.957 1.766) 7.178 34.058 ( 0.000 8.238 16.908) 18.808 37.067 ( -0.000 -3.500 5.651) 6.647 37.119 ( -0.000 -12.897 -8.495) 15.444 38.060 ( 0.000 26.891 -6.302) 27.619 ======================= Grid point 547 (167/343) ======================= q-point: ( 0.15 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 4.915 ( 18.398 -0.000 53.475) 56.552 5.052 ( 52.679 -0.000 16.198) 55.113 7.227 ( -12.898 0.000 -13.784) 18.877 7.607 ( 35.875 -0.000 72.397) 80.799 9.221 ( 52.678 -0.000 4.188) 52.844 10.022 ( 5.840 -0.000 19.566) 20.419 11.313 ( 31.009 -0.000 -18.342) 36.027 12.596 ( -4.489 0.000 -5.253) 6.910 15.237 ( -24.155 0.000 12.974) 27.419 15.930 ( 4.906 -0.000 -24.649) 25.132 16.107 ( -7.653 0.000 -8.238) 11.244 17.389 ( -7.512 0.000 4.073) 8.545 18.521 ( 2.943 -0.000 -15.131) 15.414 19.665 ( -20.915 0.000 -13.716) 25.011 20.652 ( 2.054 -0.000 -15.781) 15.914 23.721 ( -6.905 0.000 11.384) 13.314 24.046 ( -0.674 0.000 -60.080) 60.084 24.506 ( -1.390 0.000 -8.946) 9.054 24.703 ( 1.170 -0.000 -15.742) 15.785 25.300 ( -3.480 0.000 -12.802) 13.267 25.990 ( -0.507 0.000 20.161) 20.167 26.060 ( 6.587 -0.000 22.117) 23.077 29.432 ( -6.350 0.000 17.084) 18.226 29.987 ( -27.592 0.000 36.550) 45.796 31.603 ( -51.118 0.000 11.395) 52.373 32.393 ( -2.031 0.000 19.624) 19.728 33.668 ( -1.984 0.000 21.624) 21.714 35.693 ( 18.205 -0.000 -11.205) 21.377 37.615 ( 10.100 -0.000 12.621) 16.165 41.476 ( 71.993 -0.000 -55.838) 91.109 ======================= Grid point 548 (168/343) ======================= q-point: ( 0.23 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.295 ( 13.545 -26.188 43.034) 52.165 5.608 ( 55.074 -1.805 8.763) 55.796 7.173 ( 5.293 1.574 -6.124) 8.246 8.016 ( 32.494 -6.412 61.638) 69.973 9.789 ( 44.692 -7.653 8.202) 46.078 10.194 ( 23.419 -5.334 18.889) 30.556 11.565 ( 5.532 -7.012 -11.509) 14.568 12.648 ( 14.836 -1.349 -7.585) 16.717 14.997 ( -25.212 -1.228 12.180) 28.027 15.795 ( 1.924 13.096 -15.911) 20.697 16.123 ( -10.595 -6.639 -6.207) 13.959 17.369 ( -5.940 -3.922 0.460) 7.133 18.543 ( 2.758 0.837 -22.511) 22.695 19.460 ( -21.378 -1.421 -15.560) 26.479 20.587 ( -3.075 6.642 -15.189) 16.861 23.649 ( -7.499 0.429 11.257) 13.533 24.008 ( 1.035 5.763 -55.015) 55.325 24.418 ( -0.715 7.672 -7.236) 10.571 24.727 ( -2.552 -1.490 -12.828) 13.164 25.291 ( -4.029 -2.340 -10.387) 11.384 25.644 ( -0.398 17.403 12.071) 21.183 26.452 ( 1.863 -20.480 19.788) 28.539 29.326 ( -6.409 4.761 17.625) 19.349 29.763 ( -32.862 -9.222 43.297) 55.133 31.201 ( -28.330 0.511 2.524) 28.446 32.329 ( -10.465 0.387 18.397) 21.169 33.726 ( 4.887 -5.019 20.775) 21.925 35.873 ( 25.793 5.438 -13.057) 29.417 37.753 ( 8.925 -4.535 16.445) 19.252 41.973 ( 53.075 13.211 -52.870) 76.070 ======================= Grid point 549 (169/343) ======================= q-point: ( 0.31 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.957 ( 15.083 -30.190 19.183) 38.819 6.187 ( 47.631 -9.963 14.103) 50.665 7.285 ( 21.408 0.455 1.667) 21.478 8.423 ( 29.879 -5.631 45.547) 54.763 10.192 ( 6.033 -12.308 15.252) 20.506 10.713 ( 49.101 -7.517 15.738) 52.106 11.666 ( -7.531 -9.520 -3.220) 12.559 12.915 ( 28.021 -3.524 -6.822) 29.054 14.805 ( -23.565 -4.788 8.874) 25.632 15.582 ( -6.309 10.966 -8.293) 15.127 16.118 ( -5.591 -4.653 -2.734) 7.771 17.336 ( -8.494 1.248 1.061) 8.651 18.551 ( 1.159 0.193 -30.063) 30.086 19.337 ( -15.168 -6.688 -21.022) 26.772 20.399 ( -6.345 9.451 -12.984) 17.267 23.506 ( -8.152 12.396 8.110) 16.909 23.842 ( -0.108 11.960 -25.055) 27.764 24.296 ( 1.393 5.435 -14.837) 15.862 24.683 ( -8.514 -1.015 -12.771) 15.382 25.286 ( -2.029 -1.846 -4.408) 5.191 25.508 ( -1.332 -0.212 -11.444) 11.523 26.685 ( -1.394 -5.622 11.288) 12.688 29.196 ( -11.551 -1.169 25.053) 27.612 29.657 ( -27.703 -14.628 42.828) 53.062 31.023 ( -8.730 0.359 -2.515) 9.092 32.197 ( -12.376 0.921 15.985) 20.236 33.909 ( 8.122 -8.420 21.129) 24.152 35.996 ( 27.167 11.355 -11.860) 31.743 37.917 ( 4.957 -6.497 18.505) 20.230 42.118 ( 37.944 21.777 -44.756) 62.586 ======================= Grid point 550 (170/343) ======================= q-point: ( 0.38 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.416 ( 31.470 0.067 0.365) 31.473 6.912 ( 24.689 -27.614 10.380) 38.468 7.595 ( 33.999 -6.226 16.067) 38.116 8.793 ( 29.560 -3.762 26.956) 40.182 10.383 ( -7.389 -10.794 17.342) 21.722 11.136 ( 6.452 -9.645 14.961) 18.934 11.876 ( 20.239 -8.208 5.855) 22.611 13.255 ( 27.537 -3.499 0.191) 27.759 14.693 ( -23.065 -8.285 6.228) 25.287 15.294 ( -18.037 7.667 -5.629) 20.391 16.216 ( 6.237 -6.085 -2.552) 9.080 17.133 ( -13.340 9.438 2.002) 16.463 18.582 ( 2.130 -3.101 -28.531) 28.778 19.397 ( -5.806 -12.113 -32.349) 35.027 20.181 ( -6.526 8.207 -8.821) 13.702 22.982 ( -9.634 35.864 10.468) 38.583 23.751 ( -2.695 -1.302 -4.238) 5.188 24.268 ( 2.485 1.165 -21.480) 21.654 24.639 ( -8.911 -4.542 -18.401) 20.944 25.317 ( 0.561 -1.569 -7.362) 7.548 25.537 ( -3.290 -4.813 -17.763) 18.695 26.591 ( -5.312 11.993 0.134) 13.117 29.157 ( -17.653 -11.269 32.207) 38.418 29.738 ( -15.225 -20.733 40.095) 47.637 30.961 ( 0.233 3.737 -1.535) 4.046 32.092 ( -6.079 -0.155 12.853) 14.219 34.142 ( 8.259 -9.506 21.262) 24.711 36.026 ( 25.585 16.121 -9.047) 31.564 38.050 ( -1.036 -6.844 19.206) 20.415 42.028 ( 25.870 25.972 -36.869) 51.992 ======================= Grid point 551 (171/343) ======================= q-point: ( 0.46 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.641 ( 32.770 9.800 1.022) 34.219 7.409 ( 26.610 -2.030 -8.390) 27.975 8.168 ( 31.498 -20.302 31.263) 48.802 9.106 ( 27.980 0.911 7.327) 28.938 10.361 ( -21.238 -3.476 11.820) 24.553 11.360 ( -7.325 -21.930 28.149) 36.427 12.149 ( 17.082 1.343 7.938) 18.884 13.525 ( 19.812 1.573 10.772) 22.606 14.546 ( -27.154 -2.707 4.710) 27.692 15.098 ( -16.404 -6.513 -10.354) 20.463 16.347 ( -1.248 -2.623 -4.934) 5.726 16.862 ( -1.809 8.950 2.281) 9.411 18.725 ( 7.974 -8.511 -22.905) 25.703 19.557 ( -0.818 -7.473 -43.936) 44.575 20.050 ( -2.442 -0.383 -1.584) 2.936 22.258 ( -11.652 36.197 15.349) 41.007 23.778 ( -2.683 -4.323 -4.698) 6.925 24.285 ( -0.202 -1.604 -17.434) 17.509 24.666 ( -5.275 -7.144 -22.436) 24.130 25.308 ( -0.864 3.625 -9.055) 9.792 25.589 ( -2.943 -4.891 -18.405) 19.270 26.259 ( -5.816 18.385 -7.902) 20.839 29.212 ( -19.643 -17.032 32.601) 41.698 30.024 ( -6.024 -25.003 38.895) 46.629 30.867 ( 0.792 8.516 3.994) 9.439 32.103 ( 5.653 -1.490 8.220) 10.087 34.375 ( 7.787 -8.898 20.613) 23.763 35.967 ( 22.635 19.195 -5.422) 30.169 38.117 ( -8.255 -6.491 18.746) 21.487 41.781 ( 15.491 27.869 -30.715) 44.273 ======================= Grid point 552 (172/343) ======================= q-point: ( 0.54 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.750 ( 34.443 16.619 4.240) 38.477 7.570 ( 24.657 11.956 -6.578) 28.181 8.692 ( 22.351 -5.573 23.759) 33.092 9.322 ( 27.351 4.786 -2.744) 27.902 10.148 ( -30.455 -4.772 13.682) 33.727 11.668 ( -9.458 -18.368 24.607) 32.130 12.166 ( 4.338 6.149 13.803) 15.721 13.537 ( -1.242 4.487 20.375) 20.900 14.354 ( -15.608 0.097 -1.496) 15.680 15.049 ( -22.017 -5.230 -9.610) 24.585 16.342 ( -9.935 -11.868 -5.447) 16.408 16.844 ( 16.016 6.319 -0.078) 17.218 18.997 ( 12.699 -9.662 -21.022) 26.392 19.558 ( 2.660 6.196 -38.578) 39.162 20.192 ( 4.445 -12.626 -4.769) 14.209 21.626 ( -12.268 22.990 16.069) 30.615 23.822 ( -2.583 -3.492 -8.924) 9.925 24.313 ( -5.373 -5.066 -13.503) 15.390 24.759 ( -1.300 -6.626 -19.907) 21.021 25.156 ( -3.438 11.145 -10.675) 15.811 25.638 ( -0.993 -3.223 -18.270) 18.579 25.964 ( -2.824 10.131 -12.831) 16.590 29.330 ( -17.727 -19.047 29.417) 39.273 30.413 ( -2.120 -25.680 37.994) 45.908 30.699 ( -0.085 11.620 11.218) 16.152 32.241 ( 16.350 -1.606 3.384) 16.773 34.586 ( 8.052 -6.900 18.912) 21.682 35.844 ( 19.785 20.106 -1.264) 28.236 38.100 ( -16.156 -5.818 17.211) 24.312 41.413 ( 6.060 28.910 -26.062) 39.392 ======================= Grid point 553 (173/343) ======================= q-point: (-0.38 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.768 ( 37.415 23.645 8.790) 45.124 7.492 ( 12.059 19.443 1.475) 22.927 8.774 ( 19.195 16.269 14.698) 29.140 9.324 ( -2.869 15.680 -1.506) 16.011 10.094 ( -9.731 -14.048 12.442) 21.139 11.570 ( -31.947 2.097 12.157) 34.246 12.129 ( 13.091 11.491 15.853) 23.553 13.556 ( -4.811 -11.155 21.130) 24.373 14.144 ( -12.585 8.843 -4.163) 15.934 14.872 ( -24.860 -6.315 2.075) 25.734 16.614 ( 3.152 -18.796 -5.752) 19.908 16.885 ( 8.837 1.014 -2.201) 9.163 19.167 ( 11.671 6.657 -18.446) 22.821 19.510 ( 5.156 3.141 -36.752) 37.245 20.401 ( 7.566 -1.332 -6.607) 10.133 21.396 ( -6.380 -11.012 16.310) 20.688 23.834 ( -3.894 -1.745 -14.282) 14.906 24.348 ( -8.127 -7.017 -14.324) 17.901 24.722 ( -2.596 11.709 -7.421) 14.104 25.038 ( 0.226 -3.034 -17.614) 17.875 25.675 ( 1.227 -1.141 -18.195) 18.272 25.871 ( -2.040 -1.183 -14.701) 14.889 29.492 ( -13.603 -18.799 26.185) 34.987 30.489 ( 0.273 12.888 18.196) 22.300 30.822 ( -0.718 -24.423 36.421) 43.858 32.458 ( 22.107 -1.237 -0.682) 22.152 34.747 ( 8.100 -1.973 15.691) 17.768 35.721 ( 20.431 16.677 3.566) 26.613 37.990 ( -24.604 -4.853 14.876) 29.158 40.942 ( -2.444 29.947 -22.325) 37.433 ======================= Grid point 554 (174/343) ======================= q-point: (-0.31 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.689 ( 38.282 31.328 15.651) 51.883 7.163 ( 0.374 26.740 12.815) 29.655 8.555 ( -2.056 24.232 16.998) 29.671 8.903 ( -14.403 15.889 3.916) 21.800 10.183 ( 7.616 7.338 -2.599) 10.890 11.203 ( -31.725 1.210 6.684) 32.444 11.984 ( 9.222 18.339 14.293) 25.013 13.609 ( -16.164 -5.914 -3.624) 17.589 13.913 ( 4.434 14.450 6.871) 16.604 14.931 ( -17.421 -28.298 18.322) 37.947 16.674 ( 9.178 14.627 -0.693) 17.282 17.237 ( 0.204 -31.971 -6.310) 32.588 19.061 ( 13.000 18.304 -6.253) 23.305 19.461 ( -3.821 4.826 -43.158) 43.595 20.426 ( 5.999 2.775 -11.548) 13.306 21.817 ( 4.829 -34.716 18.605) 39.682 23.811 ( -5.876 -1.709 -22.089) 22.921 24.374 ( -3.486 -1.325 -18.155) 18.534 24.490 ( -4.041 7.794 -2.852) 9.231 25.120 ( 0.202 -3.667 -14.704) 15.155 25.697 ( 1.841 0.397 -17.634) 17.734 25.949 ( -2.165 -10.269 -14.267) 17.711 29.677 ( -8.529 -15.858 24.034) 30.031 30.287 ( 1.801 11.869 24.767) 27.523 31.207 ( -0.792 -22.596 33.542) 40.451 32.696 ( 21.387 -1.047 -3.797) 21.747 34.765 ( 4.258 7.856 11.692) 14.716 35.767 ( 30.244 5.918 7.868) 31.806 37.774 ( -33.760 -3.556 12.343) 36.121 40.373 ( -8.957 31.550 -18.931) 37.868 ======================= Grid point 555 (175/343) ======================= q-point: (-0.23 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.426 ( 27.489 41.383 27.655) 56.859 6.643 ( -4.858 32.193 24.187) 40.559 8.002 ( -24.090 18.028 11.299) 32.141 8.564 ( -2.228 19.285 15.962) 25.133 10.035 ( 20.529 24.340 -8.308) 32.907 10.860 ( -28.946 6.097 -8.404) 30.751 11.708 ( 2.004 21.749 16.636) 27.455 13.590 ( 7.086 12.464 2.543) 14.561 13.723 ( -11.781 -10.063 -6.335) 16.739 15.381 ( -4.920 -34.347 21.539) 40.839 16.455 ( 3.502 17.900 2.654) 18.432 17.772 ( 1.916 -29.205 -7.410) 30.191 18.832 ( 6.602 20.723 5.202) 22.362 19.342 ( -3.883 2.272 -46.432) 46.649 20.447 ( 3.526 0.995 -15.054) 15.494 22.505 ( 6.507 -38.919 20.670) 44.545 23.795 ( -5.070 -3.444 -32.739) 33.308 24.257 ( 2.233 10.451 -5.780) 12.150 24.472 ( -5.541 -6.941 -13.196) 15.906 25.141 ( -0.227 0.855 -13.273) 13.302 25.699 ( 0.904 0.920 -17.324) 17.372 26.145 ( -1.599 -14.486 -11.227) 18.397 29.803 ( -3.000 -3.719 25.841) 26.279 30.176 ( 1.655 1.421 27.540) 27.626 31.553 ( -0.773 -19.860 29.314) 35.416 32.889 ( 13.488 -0.873 -5.014) 14.417 34.600 ( 0.559 13.082 10.703) 16.912 36.124 ( 43.269 -4.526 6.571) 43.999 37.442 ( -42.395 -1.515 10.824) 43.781 39.730 ( -10.400 33.728 -15.401) 38.509 ======================= Grid point 556 (176/343) ======================= q-point: (-0.15 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.795 ( 0.000 47.893 40.609) 62.792 6.079 ( 0.000 31.630 31.967) 44.971 7.628 ( 0.000 14.002 14.176) 19.925 8.210 ( 0.000 19.490 19.714) 27.721 9.722 ( 0.000 29.759 -5.192) 30.209 10.527 ( 0.000 11.578 -22.865) 25.629 11.313 ( 0.000 26.015 20.466) 33.101 13.313 ( 0.000 17.480 2.204) 17.618 14.069 ( -0.000 -29.638 -12.864) 32.310 15.874 ( -0.000 -26.043 14.730) 29.919 16.180 ( 0.000 16.237 6.769) 17.591 18.188 ( -0.000 -17.800 -12.560) 21.785 18.522 ( 0.000 19.290 7.808) 20.810 19.362 ( -0.000 -7.695 -36.726) 37.524 20.446 ( 0.000 1.316 -14.548) 14.607 23.180 ( -0.000 -37.027 20.411) 42.280 23.838 ( -0.000 -4.817 -40.445) 40.731 24.119 ( 0.000 7.387 -4.142) 8.469 24.563 ( -0.000 -7.474 -13.298) 15.254 25.098 ( 0.000 3.835 -12.539) 13.113 25.681 ( 0.000 1.947 -17.284) 17.394 26.366 ( -0.000 -12.205 -7.095) 14.118 29.740 ( 0.000 7.076 32.846) 33.599 30.265 ( -0.000 -8.314 23.580) 25.003 31.845 ( -0.000 -15.500 24.210) 28.747 32.974 ( -0.000 -1.256 -2.658) 2.940 34.388 ( 0.000 11.954 10.994) 16.241 36.643 ( -0.000 -14.675 -1.476) 14.749 37.081 ( 0.000 3.683 13.020) 13.531 39.094 ( 0.000 34.346 -11.902) 36.350 ======================= Grid point 561 (177/343) ======================= q-point: ( 0.23 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.141 ( 5.454 -0.000 40.069) 40.438 6.167 ( 59.027 -0.000 1.664) 59.051 7.340 ( 23.040 -0.000 -0.368) 23.043 8.297 ( 33.427 -0.000 64.666) 72.795 9.977 ( 15.579 -0.000 11.749) 19.512 10.629 ( 61.889 -0.000 11.665) 62.978 11.454 ( -13.864 0.000 -8.228) 16.122 12.864 ( 29.297 -0.000 -9.801) 30.893 14.716 ( -28.173 0.000 14.620) 31.741 15.789 ( -25.171 0.000 6.660) 26.037 16.055 ( 8.210 -0.000 -23.833) 25.208 17.306 ( -1.032 0.000 -5.582) 5.677 18.587 ( 3.997 -0.000 -25.617) 25.927 19.207 ( -25.363 0.000 -15.930) 29.951 20.576 ( -10.256 0.000 -15.603) 18.672 23.579 ( -7.161 0.000 11.490) 13.539 24.078 ( 4.191 -0.000 -57.745) 57.896 24.442 ( -5.633 0.000 -7.812) 9.632 24.724 ( 1.204 -0.000 -10.958) 11.024 25.231 ( -3.433 0.000 -15.202) 15.585 25.891 ( -9.265 0.000 27.349) 28.875 26.138 ( 0.798 -0.000 20.705) 20.720 29.308 ( -37.164 0.000 51.417) 63.442 29.367 ( 0.057 -0.000 11.061) 11.061 31.004 ( -12.699 0.000 -5.380) 13.792 32.188 ( -17.389 0.000 14.921) 22.913 33.766 ( 10.676 -0.000 22.616) 25.009 36.202 ( 30.223 -0.000 -16.381) 34.377 37.810 ( 9.324 -0.000 21.629) 23.553 42.525 ( 36.988 -0.000 -54.030) 65.478 ======================= Grid point 562 (178/343) ======================= q-point: ( 0.31 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.436 ( 4.896 -28.386 32.836) 43.680 6.738 ( 58.091 0.984 -1.011) 58.108 7.595 ( 32.780 2.409 7.400) 33.691 8.646 ( 30.022 -4.395 56.365) 64.013 10.140 ( 11.598 -2.353 11.150) 16.260 11.118 ( 20.025 6.433 3.583) 21.336 11.480 ( 21.828 -13.738 1.075) 25.814 13.179 ( 31.523 -0.810 -8.320) 32.612 14.472 ( -27.091 -3.777 13.542) 30.522 15.489 ( -31.366 2.123 9.332) 32.793 16.135 ( 11.461 1.003 -18.359) 21.665 17.300 ( -2.518 0.848 -6.895) 7.389 18.594 ( 1.735 3.244 -31.067) 31.284 19.030 ( -20.798 -8.236 -19.306) 29.549 20.408 ( -15.440 4.018 -14.397) 21.490 23.508 ( -6.491 0.897 11.464) 13.204 24.079 ( 6.093 7.645 -50.602) 51.538 24.359 ( -6.275 2.038 -6.178) 9.039 24.670 ( -2.457 7.610 -6.118) 10.069 25.193 ( -5.829 -0.979 -9.678) 11.340 25.577 ( -5.471 11.135 8.514) 15.047 26.425 ( -4.508 -20.923 20.568) 29.684 28.987 ( -29.602 -2.178 46.246) 54.952 29.370 ( -1.100 -0.234 17.059) 17.096 30.960 ( -1.356 -2.639 -7.770) 8.317 32.019 ( -19.066 -2.204 11.170) 22.207 33.915 ( 12.441 -3.668 24.379) 27.614 36.441 ( 29.998 7.294 -16.609) 35.056 37.911 ( 7.011 -1.847 24.627) 25.672 42.718 ( 24.943 12.419 -48.653) 56.067 ======================= Grid point 563 (179/343) ======================= q-point: ( 0.38 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.099 ( 8.334 -40.153 22.045) 46.559 7.259 ( 54.901 3.111 -1.729) 55.016 7.908 ( 35.388 0.273 15.261) 38.540 9.033 ( 30.408 -6.502 41.293) 51.692 10.238 ( 2.157 -0.287 13.252) 13.430 11.024 ( -11.807 0.593 3.217) 12.252 12.056 ( 40.086 -7.915 3.866) 41.043 13.486 ( 27.097 -1.288 -2.250) 27.220 14.316 ( -23.815 -7.407 10.185) 26.939 15.106 ( -36.131 3.426 6.998) 36.962 16.289 ( 18.494 -1.514 -11.838) 22.010 17.170 ( -9.194 7.888 -5.262) 13.207 18.554 ( -1.641 -0.824 -30.221) 30.277 19.088 ( -8.751 -14.845 -29.061) 33.786 20.178 ( -16.328 3.728 -12.257) 20.754 23.360 ( -6.679 14.387 12.963) 20.485 23.865 ( 1.086 18.466 -12.528) 22.341 24.284 ( -4.237 0.695 -8.068) 9.139 24.516 ( -5.278 1.209 -22.131) 22.784 25.214 ( -4.057 -7.284 -9.197) 12.414 25.470 ( -2.715 0.135 -11.968) 12.272 26.601 ( -6.659 -5.138 10.123) 13.161 28.803 ( -23.082 -6.946 41.903) 48.342 29.408 ( -1.145 -7.480 26.253) 27.322 31.018 ( 4.291 -0.486 -5.778) 7.214 31.924 ( -13.835 -6.997 7.243) 17.113 34.117 ( 11.718 -6.015 25.135) 28.378 36.543 ( 27.144 14.030 -14.640) 33.882 37.990 ( 2.417 -1.577 25.861) 26.022 42.636 ( 16.618 21.019 -41.459) 49.364 ======================= Grid point 564 (180/343) ======================= q-point: ( 0.46 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.805 ( 18.405 -25.595 9.623) 32.961 7.724 ( 46.516 1.146 -2.128) 46.579 8.271 ( 30.048 -5.541 24.436) 39.125 9.437 ( 34.260 -2.505 18.883) 39.200 10.172 ( -12.135 2.613 11.995) 17.262 10.971 ( -9.709 -9.054 20.551) 24.466 12.399 ( 19.988 3.276 2.965) 20.471 13.698 ( 8.707 1.463 7.917) 11.859 14.244 ( -14.690 -6.895 5.668) 17.189 14.749 ( -30.757 -4.372 -0.985) 31.082 16.409 ( 3.350 7.579 -10.723) 13.552 16.992 ( 5.692 3.742 -3.603) 7.706 18.631 ( 1.945 -8.687 -25.996) 27.478 19.305 ( -3.239 -16.935 -39.013) 42.653 20.003 ( -11.708 -0.396 -7.526) 13.924 22.793 ( -9.693 39.055 20.935) 45.360 23.724 ( -0.393 0.337 -0.737) 0.901 24.225 ( -7.829 -0.632 -4.102) 8.861 24.539 ( 1.282 -4.790 -37.069) 37.399 25.300 ( -1.415 -4.186 -10.813) 11.681 25.469 ( -3.782 -4.060 -16.910) 17.797 26.463 ( -7.202 11.944 -2.221) 14.123 28.767 ( -18.331 -12.897 39.158) 45.118 29.620 ( -0.230 -18.452 33.917) 38.612 31.006 ( 1.996 6.016 0.347) 6.348 32.006 ( -1.883 -11.811 1.813) 12.097 34.337 ( 10.543 -7.274 24.624) 27.756 36.512 ( 22.764 18.875 -11.465) 31.716 38.001 ( -3.627 -0.336 25.917) 26.172 42.369 ( 10.333 26.504 -35.001) 45.103 ======================= Grid point 565 (181/343) ======================= q-point: ( 0.54 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.265 ( 32.898 -0.233 3.963) 33.136 8.032 ( 30.574 10.546 -6.154) 32.922 8.720 ( 21.048 -18.039 32.138) 42.441 9.728 ( 30.346 8.209 -0.187) 31.438 9.923 ( -16.318 8.112 8.600) 20.151 11.164 ( -9.763 -22.695 32.632) 40.930 12.375 ( 2.808 8.949 11.485) 14.829 13.514 ( -20.201 9.281 14.679) 26.640 14.264 ( -5.060 -4.338 -3.192) 7.390 14.687 ( -15.892 -10.906 -4.246) 19.737 16.175 ( -12.184 5.374 -9.645) 16.442 17.115 ( 20.498 4.127 -5.418) 21.599 18.883 ( 7.207 -15.274 -25.785) 30.824 19.523 ( -2.242 -10.321 -48.276) 49.418 20.023 ( -0.479 -11.436 4.020) 12.132 22.022 ( -12.077 38.509 25.122) 47.539 23.759 ( 0.863 -2.905 -3.567) 4.680 24.159 ( -10.799 -2.822 -4.256) 11.946 24.666 ( 4.635 -6.346 -34.390) 35.276 25.271 ( -2.693 5.398 -11.411) 12.908 25.540 ( -1.818 -6.871 -17.684) 19.059 26.147 ( -5.443 15.909 -10.495) 19.821 28.859 ( -14.645 -17.286 35.447) 42.069 29.984 ( 0.359 -24.148 37.562) 44.656 30.877 ( -0.361 9.718 7.044) 12.008 32.242 ( 7.648 -12.020 -2.593) 14.481 34.564 ( 10.222 -7.646 22.769) 26.103 36.375 ( 17.852 21.091 -7.602) 28.659 37.927 ( -10.223 1.154 25.016) 27.049 41.971 ( 5.083 30.256 -29.749) 42.735 ======================= Grid point 566 (182/343) ======================= q-point: (-0.38 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.496 ( 39.555 14.842 5.218) 42.569 7.981 ( 16.519 21.218 0.171) 26.890 9.142 ( 8.625 -8.525 18.718) 22.303 9.432 ( -15.403 22.985 9.574) 29.279 9.984 ( 22.625 -2.590 6.081) 23.571 11.258 ( -25.392 -3.433 11.714) 28.173 12.391 ( 14.327 -2.652 21.603) 26.057 13.194 ( -24.748 -2.672 19.490) 31.614 14.186 ( -12.164 3.039 -8.310) 15.042 14.651 ( -9.411 1.485 1.706) 9.679 16.202 ( -4.822 -19.596 -7.866) 21.659 17.157 ( 13.053 10.817 -6.213) 18.055 19.198 ( 7.288 -11.020 -35.116) 37.520 19.600 ( 0.968 -1.019 -44.854) 44.876 20.367 ( 13.129 -19.120 13.124) 26.649 21.345 ( -15.932 23.270 23.955) 37.002 23.799 ( 0.388 -0.155 -8.769) 8.779 24.130 ( -10.309 -6.924 -6.376) 13.960 24.816 ( 5.699 -3.874 -24.650) 25.595 25.086 ( -4.166 10.759 -13.216) 17.544 25.636 ( 0.754 -5.154 -17.820) 18.566 25.896 ( -3.658 8.061 -15.034) 17.447 29.045 ( -10.326 -19.725 31.388) 38.483 30.401 ( 0.330 -24.917 37.940) 45.392 30.696 ( -0.404 11.131 13.535) 17.529 32.522 ( 10.874 -9.984 -5.562) 15.775 34.783 ( 10.199 -6.028 19.387) 22.720 36.190 ( 14.417 18.857 -3.356) 23.973 37.762 ( -16.274 2.951 23.495) 28.732 41.471 ( 0.814 33.135 -25.387) 41.750 ======================= Grid point 567 (183/343) ======================= q-point: (-0.31 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.477 ( 16.795 24.982 7.413) 31.002 7.781 ( 34.411 28.408 11.831) 46.163 8.698 ( -45.086 21.576 9.678) 50.911 9.208 ( 15.156 19.423 13.641) 28.161 10.318 ( 18.704 -10.275 8.433) 22.946 10.938 ( -26.426 5.604 -0.783) 27.025 12.401 ( 10.480 19.493 11.494) 24.938 13.229 ( -16.997 -18.735 8.059) 26.549 14.130 ( 4.159 -8.594 10.282) 14.032 14.466 ( -13.431 5.340 7.983) 16.511 16.643 ( 0.343 -32.723 -7.027) 33.471 17.028 ( 4.247 14.291 -4.406) 15.546 19.345 ( 5.828 0.345 -42.209) 42.611 19.555 ( -0.353 9.135 -31.195) 32.507 20.604 ( 9.927 11.801 9.493) 18.109 21.243 ( -7.430 -32.106 21.319) 39.250 23.770 ( -2.056 1.692 -15.429) 15.658 24.193 ( -4.957 -9.084 -10.115) 14.471 24.732 ( 1.404 16.213 -9.020) 18.606 25.035 ( -0.403 -6.189 -20.362) 21.286 25.723 ( 3.488 -1.608 -17.426) 17.844 25.803 ( -4.310 -2.298 -16.524) 17.231 29.302 ( -5.114 -19.954 27.849) 34.640 30.499 ( 0.454 11.880 19.856) 23.143 30.814 ( -0.229 -23.983 36.425) 43.612 32.765 ( 8.128 -7.394 -7.609) 13.365 34.914 ( 6.169 1.897 14.667) 16.024 36.099 ( 14.806 7.201 0.390) 16.469 37.516 ( -18.459 5.559 22.161) 29.373 40.895 ( -1.578 35.401 -21.526) 41.462 ======================= Grid point 568 (184/343) ======================= q-point: (-0.23 0.23 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.079 ( 0.000 28.631 14.218) 31.967 7.432 ( 0.000 47.697 28.318) 55.470 8.077 ( 0.000 13.439 2.417) 13.655 8.919 ( 0.000 21.950 17.487) 28.064 10.538 ( 0.000 17.750 -11.492) 21.146 10.657 ( -0.000 -7.805 2.910) 8.330 12.088 ( 0.000 21.955 13.612) 25.832 13.357 ( -0.000 -11.691 -9.367) 14.981 14.055 ( 0.000 23.170 8.002) 24.512 14.716 ( -0.000 -39.513 26.523) 47.589 16.773 ( 0.000 17.549 -1.266) 17.594 17.229 ( -0.000 -35.226 -6.448) 35.811 19.249 ( 0.000 22.566 -3.906) 22.901 19.365 ( 0.000 2.572 -50.008) 50.074 20.497 ( 0.000 3.874 -9.253) 10.031 21.868 ( -0.000 -40.536 23.020) 46.616 23.740 ( -0.000 -0.222 -24.789) 24.789 24.315 ( -0.000 -8.285 -13.116) 15.514 24.477 ( 0.000 14.303 -6.825) 15.848 25.121 ( -0.000 -3.352 -15.583) 15.939 25.723 ( 0.000 1.380 -17.151) 17.206 25.917 ( -0.000 -11.391 -14.952) 18.797 29.590 ( -0.000 -16.783 25.184) 30.264 30.309 ( 0.000 10.848 25.794) 27.983 31.198 ( -0.000 -22.290 33.293) 40.066 32.908 ( -0.000 -4.334 -8.110) 9.195 34.820 ( 0.000 11.563 11.764) 16.496 36.224 ( -0.000 -8.075 0.897) 8.124 37.278 ( 0.000 7.767 20.823) 22.224 40.283 ( 0.000 36.497 -18.009) 40.698 ======================= Grid point 575 (185/343) ======================= q-point: ( 0.31 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.248 ( 7.900 -0.000 36.869) 37.706 7.307 ( 55.872 -0.000 -1.321) 55.888 7.950 ( 33.829 -0.000 8.126) 34.791 8.856 ( 21.977 -0.000 59.488) 63.418 10.311 ( 22.067 -0.000 6.147) 22.907 11.074 ( -19.404 0.000 -6.350) 20.416 11.849 ( 54.395 -0.000 5.972) 54.722 13.481 ( 30.076 -0.000 -8.111) 31.150 14.186 ( -23.168 0.000 15.017) 27.609 15.155 ( -37.792 0.000 16.218) 41.125 16.275 ( 15.008 -0.000 -19.341) 24.481 17.301 ( -0.731 0.000 -11.310) 11.334 18.688 ( 6.293 -0.000 -35.001) 35.562 18.690 ( -26.604 0.000 -18.689) 32.512 20.241 ( -23.885 0.000 -13.591) 27.481 23.456 ( -4.969 0.000 11.670) 12.684 24.208 ( 8.720 -0.000 -55.699) 56.378 24.267 ( -12.408 0.000 -3.732) 12.957 24.760 ( 2.766 -0.000 -7.361) 7.864 25.165 ( -3.304 0.000 -17.276) 17.589 25.671 ( -11.477 0.000 31.062) 33.114 26.083 ( -6.186 0.000 18.191) 19.214 28.686 ( -24.763 0.000 48.937) 54.846 29.425 ( 5.286 -0.000 9.452) 10.830 30.928 ( 1.713 -0.000 -9.521) 9.674 31.798 ( -20.454 0.000 7.092) 21.648 34.012 ( 12.882 -0.000 26.915) 29.839 36.795 ( 28.830 -0.000 -18.844) 34.443 37.970 ( 6.838 -0.000 28.683) 29.487 43.014 ( 14.894 -0.000 -47.196) 49.490 ======================= Grid point 576 (186/343) ======================= q-point: ( 0.38 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.595 ( 11.924 -28.621 35.629) 47.231 7.824 ( 51.098 1.519 -2.122) 51.164 8.246 ( 28.751 1.259 11.687) 31.062 9.117 ( 16.617 -9.332 53.560) 56.850 10.449 ( 18.651 10.584 4.780) 21.971 10.932 ( -7.393 -0.715 -4.150) 8.509 12.327 ( 31.546 -4.233 0.992) 31.844 13.735 ( 21.751 2.034 -3.404) 22.110 14.043 ( -10.217 -3.561 11.734) 15.961 14.763 ( -39.655 1.089 15.846) 42.718 16.465 ( 21.912 -1.861 -14.320) 26.243 17.221 ( -5.679 7.161 -11.657) 14.813 18.461 ( -16.612 -2.693 -23.559) 28.953 18.826 ( 1.931 -8.719 -35.760) 36.858 19.981 ( -27.702 -0.684 -11.991) 30.194 23.410 ( -3.134 1.442 11.798) 12.292 24.095 ( -13.459 5.909 -3.771) 15.175 24.287 ( 8.071 2.317 -43.235) 44.042 24.656 ( 0.969 16.514 0.174) 16.544 25.083 ( -4.720 -0.634 -9.799) 10.895 25.464 ( -5.677 4.219 0.820) 7.120 26.293 ( -8.233 -21.301 19.283) 29.889 28.508 ( -18.025 -3.548 45.284) 48.868 29.427 ( 4.846 4.612 13.759) 15.299 31.015 ( 5.089 -5.179 -8.637) 11.284 31.649 ( -17.487 -5.675 3.660) 18.745 34.157 ( 11.316 -2.966 28.209) 30.538 36.992 ( 25.105 8.305 -18.507) 32.276 38.023 ( 4.384 0.785 30.645) 30.967 43.030 ( 8.723 11.209 -42.749) 45.047 ======================= Grid point 577 (187/343) ======================= q-point: ( 0.46 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.352 ( 16.390 -42.757 29.961) 54.721 8.232 ( 41.075 4.572 -3.889) 41.511 8.480 ( 20.019 -0.489 14.006) 24.437 9.493 ( 13.184 -17.588 44.661) 49.777 10.342 ( 11.144 16.797 4.599) 20.676 10.925 ( 6.748 3.240 3.085) 8.096 12.564 ( 6.071 -1.334 0.946) 6.287 13.735 ( -6.821 5.083 4.998) 9.866 14.110 ( -0.139 -1.019 9.932) 9.985 14.424 ( -19.839 -3.613 2.991) 20.386 16.619 ( 4.987 11.727 -14.814) 19.541 17.099 ( 12.353 -1.006 -7.454) 14.463 18.450 ( -9.061 -10.053 -22.960) 26.652 19.025 ( 1.372 -13.328 -38.939) 41.180 19.770 ( -24.328 -5.939 -10.476) 27.145 23.251 ( -4.260 20.317 17.188) 26.951 23.786 ( -9.770 10.341 8.595) 16.621 24.214 ( 0.671 9.727 -4.045) 10.556 24.522 ( 3.801 -0.935 -38.606) 38.804 25.156 ( -1.550 -9.172 -12.884) 15.891 25.397 ( -4.801 -0.476 -13.195) 14.049 26.455 ( -7.337 -5.538 8.422) 12.468 28.446 ( -12.885 -7.253 41.765) 44.306 29.443 ( 3.027 -3.986 24.109) 24.623 31.098 ( 2.493 2.170 -2.939) 4.423 31.709 ( -7.166 -17.120 -2.083) 18.676 34.328 ( 9.098 -5.485 27.954) 29.904 37.013 ( 19.745 15.460 -16.306) 29.913 38.017 ( 0.521 3.141 31.220) 31.382 42.835 ( 5.118 19.881 -37.679) 42.909 ======================= Grid point 578 (188/343) ======================= q-point: ( 0.54 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.236 ( 23.717 -37.070 21.991) 49.196 8.457 ( 18.982 5.280 -1.307) 19.746 8.640 ( 10.833 -1.150 10.091) 14.850 9.893 ( 6.294 -14.218 31.501) 35.130 10.183 ( 17.957 17.258 6.970) 25.862 10.957 ( 10.613 1.396 11.633) 15.809 12.453 ( -16.001 8.180 15.869) 23.974 13.538 ( -7.829 9.584 3.386) 12.830 13.967 ( -23.916 -7.484 -0.345) 25.062 14.547 ( 9.673 -6.056 0.554) 11.426 16.260 ( -11.513 17.863 -15.404) 26.247 17.378 ( 25.191 0.574 -9.562) 26.951 18.621 ( -3.393 -19.069 -19.442) 27.443 19.280 ( 0.573 -14.893 -45.479) 47.858 19.743 ( -13.307 -14.395 -4.312) 20.072 22.617 ( -7.437 42.365 28.449) 51.570 23.714 ( -0.979 -3.982 4.734) 6.263 24.073 ( -5.322 4.558 -1.158) 7.102 24.629 ( 5.737 -4.718 -43.958) 44.581 25.276 ( -1.082 -2.852 -12.274) 12.647 25.390 ( -3.851 -6.508 -16.820) 18.442 26.335 ( -5.193 10.992 -3.698) 12.707 28.497 ( -8.983 -11.882 38.776) 41.539 29.644 ( 1.609 -16.857 33.585) 37.612 31.013 ( -0.797 7.429 3.132) 8.102 32.014 ( 1.813 -20.220 -6.235) 21.237 34.518 ( 7.079 -7.860 26.034) 28.101 36.877 ( 13.428 20.143 -12.994) 27.475 37.927 ( -3.361 5.900 30.907) 31.645 42.486 ( 2.682 26.402 -33.022) 42.364 ======================= Grid point 579 (189/343) ======================= q-point: ( 0.62 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.946 ( 35.050 -9.185 10.391) 37.694 8.405 ( 1.421 9.061 2.999) 9.650 8.739 ( -14.487 -9.518 9.562) 19.797 9.910 ( 17.813 19.769 15.323) 30.707 10.192 ( 4.744 2.089 18.198) 18.922 11.067 ( 1.838 -0.519 -0.008) 1.910 12.218 ( -13.460 -9.754 40.456) 43.738 13.232 ( -4.629 19.367 4.774) 20.477 13.963 ( -14.991 -11.207 -13.006) 22.792 14.672 ( 4.167 0.362 3.570) 5.500 15.985 ( -5.629 1.171 -12.457) 13.720 17.452 ( 10.444 10.478 -11.110) 18.502 18.983 ( 2.669 -21.201 -27.076) 34.492 19.485 ( -1.208 -10.180 -51.663) 52.670 20.023 ( 0.251 -26.648 9.376) 28.251 21.826 ( -6.199 42.950 31.839) 53.823 23.812 ( 4.279 -4.173 -1.215) 6.099 23.957 ( -8.434 0.405 -2.758) 8.883 24.771 ( 4.143 -6.191 -38.142) 38.862 25.210 ( -2.637 6.695 -11.255) 13.359 25.520 ( -0.324 -8.845 -17.723) 19.811 26.064 ( -2.471 14.756 -11.439) 18.833 28.664 ( -4.990 -16.464 35.440) 39.395 29.999 ( 0.616 -23.413 37.920) 44.570 30.863 ( -0.596 9.498 8.358) 12.666 32.361 ( 3.524 -17.322 -7.806) 19.324 34.725 ( 4.902 -9.534 22.512) 24.934 36.628 ( 7.021 21.018 -9.092) 23.952 37.763 ( -5.136 8.422 29.843) 31.431 42.021 ( 0.844 31.272 -28.863) 42.564 ======================= Grid point 580 (190/343) ======================= q-point: (-0.31 0.31 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.946 ( 0.000 22.173 1.580) 22.229 8.481 ( 0.000 10.941 -0.988) 10.986 8.538 ( 0.000 4.902 20.084) 20.674 9.669 ( 0.000 22.895 11.316) 25.539 10.212 ( -0.000 -6.960 30.460) 31.245 10.948 ( 0.000 8.855 -15.238) 17.624 12.623 ( -0.000 -36.284 38.712) 53.058 12.838 ( 0.000 22.977 7.044) 24.033 13.988 ( -0.000 -2.899 -11.074) 11.447 14.611 ( 0.000 8.823 5.979) 10.658 16.153 ( -0.000 -22.849 -8.741) 24.463 17.292 ( 0.000 13.673 -8.247) 15.967 19.272 ( -0.000 -10.989 -40.748) 42.204 19.603 ( -0.000 -3.766 -47.625) 47.774 20.571 ( -0.000 -35.885 18.933) 40.573 21.119 ( 0.000 35.906 28.894) 46.088 23.817 ( 0.000 4.320 -8.959) 9.947 24.007 ( -0.000 -9.806 -4.780) 10.908 24.909 ( -0.000 -7.524 -29.501) 30.446 25.013 ( 0.000 14.727 -9.867) 17.727 25.650 ( -0.000 -6.861 -17.916) 19.185 25.852 ( 0.000 8.565 -15.471) 17.684 28.942 ( -0.000 -19.679 31.719) 37.328 30.406 ( -0.000 -24.774 38.315) 45.627 30.690 ( 0.000 10.902 14.039) 17.775 32.633 ( -0.000 -12.718 -8.322) 15.199 34.900 ( -0.000 -7.119 18.147) 19.493 36.349 ( 0.000 15.812 -5.071) 16.605 37.574 ( 0.000 9.717 27.806) 29.455 41.475 ( 0.000 34.499 -25.032) 42.623 ======================= Grid point 589 (191/343) ======================= q-point: ( 0.38 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.471 ( 13.669 -0.000 43.693) 45.781 8.309 ( 44.728 -0.000 0.843) 44.736 8.482 ( 16.837 -0.000 6.355) 17.997 9.145 ( 8.415 -0.000 55.252) 55.889 10.824 ( 27.625 -0.000 2.780) 27.764 10.851 ( -0.534 0.000 -6.073) 6.096 12.468 ( 3.981 -0.000 -0.917) 4.085 13.982 ( 19.857 -0.000 -5.767) 20.677 13.998 ( 7.494 -0.000 8.845) 11.593 14.382 ( -38.386 0.000 21.779) 44.134 16.673 ( 25.607 -0.000 -10.814) 27.797 17.258 ( -3.377 0.000 -15.887) 16.242 18.209 ( -20.655 0.000 -22.133) 30.274 18.820 ( 6.521 -0.000 -39.734) 40.266 19.654 ( -35.024 0.000 -9.541) 36.300 23.399 ( -0.589 0.000 12.041) 12.055 23.975 ( -16.107 0.000 3.408) 16.464 24.391 ( 8.844 -0.000 -51.757) 52.507 24.842 ( 5.750 -0.000 -10.269) 11.769 25.105 ( -2.656 0.000 -18.150) 18.344 25.491 ( -6.483 0.000 29.199) 29.910 25.915 ( -10.241 0.000 17.716) 20.463 28.334 ( -11.905 0.000 43.634) 45.229 29.544 ( 6.011 -0.000 10.513) 12.110 30.995 ( 3.934 -0.000 -9.498) 10.281 31.437 ( -15.401 0.000 1.027) 15.435 34.234 ( 9.200 -0.000 30.157) 31.529 37.289 ( 20.528 -0.000 -20.176) 28.783 38.076 ( 3.999 -0.000 33.316) 33.555 43.183 ( 3.916 -0.000 -41.326) 41.511 ======================= Grid point 590 (192/343) ======================= q-point: ( 0.46 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.863 ( 13.152 -29.949 44.471) 55.205 8.568 ( 8.294 2.448 2.256) 8.937 8.701 ( 31.820 0.454 0.475) 31.827 9.303 ( 3.562 -11.616 54.493) 55.831 10.756 ( 14.251 13.992 -0.350) 19.974 11.102 ( 19.093 0.217 -1.231) 19.134 12.457 ( -12.264 -5.084 0.455) 13.284 13.830 ( -12.796 13.587 10.738) 21.532 14.090 ( -8.944 5.143 9.791) 14.224 14.288 ( 13.429 -9.349 -1.630) 16.444 16.873 ( 8.089 11.007 -14.371) 19.827 17.213 ( 16.100 -3.085 -10.103) 19.256 18.144 ( -13.533 -10.177 -23.330) 28.827 18.911 ( 4.213 -4.652 -39.229) 39.727 19.365 ( -32.509 -7.523 -8.810) 34.511 23.399 ( 2.391 1.985 12.275) 12.663 23.777 ( -15.857 5.486 8.951) 19.018 24.475 ( 8.267 0.862 -47.304) 48.029 24.696 ( 2.653 25.647 5.842) 26.437 25.027 ( -0.685 -3.669 -16.043) 16.471 25.352 ( -5.780 2.196 -4.025) 7.378 26.137 ( -6.609 -22.954 19.438) 30.796 28.264 ( -7.470 -2.931 41.525) 42.293 29.520 ( 3.850 6.766 14.845) 16.763 31.115 ( 4.471 -5.055 -6.858) 9.622 31.367 ( -10.713 -10.281 -2.566) 15.069 34.335 ( 6.382 -2.830 30.559) 31.346 37.387 ( 14.349 8.765 -19.566) 25.798 38.085 ( 1.996 2.801 34.291) 34.463 43.121 ( 1.737 10.384 -38.565) 39.977 ======================= Grid point 591 (193/343) ======================= q-point: ( 0.54 0.38 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.647 ( 10.265 -47.809 40.484) 63.482 8.554 ( -0.784 3.388 0.319) 3.492 8.901 ( 17.455 5.763 -9.051) 20.489 9.591 ( 0.363 -20.534 57.960) 61.491 10.640 ( 12.826 17.222 4.544) 21.948 11.217 ( 16.463 5.829 -5.276) 18.244 12.366 ( -16.698 1.930 13.089) 21.304 13.524 ( -11.848 1.790 8.231) 14.537 13.876 ( -4.599 13.622 0.197) 14.379 14.541 ( 8.552 -7.031 -0.593) 11.087 16.516 ( -6.214 22.763 -19.373) 30.530 17.628 ( 31.061 -4.435 -11.507) 33.419 18.196 ( -17.635 -17.593 -14.758) 28.954 19.085 ( 4.203 -11.380 -40.737) 42.505 19.316 ( -17.866 -16.685 -9.529) 26.237 23.196 ( -1.299 29.792 21.894) 36.995 23.604 ( -5.882 -3.912 10.725) 12.842 24.255 ( 1.714 19.871 4.705) 20.493 24.605 ( 3.255 -3.909 -47.435) 47.707 25.157 ( 1.401 -9.485 -17.483) 19.939 25.294 ( -4.687 -0.626 -11.721) 12.638 26.346 ( -3.102 -6.077 7.889) 10.430 28.285 ( -3.874 -6.421 39.841) 40.541 29.492 ( 1.462 -2.647 24.754) 24.938 31.110 ( -0.411 4.976 -0.114) 4.995 31.639 ( -0.996 -24.205 -8.091) 25.541 34.454 ( 3.361 -5.753 29.223) 29.973 37.285 ( 7.267 16.050 -17.216) 24.633 38.019 ( -0.063 6.174 34.155) 34.709 42.884 ( 0.799 19.220 -35.444) 40.328 ======================= Grid point 592 (194/343) ======================= q-point: (-0.38 -0.62 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.547 ( -0.000 -50.104 34.967) 61.099 8.445 ( 0.000 8.113 -2.088) 8.377 8.846 ( 0.000 10.290 -8.826) 13.556 9.959 ( -0.000 -20.755 48.666) 52.907 10.396 ( 0.000 20.162 7.757) 21.603 11.213 ( 0.000 7.076 -13.142) 14.926 12.116 ( 0.000 9.622 38.435) 39.621 13.559 ( 0.000 19.530 0.286) 19.533 13.623 ( -0.000 -16.312 -6.736) 17.648 14.673 ( -0.000 -3.656 1.769) 4.061 16.128 ( 0.000 17.952 -17.673) 25.192 17.690 ( 0.000 10.364 -16.293) 19.310 18.554 ( -0.000 -29.827 -12.416) 32.308 19.299 ( -0.000 -11.216 -50.843) 52.066 19.582 ( -0.000 -24.165 0.509) 24.170 22.538 ( 0.000 43.999 30.941) 53.789 23.698 ( -0.000 -8.318 6.265) 10.413 24.026 ( 0.000 9.622 -0.602) 9.641 24.699 ( -0.000 -5.018 -46.293) 46.564 25.260 ( 0.000 1.488 -11.058) 11.157 25.347 ( -0.000 -11.165 -17.801) 21.013 26.281 ( 0.000 10.618 -3.977) 11.338 28.410 ( -0.000 -11.203 38.099) 39.712 29.662 ( -0.000 -16.362 33.922) 37.661 31.001 ( 0.000 7.501 3.748) 8.385 32.038 ( -0.000 -22.832 -8.629) 24.408 34.591 ( -0.000 -8.633 26.258) 27.640 37.012 ( 0.000 20.434 -13.610) 24.551 37.890 ( 0.000 8.667 32.908) 34.030 42.508 ( 0.000 26.328 -32.232) 41.618 ======================= Grid point 604 (195/343) ======================= q-point: ( 0.46 0.46 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.703 ( 7.576 -0.000 51.578) 52.131 8.613 ( 0.205 -0.000 -1.037) 1.057 8.981 ( 21.295 -0.000 -0.821) 21.311 9.223 ( -0.244 0.000 57.115) 57.115 10.999 ( 9.429 -0.000 -4.894) 10.623 11.275 ( 14.956 -0.000 1.920) 15.079 12.272 ( -12.615 0.000 0.563) 12.627 13.747 ( -19.812 0.000 22.597) 30.052 14.241 ( 9.311 -0.000 -4.959) 10.549 14.270 ( 7.246 -0.000 -0.918) 7.304 17.165 ( 17.459 -0.000 -4.381) 18.000 17.197 ( -2.057 0.000 -19.594) 19.702 17.987 ( 0.495 -0.000 -26.069) 26.074 18.916 ( 2.739 -0.000 -41.011) 41.102 18.964 ( -29.285 0.000 -3.246) 29.464 23.437 ( 3.811 -0.000 12.733) 13.291 23.694 ( -10.631 0.000 7.804) 13.188 24.515 ( 3.246 -0.000 -43.759) 43.879 24.967 ( 5.309 -0.000 -24.300) 24.873 25.067 ( -1.129 0.000 -18.312) 18.347 25.413 ( -1.793 0.000 26.610) 26.670 25.730 ( -6.676 0.000 23.536) 24.465 28.189 ( -3.403 0.000 40.630) 40.773 29.634 ( 2.622 -0.000 11.807) 12.095 31.054 ( 1.706 -0.000 -9.083) 9.242 31.224 ( -5.780 0.000 -2.336) 6.234 34.359 ( 3.275 -0.000 31.794) 31.962 37.570 ( 7.474 -0.000 -20.802) 22.104 38.128 ( 1.299 -0.000 35.582) 35.606 43.216 ( 0.389 -0.000 -38.185) 38.186 ======================= Grid point 605 (196/343) ======================= q-point: (-0.46 -0.54 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.011 ( -0.000 -31.092 49.781) 58.693 8.596 ( 0.000 1.931 -2.394) 3.076 9.072 ( 0.000 3.132 -13.995) 14.341 9.311 ( -0.000 -11.876 69.035) 70.049 10.948 ( 0.000 11.281 -0.542) 11.294 11.354 ( 0.000 0.699 -2.912) 2.995 12.247 ( -0.000 -4.252 3.722) 5.651 13.557 ( 0.000 8.917 21.014) 22.827 14.102 ( 0.000 13.089 -3.946) 13.671 14.456 ( -0.000 -8.617 -2.571) 8.993 16.867 ( 0.000 22.099 -19.184) 29.264 17.590 ( -0.000 -24.649 -4.688) 25.091 17.963 ( 0.000 5.196 -25.244) 25.773 18.920 ( -0.000 -13.569 -2.253) 13.755 18.984 ( -0.000 -6.149 -43.077) 43.514 23.492 ( -0.000 -3.484 12.529) 13.004 23.546 ( 0.000 11.730 11.510) 16.434 24.559 ( -0.000 -3.101 -44.878) 44.986 24.730 ( 0.000 32.107 8.386) 33.184 25.039 ( -0.000 -5.228 -25.196) 25.733 25.274 ( 0.000 2.248 -2.452) 3.327 26.067 ( -0.000 -24.272 20.319) 31.654 28.194 ( -0.000 -2.650 40.119) 40.206 29.560 ( 0.000 7.609 15.500) 17.267 31.173 ( 0.000 2.667 -2.037) 3.356 31.247 ( -0.000 -19.768 -8.881) 21.671 34.398 ( -0.000 -2.839 31.333) 31.462 37.532 ( 0.000 8.884 -19.945) 21.834 38.104 ( 0.000 3.577 35.534) 35.713 43.133 ( 0.000 10.104 -37.099) 38.450 ======================= Grid point 692 (197/343) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.082 ( 0.000 0.000 60.454) 60.454 5.557 ( 0.000 0.000 56.332) 56.332 7.347 ( 0.000 0.000 13.580) 13.580 7.937 ( 0.000 0.000 -10.998) 10.998 8.214 ( 0.000 0.000 -2.674) 2.674 9.235 ( 0.000 0.000 -40.239) 40.239 10.747 ( 0.000 0.000 49.048) 49.048 12.799 ( 0.000 0.000 -5.839) 5.839 15.229 ( 0.000 0.000 -24.039) 24.039 15.600 ( 0.000 0.000 -30.093) 30.093 16.265 ( 0.000 0.000 28.423) 28.423 17.834 ( 0.000 0.000 8.776) 8.776 18.577 ( 0.000 0.000 14.433) 14.433 19.968 ( 0.000 0.000 -13.466) 13.466 20.145 ( 0.000 0.000 -9.838) 9.838 22.722 ( 0.000 0.000 -71.295) 71.295 24.124 ( 0.000 0.000 12.706) 12.706 24.277 ( 0.000 0.000 -11.620) 11.620 24.322 ( 0.000 0.000 -14.307) 14.307 25.153 ( 0.000 0.000 -11.737) 11.737 26.163 ( 0.000 0.000 13.650) 13.650 26.252 ( 0.000 0.000 15.596) 15.596 30.237 ( 0.000 0.000 26.503) 26.503 30.848 ( 0.000 0.000 13.353) 13.353 32.424 ( 0.000 0.000 7.802) 7.802 33.091 ( 0.000 0.000 -9.439) 9.439 34.592 ( 0.000 0.000 36.351) 36.351 37.013 ( 0.000 0.000 -20.442) 20.442 37.340 ( 0.000 0.000 -0.647) 0.647 37.357 ( 0.000 0.000 -0.446) 0.446 ======================= Grid point 693 (198/343) ======================= q-point: ( 0.08 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.168 ( -4.784 -12.322 53.216) 54.833 5.716 ( 8.778 -13.753 52.678) 55.146 7.571 ( 20.583 -7.230 15.651) 26.849 7.745 ( -17.054 -2.779 -10.643) 20.293 8.364 ( -1.615 -11.919 -3.653) 12.570 9.533 ( 42.579 -7.789 -33.882) 54.969 10.835 ( -0.902 -11.010 46.463) 47.758 12.789 ( -5.654 -2.323 -5.628) 8.309 15.050 ( 2.119 17.531 -20.386) 26.971 15.751 ( 1.646 -11.803 -30.349) 32.605 16.217 ( -5.845 1.397 27.889) 28.529 17.883 ( -5.271 -8.213 7.574) 12.353 18.517 ( -1.334 6.200 12.423) 13.948 19.830 ( -8.480 9.282 -13.292) 18.296 20.178 ( 4.652 0.819 -10.095) 11.145 22.718 ( -0.788 -0.040 -69.859) 69.863 24.111 ( -3.609 -0.380 10.634) 11.236 24.205 ( 1.766 5.912 -8.208) 10.269 24.409 ( 1.325 -5.512 -14.922) 15.962 25.175 ( -1.532 -3.308 -12.457) 12.979 25.857 ( 3.867 24.405 20.052) 31.821 26.476 ( 4.510 -9.588 7.406) 12.927 30.186 ( -8.723 0.146 26.196) 27.610 30.811 ( -7.012 -0.033 12.751) 14.551 32.454 ( 6.963 1.398 8.842) 11.341 33.031 ( -9.269 1.871 -6.215) 11.315 34.541 ( -10.077 -0.626 33.620) 35.103 36.333 ( -71.369 0.430 -4.779) 71.530 37.453 ( 12.975 -4.902 0.848) 13.897 38.116 ( 84.387 -2.781 -17.163) 86.160 ======================= Grid point 694 (199/343) ======================= q-point: ( 0.15 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.368 ( -6.828 -17.896 37.764) 42.344 6.153 ( 17.532 -21.191 45.043) 52.776 7.503 ( -28.385 -10.728 -13.715) 33.300 8.155 ( 28.408 -10.851 19.631) 36.196 8.644 ( 21.374 -17.752 1.313) 27.815 10.204 ( 51.183 -14.270 -22.320) 57.632 11.089 ( -0.183 -19.743 38.319) 43.106 12.776 ( -10.445 -6.236 -4.616) 13.011 14.770 ( 6.299 20.035 -13.173) 24.791 15.923 ( -1.924 -6.738 -20.819) 21.967 16.159 ( -5.673 -3.539 18.910) 20.057 17.963 ( -12.186 -10.080 4.621) 16.476 18.365 ( -1.883 8.975 6.149) 11.041 19.532 ( -8.312 15.938 -14.966) 23.390 20.187 ( 1.574 1.685 -8.486) 8.794 22.706 ( -1.768 0.084 -65.218) 65.242 24.064 ( -3.566 1.867 1.689) 4.366 24.119 ( -0.759 5.666 3.719) 6.820 24.503 ( 2.061 -3.452 -14.882) 15.416 25.218 ( -2.845 -3.645 -12.929) 13.731 25.499 ( 6.794 23.177 20.433) 31.636 26.600 ( 7.054 2.178 -0.632) 7.410 30.099 ( -12.294 -3.268 25.440) 28.443 30.726 ( -9.028 0.317 11.490) 14.616 32.461 ( 1.615 4.696 11.213) 12.264 32.853 ( -18.098 2.519 1.921) 18.374 34.461 ( -12.304 -4.562 27.279) 30.272 35.772 ( -44.582 -1.829 -0.805) 44.627 37.727 ( 16.599 -9.457 4.535) 19.635 38.923 ( 75.343 0.936 -24.015) 79.083 ======================= Grid point 695 (200/343) ======================= q-point: ( 0.23 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.605 ( -4.912 -16.886 24.220) 29.931 6.657 ( 17.304 -14.665 27.841) 35.911 7.532 ( -24.478 -26.010 -6.283) 36.265 8.452 ( 13.236 -5.600 11.849) 18.627 9.416 ( 51.694 -24.813 14.736) 59.204 10.920 ( 39.153 -16.330 -4.783) 42.691 11.460 ( 5.372 -20.609 22.028) 30.640 12.825 ( -11.706 -14.037 -1.765) 18.362 14.535 ( 12.487 18.507 -5.692) 23.040 15.916 ( -10.561 -1.570 0.305) 10.681 16.239 ( 0.159 -6.936 1.731) 7.151 17.902 ( -16.320 1.797 0.019) 16.419 18.251 ( -5.489 -0.635 -4.229) 6.958 19.171 ( -4.912 18.214 -18.918) 26.717 20.162 ( -1.643 1.042 -4.434) 4.842 22.668 ( -3.814 2.083 -54.877) 55.049 23.928 ( 1.554 14.490 1.256) 14.628 24.024 ( -8.161 -0.647 6.605) 10.519 24.557 ( 2.676 -0.497 -11.560) 11.876 25.182 ( 2.222 7.538 3.222) 8.493 25.324 ( 3.413 3.105 -4.347) 6.339 26.527 ( 5.171 13.887 -7.430) 16.577 30.081 ( -10.698 -8.382 23.672) 27.296 30.639 ( -5.664 1.155 10.599) 12.073 32.297 ( -21.029 2.601 14.286) 25.555 32.630 ( -11.563 6.411 9.682) 16.387 34.485 ( -7.295 -9.907 20.659) 24.045 35.493 ( -20.397 -1.436 0.337) 20.450 38.060 ( 15.942 -10.549 7.939) 20.699 39.548 ( 59.765 3.721 -26.325) 65.412 ======================= Grid point 696 (201/343) ======================= q-point: ( 0.31 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.821 ( -1.329 -12.746 15.285) 19.947 6.891 ( -0.782 -5.036 0.329) 5.107 7.896 ( -2.202 -30.245 14.257) 33.509 8.682 ( 10.610 -8.012 8.898) 15.998 10.317 ( 50.011 -20.214 16.069) 56.284 11.446 ( 9.528 -16.217 17.675) 25.811 11.860 ( 20.405 -13.884 3.568) 24.937 13.042 ( -7.169 -22.570 2.315) 23.794 14.431 ( 20.550 12.617 -0.943) 24.133 15.785 ( -14.653 3.045 4.368) 15.590 16.349 ( 0.395 -5.837 4.164) 7.181 17.631 ( -16.098 10.538 -4.683) 19.803 18.222 ( -11.093 -4.628 -18.132) 21.755 18.888 ( 0.400 11.964 -25.341) 28.026 20.135 ( -3.041 -1.209 2.725) 4.258 22.515 ( -8.076 10.912 -31.198) 34.023 23.697 ( 2.909 12.412 -2.201) 12.937 23.965 ( -6.855 -1.001 -0.408) 6.939 24.589 ( 3.347 -0.170 -7.393) 8.117 25.115 ( 4.154 4.453 -0.616) 6.121 25.337 ( 1.344 -0.378 -11.458) 11.543 26.259 ( 0.133 20.318 -11.371) 23.284 30.157 ( -7.467 -10.766 20.418) 24.259 30.586 ( 0.710 2.029 10.239) 10.462 32.030 ( -31.984 -3.521 18.108) 36.922 32.406 ( -5.196 10.559 13.216) 17.697 34.626 ( -2.753 -11.979 15.911) 20.106 35.375 ( -6.580 0.676 1.926) 6.889 38.368 ( 12.519 -9.242 10.428) 18.732 39.978 ( 42.549 4.617 -26.147) 50.154 ======================= Grid point 697 (202/343) ======================= q-point: ( 0.38 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.999 ( 1.580 -8.258 9.962) 13.036 6.891 ( -7.899 -1.820 -9.245) 12.296 8.374 ( 9.916 -20.503 18.249) 29.184 8.893 ( 3.769 -7.241 5.293) 9.729 10.970 ( 31.255 -8.695 17.343) 36.787 11.657 ( -6.936 -10.478 22.147) 25.464 12.367 ( 29.961 -16.241 5.140) 34.465 13.345 ( -6.201 -18.332 6.277) 20.345 14.536 ( 27.329 3.259 -0.118) 27.523 15.520 ( -18.708 8.597 6.969) 21.736 16.443 ( 0.231 -5.491 3.715) 6.634 17.249 ( -16.715 15.296 -3.455) 22.919 18.229 ( -5.703 -7.971 -33.272) 34.685 18.753 ( 0.151 6.809 -33.384) 34.071 20.162 ( -1.750 -5.146 12.353) 13.496 22.151 ( -9.972 19.703 -3.108) 22.300 23.636 ( 6.093 1.002 -14.895) 16.124 23.925 ( -5.790 -1.777 -7.702) 9.798 24.635 ( 3.781 -1.230 -6.011) 7.207 25.073 ( 1.177 5.068 -6.695) 8.479 25.355 ( 2.139 0.222 -11.268) 11.471 25.909 ( -3.824 17.478 -11.759) 21.410 30.262 ( -5.264 -8.459 16.915) 19.631 30.588 ( 5.973 1.876 9.289) 11.202 31.820 ( -27.308 -6.684 21.702) 35.516 32.192 ( -1.941 10.391 14.566) 17.998 34.797 ( -1.182 -10.172 12.675) 16.294 35.317 ( -0.588 2.440 4.282) 4.964 38.599 ( 7.805 -6.260 12.012) 15.633 40.240 ( 25.325 3.663 -25.210) 35.921 ======================= Grid point 698 (203/343) ======================= q-point: ( 0.46 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.113 ( 1.423 -3.087 7.325) 8.076 6.839 ( -4.110 -0.190 -10.645) 11.412 8.730 ( 9.641 -9.352 14.536) 19.792 8.956 ( -3.862 -0.492 4.063) 5.627 11.237 ( 9.251 -1.325 21.355) 23.311 11.721 ( -3.450 -3.865 22.986) 23.563 12.881 ( 19.394 -10.976 2.224) 22.395 13.458 ( -7.981 -4.111 13.697) 16.377 14.819 ( 26.440 -3.760 2.317) 26.806 15.172 ( -22.061 7.853 3.821) 23.726 16.566 ( 4.109 -7.827 -1.862) 9.034 16.848 ( -12.232 13.674 1.304) 18.393 18.374 ( 0.849 -10.459 -41.618) 42.921 18.614 ( -2.241 8.547 -37.655) 38.677 20.250 ( 0.060 -4.541 19.417) 19.941 21.789 ( -4.789 11.013 9.174) 15.113 23.709 ( 3.803 -1.368 -11.073) 11.787 23.913 ( -3.005 -1.813 -21.090) 21.380 24.707 ( 3.326 -2.767 -7.659) 8.796 24.959 ( -1.978 6.438 -8.029) 10.480 25.371 ( 1.512 0.175 -10.936) 11.042 25.673 ( -2.499 5.993 -9.888) 11.830 30.321 ( -2.091 -2.972 15.097) 15.529 30.622 ( 3.709 0.636 7.402) 8.304 31.720 ( -11.341 -3.910 24.859) 27.602 32.048 ( 0.024 4.924 14.708) 15.510 34.916 ( -0.568 -4.457 10.447) 11.372 35.280 ( 0.553 1.757 6.474) 6.731 38.722 ( 2.633 -2.213 12.779) 13.233 40.362 ( 8.398 1.384 -24.523) 25.958 ======================= Grid point 706 (204/343) ======================= q-point: ( 0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.058 ( 2.991 -0.000 41.768) 41.875 5.697 ( 12.445 -0.000 54.114) 55.527 7.387 ( -35.498 0.000 -17.908) 39.760 7.863 ( 42.273 -0.000 25.574) 49.407 8.407 ( 23.398 -0.000 -4.971) 23.920 9.943 ( 52.687 -0.000 -29.398) 60.334 10.728 ( -1.705 0.000 48.080) 48.110 12.692 ( -10.271 0.000 -5.928) 11.859 15.249 ( 1.860 -0.000 -22.784) 22.860 15.653 ( 5.082 -0.000 -28.624) 29.071 16.141 ( -12.035 0.000 28.722) 31.142 17.741 ( -9.284 0.000 8.468) 12.566 18.547 ( -3.239 0.000 11.986) 12.416 19.769 ( -15.811 0.000 -12.623) 20.232 20.261 ( 6.998 -0.000 -11.999) 13.891 22.710 ( -0.806 0.000 -70.690) 70.694 24.064 ( -5.238 0.000 10.112) 11.388 24.307 ( 2.076 -0.000 -8.413) 8.665 24.345 ( 2.228 -0.000 -14.129) 14.303 25.124 ( -2.876 0.000 -11.815) 12.160 26.245 ( 7.307 -0.000 14.690) 16.407 26.328 ( 7.113 -0.000 16.261) 17.748 30.069 ( -14.807 0.000 22.523) 26.954 30.707 ( -12.779 0.000 10.890) 16.790 32.568 ( 11.633 -0.000 10.183) 15.461 32.865 ( -28.426 0.000 2.746) 28.559 34.395 ( -17.023 0.000 29.743) 34.270 35.736 ( -45.821 0.000 -3.697) 45.970 37.544 ( 17.091 -0.000 6.936) 18.445 38.979 ( 87.043 -0.000 -29.597) 91.938 ======================= Grid point 707 (205/343) ======================= q-point: ( 0.15 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.197 ( 12.281 -6.514 27.154) 30.506 5.980 ( 13.584 -18.330 47.897) 53.053 7.106 ( -22.927 -1.794 -15.977) 28.003 8.295 ( 27.147 -5.167 21.396) 34.949 8.823 ( 53.242 -7.769 4.444) 53.989 10.516 ( 47.115 -6.428 -16.172) 50.226 10.824 ( 3.033 -12.919 37.763) 40.027 12.594 ( -12.641 -2.193 -5.923) 14.131 15.123 ( 4.806 14.607 -17.950) 23.636 15.794 ( 0.794 -6.834 -20.422) 21.550 16.022 ( -11.451 -3.000 21.289) 24.358 17.688 ( -14.001 -6.565 6.783) 16.886 18.456 ( -5.093 5.663 7.575) 10.742 19.561 ( -17.963 4.524 -13.836) 23.121 20.282 ( 4.363 4.263 -11.595) 13.101 22.702 ( -0.231 0.384 -68.660) 68.661 24.007 ( -6.447 -0.108 9.152) 11.195 24.245 ( 2.129 6.225 -6.736) 9.416 24.444 ( 1.842 -5.215 -13.094) 14.214 25.121 ( -3.810 -3.397 -12.555) 13.553 25.975 ( 6.659 24.949 21.056) 33.319 26.621 ( 8.900 -9.631 8.612) 15.689 29.920 ( -15.745 -1.112 20.549) 25.912 30.593 ( -13.274 -2.457 9.101) 16.281 32.427 ( -38.095 5.090 15.332) 41.379 32.702 ( -1.438 -2.214 10.040) 10.381 34.255 ( -14.260 -3.331 24.618) 28.644 35.460 ( -13.528 -0.552 -6.647) 15.083 37.772 ( 19.433 -4.970 12.400) 23.582 39.745 ( 75.308 4.851 -36.294) 83.738 ======================= Grid point 708 (206/343) ======================= q-point: ( 0.23 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.480 ( 19.530 -7.700 15.464) 26.074 6.507 ( 7.428 -27.645 29.819) 41.335 7.030 ( -2.212 -6.921 -4.110) 8.348 8.557 ( 19.576 -0.993 12.910) 23.470 9.637 ( 62.656 -17.092 15.853) 66.852 10.922 ( 9.293 -12.953 29.417) 33.459 11.301 ( 30.170 -18.032 -6.297) 35.708 12.550 ( -8.408 -6.692 -5.356) 12.007 14.932 ( 9.058 15.590 -10.276) 20.753 15.761 ( -14.066 -1.100 11.520) 18.214 16.107 ( 0.081 -9.325 -8.398) 12.549 17.651 ( -18.623 -7.166 2.835) 20.154 18.277 ( -7.147 7.735 -0.828) 10.564 19.286 ( -16.154 7.749 -17.401) 24.976 20.221 ( 0.993 5.549 -8.148) 9.908 22.689 ( 0.740 1.819 -62.861) 62.892 23.940 ( -7.814 0.005 8.498) 11.544 24.139 ( 1.829 9.429 -2.981) 10.057 24.529 ( 0.159 -3.567 -11.785) 12.314 25.151 ( -3.831 -4.282 -13.406) 14.585 25.628 ( 4.768 21.657 19.605) 29.600 26.746 ( 6.203 4.617 -0.079) 7.733 29.834 ( -12.850 -6.300 21.114) 25.507 30.542 ( -8.553 -4.384 8.449) 12.797 31.944 ( -47.756 -0.369 22.126) 52.634 32.662 ( -5.449 3.623 9.824) 11.804 34.262 ( -4.316 -8.453 20.933) 22.984 35.425 ( 5.175 1.667 -7.658) 9.392 38.060 ( 17.029 -7.309 16.004) 24.485 40.281 ( 59.889 10.320 -37.255) 71.282 ======================= Grid point 709 (207/343) ======================= q-point: ( 0.31 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.801 ( 23.975 -4.393 8.488) 25.810 6.797 ( -5.289 -8.966 -9.694) 14.224 7.465 ( 23.377 -27.482 28.676) 46.088 8.749 ( 17.756 -0.388 10.880) 20.828 10.491 ( 46.948 -17.011 17.210) 52.817 11.222 ( 4.340 -15.158 28.950) 32.965 11.819 ( 15.754 -16.397 -2.576) 22.884 12.722 ( 8.926 -14.558 -4.238) 17.595 14.811 ( 13.696 11.660 -3.606) 18.345 15.621 ( -18.294 -0.499 12.300) 22.050 16.244 ( -1.102 -7.463 -4.114) 8.593 17.526 ( -20.890 -0.126 -0.389) 20.894 18.100 ( -9.067 2.658 -14.558) 17.356 19.021 ( -10.006 7.593 -23.807) 26.917 20.141 ( -0.771 3.439 -1.503) 3.832 22.633 ( 0.979 7.187 -48.702) 49.239 23.830 ( -9.523 4.094 7.602) 12.855 23.982 ( 2.019 9.500 -2.478) 10.024 24.570 ( -1.565 -2.618 -7.924) 8.491 25.170 ( -2.152 -1.081 -11.610) 11.857 25.408 ( 2.651 8.410 6.854) 11.168 26.582 ( -0.439 17.747 -7.446) 19.251 29.883 ( -8.576 -11.623 21.829) 26.176 30.568 ( -1.722 -4.627 8.994) 10.260 31.550 ( -42.365 -6.163 24.272) 49.212 32.501 ( -8.904 6.037 9.214) 14.164 34.422 ( 2.383 -10.713 18.693) 21.677 35.463 ( 12.696 5.075 -6.108) 14.975 38.329 ( 11.666 -7.713 17.785) 22.625 40.586 ( 44.222 14.065 -34.859) 58.040 ======================= Grid point 710 (208/343) ======================= q-point: ( 0.38 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.077 ( 25.057 0.536 5.522) 25.664 6.865 ( 4.185 -1.179 -13.346) 14.036 8.162 ( 25.167 -24.549 25.780) 43.596 8.911 ( 13.319 -0.112 8.165) 15.623 10.980 ( 2.861 -11.113 19.409) 22.548 11.540 ( 18.783 -9.570 20.233) 29.219 12.233 ( 7.258 -21.711 7.979) 24.243 13.132 ( 20.103 -13.992 -0.622) 24.501 14.829 ( 16.965 4.278 -0.261) 17.498 15.383 ( -25.707 3.782 11.207) 28.298 16.339 ( -2.768 -6.470 -0.856) 7.090 17.241 ( -21.734 8.113 1.769) 23.266 18.052 ( -4.745 -5.801 -30.965) 31.859 18.851 ( -4.161 5.019 -32.556) 33.203 20.117 ( 1.345 -1.078 8.027) 8.210 22.418 ( -1.577 19.024 -19.751) 27.468 23.676 ( -5.116 2.191 -6.547) 8.593 23.894 ( 0.026 3.228 -4.590) 5.611 24.603 ( -1.809 -3.746 -4.764) 6.324 25.141 ( -1.051 2.688 -10.549) 10.937 25.367 ( 0.240 0.003 -4.814) 4.820 26.199 ( -5.997 22.483 -11.033) 25.752 30.013 ( -7.546 -12.343 21.196) 25.662 30.653 ( 5.322 -2.913 7.737) 9.832 31.330 ( -32.573 -11.900 25.903) 43.285 32.323 ( -5.590 6.128 9.070) 12.291 34.631 ( 4.162 -9.838 16.944) 20.030 35.490 ( 14.776 8.150 -3.190) 17.173 38.533 ( 4.736 -6.832 18.132) 19.947 40.695 ( 29.435 15.892 -31.405) 45.883 ======================= Grid point 711 (209/343) ======================= q-point: ( 0.46 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.264 ( 23.111 5.589 5.230) 24.346 6.933 ( 14.878 3.929 -11.698) 19.330 8.709 ( 21.583 -11.964 18.297) 30.720 8.991 ( 7.686 3.067 4.837) 9.586 11.043 ( -19.176 -9.863 22.973) 31.508 11.825 ( 20.208 -0.173 18.641) 27.493 12.633 ( -5.451 -21.267 9.275) 23.833 13.497 ( 22.207 -3.810 5.999) 23.316 14.939 ( -5.331 2.164 8.189) 10.008 15.049 ( -12.070 1.076 1.962) 12.276 16.411 ( -6.903 -8.464 -6.206) 12.562 16.903 ( -13.134 9.113 6.245) 17.162 18.190 ( 1.854 -11.217 -39.903) 41.491 18.736 ( -1.961 5.992 -40.147) 40.639 20.217 ( 7.613 -5.163 17.716) 19.961 22.023 ( -3.511 22.106 4.641) 22.860 23.677 ( -2.290 -4.296 -14.443) 15.241 23.866 ( 0.332 -0.119 -13.821) 13.826 24.665 ( -0.696 -5.234 -4.123) 6.700 25.042 ( -4.029 7.078 -11.357) 13.975 25.372 ( -1.246 -0.477 -9.013) 9.111 25.804 ( -5.879 15.097 -11.345) 19.779 30.124 ( -9.336 -10.976 19.941) 24.603 30.726 ( 6.781 2.737 4.087) 8.377 31.323 ( -19.218 -18.052 28.959) 39.164 32.208 ( 2.408 5.425 9.119) 10.881 34.814 ( 3.920 -7.056 15.138) 17.156 35.480 ( 14.564 10.215 0.287) 17.791 38.642 ( -2.794 -5.048 17.328) 18.264 40.646 ( 15.475 16.315 -28.107) 35.996 ======================= Grid point 712 (210/343) ======================= q-point: (-0.46 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.341 ( 21.503 11.368 7.057) 25.327 7.029 ( 21.774 6.591 -8.796) 24.391 8.846 ( 2.680 9.205 12.733) 15.938 9.065 ( 14.372 1.613 2.972) 14.764 10.972 ( -25.796 -7.552 24.159) 36.141 11.941 ( 14.072 6.068 19.049) 24.448 12.690 ( -25.296 -1.865 7.811) 26.540 13.704 ( 20.697 3.750 10.677) 23.589 14.589 ( -32.548 4.120 4.583) 33.126 15.177 ( 4.807 -7.894 4.041) 10.087 16.512 ( -7.745 -11.420 -9.516) 16.762 16.767 ( 4.541 -0.213 7.120) 8.448 18.382 ( -0.030 -6.689 -43.454) 43.966 18.633 ( 3.397 4.373 -41.574) 41.941 20.372 ( 12.268 1.549 23.103) 26.204 21.754 ( 0.585 4.241 12.625) 13.331 23.678 ( -5.579 0.559 -10.426) 11.838 23.922 ( 2.439 -3.915 -24.124) 24.561 24.736 ( -0.767 0.991 -7.390) 7.496 24.867 ( -6.468 0.565 -5.770) 8.686 25.352 ( -2.212 0.438 -12.292) 12.498 25.638 ( -1.671 1.049 -11.157) 11.330 30.202 ( -9.412 -9.812 18.413) 22.889 30.691 ( 2.879 6.370 6.010) 9.218 31.522 ( -6.239 -19.332 27.211) 33.957 32.196 ( 11.999 4.408 8.693) 15.459 34.931 ( 3.421 -2.257 13.203) 13.825 35.447 ( 14.287 10.171 3.848) 17.955 38.642 ( -10.252 -2.597 15.544) 18.800 40.463 ( 1.909 15.929 -25.387) 30.031 ======================= Grid point 713 (211/343) ======================= q-point: (-0.38 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.324 ( 23.539 16.791 11.032) 30.947 7.113 ( 19.173 8.743 -3.801) 21.412 8.646 ( 3.905 16.526 13.187) 21.500 9.051 ( 3.299 11.260 1.773) 11.867 10.738 ( -33.357 2.797 18.432) 38.213 11.881 ( -4.764 9.232 14.421) 17.774 12.311 ( -20.761 13.026 12.276) 27.412 13.737 ( 13.122 13.593 7.414) 20.296 14.223 ( -30.374 1.241 1.810) 30.454 15.406 ( 0.884 -16.781 8.950) 19.039 16.552 ( 4.785 4.258 3.151) 7.138 17.033 ( 5.167 -22.161 -6.103) 23.559 18.366 ( 0.273 3.715 -40.899) 41.068 18.695 ( 4.679 -2.494 -37.226) 37.601 20.354 ( 9.721 11.686 20.295) 25.356 21.947 ( 11.039 -17.931 10.095) 23.351 23.565 ( -9.946 2.705 -16.778) 19.691 23.996 ( 4.100 -0.972 -16.206) 16.745 24.604 ( -6.899 3.471 -4.196) 8.789 24.949 ( -2.288 -7.818 -4.820) 9.465 25.334 ( -0.629 -0.198 -14.677) 14.692 25.701 ( -0.675 -9.617 -12.611) 15.874 30.271 ( -6.355 -7.721 17.124) 19.830 30.599 ( 2.031 6.615 10.976) 12.975 31.799 ( -0.874 -17.352 23.253) 29.027 32.294 ( 19.747 2.689 7.452) 21.277 34.940 ( 3.026 5.098 12.419) 13.761 35.452 ( 16.735 6.689 6.261) 19.079 38.527 ( -17.233 0.211 12.924) 21.542 40.155 ( -11.554 15.396 -23.201) 30.147 ======================= Grid point 714 (212/343) ======================= q-point: (-0.31 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.255 ( 27.342 21.454 17.290) 38.817 7.070 ( 6.402 12.647 7.579) 16.074 8.410 ( 12.447 22.004 9.377) 26.963 8.787 ( -8.247 14.923 5.665) 17.967 10.198 ( -38.796 18.205 11.655) 44.412 11.458 ( -37.261 13.976 -1.660) 39.831 12.023 ( 4.166 14.635 21.016) 25.946 13.526 ( 9.354 23.120 4.314) 25.311 14.021 ( -22.662 -9.627 3.487) 24.867 15.714 ( 2.101 -16.589 4.816) 17.401 16.488 ( 5.022 8.881 9.442) 13.902 17.477 ( 6.710 -21.834 -10.774) 25.255 18.372 ( 7.336 -0.581 -29.528) 30.431 18.738 ( -1.144 -1.520 -27.507) 27.573 20.258 ( 6.845 8.372 10.189) 14.858 22.415 ( 16.606 -17.168 -7.331) 24.985 23.460 ( -11.891 -5.820 -12.783) 18.403 24.051 ( 6.405 0.221 -6.364) 9.032 24.515 ( -8.087 -0.979 -3.080) 8.709 25.007 ( -4.295 -3.335 -2.950) 6.187 25.340 ( 0.918 0.019 -15.484) 15.512 25.928 ( -1.679 -17.930 -13.738) 22.651 30.313 ( -0.706 -0.494 18.066) 18.087 30.551 ( 2.921 0.807 14.777) 15.084 32.057 ( -0.543 -14.005 18.676) 23.350 32.486 ( 22.415 -0.452 5.270) 23.031 34.837 ( 3.193 10.028 15.048) 18.363 35.568 ( 24.622 3.497 5.740) 25.523 38.300 ( -23.660 2.745 9.658) 25.702 39.722 ( -24.464 15.523 -21.139) 35.865 ======================= Grid point 715 (213/343) ======================= q-point: (-0.23 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.137 ( 28.607 26.378 27.250) 47.506 6.807 ( -6.663 18.270 24.187) 31.035 8.091 ( -3.928 21.608 1.264) 21.998 8.520 ( 2.551 12.947 11.559) 17.542 9.483 ( -22.050 27.447 5.245) 35.596 10.771 ( -47.073 17.868 -14.495) 52.395 11.789 ( 2.983 19.002 26.699) 32.906 13.230 ( 9.272 21.647 0.628) 23.557 14.094 ( -12.849 -19.022 1.554) 23.008 15.948 ( 2.874 -7.825 -6.366) 10.489 16.373 ( 2.730 8.959 13.635) 16.542 17.850 ( 6.557 -15.311 -9.143) 19.001 18.433 ( 9.349 7.754 -10.699) 16.186 18.846 ( -3.376 -18.258 -20.824) 27.900 20.215 ( 4.162 3.771 -0.051) 5.617 22.707 ( 10.133 -1.360 -42.152) 43.374 23.604 ( -5.685 -20.801 5.281) 22.201 24.117 ( 8.042 0.615 2.265) 8.378 24.472 ( -8.150 -3.733 -6.184) 10.890 25.010 ( -4.890 -3.820 2.542) 6.706 25.340 ( 1.116 1.403 -15.381) 15.485 26.213 ( -3.403 -18.085 -11.990) 21.964 30.281 ( 4.383 5.260 22.987) 23.985 30.628 ( 4.104 -4.668 14.819) 16.069 32.245 ( -1.889 -9.954 14.134) 17.390 32.722 ( 17.328 -3.445 1.247) 17.711 34.705 ( 4.650 9.571 20.639) 23.220 35.833 ( 38.912 1.522 2.963) 39.054 37.979 ( -30.124 3.884 6.080) 30.976 39.160 ( -34.399 17.231 -18.388) 42.642 ======================= Grid point 716 (214/343) ======================= q-point: (-0.15 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.911 ( 19.803 30.226 42.874) 56.071 6.372 ( -10.247 22.106 35.929) 43.411 7.731 ( -14.670 7.509 -0.675) 16.494 8.275 ( -0.157 20.759 16.333) 26.415 9.005 ( 17.262 25.623 -5.116) 31.316 9.990 ( -46.618 18.234 -25.703) 56.270 11.454 ( 0.829 22.585 34.270) 41.052 13.015 ( 5.761 13.228 -3.036) 14.744 14.360 ( -4.828 -22.243 -5.410) 23.395 16.020 ( 1.349 1.697 -20.241) 20.357 16.267 ( 1.993 5.761 19.883) 20.797 18.131 ( 6.363 -10.682 -0.103) 12.433 18.312 ( 1.144 10.448 -0.499) 10.523 19.219 ( 0.676 -24.780 -15.549) 29.262 20.198 ( 1.405 1.986 -6.094) 6.562 22.743 ( 2.668 2.078 -59.075) 59.172 23.898 ( -1.022 -15.291 1.301) 15.380 24.165 ( 4.990 2.050 10.414) 11.729 24.484 ( -3.614 -3.683 -13.677) 14.619 25.100 ( -3.401 -14.023 14.499) 20.455 25.312 ( 0.531 3.014 -14.727) 15.042 26.431 ( -3.215 -11.511 -7.574) 14.149 30.249 ( 5.081 4.072 27.158) 27.928 30.750 ( 4.007 -4.362 14.486) 15.650 32.350 ( -2.895 -5.645 10.616) 12.368 32.914 ( 7.862 -4.394 -4.281) 9.972 34.629 ( 5.189 5.404 27.628) 28.626 36.299 ( 55.098 -2.043 -2.687) 55.202 37.588 ( -39.237 2.222 3.157) 39.426 38.497 ( -33.189 21.203 -13.802) 41.732 ======================= Grid point 717 (215/343) ======================= q-point: (-0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.527 ( 0.000 25.586 55.361) 60.988 5.957 ( 0.000 20.128 43.496) 47.928 7.574 ( 0.000 4.205 6.424) 7.677 7.935 ( 0.000 15.531 4.920) 16.292 8.758 ( 0.000 23.395 -1.281) 23.430 9.442 ( 0.000 12.161 -37.909) 39.812 11.098 ( 0.000 19.512 41.303) 45.680 12.886 ( 0.000 6.303 -4.901) 7.984 14.706 ( -0.000 -21.538 -13.654) 25.501 15.928 ( 0.000 9.227 -29.458) 30.869 16.230 ( 0.000 0.519 25.987) 25.992 18.092 ( 0.000 12.836 4.577) 13.627 18.375 ( -0.000 -11.204 8.425) 14.018 19.610 ( -0.000 -20.240 -13.697) 24.439 20.173 ( 0.000 1.553 -8.645) 8.784 22.729 ( 0.000 0.815 -66.169) 66.174 24.079 ( -0.000 -8.190 -6.297) 10.331 24.151 ( 0.000 1.819 12.521) 12.653 24.476 ( 0.000 2.761 -16.690) 16.917 25.250 ( 0.000 4.329 -13.918) 14.576 25.421 ( -0.000 -24.537 21.873) 32.871 26.523 ( -0.000 -1.320 -0.881) 1.587 30.235 ( 0.000 1.260 28.369) 28.397 30.828 ( -0.000 -2.184 14.009) 14.179 32.394 ( -0.000 -2.240 8.722) 9.005 33.021 ( -0.000 -3.882 -7.937) 8.835 34.605 ( 0.000 1.634 32.955) 32.995 36.859 ( -0.000 -8.403 -16.934) 18.905 37.201 ( 0.000 1.249 7.587) 7.689 37.916 ( 0.000 23.037 -7.899) 24.353 ======================= Grid point 720 (216/343) ======================= q-point: ( 0.15 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.354 ( 27.885 -0.000 14.309) 31.342 5.865 ( -0.986 0.000 36.188) 36.201 7.018 ( 5.237 -0.000 -2.733) 5.907 8.531 ( 28.090 -0.000 16.645) 32.652 9.346 ( 64.488 -0.000 11.377) 65.483 10.703 ( 0.350 -0.000 44.474) 44.476 10.938 ( 42.903 -0.000 -19.008) 46.925 12.463 ( -9.242 0.000 -7.708) 12.034 15.280 ( -0.343 0.000 -14.214) 14.218 15.774 ( 6.140 -0.000 -22.614) 23.433 15.847 ( -15.340 0.000 24.207) 28.658 17.487 ( -15.870 0.000 6.151) 17.020 18.444 ( -7.115 0.000 4.620) 8.483 19.388 ( -22.870 0.000 -13.830) 26.726 20.353 ( 1.517 -0.000 -13.026) 13.114 22.711 ( 1.492 -0.000 -69.191) 69.207 23.941 ( -6.951 0.000 9.586) 11.841 24.334 ( 0.378 -0.000 -6.135) 6.146 24.402 ( 3.393 -0.000 -13.525) 13.944 25.048 ( -4.632 0.000 -12.138) 12.992 26.386 ( 5.179 -0.000 17.877) 18.612 26.484 ( 7.221 -0.000 17.715) 19.130 29.766 ( -13.587 0.000 15.913) 20.924 30.422 ( -14.951 0.000 8.652) 17.274 31.961 ( -55.367 0.000 22.436) 59.740 32.694 ( -3.992 0.000 10.184) 10.939 34.120 ( -5.471 0.000 22.283) 22.944 35.457 ( 10.418 -0.000 -12.259) 16.088 37.936 ( 21.092 -0.000 19.387) 28.648 40.482 ( 64.435 -0.000 -43.984) 78.015 ======================= Grid point 721 (217/343) ======================= q-point: ( 0.23 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.682 ( 34.122 -1.590 5.207) 34.553 6.028 ( -4.143 -22.414 19.183) 29.791 7.170 ( 27.227 1.071 12.200) 29.854 8.801 ( 27.978 1.667 12.853) 30.835 10.038 ( 58.202 -7.939 17.076) 61.173 10.803 ( 8.751 -7.534 38.443) 40.140 11.342 ( 18.946 -9.469 -10.829) 23.788 12.460 ( 7.541 -2.796 -10.582) 13.291 15.174 ( -3.671 7.608 -2.229) 8.737 15.655 ( -8.735 4.132 11.043) 14.674 15.943 ( 0.129 -9.762 -10.982) 14.694 17.368 ( -17.231 -4.799 1.590) 17.957 18.316 ( -8.894 5.832 -1.972) 10.817 19.146 ( -23.807 0.563 -15.816) 28.588 20.309 ( -2.293 4.325 -11.308) 12.322 22.732 ( 3.695 0.630 -66.816) 66.921 23.869 ( -7.366 0.322 9.616) 12.117 24.281 ( 1.130 5.329 -5.284) 7.589 24.471 ( 0.862 -3.103 -11.662) 12.098 25.034 ( -4.858 -3.801 -12.932) 14.327 26.057 ( 0.450 25.897 22.775) 34.490 26.761 ( 3.931 -9.651 10.273) 14.633 29.656 ( -9.617 -1.074 15.787) 18.517 30.336 ( -13.600 -6.694 11.682) 19.138 31.448 ( -47.376 -0.853 22.779) 52.575 32.586 ( -16.748 0.134 6.903) 18.115 34.163 ( 6.457 -4.118 21.972) 23.268 35.601 ( 20.733 2.517 -13.983) 25.134 38.159 ( 18.835 -2.434 23.843) 30.482 40.986 ( 50.728 7.513 -45.476) 68.541 ======================= Grid point 722 (218/343) ======================= q-point: ( 0.31 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.058 ( 32.113 -3.885 0.736) 32.356 6.445 ( 5.917 -23.681 1.364) 24.447 7.531 ( 38.407 -6.283 25.241) 46.387 9.012 ( 26.568 5.149 11.241) 29.305 10.604 ( 18.876 -10.748 22.334) 31.155 11.138 ( 25.436 -10.331 25.534) 37.493 11.620 ( 2.732 -15.234 -1.505) 15.551 12.737 ( 28.581 -7.901 -10.657) 31.510 15.011 ( -6.504 4.946 7.884) 11.355 15.506 ( -7.920 5.389 7.476) 12.152 16.082 ( -3.193 -8.871 -3.729) 10.139 17.287 ( -16.957 -4.450 -4.728) 18.157 18.100 ( -9.806 7.437 -12.559) 17.584 18.930 ( -19.286 -0.598 -20.762) 28.344 20.194 ( -4.267 4.533 -5.985) 8.636 22.756 ( 6.322 2.920 -59.963) 60.367 23.780 ( -8.118 1.675 9.289) 12.450 24.178 ( 1.902 9.356 -2.864) 9.968 24.499 ( -3.474 -1.876 -7.760) 8.707 25.070 ( -4.445 -5.595 -13.979) 15.699 25.645 ( -3.228 19.596 18.282) 26.994 26.795 ( -1.785 7.485 -0.219) 7.698 29.643 ( -6.443 -7.102 20.406) 22.547 30.361 ( -13.479 -11.791 19.914) 26.782 31.103 ( -29.101 -3.234 15.229) 33.003 32.399 ( -20.177 -0.735 3.827) 20.550 34.348 ( 11.562 -6.369 21.939) 25.604 35.747 ( 23.363 6.495 -12.883) 27.459 38.366 ( 13.696 -2.866 25.950) 29.482 41.235 ( 37.485 14.119 -42.639) 58.503 ======================= Grid point 723 (219/343) ======================= q-point: ( 0.38 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.408 ( 31.313 -0.051 -0.211) 31.314 6.870 ( 20.599 -11.143 -8.918) 25.060 8.115 ( 37.929 -17.063 29.649) 51.076 9.153 ( 23.149 7.251 8.952) 25.857 10.763 ( -11.932 -6.401 19.099) 23.412 11.520 ( 7.627 -16.748 20.139) 27.281 11.997 ( 20.156 -13.458 5.780) 24.915 13.208 ( 32.821 -10.467 -5.444) 34.877 14.907 ( -9.704 -2.201 13.415) 16.703 15.262 ( -17.328 9.957 6.716) 21.084 16.192 ( -1.597 -6.900 -1.604) 7.262 17.132 ( -18.050 2.940 -2.618) 18.475 17.961 ( -3.318 -0.598 -27.987) 28.190 18.798 ( -12.233 -1.945 -29.611) 32.097 20.114 ( -2.363 0.058 3.255) 4.023 22.718 ( 7.604 12.042 -40.414) 42.850 23.643 ( -9.216 3.799 4.521) 10.946 24.021 ( 1.776 9.938 -3.276) 10.614 24.490 ( -6.702 -4.052 -2.461) 8.209 25.115 ( -3.389 -3.660 -14.402) 15.241 25.394 ( -3.619 6.434 5.086) 8.964 26.503 ( -7.071 20.503 -8.377) 23.250 29.735 ( -8.165 -10.958 25.230) 28.693 30.473 ( -11.539 -17.381 26.981) 34.106 30.967 ( -10.882 -2.546 6.718) 13.040 32.248 ( -15.133 -2.698 2.055) 15.509 34.575 ( 11.837 -6.548 21.209) 25.156 35.833 ( 22.361 10.222 -10.174) 26.608 38.510 ( 6.710 -2.156 26.319) 27.246 41.268 ( 25.700 18.760 -38.118) 49.653 ======================= Grid point 724 (220/343) ======================= q-point: ( 0.46 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.668 ( 32.496 6.251 1.896) 33.146 7.209 ( 31.002 1.032 -10.436) 32.727 8.753 ( 32.602 -14.873 24.272) 43.281 9.223 ( 19.060 9.085 4.759) 21.644 10.671 ( -24.930 -6.633 19.675) 32.444 11.853 ( 0.068 -16.884 17.690) 24.455 12.351 ( 14.070 -7.964 11.247) 19.695 13.662 ( 27.310 -6.622 0.594) 28.108 14.770 ( -31.938 4.623 19.282) 37.593 14.977 ( -8.413 -2.701 0.831) 8.875 16.218 ( -10.439 -1.933 -8.545) 13.628 16.921 ( -5.836 4.423 3.708) 8.208 18.056 ( 4.351 -8.676 -38.229) 39.442 18.734 ( -7.333 -1.147 -39.882) 40.567 20.183 ( 5.113 -7.553 14.811) 17.394 22.439 ( 2.772 27.166 -3.926) 27.587 23.557 ( -5.578 -3.771 -13.747) 15.307 23.915 ( 0.961 4.714 -9.019) 10.222 24.518 ( -6.730 -7.363 0.021) 9.976 25.096 ( -3.037 2.818 -13.197) 13.832 25.330 ( -3.379 -1.386 -5.815) 6.867 26.052 ( -8.301 22.222 -12.329) 26.735 29.818 ( -13.077 -11.799 26.976) 32.217 30.716 ( -1.772 -18.049 22.895) 29.208 30.929 ( -5.410 -2.528 9.221) 10.986 32.208 ( -4.809 -4.288 1.086) 6.534 34.786 ( 10.777 -5.317 19.764) 23.131 35.848 ( 19.759 12.778 -6.641) 24.450 38.563 ( -1.309 -0.901 25.415) 25.465 41.129 ( 15.291 21.825 -33.510) 42.815 ======================= Grid point 725 (221/343) ======================= q-point: ( 0.54 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.844 ( 35.619 12.666 5.213) 38.162 7.437 ( 32.094 8.989 -6.867) 34.029 9.089 ( 16.613 7.708 14.238) 23.197 9.298 ( 23.496 4.651 0.754) 23.964 10.544 ( -28.957 -10.499 25.362) 39.900 11.997 ( -13.115 -5.835 9.579) 17.257 12.530 ( 7.227 -0.303 18.654) 20.007 13.911 ( 11.692 0.474 10.382) 15.643 14.349 ( -28.418 4.609 6.935) 29.613 14.997 ( -13.838 -8.432 5.761) 17.198 16.172 ( -12.685 -12.596 -11.247) 21.120 16.880 ( 8.144 4.369 3.742) 9.970 18.268 ( 4.695 -9.202 -43.009) 44.232 18.683 ( -2.991 0.466 -46.012) 46.112 20.456 ( 16.329 -10.777 24.053) 31.005 21.977 ( -2.560 24.298 15.792) 29.092 23.606 ( -3.290 -4.074 -15.312) 16.182 23.879 ( -0.709 -0.779 -20.024) 20.052 24.605 ( -4.890 -9.852 -0.399) 11.006 24.946 ( -4.586 10.648 -10.684) 15.766 25.332 ( -1.847 -1.298 -11.551) 11.770 25.691 ( -5.877 10.858 -13.960) 18.637 29.890 ( -13.466 -13.027 25.540) 31.675 30.820 ( 2.767 5.113 2.417) 6.296 31.112 ( -3.727 -22.887 30.140) 38.028 32.288 ( 5.773 -4.385 0.176) 7.251 34.957 ( 9.992 -2.800 17.685) 20.504 35.807 ( 17.249 13.339 -2.692) 21.970 38.512 ( -9.726 0.619 23.520) 25.459 40.851 ( 6.020 24.017 -29.383) 38.424 ======================= Grid point 726 (222/343) ======================= q-point: (-0.38 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.951 ( 39.496 18.717 9.363) 44.698 7.525 ( 23.863 14.073 0.516) 27.708 9.019 ( 16.609 16.296 9.405) 25.097 9.310 ( 5.634 14.290 0.433) 15.367 10.428 ( -24.938 -5.243 20.122) 32.469 11.766 ( -34.418 4.089 5.476) 35.090 12.499 ( 9.581 12.410 20.528) 25.830 13.820 ( -24.233 1.863 7.937) 25.568 14.171 ( 6.860 6.291 4.940) 10.538 15.030 ( -15.743 -16.974 12.664) 26.388 16.445 ( -0.518 -24.853 -10.819) 27.111 16.884 ( 6.678 3.840 2.719) 8.169 18.378 ( -0.380 -1.194 -46.240) 46.257 18.704 ( 3.217 -2.831 -44.337) 44.543 20.703 ( 20.053 9.076 27.845) 35.494 21.772 ( 0.080 -7.673 19.314) 20.782 23.546 ( -7.229 5.201 -15.382) 17.774 23.940 ( -1.253 -6.693 -22.545) 23.551 24.658 ( -4.800 7.170 -1.743) 8.802 24.786 ( -2.129 -6.322 -6.738) 9.481 25.336 ( 0.931 -0.141 -15.225) 15.254 25.575 ( -4.779 -1.976 -14.475) 15.371 29.995 ( -10.230 -13.710 23.169) 28.800 30.742 ( 2.405 6.519 7.256) 10.046 31.461 ( -1.054 -21.001 26.899) 34.142 32.448 ( 12.154 -3.734 -1.204) 12.771 35.060 ( 8.799 2.236 15.375) 17.855 35.775 ( 17.833 9.853 1.157) 20.407 38.351 ( -18.035 2.337 20.928) 27.726 40.455 ( -1.990 25.957 -25.742) 36.611 ======================= Grid point 727 (223/343) ======================= q-point: (-0.31 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.997 ( 41.182 23.701 14.675) 49.730 7.428 ( 12.960 19.025 11.511) 25.737 8.826 ( -9.434 22.089 8.763) 25.568 9.021 ( 7.791 16.593 8.702) 20.292 10.179 ( -13.936 11.400 2.806) 18.222 11.262 ( -41.848 10.275 -3.194) 43.209 12.350 ( 8.523 16.000 22.289) 28.731 13.594 ( -21.232 -5.918 8.502) 23.624 14.048 ( 8.152 19.288 2.056) 21.041 15.304 ( -7.647 -27.725 15.620) 32.728 16.707 ( 8.630 6.623 3.711) 11.495 17.060 ( -1.515 -28.168 -9.897) 29.894 18.377 ( 0.528 -0.926 -43.487) 43.500 18.769 ( 2.630 0.375 -36.047) 36.145 20.567 ( 9.876 19.068 21.856) 30.640 22.196 ( 13.095 -28.554 16.585) 35.523 23.335 ( -12.605 6.734 -22.858) 26.957 24.045 ( 0.676 -6.087 -15.131) 16.324 24.481 ( -4.293 6.220 1.434) 7.692 24.902 ( -1.996 -6.369 -6.289) 9.170 25.356 ( 2.294 0.075 -16.277) 16.438 25.647 ( -3.885 -12.056 -15.402) 19.942 30.139 ( -5.670 -12.647 21.286) 25.401 30.666 ( 3.575 5.819 12.783) 14.493 31.773 ( -1.287 -17.745 22.843) 28.954 32.634 ( 12.710 -3.355 -3.125) 13.511 35.037 ( 5.506 8.832 15.238) 18.453 35.876 ( 24.217 2.083 2.316) 24.416 38.082 ( -25.529 4.278 18.210) 31.649 39.956 ( -7.753 28.062 -22.319) 36.684 ======================= Grid point 728 (224/343) ======================= q-point: (-0.23 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.935 ( 27.847 26.267 21.747) 44.026 7.172 ( 14.545 28.035 26.519) 41.240 8.172 ( -37.363 19.143 7.289) 42.609 8.892 ( 12.235 16.948 15.625) 26.098 9.867 ( 12.062 22.182 -8.529) 26.651 10.615 ( -42.720 17.046 -16.469) 48.855 12.129 ( 3.460 17.850 25.010) 30.920 13.630 ( -1.117 -5.395 7.601) 9.388 13.742 ( -3.232 13.246 2.253) 13.820 15.697 ( -1.569 -22.432 6.208) 23.328 16.584 ( 3.211 12.109 10.713) 16.484 17.546 ( 1.204 -26.314 -13.377) 29.543 18.475 ( 2.731 -10.221 -32.121) 33.818 18.720 ( -0.471 6.536 -22.418) 23.356 20.374 ( 3.685 11.243 9.910) 15.434 22.781 ( 20.013 -13.511 -10.447) 26.310 23.165 ( -17.972 -11.595 -9.470) 23.391 24.161 ( 4.369 -5.234 -9.131) 11.396 24.361 ( -6.041 2.610 3.624) 7.513 24.945 ( -1.689 -1.693 -5.051) 5.589 25.368 ( 1.159 0.667 -15.927) 15.983 25.880 ( -2.005 -18.155 -14.895) 23.569 30.280 ( -1.367 -7.276 21.260) 22.512 30.633 ( 3.216 1.598 17.119) 17.492 32.023 ( -1.504 -13.971 17.913) 22.767 32.792 ( 7.691 -3.268 -5.073) 9.776 34.906 ( 2.620 10.581 19.130) 22.017 36.173 ( 29.517 -5.144 -2.074) 30.034 37.718 ( -28.863 6.708 16.627) 33.978 39.385 ( -8.736 30.177 -18.743) 36.582 ======================= Grid point 729 (225/343) ======================= q-point: (-0.15 0.15 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.660 ( 0.000 40.440 44.685) 60.267 6.676 ( 0.000 21.909 26.278) 34.213 7.737 ( 0.000 8.473 -0.519) 8.489 8.637 ( 0.000 20.241 19.996) 28.452 9.625 ( 0.000 26.188 -4.914) 26.645 9.993 ( 0.000 19.617 -30.487) 36.253 11.824 ( 0.000 20.746 29.298) 35.900 13.334 ( 0.000 21.553 -0.972) 21.575 13.960 ( -0.000 -22.114 3.115) 22.332 15.964 ( -0.000 -9.857 -9.273) 13.533 16.409 ( 0.000 10.081 16.556) 19.384 17.910 ( -0.000 -17.187 -9.982) 19.876 18.540 ( 0.000 12.597 -8.551) 15.225 18.797 ( -0.000 -23.917 -20.268) 31.349 20.262 ( 0.000 4.941 -0.710) 4.992 22.829 ( 0.000 6.245 -51.117) 51.497 23.530 ( -0.000 -28.105 13.335) 31.108 24.248 ( 0.000 4.006 9.711) 10.504 24.331 ( -0.000 -9.140 -10.907) 14.230 24.960 ( -0.000 -2.584 0.976) 2.763 25.355 ( 0.000 1.647 -15.594) 15.680 26.172 ( -0.000 -17.266 -12.179) 21.129 30.323 ( 0.000 1.381 24.765) 24.803 30.683 ( -0.000 -4.888 16.957) 17.647 32.211 ( -0.000 -9.661 13.173) 16.336 32.886 ( -0.000 -3.529 -5.995) 6.956 34.761 ( 0.000 8.107 24.384) 25.696 36.522 ( -0.000 -10.992 -10.270) 15.043 37.383 ( 0.000 8.950 16.745) 18.987 38.822 ( 0.000 30.451 -14.978) 33.935 ======================= Grid point 734 (226/343) ======================= q-point: ( 0.23 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.764 ( -2.549 0.000 19.736) 19.900 6.104 ( 46.374 -0.000 -4.869) 46.629 7.498 ( 36.086 -0.000 17.608) 40.153 9.124 ( 32.558 -0.000 12.331) 34.815 10.392 ( 22.525 -0.000 27.726) 35.723 10.987 ( 44.388 -0.000 24.744) 50.818 11.316 ( -6.985 0.000 -5.595) 8.950 12.614 ( 27.376 -0.000 -14.553) 31.003 15.096 ( -19.709 0.000 18.977) 27.360 15.721 ( 5.160 -0.000 -2.781) 5.861 15.816 ( -4.739 0.000 -5.979) 7.629 17.172 ( -14.160 0.000 -4.110) 14.745 18.283 ( -8.568 0.000 -6.623) 10.829 18.884 ( -28.104 0.000 -16.289) 32.483 20.295 ( -7.918 0.000 -11.199) 13.715 22.784 ( 6.051 -0.000 -67.499) 67.770 23.802 ( -6.904 0.000 10.146) 12.273 24.312 ( -2.858 0.000 -3.954) 4.879 24.473 ( 3.691 -0.000 -12.884) 13.402 24.950 ( -5.114 0.000 -12.682) 13.675 26.397 ( -4.438 0.000 21.848) 22.294 26.560 ( -0.182 0.000 18.319) 18.320 29.598 ( -2.977 0.000 11.792) 12.162 30.095 ( -21.122 0.000 21.778) 30.338 31.043 ( -31.447 0.000 13.634) 34.275 32.368 ( -25.636 0.000 2.787) 25.787 34.239 ( 14.489 -0.000 23.805) 27.868 35.865 ( 26.794 -0.000 -17.058) 31.763 38.325 ( 17.807 -0.000 29.218) 34.217 41.493 ( 39.109 -0.000 -48.528) 62.325 ======================= Grid point 735 (227/343) ======================= q-point: ( 0.31 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.942 ( 6.557 -18.094 16.737) 25.505 6.602 ( 49.136 -2.465 -9.256) 50.061 7.871 ( 39.148 -0.796 21.362) 44.604 9.401 ( 31.888 5.363 12.059) 34.511 10.553 ( 3.960 -5.393 28.354) 29.133 11.180 ( -11.506 -1.750 2.610) 11.928 11.598 ( 46.338 -9.664 11.141) 48.628 12.958 ( 34.285 -3.829 -13.270) 36.962 14.875 ( -23.001 -0.016 25.377) 34.250 15.599 ( -7.914 9.460 2.250) 12.538 15.924 ( 4.380 -8.455 -2.068) 9.744 17.084 ( -10.616 -3.000 -11.989) 16.292 18.133 ( -8.907 7.235 -14.442) 18.445 18.653 ( -25.398 -5.261 -18.960) 32.128 20.174 ( -11.716 1.976 -7.619) 14.115 22.853 ( 8.564 0.299 -65.201) 65.762 23.732 ( -6.292 0.888 10.192) 12.010 24.266 ( -3.251 1.334 -2.496) 4.310 24.488 ( 1.258 2.405 -11.101) 11.428 24.935 ( -5.076 -4.042 -12.987) 14.518 25.979 ( -7.832 26.200 23.802) 36.254 26.748 ( -5.050 -9.557 10.592) 15.134 29.555 ( -2.329 1.893 16.591) 16.860 29.968 ( -22.913 -11.127 31.897) 40.819 30.863 ( -10.901 -3.453 1.112) 11.489 32.125 ( -26.829 -2.837 -0.760) 26.989 34.418 ( 16.382 -2.513 25.019) 30.011 36.097 ( 27.309 4.614 -17.436) 32.727 38.486 ( 14.183 0.049 32.056) 35.053 41.751 ( 28.249 8.415 -46.965) 55.449 ======================= Grid point 736 (228/343) ======================= q-point: ( 0.38 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.422 ( 17.264 -22.769 10.664) 30.500 7.122 ( 48.205 -1.961 -9.978) 49.266 8.307 ( 37.379 -6.824 25.239) 45.615 9.568 ( 28.646 10.043 9.560) 31.825 10.593 ( -9.240 -0.401 17.633) 19.912 11.191 ( -10.427 -15.121 11.412) 21.624 12.159 ( 37.231 -6.234 8.133) 38.616 13.386 ( 32.749 -7.390 -8.090) 34.533 14.673 ( -22.594 -3.049 25.444) 34.164 15.261 ( -25.041 11.539 9.713) 29.232 16.137 ( 12.263 -5.140 -3.984) 13.881 17.005 ( -12.169 0.178 -10.956) 16.375 17.952 ( -4.258 3.385 -25.374) 25.951 18.562 ( -17.141 -8.150 -25.656) 31.913 20.042 ( -11.228 -1.181 -0.188) 11.292 22.933 ( 11.277 2.622 -57.615) 58.767 23.635 ( -6.279 4.025 9.597) 12.154 24.199 ( -0.594 5.561 -1.661) 5.834 24.393 ( -6.636 4.725 -3.111) 8.720 24.980 ( -4.458 -6.673 -13.166) 15.419 25.526 ( -7.788 16.469 14.758) 23.445 26.687 ( -8.264 8.929 -1.367) 12.243 29.515 ( -10.030 -4.446 28.692) 30.718 30.024 ( -12.645 -17.310 32.372) 38.826 30.900 ( 1.993 -3.823 -4.837) 6.480 31.968 ( -21.613 -7.824 -3.195) 23.207 34.626 ( 15.000 -3.699 24.994) 29.384 36.236 ( 24.777 9.508 -15.796) 30.884 38.587 ( 8.734 1.632 33.004) 34.179 41.781 ( 19.197 15.545 -42.946) 49.543 ======================= Grid point 737 (229/343) ======================= q-point: ( 0.46 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.950 ( 29.159 -11.631 5.762) 31.918 7.589 ( 43.567 0.896 -9.292) 44.556 8.827 ( 30.253 -14.946 28.134) 43.933 9.641 ( 25.883 12.802 3.947) 29.145 10.416 ( -17.756 3.807 12.371) 21.972 11.428 ( -9.250 -21.656 16.085) 28.518 12.519 ( 24.860 -1.061 10.571) 27.036 13.795 ( 21.990 -6.927 -0.897) 23.072 14.521 ( -22.309 -1.738 24.267) 33.009 14.791 ( -31.214 5.763 7.369) 32.585 16.181 ( -6.351 6.961 -12.756) 15.859 16.936 ( 3.634 -1.208 -1.750) 4.210 17.979 ( 3.612 -5.880 -34.506) 35.189 18.563 ( -10.866 -7.812 -35.755) 38.177 20.043 ( -4.667 -9.809 11.011) 15.468 22.907 ( 10.427 18.257 -26.171) 33.570 23.483 ( -6.610 3.112 -4.184) 8.419 24.044 ( 0.310 10.527 -4.816) 11.581 24.314 ( -10.331 -6.246 3.418) 12.547 25.051 ( -2.592 -5.047 -13.809) 14.929 25.299 ( -5.563 4.048 0.309) 6.887 26.338 ( -8.892 20.843 -9.803) 24.690 29.503 ( -14.502 -8.989 33.280) 37.398 30.292 ( -3.066 -23.058 31.587) 39.227 30.958 ( 3.052 1.003 -4.215) 5.300 31.984 ( -10.261 -12.914 -4.798) 17.178 34.828 ( 12.698 -4.061 23.687) 27.181 36.268 ( 20.580 13.300 -12.831) 27.660 38.596 ( 2.273 3.880 32.693) 33.001 41.626 ( 11.804 20.984 -38.280) 45.222 ======================= Grid point 738 (230/343) ======================= q-point: ( 0.54 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.356 ( 38.120 2.511 5.175) 38.551 7.911 ( 34.684 7.602 -6.124) 36.032 9.309 ( 17.713 -9.605 23.417) 30.893 9.694 ( 28.855 11.153 -1.614) 30.978 10.165 ( -20.319 2.090 16.951) 26.543 11.616 ( -20.490 -14.746 9.511) 26.976 12.719 ( 19.893 2.342 20.093) 28.372 13.903 ( -16.827 2.774 20.123) 26.378 14.229 ( -12.681 2.846 4.208) 13.661 14.669 ( -14.162 -10.728 4.523) 18.333 15.933 ( -16.007 1.613 -14.470) 21.638 17.045 ( 13.747 2.254 -1.374) 13.998 18.164 ( 5.020 -9.516 -40.513) 41.918 18.590 ( -6.377 -5.557 -44.390) 45.189 20.307 ( 7.019 -20.477 21.928) 30.812 22.476 ( -0.179 35.197 15.788) 38.576 23.497 ( 0.050 -6.341 -25.080) 25.870 23.902 ( -2.716 5.712 -11.541) 13.160 24.376 ( -6.186 -10.558 2.128) 12.421 25.044 ( -1.914 4.348 -11.244) 12.207 25.258 ( -3.691 -3.871 -9.804) 11.168 25.896 ( -6.928 20.595 -14.064) 25.884 29.542 ( -13.085 -12.191 31.751) 36.442 30.683 ( 0.409 -24.290 30.854) 39.270 30.929 ( 0.560 3.792 -0.910) 3.940 32.167 ( 0.626 -13.562 -5.667) 14.712 35.009 ( 10.765 -3.822 21.181) 24.065 36.208 ( 15.810 14.942 -9.090) 23.576 38.501 ( -4.323 6.299 31.542) 32.454 41.327 ( 5.750 25.129 -33.814) 42.520 ======================= Grid point 739 (231/343) ======================= q-point: (-0.38 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.618 ( 39.433 12.182 6.800) 41.828 8.008 ( 24.340 14.596 1.474) 28.419 9.408 ( 1.625 7.851 8.567) 11.733 9.649 ( 8.900 21.094 8.565) 24.444 10.150 ( 5.432 -9.565 13.310) 17.267 11.442 ( -37.103 0.395 4.480) 37.374 12.817 ( 16.197 9.425 20.457) 27.743 13.587 ( -27.090 2.648 16.593) 31.878 14.212 ( -3.571 -9.460 12.934) 16.417 14.685 ( -9.607 -3.610 2.086) 10.473 15.984 ( -6.667 -21.667 -13.127) 26.196 17.080 ( 9.413 7.374 -1.215) 12.019 18.328 ( 1.014 -5.243 -47.122) 47.423 18.644 ( -0.652 -5.794 -46.393) 46.758 20.820 ( 18.927 -22.966 27.802) 40.726 21.874 ( -8.158 28.652 26.621) 39.952 23.581 ( 1.053 1.314 -16.148) 16.236 23.810 ( -5.780 -2.415 -22.050) 22.923 24.531 ( -1.644 -12.071 -2.521) 12.440 24.877 ( -2.670 12.012 -7.971) 14.662 25.310 ( -0.513 -4.185 -14.485) 15.086 25.582 ( -4.579 9.672 -15.921) 19.183 29.656 ( -9.046 -14.681 28.719) 33.499 30.851 ( 0.688 4.742 2.748) 5.524 31.093 ( 0.396 -22.851 29.807) 37.560 32.410 ( 5.550 -11.112 -6.308) 13.931 35.158 ( 8.956 -1.858 17.744) 19.963 36.107 ( 12.049 12.525 -5.141) 18.124 38.305 ( -9.812 8.787 29.898) 32.670 40.913 ( 1.111 28.412 -29.727) 41.135 ======================= Grid point 740 (232/343) ======================= q-point: (-0.31 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.660 ( 17.364 18.598 10.228) 27.423 8.000 ( 36.197 18.522 8.476) 41.535 8.954 ( -35.452 23.451 15.983) 45.412 9.465 ( 16.323 18.456 11.835) 27.334 10.323 ( 17.183 4.428 -5.148) 18.476 10.993 ( -39.435 5.405 0.234) 39.804 12.703 ( 7.515 16.833 19.109) 26.552 13.339 ( -16.414 -1.001 11.155) 19.871 14.391 ( 10.677 7.295 3.459) 13.386 14.716 ( -13.594 -26.252 20.552) 36.005 16.437 ( -0.387 -33.919 -12.636) 36.199 16.993 ( 3.329 10.327 1.311) 10.929 18.368 ( -0.456 -0.634 -49.952) 49.958 18.749 ( 1.254 -4.972 -43.300) 43.602 21.067 ( 13.423 25.908 29.697) 41.633 21.728 ( -3.717 -31.129 25.958) 40.702 23.426 ( -3.826 12.399 -19.410) 23.348 23.897 ( -1.888 -9.521 -19.464) 21.750 24.620 ( 0.309 10.963 -1.766) 11.109 24.745 ( -1.826 -9.669 -7.784) 12.547 25.382 ( 3.517 -1.896 -16.322) 16.804 25.470 ( -5.260 -2.198 -16.322) 17.288 29.847 ( -4.145 -15.709 25.649) 30.362 30.778 ( 1.045 4.911 7.829) 9.301 31.453 ( -0.090 -20.073 26.971) 33.621 32.624 ( 4.892 -8.024 -6.999) 11.717 35.211 ( 4.843 4.690 14.935) 16.386 36.079 ( 10.354 2.836 -2.748) 11.081 38.028 ( -11.296 11.369 28.193) 32.430 40.415 ( -1.361 30.957 -25.900) 40.385 ======================= Grid point 741 (233/343) ======================= q-point: (-0.23 0.23 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.394 ( 0.000 21.088 15.941) 26.435 8.058 ( 0.000 40.744 33.477) 52.734 8.101 ( 0.000 12.033 -0.307) 12.037 9.247 ( 0.000 17.759 15.289) 23.434 10.308 ( 0.000 14.318 -11.378) 18.289 10.582 ( 0.000 12.197 -12.419) 17.407 12.445 ( 0.000 17.859 22.160) 28.460 13.363 ( -0.000 -11.234 12.688) 16.947 14.143 ( 0.000 22.548 -0.539) 22.554 15.213 ( -0.000 -33.059 19.485) 38.374 16.811 ( 0.000 12.523 5.553) 13.699 17.027 ( -0.000 -34.920 -12.889) 37.223 18.382 ( -0.000 -2.322 -45.127) 45.187 18.795 ( 0.000 0.911 -35.181) 35.192 20.674 ( 0.000 22.543 22.234) 31.663 22.360 ( -0.000 -38.985 25.162) 46.400 23.173 ( 0.000 13.715 -30.436) 33.384 24.044 ( -0.000 -8.936 -14.337) 16.893 24.444 ( 0.000 8.727 2.719) 9.141 24.881 ( -0.000 -5.848 -7.606) 9.594 25.389 ( 0.000 1.218 -16.163) 16.209 25.597 ( -0.000 -13.863 -16.539) 21.581 30.080 ( -0.000 -14.134 22.944) 26.949 30.706 ( 0.000 4.506 13.398) 14.135 31.759 ( -0.000 -16.982 22.661) 28.318 32.760 ( -0.000 -5.186 -7.109) 8.800 35.100 ( 0.000 10.388 15.985) 19.064 36.192 ( -0.000 -7.183 -4.310) 8.376 37.752 ( 0.000 12.707 25.832) 28.788 39.877 ( 0.000 32.243 -22.166) 39.127 ======================= Grid point 748 (234/343) ======================= q-point: ( 0.31 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.881 ( 14.687 -0.000 25.228) 29.192 7.083 ( 51.324 -0.000 -14.666) 53.379 8.231 ( 34.643 -0.000 19.954) 39.978 9.752 ( 28.228 -0.000 15.632) 32.268 10.565 ( 7.754 -0.000 22.914) 24.190 10.982 ( -19.408 0.000 -2.625) 19.584 12.019 ( 47.300 -0.000 11.793) 48.748 13.259 ( 32.899 -0.000 -13.339) 35.500 14.635 ( -24.104 0.000 29.505) 38.099 15.505 ( -26.526 0.000 16.775) 31.385 15.988 ( 20.924 -0.000 -6.921) 22.039 16.983 ( -6.018 0.000 -18.733) 19.676 18.150 ( -3.964 0.000 -18.891) 19.302 18.307 ( -29.843 0.000 -19.457) 35.626 20.036 ( -18.307 0.000 -5.438) 19.097 22.945 ( 9.977 -0.000 -66.450) 67.195 23.684 ( -4.752 0.000 10.613) 11.628 24.214 ( -7.285 0.000 -0.662) 7.315 24.543 ( 3.318 -0.000 -13.219) 13.629 24.854 ( -4.620 0.000 -13.098) 13.889 26.237 ( -10.456 0.000 24.183) 26.347 26.478 ( -7.453 0.000 17.538) 19.056 29.596 ( -25.650 0.000 39.237) 46.878 29.637 ( 5.893 -0.000 11.312) 12.755 30.764 ( -1.943 0.000 -5.415) 5.753 31.828 ( -27.107 0.000 -4.113) 27.417 34.563 ( 16.535 -0.000 27.220) 31.849 36.406 ( 26.776 -0.000 -19.674) 33.227 38.622 ( 12.413 -0.000 35.608) 37.710 42.056 ( 19.566 -0.000 -47.369) 51.251 ======================= Grid point 749 (235/343) ======================= q-point: ( 0.38 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.232 ( 22.141 -19.312 26.766) 39.744 7.588 ( 48.919 -0.776 -15.361) 51.280 8.545 ( 24.951 -2.737 19.705) 31.912 9.948 ( 19.599 3.793 15.635) 25.357 10.610 ( 4.541 6.226 11.973) 14.238 10.907 ( -5.349 -8.615 2.266) 10.391 12.437 ( 31.494 -2.425 11.528) 33.625 13.594 ( 28.207 -3.702 -9.923) 30.130 14.423 ( -20.063 -1.050 26.590) 33.326 15.136 ( -33.327 8.299 20.785) 40.144 16.254 ( 23.880 -2.653 -6.170) 24.806 16.917 ( -7.368 0.923 -18.172) 19.631 17.953 ( -12.539 4.104 -24.069) 27.448 18.244 ( -11.658 -9.742 -24.153) 28.534 19.853 ( -20.555 -2.343 0.329) 20.691 23.052 ( 11.045 -0.499 -64.476) 65.417 23.637 ( -2.921 1.436 10.269) 10.773 24.142 ( -9.137 -1.343 1.798) 9.409 24.523 ( 2.032 7.004 -12.124) 14.148 24.841 ( -4.286 -3.979 -12.184) 13.515 25.793 ( -9.838 25.390 23.344) 35.866 26.598 ( -9.004 -9.456 9.880) 16.374 29.360 ( -17.268 0.130 37.185) 40.999 29.757 ( 2.733 -7.067 19.299) 20.733 30.841 ( 4.277 -6.779 -8.182) 11.454 31.621 ( -23.169 -5.775 -6.395) 24.720 34.729 ( 14.263 -1.571 28.066) 31.522 36.606 ( 23.387 5.825 -19.680) 31.116 38.711 ( 8.860 2.216 37.155) 38.261 42.141 ( 12.706 8.565 -45.003) 47.541 ======================= Grid point 750 (236/343) ======================= q-point: ( 0.46 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.891 ( 29.364 -27.046 22.725) 45.936 8.039 ( 42.012 1.167 -12.361) 43.808 8.809 ( 7.877 -9.388 20.909) 24.236 10.045 ( 17.810 5.612 6.903) 19.908 10.494 ( 5.668 11.379 8.621) 15.359 11.074 ( -0.878 -11.694 6.625) 13.468 12.718 ( 19.194 -2.522 16.005) 25.118 13.860 ( 8.082 -2.186 3.761) 9.178 14.325 ( -4.592 -4.786 14.289) 15.753 14.605 ( -36.938 12.477 18.107) 42.988 16.298 ( -5.399 13.462 -17.621) 22.822 16.962 ( 14.857 -6.263 -5.797) 17.133 17.892 ( -4.565 -6.047 -30.066) 31.006 18.314 ( -6.516 -9.195 -31.524) 33.478 19.768 ( -15.849 -10.739 9.887) 21.547 23.168 ( 11.614 0.898 -55.905) 57.106 23.545 ( -2.805 8.131 9.284) 12.656 24.094 ( -9.521 -4.616 4.545) 11.516 24.313 ( -1.103 17.488 -3.810) 17.933 24.908 ( -2.558 -7.804 -12.142) 14.658 25.374 ( -7.167 13.328 10.762) 18.570 26.515 ( -8.139 8.993 -2.247) 12.336 29.252 ( -13.150 -4.799 37.318) 39.857 29.961 ( 2.399 -15.186 26.270) 30.438 30.983 ( 3.968 -2.386 -7.791) 9.064 31.614 ( -13.328 -16.273 -7.995) 22.503 34.889 ( 11.041 -2.690 27.328) 29.596 36.668 ( 18.232 11.224 -17.824) 27.859 38.713 ( 4.378 5.485 37.392) 38.044 42.033 ( 7.632 15.994 -41.383) 45.018 ======================= Grid point 751 (237/343) ======================= q-point: ( 0.54 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.613 ( 37.442 -17.443 14.942) 43.925 8.339 ( 28.819 5.446 -7.316) 30.228 9.003 ( -16.242 -18.720 23.432) 34.107 10.145 ( 25.940 7.416 1.055) 27.000 10.355 ( 12.770 16.378 7.524) 22.089 11.209 ( -13.443 -10.883 5.074) 18.026 12.925 ( 16.881 -1.218 26.626) 31.550 13.771 ( -18.618 4.499 23.262) 30.133 14.070 ( -30.134 6.197 11.519) 32.851 14.502 ( 8.857 -7.633 -4.030) 12.367 15.910 ( -15.663 14.058 -19.239) 28.515 17.219 ( 18.123 -0.184 -5.895) 19.059 18.022 ( -0.683 -11.591 -36.458) 38.262 18.410 ( -3.973 -8.256 -39.127) 40.186 19.946 ( -4.645 -23.249 20.813) 31.549 23.058 ( 3.426 29.905 5.864) 30.666 23.417 ( 0.461 -3.025 -31.161) 31.311 24.025 ( -1.971 12.260 -4.351) 13.158 24.146 ( -5.653 -9.604 3.524) 11.688 25.025 ( 0.048 -6.444 -12.895) 14.416 25.186 ( -5.546 3.047 -2.564) 6.827 26.188 ( -5.659 20.236 -10.494) 23.487 29.254 ( -9.416 -8.713 35.659) 37.896 30.301 ( 1.952 -22.241 30.703) 37.962 30.985 ( -0.361 2.717 -5.596) 6.231 31.868 ( -2.127 -20.848 -8.774) 22.719 35.035 ( 7.766 -3.805 24.962) 26.418 36.598 ( 12.170 14.868 -14.615) 24.141 38.615 ( 0.074 8.916 36.785) 37.850 41.771 ( 3.871 22.021 -37.473) 43.636 ======================= Grid point 752 (238/343) ======================= q-point: ( 0.62 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.095 ( 30.971 4.389 5.572) 31.773 8.435 ( 20.029 8.548 -0.140) 21.777 9.099 ( -30.606 -19.087 24.105) 43.383 10.142 ( 13.359 20.279 9.276) 25.995 10.374 ( 33.535 4.816 0.288) 33.881 11.088 ( -32.285 -0.353 0.204) 32.287 13.090 ( 16.588 1.614 33.963) 37.832 13.438 ( -18.100 9.537 21.214) 29.472 13.879 ( -18.703 -11.075 10.056) 23.950 14.659 ( 4.373 -1.894 -5.602) 7.355 15.686 ( -7.395 -4.097 -16.705) 18.722 17.284 ( 7.607 6.722 -5.379) 11.488 18.214 ( 0.315 -9.964 -45.085) 46.174 18.514 ( -1.373 -7.819 -43.144) 43.868 20.425 ( 3.882 -33.227 26.996) 42.987 22.437 ( -2.273 40.479 27.767) 49.140 23.544 ( 3.151 -7.671 -32.942) 33.970 23.824 ( -3.715 9.328 -7.692) 12.648 24.306 ( -1.272 -12.843 -2.462) 13.139 25.019 ( -0.680 6.810 -6.890) 9.711 25.198 ( -1.913 -7.324 -14.453) 16.316 25.800 ( -2.559 19.647 -14.472) 24.536 29.358 ( -4.964 -12.360 32.874) 35.470 30.706 ( 1.014 -23.959 31.721) 39.766 30.923 ( -0.554 3.651 -2.219) 4.308 32.198 ( 1.448 -18.052 -8.794) 20.132 35.167 ( 4.500 -4.558 21.176) 22.123 36.430 ( 6.067 15.428 -10.598) 19.676 38.427 ( -2.395 11.888 35.514) 37.528 41.388 ( 1.204 26.691 -33.605) 42.932 ======================= Grid point 753 (239/343) ======================= q-point: (-0.31 0.31 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.030 ( 0.000 16.134 6.255) 17.304 8.460 ( 0.000 9.018 -1.369) 9.122 9.017 ( 0.000 7.560 26.897) 27.939 9.875 ( 0.000 20.154 9.315) 22.202 10.665 ( 0.000 8.971 -12.760) 15.598 10.682 ( -0.000 -2.182 12.554) 12.742 13.042 ( 0.000 17.849 13.890) 22.617 13.245 ( -0.000 -0.849 22.296) 22.312 14.103 ( -0.000 -26.467 24.501) 36.067 14.637 ( 0.000 6.476 -4.560) 7.921 15.916 ( -0.000 -25.590 -13.924) 29.133 17.180 ( 0.000 9.414 -2.528) 9.748 18.330 ( -0.000 -4.116 -50.523) 50.691 18.643 ( -0.000 -7.871 -44.557) 45.247 21.059 ( -0.000 -38.214 28.014) 47.382 21.746 ( 0.000 39.508 31.590) 50.585 23.621 ( 0.000 11.771 -11.449) 16.421 23.719 ( -0.000 -10.036 -25.860) 27.739 24.524 ( -0.000 -13.436 -6.429) 14.894 24.846 ( 0.000 12.877 -5.665) 14.068 25.306 ( -0.000 -6.398 -16.272) 17.485 25.534 ( 0.000 10.420 -15.927) 19.033 29.564 ( -0.000 -15.173 29.506) 33.179 30.856 ( 0.000 4.132 2.401) 4.779 31.100 ( -0.000 -22.511 30.273) 37.725 32.470 ( -0.000 -13.185 -8.383) 15.624 35.254 ( -0.000 -2.258 17.018) 17.167 36.234 ( 0.000 10.823 -6.519) 12.634 38.195 ( 0.000 13.523 33.278) 35.920 40.920 ( 0.000 29.871 -29.768) 42.172 ======================= Grid point 762 (240/343) ======================= q-point: ( 0.38 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.294 ( 25.177 -0.000 36.848) 44.628 8.042 ( 44.408 -0.000 -17.002) 47.551 8.683 ( 7.807 -0.000 14.162) 16.171 10.066 ( 3.350 -0.000 19.562) 19.846 10.765 ( 0.879 -0.000 -2.173) 2.344 10.885 ( 23.477 -0.000 4.591) 23.922 12.655 ( 16.056 -0.000 20.421) 25.977 13.818 ( 23.211 -0.000 -9.759) 25.179 14.254 ( -12.529 0.000 18.853) 22.637 14.880 ( -33.618 0.000 26.814) 43.002 16.505 ( 29.448 -0.000 -5.480) 29.954 16.866 ( -6.658 0.000 -23.154) 24.092 17.768 ( -22.779 0.000 -21.421) 31.269 18.141 ( 2.380 -0.000 -27.351) 27.455 19.594 ( -25.860 0.000 4.732) 26.289 23.151 ( 10.176 -0.000 -66.431) 67.206 23.630 ( -0.462 0.000 10.594) 10.604 24.033 ( -10.666 0.000 3.686) 11.285 24.600 ( 2.462 -0.000 -15.192) 15.391 24.773 ( -3.605 0.000 -13.038) 13.528 26.042 ( -8.363 0.000 24.161) 25.567 26.310 ( -8.578 0.000 17.419) 19.417 29.190 ( -15.102 0.000 40.259) 42.998 29.781 ( 7.653 -0.000 12.628) 14.766 30.805 ( 3.850 -0.000 -9.100) 9.881 31.360 ( -19.639 0.000 -8.544) 21.417 34.845 ( 11.558 -0.000 29.919) 32.074 36.868 ( 19.282 -0.000 -21.489) 28.872 38.812 ( 7.052 -0.000 39.195) 39.825 42.311 ( 7.626 -0.000 -44.617) 45.264 ======================= Grid point 763 (241/343) ======================= q-point: ( 0.46 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.730 ( 25.453 -21.796 40.181) 52.320 8.432 ( 34.117 0.906 -13.990) 36.885 8.708 ( -6.499 -2.640 8.679) 11.159 10.112 ( 0.223 -5.365 12.423) 13.534 10.766 ( 12.115 7.261 1.660) 14.221 11.093 ( 16.838 1.767 -0.738) 16.946 12.778 ( 4.894 -4.144 32.604) 33.228 13.948 ( 5.292 6.209 3.264) 8.787 14.240 ( 3.230 -6.588 -0.315) 7.344 14.477 ( -28.890 10.282 26.011) 40.211 16.513 ( -4.322 18.162 -21.177) 28.232 17.007 ( 21.051 -11.675 -11.010) 26.470 17.665 ( -12.011 -7.873 -23.322) 27.389 18.196 ( 2.062 -3.303 -30.187) 30.437 19.407 ( -22.712 -8.422 12.636) 27.321 23.250 ( 8.068 -1.053 -63.779) 64.295 23.629 ( 2.254 2.006 8.816) 9.318 23.936 ( -10.809 -1.678 6.527) 12.738 24.559 ( 1.436 9.174 -14.787) 17.461 24.774 ( -2.478 -4.709 -11.252) 12.447 25.629 ( -6.280 24.916 22.843) 34.381 26.440 ( -6.225 -9.638 9.655) 14.995 29.085 ( -9.475 -1.995 38.952) 40.138 29.855 ( 4.872 -2.553 17.824) 18.654 30.944 ( 5.333 -8.330 -9.587) 13.775 31.249 ( -14.390 -8.555 -9.536) 19.267 34.951 ( 7.916 -1.211 30.133) 31.178 36.976 ( 13.430 6.458 -21.169) 25.888 38.837 ( 4.128 3.758 39.819) 40.209 42.296 ( 4.155 8.512 -42.715) 43.752 ======================= Grid point 764 (242/343) ======================= q-point: ( 0.54 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1015 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.467 ( 23.879 -35.747 38.958) 58.016 8.576 ( -5.273 1.571 1.187) 5.628 8.712 ( 6.626 0.211 -5.811) 8.816 10.282 ( 5.870 -11.340 6.912) 14.520 10.726 ( 10.632 12.391 4.012) 16.812 11.129 ( 4.042 6.322 -4.866) 8.943 12.935 ( 4.074 -9.821 43.465) 44.747 13.786 ( -2.524 11.730 14.094) 18.509 13.978 ( -22.847 14.022 15.161) 30.797 14.469 ( 7.782 -8.026 -6.295) 12.830 16.086 ( -8.861 21.282 -23.185) 32.695 17.387 ( 20.462 -3.425 -11.631) 23.784 17.738 ( -10.063 -14.993 -29.425) 34.523 18.283 ( 0.711 -5.270 -34.449) 34.857 19.490 ( -9.639 -21.345 21.630) 31.881 23.341 ( 5.063 -2.047 -53.608) 53.886 23.518 ( -0.463 15.374 9.453) 18.054 23.933 ( -4.860 -8.414 5.636) 11.233 24.304 ( -0.204 19.930 -4.785) 20.497 24.879 ( -0.571 -9.017 -12.269) 15.237 25.265 ( -3.304 12.264 9.871) 16.086 26.400 ( -3.171 8.729 -2.421) 9.598 29.072 ( -4.679 -4.900 37.532) 38.138 30.015 ( 1.877 -13.435 26.070) 29.388 31.017 ( -0.010 1.557 -8.865) 9.000 31.461 ( -2.937 -24.066 -9.848) 26.168 35.040 ( 3.986 -2.506 28.550) 28.936 36.919 ( 6.708 12.003 -18.963) 23.424 38.767 ( 1.262 7.794 39.489) 40.270 42.118 ( 1.785 16.109 -40.083) 43.236 ======================= Grid point 765 (243/343) ======================= q-point: (-0.38 -0.62 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.300 ( -0.000 -41.180 39.001) 56.717 8.416 ( 0.000 7.113 -0.525) 7.132 8.699 ( 0.000 5.446 -6.067) 8.153 10.530 ( 0.000 17.569 5.649) 18.455 10.544 ( -0.000 -11.222 8.294) 13.954 10.981 ( 0.000 10.287 -9.703) 14.141 13.127 ( -0.000 -6.784 58.850) 59.239 13.597 ( 0.000 14.976 4.116) 15.532 13.642 ( 0.000 0.855 10.846) 10.880 14.626 ( -0.000 -5.599 -7.039) 8.994 15.732 ( 0.000 13.635 -21.213) 25.217 17.435 ( 0.000 5.900 -8.866) 10.649 17.988 ( -0.000 -16.897 -39.182) 42.670 18.384 ( -0.000 -6.776 -38.705) 39.294 19.893 ( -0.000 -30.631 26.197) 40.306 23.074 ( 0.000 34.854 21.836) 41.129 23.441 ( -0.000 -5.904 -44.165) 44.558 24.004 ( 0.000 14.371 -2.623) 14.608 24.090 ( -0.000 -11.983 0.054) 11.983 25.039 ( -0.000 -9.747 -14.083) 17.127 25.115 ( 0.000 5.599 -1.546) 5.809 26.131 ( 0.000 19.894 -10.550) 22.518 29.160 ( -0.000 -8.511 35.673) 36.675 30.325 ( -0.000 -21.771 30.980) 37.865 30.974 ( 0.000 2.906 -6.319) 6.955 31.856 ( -0.000 -23.291 -9.766) 25.256 35.114 ( -0.000 -4.029 25.308) 25.627 36.721 ( 0.000 15.329 -15.278) 21.643 38.613 ( 0.000 10.959 38.241) 39.781 41.805 ( 0.000 22.335 -37.048) 43.259 ======================= Grid point 777 (244/343) ======================= q-point: ( 0.46 0.46 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.740 ( 15.633 -0.000 50.354) 52.725 8.608 ( -8.150 0.000 1.046) 8.217 8.723 ( 21.168 -0.000 -13.136) 24.913 10.019 ( -4.449 0.000 6.580) 7.943 10.937 ( 9.638 -0.000 -0.969) 9.686 11.282 ( 12.611 -0.000 -1.518) 12.702 12.739 ( -1.958 0.000 47.650) 47.690 14.139 ( 8.752 -0.000 3.099) 9.284 14.146 ( -0.856 0.000 -3.228) 3.339 14.339 ( -17.086 0.000 20.760) 26.887 16.750 ( -3.825 0.000 -24.919) 25.211 16.932 ( 8.234 -0.000 -19.128) 20.825 17.558 ( 2.883 -0.000 -15.579) 15.844 18.195 ( 1.984 -0.000 -30.103) 30.168 19.113 ( -18.232 0.000 18.577) 26.029 23.305 ( 4.515 -0.000 -66.941) 67.093 23.675 ( 5.076 -0.000 9.939) 11.160 23.824 ( -9.751 0.000 7.317) 12.191 24.641 ( 1.756 -0.000 -18.401) 18.485 24.713 ( -2.319 0.000 -11.884) 12.108 25.930 ( -2.856 0.000 23.260) 23.434 26.181 ( -3.707 0.000 18.494) 18.862 28.999 ( -4.691 0.000 38.827) 39.110 29.898 ( 3.504 -0.000 13.979) 14.411 30.867 ( 1.862 -0.000 -9.409) 9.592 31.088 ( -7.391 0.000 -10.973) 13.230 35.001 ( 4.089 -0.000 31.412) 31.677 37.132 ( 7.037 -0.000 -22.501) 23.576 38.903 ( 2.259 -0.000 40.743) 40.806 42.395 ( 1.754 -0.000 -42.695) 42.731 ======================= Grid point 778 (245/343) ======================= q-point: (-0.46 -0.54 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 553 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.037 ( -0.000 -25.048 51.292) 57.081 8.549 ( 0.000 1.652 -2.038) 2.624 8.817 ( 0.000 1.665 -10.992) 11.118 10.084 ( -0.000 -10.424 4.184) 11.232 10.937 ( 0.000 6.225 0.164) 6.227 11.291 ( 0.000 6.340 -3.767) 7.374 12.787 ( -0.000 -7.216 51.604) 52.106 14.018 ( 0.000 10.360 -3.647) 10.983 14.068 ( 0.000 12.934 29.258) 31.989 14.365 ( -0.000 -8.816 -6.499) 10.953 16.423 ( 0.000 23.369 -24.592) 33.924 17.275 ( -0.000 -23.687 -25.659) 34.921 17.569 ( 0.000 2.110 -13.714) 13.876 18.226 ( -0.000 -2.494 -31.552) 31.650 19.130 ( -0.000 -13.271 22.643) 26.246 23.334 ( -0.000 -1.005 -62.780) 62.788 23.697 ( 0.000 5.849 5.286) 7.884 23.781 ( -0.000 -5.530 10.390) 11.770 24.574 ( 0.000 10.251 -16.385) 19.327 24.749 ( -0.000 -5.702 -11.026) 12.413 25.565 ( 0.000 25.114 23.127) 34.140 26.376 ( -0.000 -9.815 9.749) 13.834 28.993 ( -0.000 -2.089 38.324) 38.381 29.907 ( -0.000 -1.333 18.337) 18.385 31.042 ( 0.000 1.088 -10.778) 10.833 31.061 ( -0.000 -19.701 -9.670) 21.946 35.030 ( -0.000 -1.124 30.869) 30.889 37.110 ( 0.000 6.656 -21.713) 22.710 38.877 ( 0.000 4.324 40.632) 40.862 42.333 ( 0.000 8.475 -41.773) 42.624 ======================= Grid point 865 (246/343) ======================= q-point: ( 0.00 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.269 ( 0.000 0.000 57.129) 57.129 6.593 ( 0.000 0.000 46.199) 46.199 7.487 ( 0.000 0.000 4.060) 4.060 7.734 ( 0.000 0.000 -8.900) 8.900 7.973 ( 0.000 0.000 -20.584) 20.584 8.365 ( 0.000 0.000 -46.240) 46.240 11.696 ( 0.000 0.000 40.529) 40.529 12.639 ( 0.000 0.000 -10.823) 10.823 14.863 ( 0.000 0.000 -11.445) 11.445 15.063 ( 0.000 0.000 -21.177) 21.177 16.970 ( 0.000 0.000 39.532) 39.532 17.932 ( 0.000 0.000 -1.097) 1.097 18.931 ( 0.000 0.000 19.256) 19.256 19.669 ( 0.000 0.000 -16.197) 16.197 20.038 ( 0.000 0.000 1.484) 1.484 21.339 ( 0.000 0.000 -63.049) 63.049 24.084 ( 0.000 0.000 -6.910) 6.910 24.097 ( 0.000 0.000 -7.805) 7.805 24.386 ( 0.000 0.000 13.185) 13.185 24.910 ( 0.000 0.000 -12.489) 12.489 26.399 ( 0.000 0.000 9.098) 9.098 26.472 ( 0.000 0.000 6.355) 6.355 30.698 ( 0.000 0.000 18.705) 18.705 31.019 ( 0.000 0.000 3.283) 3.283 32.571 ( 0.000 0.000 7.285) 7.285 32.902 ( 0.000 0.000 -9.167) 9.167 35.314 ( 0.000 0.000 34.753) 34.753 36.547 ( 0.000 0.000 -25.791) 25.791 37.333 ( 0.000 0.000 -0.065) 0.065 37.346 ( 0.000 0.000 -0.536) 0.536 ======================= Grid point 866 (247/343) ======================= q-point: ( 0.08 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.172 ( -29.117 -8.388 45.193) 54.411 6.683 ( 9.557 -7.149 43.171) 44.791 7.402 ( -36.436 -0.070 -17.541) 40.439 7.876 ( 40.402 -13.153 11.661) 44.060 8.121 ( 1.288 -13.445 -19.231) 23.501 8.851 ( 57.847 -12.467 -32.592) 67.557 11.737 ( -2.466 -6.370 38.621) 39.220 12.636 ( -5.366 -2.979 -10.348) 12.031 14.772 ( 2.829 9.368 -6.404) 11.695 15.172 ( 2.871 -8.129 -24.817) 26.272 16.912 ( -5.415 3.116 39.247) 39.741 17.946 ( -5.152 -4.166 -3.576) 7.529 18.841 ( -3.506 8.489 18.143) 20.335 19.542 ( -7.333 9.993 -15.399) 19.768 20.073 ( 2.518 -2.022 2.121) 3.864 21.368 ( -0.244 -3.625 -61.331) 61.439 24.042 ( 0.548 2.857 -4.543) 5.394 24.145 ( 0.194 -2.861 -9.380) 9.809 24.391 ( -0.519 -0.967 12.816) 12.863 24.920 ( -1.494 -2.079 -12.903) 13.155 26.217 ( 4.394 18.033 15.191) 23.985 26.546 ( 4.850 0.501 -0.530) 4.904 30.640 ( -12.051 -0.919 18.327) 21.954 30.968 ( -10.405 -0.480 2.551) 10.724 32.613 ( 8.861 1.210 7.341) 11.570 32.897 ( 0.948 1.658 -6.884) 7.144 35.201 ( -19.655 0.229 30.935) 36.652 36.144 ( -55.154 -0.212 -14.236) 56.961 37.495 ( 23.591 -4.166 3.627) 24.229 37.814 ( 59.680 -4.945 -12.663) 61.209 ======================= Grid point 867 (248/343) ======================= q-point: ( 0.15 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.069 ( -27.443 -13.361 31.328) 43.738 6.896 ( -3.264 -4.636 15.451) 16.459 7.252 ( -16.008 -21.751 3.169) 27.192 8.226 ( 10.157 -7.699 -13.375) 18.475 8.802 ( 53.729 -24.808 16.909) 61.548 9.716 ( 60.799 -19.296 -24.924) 68.484 11.858 ( -4.779 -12.200 33.505) 35.976 12.646 ( -9.632 -7.882 -8.974) 15.344 14.653 ( 6.844 10.180 2.053) 12.438 15.344 ( 4.646 -7.643 -29.020) 30.367 16.788 ( -9.037 2.447 37.500) 38.651 17.941 ( -11.178 -3.888 -9.250) 15.021 18.596 ( -6.096 14.570 14.666) 21.553 19.222 ( -10.235 17.481 -15.694) 25.625 20.142 ( 1.451 -3.986 6.291) 7.587 21.452 ( -0.596 -6.871 -56.780) 57.198 23.999 ( 0.995 3.502 -1.738) 4.035 24.171 ( -1.631 -0.361 -7.963) 8.136 24.414 ( 0.132 -2.192 10.047) 10.285 24.944 ( -2.642 -2.948 -13.766) 14.323 25.923 ( 6.381 23.130 20.039) 31.262 26.511 ( 7.094 11.107 -8.136) 15.488 30.531 ( -16.080 -3.736 17.213) 23.850 30.856 ( -13.801 -1.117 1.426) 13.919 32.652 ( 5.413 4.348 7.895) 10.513 32.849 ( -2.971 2.993 -1.912) 4.630 34.999 ( -22.876 -3.188 24.805) 33.894 35.684 ( -42.321 -3.644 -8.347) 43.290 37.866 ( 28.980 -7.625 9.561) 31.454 38.478 ( 58.715 -3.219 -20.195) 62.174 ======================= Grid point 868 (249/343) ======================= q-point: ( 0.23 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.070 ( -19.567 -13.894 21.944) 32.519 6.818 ( -19.723 -5.457 -10.615) 23.054 7.703 ( 8.143 -28.875 22.362) 37.418 8.477 ( 11.852 -9.306 -8.357) 17.231 9.775 ( 58.436 -23.954 20.436) 66.379 10.629 ( 56.332 -20.056 -19.296) 62.832 12.030 ( -7.474 -14.936 27.743) 32.382 12.741 ( -10.582 -16.541 -7.523) 21.027 14.579 ( 11.837 9.331 10.309) 18.261 15.504 ( 5.281 -5.292 -29.641) 30.569 16.674 ( -10.700 -0.760 32.644) 34.361 17.821 ( -16.981 2.724 -11.476) 20.675 18.274 ( -8.162 14.515 5.726) 17.609 18.787 ( -10.420 21.599 -18.482) 30.277 20.240 ( 0.066 -7.193 13.474) 15.274 21.581 ( -0.949 -9.396 -50.221) 51.101 23.933 ( 1.440 6.504 1.104) 6.752 24.107 ( -5.273 4.066 -2.730) 7.196 24.463 ( 1.337 -2.576 5.182) 5.940 24.959 ( -3.281 -2.046 -14.323) 14.835 25.607 ( 6.691 21.365 19.452) 29.658 26.314 ( 5.195 19.562 -13.531) 24.346 30.472 ( -13.188 -6.639 15.163) 21.164 30.755 ( -10.410 -1.331 1.165) 10.559 32.549 ( -10.540 4.189 10.423) 15.404 32.740 ( -4.733 5.695 1.615) 7.579 34.902 ( -14.594 -7.655 19.689) 25.676 35.441 ( -23.324 -5.111 -5.931) 24.603 38.275 ( 26.481 -8.065 13.670) 30.873 39.044 ( 48.425 -1.324 -23.523) 53.852 ======================= Grid point 869 (250/343) ======================= q-point: ( 0.31 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.128 ( -11.604 -11.151 15.269) 22.184 6.732 ( -17.423 -5.951 -13.047) 22.566 8.256 ( 11.641 -24.198 18.770) 32.763 8.746 ( 10.506 -9.130 -2.735) 14.185 10.685 ( 51.508 -18.916 19.974) 58.394 11.452 ( 45.693 -17.742 -13.280) 50.784 12.195 ( -8.662 -15.031 25.370) 30.734 12.996 ( -7.656 -23.794 -8.424) 26.376 14.589 ( 17.840 6.603 16.385) 25.107 15.604 ( 3.289 -0.911 -23.147) 23.397 16.606 ( -11.146 -3.471 23.757) 26.470 17.524 ( -16.284 11.296 -6.740) 20.933 17.958 ( -14.209 11.377 -7.850) 19.823 18.350 ( -7.110 18.977 -26.499) 33.359 20.391 ( -0.246 -11.242 21.727) 24.465 21.734 ( -1.449 -9.838 -40.986) 42.175 23.780 ( 0.938 14.009 5.958) 15.252 23.960 ( -6.949 4.895 -1.121) 8.574 24.516 ( 1.974 -1.564 1.659) 3.016 24.937 ( -3.648 0.866 -13.965) 14.460 25.383 ( 6.307 12.631 11.923) 18.479 25.991 ( 1.201 21.788 -14.941) 26.446 30.487 ( -8.086 -7.222 12.431) 16.495 30.701 ( -4.195 -0.838 1.642) 4.583 32.354 ( -19.444 0.293 13.296) 23.557 32.572 ( -6.077 7.678 3.287) 10.330 34.949 ( -5.992 -9.095 15.416) 18.875 35.362 ( -9.984 -4.033 -3.716) 11.391 38.632 ( 20.306 -6.852 15.926) 26.701 39.466 ( 35.350 0.014 -24.414) 42.962 ======================= Grid point 870 (251/343) ======================= q-point: ( 0.38 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.202 ( -5.054 -7.325 10.454) 13.729 6.668 ( -12.293 -3.828 -12.104) 17.671 8.694 ( 10.819 -14.698 13.185) 22.515 8.959 ( 5.286 -6.303 0.436) 8.238 11.362 ( 34.110 -10.964 21.040) 41.550 12.045 ( 17.848 -12.255 3.500) 21.932 12.428 ( 8.396 -16.308 13.822) 22.967 13.314 ( -5.730 -20.060 -10.704) 23.448 14.724 ( 23.398 1.294 18.129) 29.628 15.573 ( -3.812 4.870 -7.707) 9.882 16.540 ( -12.164 -1.528 11.317) 16.685 17.201 ( -8.437 12.038 -1.518) 14.778 17.647 ( -13.965 5.508 -20.753) 25.614 18.030 ( -5.091 13.389 -35.818) 38.576 20.606 ( 0.646 -13.894 28.639) 31.838 21.845 ( -2.616 -4.579 -25.749) 26.283 23.546 ( 0.946 11.767 4.641) 12.685 23.814 ( -5.587 6.014 -4.733) 9.475 24.552 ( 2.483 -0.276 -1.271) 2.803 24.857 ( -4.124 3.912 -13.291) 14.455 25.297 ( 4.875 5.275 4.100) 8.270 25.667 ( -1.429 15.299 -11.894) 19.431 30.534 ( -4.102 -5.161 10.187) 12.134 30.695 ( 0.611 -0.280 1.913) 2.027 32.189 ( -17.583 -2.952 14.382) 22.907 32.390 ( -4.665 7.159 4.838) 9.820 35.053 ( -1.790 -7.163 12.132) 14.202 35.352 ( -3.219 -1.993 -1.273) 3.995 38.890 ( 12.562 -4.567 16.967) 21.599 39.739 ( 21.362 0.503 -24.173) 32.263 ======================= Grid point 871 (252/343) ======================= q-point: ( 0.46 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.260 ( -1.026 -2.684 7.512) 8.042 6.623 ( -4.721 -1.147 -10.547) 11.612 8.953 ( 7.300 -5.944 7.749) 12.193 9.039 ( -1.531 -0.895 3.119) 3.588 11.706 ( 11.685 -3.377 24.525) 27.375 12.235 ( -0.418 -4.433 21.923) 22.371 12.798 ( 12.087 -8.550 -4.461) 15.462 13.496 ( -3.788 -7.116 -10.517) 13.251 14.986 ( 21.505 -4.281 13.865) 25.943 15.373 ( -13.335 7.272 10.325) 18.366 16.445 ( -6.301 0.165 -2.561) 6.803 16.969 ( -3.168 7.098 7.760) 10.983 17.594 ( -2.403 -7.730 -34.721) 35.652 17.778 ( -3.781 11.759 -38.723) 40.645 20.819 ( 0.935 -8.211 32.369) 33.408 21.828 ( -2.154 1.792 -8.161) 8.628 23.484 ( 3.721 -1.447 -7.007) 8.064 23.644 ( -4.989 7.457 -8.175) 12.138 24.577 ( 1.991 0.058 -4.197) 4.645 24.753 ( -2.919 2.825 -11.114) 11.833 25.278 ( 2.081 1.639 0.691) 2.738 25.489 ( -1.052 4.532 -8.179) 9.410 30.567 ( -1.236 -1.769 9.226) 9.475 30.709 ( 1.015 -0.067 1.689) 1.971 32.113 ( -7.506 -2.453 14.122) 16.180 32.265 ( -1.207 3.625 6.272) 7.344 35.130 ( -0.365 -2.813 10.139) 10.528 35.354 ( -0.589 -0.414 0.531) 0.895 39.025 ( 4.233 -1.603 17.335) 17.916 39.872 ( 7.134 0.264 -23.785) 24.833 ======================= Grid point 879 (253/343) ======================= q-point: ( 0.08 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.836 ( -23.903 0.000 34.819) 42.234 6.631 ( -9.167 0.000 29.639) 31.024 7.063 ( -19.062 0.000 -5.877) 19.947 8.085 ( 14.817 -0.000 -15.272) 21.279 8.339 ( 62.925 -0.000 14.732) 64.627 9.345 ( 63.224 -0.000 -29.553) 69.790 11.649 ( -4.600 0.000 38.764) 39.036 12.535 ( -10.099 0.000 -10.290) 14.418 14.904 ( 4.245 -0.000 -10.397) 11.230 15.132 ( 6.802 -0.000 -21.037) 22.109 16.859 ( -10.873 0.000 40.371) 41.809 17.838 ( -9.392 0.000 -1.070) 9.453 18.856 ( -7.930 0.000 17.222) 18.960 19.506 ( -15.164 0.000 -13.783) 20.492 20.102 ( 4.886 -0.000 -1.285) 5.052 21.338 ( 0.304 -0.000 -62.428) 62.429 24.079 ( -0.759 0.000 -4.895) 4.954 24.120 ( 2.268 -0.000 -7.953) 8.270 24.373 ( -1.149 0.000 11.733) 11.789 24.880 ( -2.871 0.000 -12.395) 12.723 26.494 ( 8.729 -0.000 9.427) 12.848 26.561 ( 8.315 -0.000 6.874) 10.788 30.466 ( -20.003 0.000 16.600) 25.994 30.817 ( -17.861 0.000 0.213) 17.862 32.740 ( 12.393 -0.000 7.027) 14.247 32.890 ( -7.191 0.000 -0.310) 7.198 34.947 ( -28.700 0.000 24.353) 37.640 35.611 ( -46.561 0.000 -9.067) 47.435 37.730 ( 32.067 -0.000 11.842) 34.184 38.447 ( 68.373 -0.000 -23.596) 72.330 ======================= Grid point 880 (254/343) ======================= q-point: ( 0.15 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.715 ( -11.321 -6.096 24.230) 27.430 6.520 ( -30.519 -12.263 -7.596) 33.757 7.110 ( 20.145 -3.294 29.454) 35.836 8.276 ( 17.738 -3.143 -16.882) 24.689 9.106 ( 68.460 -12.372 20.761) 72.601 10.059 ( 61.060 -11.140 -24.352) 66.674 11.649 ( -6.144 -6.299 35.109) 36.195 12.444 ( -13.044 -3.218 -9.461) 16.432 14.879 ( 7.914 7.681 -5.231) 12.206 15.282 ( 8.243 -6.676 -23.452) 25.740 16.714 ( -14.232 1.893 40.405) 42.880 17.754 ( -14.091 -3.100 -2.919) 14.720 18.691 ( -12.209 7.627 14.087) 20.141 19.277 ( -18.999 6.831 -14.366) 24.779 20.144 ( 3.817 0.136 0.314) 3.832 21.373 ( 1.286 -3.164 -60.268) 60.365 24.049 ( -0.633 1.889 -2.269) 3.020 24.154 ( 0.951 -0.547 -6.939) 7.025 24.376 ( -0.752 -1.783 8.960) 9.166 24.867 ( -3.802 -2.239 -12.711) 13.455 26.356 ( 8.248 19.608 16.151) 26.709 26.704 ( 9.795 1.348 -0.382) 9.895 30.286 ( -20.236 -3.208 15.585) 25.742 30.657 ( -17.957 -3.051 -1.873) 18.310 32.694 ( -19.711 4.057 10.636) 22.762 32.839 ( -0.132 0.035 3.521) 3.523 34.712 ( -21.366 -3.128 20.150) 29.535 35.298 ( -21.419 -2.728 -9.699) 23.670 38.085 ( 33.369 -2.883 18.741) 38.380 39.079 ( 61.371 1.566 -30.156) 68.398 ======================= Grid point 881 (255/343) ======================= q-point: ( 0.23 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.796 ( 1.259 -8.565 16.052) 18.238 6.475 ( -20.165 -12.149 -16.272) 28.618 7.503 ( 26.682 -14.668 34.242) 45.821 8.524 ( 20.014 -3.954 -12.741) 24.053 10.023 ( 63.364 -18.056 21.165) 69.202 10.856 ( 51.629 -16.382 -17.840) 57.028 11.735 ( -6.836 -11.519 28.357) 31.361 12.418 ( -10.982 -9.330 -8.396) 16.677 14.844 ( 12.292 7.979 2.493) 14.865 15.473 ( 8.052 -5.878 -24.667) 26.605 16.547 ( -14.868 0.238 37.413) 40.260 17.639 ( -19.127 -2.025 -6.554) 20.320 18.381 ( -16.034 12.189 8.926) 22.030 18.923 ( -19.665 12.281 -18.040) 29.376 20.184 ( 2.433 -1.814 6.508) 7.180 21.467 ( 2.721 -5.692 -55.589) 55.946 24.005 ( -1.413 2.312 0.241) 2.720 24.130 ( -1.611 3.475 -2.444) 4.543 24.420 ( 0.351 -3.475 4.028) 5.332 24.876 ( -3.956 -3.351 -13.481) 14.444 26.046 ( 4.549 24.195 20.287) 31.901 26.656 ( 5.974 14.118 -8.589) 17.572 30.205 ( -14.672 -8.016 15.593) 22.862 30.585 ( -11.425 -5.694 -2.788) 13.067 32.370 ( -33.855 1.183 18.608) 38.650 32.759 ( -10.380 3.184 -0.111) 10.858 34.663 ( -6.193 -6.973 18.463) 20.685 35.245 ( -1.491 -2.770 -10.472) 10.934 38.449 ( 28.843 -3.518 22.606) 36.815 39.578 ( 50.297 4.679 -32.741) 60.197 ======================= Grid point 882 (256/343) ======================= q-point: ( 0.31 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.989 ( 11.205 -6.306 10.385) 16.528 6.514 ( -6.184 -7.663 -15.197) 18.109 8.063 ( 25.994 -19.792 27.531) 42.724 8.782 ( 18.793 -3.576 -6.331) 20.150 10.870 ( 45.899 -16.742 19.679) 52.672 11.544 ( 29.113 -16.320 -6.322) 33.969 11.899 ( -0.772 -14.364 19.025) 23.851 12.597 ( 1.979 -18.393 -9.439) 20.768 14.865 ( 16.357 6.192 9.403) 19.857 15.608 ( 3.880 -2.226 -18.021) 18.567 16.432 ( -13.057 -3.116 27.992) 31.044 17.434 ( -21.816 2.028 -8.744) 23.591 17.996 ( -19.356 12.662 1.420) 23.173 18.516 ( -16.632 14.066 -25.216) 33.321 20.270 ( 2.823 -5.860 15.145) 16.482 21.612 ( 4.622 -7.183 -48.662) 49.406 23.939 ( -3.490 3.029 1.603) 4.891 23.995 ( -3.295 9.911 2.495) 10.738 24.487 ( 0.716 -3.590 1.345) 3.900 24.891 ( -3.414 -2.314 -14.028) 14.622 25.691 ( 0.710 20.043 17.529) 26.637 26.367 ( -0.811 22.578 -13.583) 26.362 30.256 ( -7.650 -10.485 15.171) 19.966 30.612 ( -3.090 -5.568 -2.570) 6.867 32.046 ( -34.608 -3.919 22.539) 41.486 32.569 ( -15.703 3.005 -2.401) 16.167 34.784 ( 3.351 -7.874 16.848) 18.897 35.313 ( 7.852 -0.586 -9.124) 12.051 38.752 ( 21.418 -2.871 24.035) 32.321 39.907 ( 37.821 7.636 -32.407) 50.388 ======================= Grid point 883 (257/343) ======================= q-point: ( 0.38 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.200 ( 17.751 -1.559 7.047) 19.162 6.597 ( 6.150 -2.218 -12.649) 14.239 8.607 ( 22.903 -15.131 18.078) 32.868 8.988 ( 14.056 -1.200 -0.641) 14.121 11.394 ( 8.958 -13.163 20.927) 26.295 11.949 ( 11.505 -12.332 13.110) 21.362 12.267 ( 13.566 -19.369 2.993) 23.836 13.015 ( 15.545 -18.455 -12.254) 27.063 14.961 ( 17.761 2.558 13.254) 22.308 15.585 ( -7.293 3.766 -0.213) 8.211 16.370 ( -13.153 -3.347 11.918) 18.062 17.201 ( -14.980 2.047 -7.680) 16.958 17.604 ( -19.034 9.988 -10.111) 23.755 18.165 ( -11.404 11.299 -33.988) 37.589 20.446 ( 5.927 -10.389 23.736) 26.579 21.780 ( 6.551 -5.671 -37.744) 38.726 23.730 ( -7.642 12.811 6.994) 16.475 23.853 ( -2.320 5.383 -0.676) 5.900 24.549 ( 1.136 -2.795 -0.048) 3.017 24.871 ( -2.899 1.379 -13.801) 14.170 25.434 ( -1.681 9.909 8.799) 13.358 25.945 ( -5.925 22.269 -13.749) 26.834 30.369 ( -4.044 -9.051 14.158) 17.284 30.687 ( 2.559 -3.065 -2.231) 4.574 31.850 ( -27.332 -9.600 23.189) 37.107 32.387 ( -12.898 1.245 -2.608) 13.218 34.955 ( 6.389 -6.279 14.922) 17.405 35.396 ( 10.911 2.105 -6.525) 12.886 38.956 ( 12.600 -1.476 23.756) 26.931 40.070 ( 25.163 9.847 -30.452) 40.712 ======================= Grid point 884 (258/343) ======================= q-point: ( 0.46 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.375 ( 21.000 3.695 6.044) 22.163 6.707 ( 17.286 2.828 -10.529) 20.437 8.979 ( 17.199 -5.459 8.958) 20.146 9.083 ( 7.661 2.875 3.260) 8.808 11.558 ( -13.869 -11.505 26.674) 32.191 12.212 ( 7.864 -6.358 13.154) 16.592 12.671 ( 5.879 -14.573 1.983) 15.839 13.429 ( 18.678 -9.641 -13.162) 24.801 15.080 ( 3.033 0.477 10.961) 11.383 15.368 ( -10.470 6.730 17.104) 21.154 16.279 ( -15.446 -4.950 -0.901) 16.244 17.050 ( -6.509 5.577 7.716) 11.533 17.422 ( -5.512 -5.176 -34.217) 35.042 17.909 ( -6.772 8.871 -38.623) 40.203 20.721 ( 11.077 -11.565 29.790) 33.822 21.887 ( 6.927 1.867 -19.129) 20.430 23.492 ( -6.692 4.714 0.105) 8.186 23.718 ( -4.040 7.170 -4.978) 9.618 24.601 ( 2.227 -1.366 -2.076) 3.337 24.787 ( -2.868 4.700 -12.083) 13.279 25.308 ( -3.899 3.273 1.510) 5.310 25.581 ( -6.842 12.072 -10.413) 17.349 30.459 ( -4.194 -6.607 13.250) 15.389 30.743 ( 3.457 0.235 -1.668) 3.846 31.834 ( -15.610 -13.524 21.091) 29.519 32.289 ( -5.264 -0.393 -1.173) 5.407 35.101 ( 6.648 -3.290 13.059) 15.018 35.450 ( 11.307 4.416 -3.652) 12.676 39.043 ( 3.274 0.435 22.363) 22.606 40.079 ( 12.755 11.317 -27.922) 32.717 ======================= Grid point 885 (259/343) ======================= q-point: (-0.46 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.486 ( 23.566 9.092 7.607) 26.380 6.841 ( 25.477 6.476 -9.612) 27.990 9.040 ( 2.379 7.766 6.861) 10.632 9.131 ( 9.948 3.126 2.390) 10.697 11.503 ( -25.245 -3.789 27.309) 37.383 12.270 ( -9.586 0.232 4.246) 10.487 12.796 ( -0.130 2.566 12.028) 12.300 13.678 ( 16.371 0.983 -12.786) 20.796 14.829 ( -28.324 6.889 17.664) 34.084 15.361 ( 2.856 -4.409 7.903) 9.490 16.331 ( -3.969 -14.158 -1.645) 14.796 16.949 ( 1.114 1.716 10.366) 10.566 17.547 ( -2.295 -8.891 -40.126) 41.164 17.766 ( 2.585 3.073 -37.852) 38.064 20.968 ( 13.921 0.385 32.330) 35.202 21.884 ( 7.356 3.459 -3.031) 8.675 23.438 ( -8.215 -1.134 -10.069) 13.045 23.585 ( -1.325 -0.191 -10.281) 10.368 24.601 ( 0.418 3.870 -4.312) 5.810 24.735 ( 0.985 -2.023 -7.798) 8.116 25.221 ( -6.753 0.739 -0.761) 6.836 25.432 ( -4.806 -0.128 -9.055) 10.252 30.513 ( -4.336 -5.210 12.224) 13.977 30.749 ( 2.509 2.287 0.040) 3.395 31.969 ( -5.375 -14.083 17.280) 22.931 32.296 ( 3.348 -1.429 0.809) 3.729 35.188 ( 6.426 0.791 11.851) 13.505 35.477 ( 11.597 5.552 -1.333) 12.927 39.004 ( -5.959 2.745 20.269) 21.305 39.948 ( 0.654 12.298 -25.446) 28.270 ======================= Grid point 886 (260/343) ======================= q-point: (-0.38 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.546 ( 27.870 13.689 11.152) 32.992 6.979 ( 28.327 9.121 -9.029) 31.099 8.878 ( 0.781 13.524 9.681) 16.650 9.080 ( 2.072 9.821 0.016) 10.038 11.156 ( -38.862 8.032 22.385) 45.561 11.950 ( -37.197 10.537 -9.956) 39.922 12.685 ( 8.239 12.888 27.154) 31.166 13.696 ( 11.782 13.697 -12.316) 21.866 14.475 ( -26.119 1.269 22.799) 34.693 15.472 ( -3.032 -8.390 -8.219) 12.130 16.607 ( 10.258 -10.676 7.245) 16.484 17.026 ( 1.318 -10.230 6.162) 12.015 17.626 ( 0.815 -6.966 -30.389) 31.187 17.892 ( 6.755 -8.263 -38.608) 40.056 20.915 ( 9.524 17.703 31.668) 37.509 21.970 ( 11.941 0.919 -10.711) 16.067 23.348 ( -9.819 -4.896 -1.726) 11.107 23.721 ( 2.268 -10.359 -12.388) 16.307 24.544 ( -0.856 1.887 -0.221) 2.084 24.828 ( 3.915 -4.724 -9.525) 11.330 25.164 ( -7.732 -2.598 -0.290) 8.162 25.459 ( -4.275 -8.390 -11.155) 14.598 30.558 ( -1.933 -4.105 11.105) 11.996 30.732 ( 3.292 2.634 2.619) 4.963 32.166 ( -0.556 -12.403 13.562) 18.387 32.394 ( 9.299 -2.581 1.843) 9.825 35.200 ( 6.822 5.293 12.637) 15.305 35.510 ( 14.231 5.123 -0.821) 15.148 38.836 ( -14.633 5.271 17.711) 23.571 39.685 ( -11.037 13.171 -23.220) 28.887 ======================= Grid point 887 (261/343) ======================= q-point: (-0.31 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.588 ( 32.970 16.975 15.712) 40.275 7.081 ( 25.505 10.713 -5.874) 28.280 8.597 ( 1.190 22.140 10.133) 24.378 8.869 ( -2.986 13.526 0.452) 13.859 10.496 ( -48.970 17.843 17.735) 55.055 11.266 ( -50.848 17.458 -15.935) 56.073 12.543 ( 9.777 15.288 28.948) 34.166 13.476 ( 8.522 23.107 -10.629) 26.824 14.304 ( -17.779 -6.285 24.246) 30.716 15.549 ( -3.929 -4.144 -23.082) 23.778 16.764 ( 9.928 2.769 19.494) 22.051 17.347 ( 5.633 -22.498 0.068) 23.193 17.871 ( 8.175 -15.180 -19.135) 25.757 18.101 ( 2.133 -12.267 -33.449) 35.691 20.669 ( 5.801 18.863 27.672) 33.988 21.969 ( 8.958 11.931 -31.570) 34.917 23.483 ( -4.811 -18.292 9.733) 21.271 23.907 ( 3.349 -8.405 -8.449) 12.379 24.515 ( -1.103 0.939 4.000) 4.254 24.937 ( 3.601 -3.528 -10.387) 11.546 25.156 ( -7.935 -5.861 3.002) 10.312 25.635 ( -4.000 -17.491 -14.907) 23.327 30.608 ( 2.765 -1.197 11.123) 11.524 30.746 ( 5.636 0.416 4.863) 7.456 32.348 ( -0.436 -9.616 10.821) 14.483 32.551 ( 9.919 -4.354 0.661) 10.853 35.165 ( 8.853 7.450 16.375) 20.050 35.601 ( 20.873 4.271 -2.852) 21.496 38.546 ( -22.287 7.613 14.783) 27.806 39.295 ( -21.630 14.386 -21.011) 33.411 ======================= Grid point 888 (262/343) ======================= q-point: (-0.23 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.632 ( 36.871 19.138 21.487) 46.770 7.114 ( 16.712 10.571 3.942) 20.164 8.151 ( -6.379 27.528 8.900) 29.626 8.630 ( 5.677 15.580 -2.933) 16.840 9.670 ( -44.669 24.255 13.848) 52.682 10.417 ( -56.115 20.842 -19.709) 63.021 12.361 ( 6.523 16.263 28.137) 33.147 13.159 ( 7.213 22.589 -8.722) 25.266 14.310 ( -10.044 -9.993 19.697) 24.263 15.528 ( -3.393 2.051 -31.714) 31.961 16.789 ( 6.923 2.762 27.232) 28.234 17.797 ( 10.718 -19.791 -0.063) 22.507 18.127 ( 3.660 -7.123 -17.276) 19.042 18.440 ( 2.294 -26.157 -18.671) 32.219 20.434 ( 3.130 14.386 20.915) 25.578 21.803 ( 4.281 14.206 -43.739) 46.187 23.748 ( -1.716 -14.634 7.045) 16.332 24.068 ( 3.603 -6.676 -7.422) 10.613 24.483 ( -1.087 1.598 8.083) 8.311 25.006 ( 3.149 -0.255 -13.561) 13.924 25.234 ( -7.425 -14.079 13.678) 20.986 25.927 ( -4.036 -20.991 -16.211) 26.828 30.651 ( 7.286 1.705 13.770) 15.671 30.831 ( 7.582 -2.275 5.137) 9.437 32.471 ( -2.878 -7.062 8.969) 11.773 32.707 ( 5.189 -4.730 -2.688) 7.519 35.153 ( 12.171 5.800 22.294) 26.054 35.795 ( 30.943 2.449 -7.023) 31.825 38.156 ( -28.249 9.064 11.604) 31.856 38.789 ( -28.821 16.350 -18.209) 37.809 ======================= Grid point 889 (263/343) ======================= q-point: (-0.15 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.667 ( 34.774 19.155 30.099) 49.821 7.030 ( 2.256 13.195 26.788) 29.946 7.652 ( -13.393 15.761 -1.317) 20.724 8.467 ( 18.415 20.451 -5.092) 27.987 8.889 ( -19.692 27.821 0.378) 34.087 9.499 ( -54.935 22.998 -21.831) 63.430 12.135 ( 2.815 16.064 30.610) 34.684 12.904 ( 4.753 14.912 -8.737) 17.924 14.419 ( -4.256 -11.144 11.473) 16.551 15.429 ( -2.039 6.118 -33.245) 33.864 16.825 ( 4.105 -0.558 33.501) 33.757 18.081 ( 8.557 0.656 -16.751) 18.821 18.332 ( -0.759 -19.729 10.533) 22.378 18.916 ( 2.937 -26.008 -14.996) 30.165 20.255 ( 0.873 9.653 13.235) 16.404 21.614 ( 1.461 11.381 -51.190) 52.461 23.909 ( -0.742 -6.850 1.463) 7.044 24.176 ( 1.649 -2.465 -10.879) 11.276 24.445 ( -0.450 1.932 11.977) 12.141 25.008 ( 1.478 2.239 -14.655) 14.899 25.489 ( -3.877 -22.181 20.816) 30.665 26.218 ( -3.218 -17.581 -13.554) 22.431 30.697 ( 7.356 1.787 17.060) 18.665 30.946 ( 6.660 -2.441 4.691) 8.504 32.527 ( -4.445 -4.236 7.555) 9.735 32.801 ( 0.224 -3.671 -6.349) 7.337 35.214 ( 11.743 1.600 28.824) 31.165 36.129 ( 37.123 -1.586 -14.108) 39.745 37.712 ( -30.258 8.821 9.125) 32.812 38.214 ( -25.895 18.951 -14.082) 35.043 ======================= Grid point 890 (264/343) ======================= q-point: (-0.08 0.08 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.628 ( 0.000 20.902 53.613) 57.543 6.708 ( 0.000 8.247 30.665) 31.755 7.495 ( -0.000 -1.667 -10.659) 10.788 8.099 ( 0.000 29.305 11.479) 31.474 8.617 ( 0.000 14.809 -44.057) 46.479 8.645 ( 0.000 26.448 -10.208) 28.349 11.907 ( 0.000 12.372 35.229) 37.338 12.746 ( 0.000 7.536 -9.699) 12.282 14.584 ( -0.000 -10.976 2.100) 11.175 15.298 ( 0.000 8.124 -30.153) 31.228 16.880 ( -0.000 -3.255 37.310) 37.451 18.055 ( 0.000 5.147 -10.528) 11.718 18.649 ( -0.000 -16.291 16.662) 23.303 19.321 ( -0.000 -19.968 -15.219) 25.107 20.130 ( 0.000 5.818 6.783) 8.936 21.463 ( 0.000 7.538 -57.177) 57.671 23.987 ( -0.000 -3.613 -1.983) 4.122 24.186 ( 0.000 1.582 -11.711) 11.817 24.414 ( 0.000 1.542 13.477) 13.565 24.971 ( 0.000 2.879 -13.890) 14.185 25.852 ( -0.000 -22.740 19.992) 30.278 26.433 ( -0.000 -10.023 -8.002) 12.825 30.715 ( 0.000 1.125 18.851) 18.885 31.015 ( -0.000 -1.104 4.069) 4.216 32.547 ( -0.000 -1.797 7.023) 7.249 32.851 ( -0.000 -2.761 -8.419) 8.861 35.283 ( -0.000 -1.137 33.227) 33.247 36.449 ( -0.000 -5.355 -23.577) 24.178 37.369 ( 0.000 6.871 8.990) 11.315 37.745 ( 0.000 18.254 -9.042) 20.371 ======================= Grid point 893 (265/343) ======================= q-point: ( 0.15 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.639 ( 5.335 -0.000 14.159) 15.130 6.145 ( -21.767 0.000 -5.333) 22.410 7.334 ( 29.088 -0.000 30.889) 42.430 8.463 ( 24.606 -0.000 -16.929) 29.867 9.690 ( 69.488 -0.000 20.345) 72.405 10.541 ( 55.034 -0.000 -20.469) 58.718 11.534 ( -6.349 0.000 33.563) 34.158 12.287 ( -12.782 0.000 -10.031) 16.248 15.029 ( 8.453 -0.000 -7.136) 11.062 15.320 ( 11.958 -0.000 -19.981) 23.286 16.569 ( -17.847 0.000 42.221) 45.838 17.574 ( -17.221 0.000 -0.518) 17.229 18.611 ( -16.849 0.000 10.597) 19.905 19.110 ( -24.682 0.000 -13.584) 28.173 20.183 ( 2.670 -0.000 -1.593) 3.109 21.369 ( 3.182 -0.000 -60.859) 60.942 24.043 ( -2.990 0.000 0.583) 3.046 24.177 ( 3.226 -0.000 -8.569) 9.156 24.349 ( -1.252 0.000 7.895) 7.994 24.805 ( -4.619 0.000 -12.104) 12.955 26.678 ( 8.087 -0.000 10.698) 13.411 26.744 ( 8.523 -0.000 7.966) 11.666 30.064 ( -18.020 0.000 13.466) 22.495 30.447 ( -17.099 0.000 -4.141) 17.593 32.403 ( -41.078 0.000 19.470) 45.459 32.801 ( -11.895 0.000 0.372) 11.900 34.541 ( -5.954 0.000 19.323) 20.219 35.196 ( 3.396 -0.000 -13.769) 14.182 38.395 ( 33.071 -0.000 26.067) 42.109 39.671 ( 54.687 -0.000 -37.050) 66.056 ======================= Grid point 894 (266/343) ======================= q-point: ( 0.23 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.794 ( 18.306 -3.708 6.429) 19.753 6.107 ( -8.238 -12.363 -5.887) 15.980 7.674 ( 34.540 -3.471 31.954) 47.182 8.729 ( 27.925 -0.202 -15.054) 31.725 10.413 ( 59.565 -8.319 18.961) 63.062 11.084 ( 35.863 -8.897 -13.033) 39.181 11.535 ( -2.658 -6.160 28.346) 29.129 12.235 ( -1.269 -4.374 -11.776) 12.626 15.073 ( 11.443 5.092 -1.929) 12.672 15.483 ( 11.480 -3.949 -19.315) 22.813 16.386 ( -17.956 -0.049 41.124) 44.873 17.405 ( -21.202 -1.835 -1.427) 21.329 18.364 ( -20.323 7.358 5.459) 22.293 18.821 ( -26.804 3.725 -16.127) 31.503 20.194 ( 0.819 0.172 2.106) 2.266 21.435 ( 5.218 -2.998 -58.866) 59.172 24.000 ( -4.075 0.962 3.385) 5.384 24.187 ( 2.076 2.495 -6.564) 7.323 24.363 ( -0.836 -2.891 4.173) 5.145 24.781 ( -4.705 -2.657 -12.282) 13.418 26.473 ( 2.183 22.155 17.776) 28.489 26.860 ( 4.383 2.898 -0.389) 5.268 29.957 ( -11.476 -5.147 13.825) 18.690 30.366 ( -10.236 -6.862 -5.008) 13.302 31.971 ( -44.958 -0.793 25.328) 51.608 32.606 ( -25.528 -0.030 -4.834) 25.982 34.592 ( 8.891 -3.124 20.248) 22.333 35.306 ( 16.200 0.023 -15.450) 22.386 38.706 ( 28.683 -0.311 30.296) 41.721 40.128 ( 44.775 4.166 -39.982) 60.172 ======================= Grid point 895 (267/343) ======================= q-point: ( 0.31 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.090 ( 25.235 -5.226 2.941) 25.937 6.339 ( 8.815 -13.360 -8.167) 17.969 8.129 ( 35.828 -9.459 30.139) 47.764 8.996 ( 27.516 1.481 -10.035) 29.326 10.997 ( 21.414 -9.085 16.809) 28.700 11.462 ( 4.437 -13.887 -2.391) 14.774 11.742 ( 18.280 -11.421 19.729) 29.221 12.486 ( 25.325 -11.441 -14.497) 31.343 15.105 ( 12.577 5.196 5.638) 14.729 15.622 ( 5.207 -1.155 -11.137) 12.349 16.250 ( -13.494 -2.801 31.333) 34.230 17.208 ( -23.891 -1.321 -4.540) 24.355 17.993 ( -22.022 11.346 -0.116) 24.773 18.482 ( -24.383 6.210 -23.052) 34.125 20.220 ( 0.869 -3.117 10.117) 10.622 21.570 ( 7.755 -5.539 -54.717) 55.541 23.928 ( -5.602 2.247 5.372) 8.081 24.127 ( 0.661 6.507 -3.628) 7.479 24.416 ( -1.102 -4.336 1.775) 4.813 24.797 ( -3.943 -4.210 -12.864) 14.098 26.054 ( -4.144 25.230 20.508) 32.777 26.693 ( -2.756 17.503 -9.451) 20.082 30.015 ( -4.298 -10.465 16.310) 19.850 30.458 ( -1.591 -10.115 -4.479) 11.176 31.595 ( -39.596 -4.915 27.300) 48.345 32.353 ( -27.867 -2.349 -8.279) 29.166 34.774 ( 14.376 -4.023 20.114) 25.049 35.472 ( 19.916 2.161 -14.648) 24.817 38.952 ( 21.905 0.889 31.950) 38.748 40.406 ( 33.963 8.783 -39.620) 52.919 ======================= Grid point 896 (268/343) ======================= q-point: ( 0.38 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.428 ( 29.468 -2.279 2.472) 29.660 6.674 ( 24.209 -6.457 -9.389) 26.757 8.659 ( 33.503 -11.786 23.205) 42.424 9.200 ( 23.307 4.462 -3.419) 23.975 11.143 ( -14.767 -9.719 18.707) 25.739 11.728 ( -6.833 -20.286 -3.294) 21.658 12.205 ( 31.536 -10.618 17.898) 37.783 13.007 ( 32.677 -13.527 -14.966) 38.402 15.140 ( 7.586 3.170 11.715) 14.312 15.576 ( -8.474 4.960 10.743) 14.554 16.190 ( -12.262 -2.471 10.535) 16.354 17.023 ( -17.141 -2.960 -8.207) 19.234 17.600 ( -17.784 10.640 -7.481) 22.033 18.165 ( -18.195 6.113 -32.108) 37.407 20.341 ( 4.201 -9.080 19.638) 22.039 21.767 ( 11.024 -6.840 -47.831) 49.559 23.795 ( -8.518 6.571 7.415) 13.066 23.985 ( -0.327 10.053 -1.837) 10.225 24.480 ( -1.705 -4.936 2.189) 5.663 24.830 ( -2.703 -3.104 -13.144) 13.774 25.620 ( -7.376 18.418 15.360) 25.091 26.273 ( -8.181 24.669 -14.071) 29.554 30.171 ( -2.246 -10.476 18.117) 21.048 30.631 ( 3.958 -8.145 -4.231) 9.995 31.386 ( -29.102 -11.198 27.164) 41.355 32.171 ( -22.024 -5.937 -9.578) 24.739 34.981 ( 14.497 -3.308 18.885) 24.037 35.609 ( 19.333 4.789 -12.368) 23.445 39.099 ( 13.818 2.777 31.740) 34.729 40.507 ( 23.393 12.813 -37.257) 45.820 ======================= Grid point 897 (269/343) ======================= q-point: ( 0.46 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.727 ( 33.557 3.665 4.120) 34.007 7.006 ( 34.123 1.412 -9.409) 35.425 9.114 ( 27.692 -4.973 12.112) 30.631 9.294 ( 17.019 8.066 1.761) 18.916 11.143 ( -23.749 -14.004 25.896) 37.824 11.970 ( -13.458 -18.834 -7.086) 24.208 12.638 ( 25.250 -7.306 19.069) 32.474 13.501 ( 26.585 -9.589 -15.943) 32.449 15.068 ( -15.382 6.045 12.644) 20.809 15.372 ( -8.790 3.720 26.654) 28.312 16.037 ( -21.026 -0.955 -3.098) 21.275 16.992 ( -5.093 -3.911 -0.106) 6.422 17.369 ( -2.975 2.662 -25.891) 26.197 17.931 ( -11.308 4.561 -37.770) 39.690 20.615 ( 10.950 -14.937 27.361) 33.040 21.989 ( 14.298 -3.483 -34.731) 37.720 23.531 ( -11.600 11.275 8.010) 18.051 23.816 ( -2.572 8.776 -3.811) 9.907 24.548 ( -1.631 -5.258 2.542) 6.064 24.828 ( -1.324 1.517 -12.041) 12.208 25.331 ( -7.794 7.502 5.118) 11.968 25.780 ( -9.893 21.832 -14.070) 27.793 30.284 ( -6.108 -8.012 19.213) 21.694 30.765 ( 4.024 -2.453 -5.443) 7.200 31.412 ( -15.102 -17.845 25.860) 34.860 32.130 ( -11.263 -8.680 -8.821) 16.733 35.159 ( 12.879 -1.732 16.999) 21.397 35.689 ( 16.996 6.885 -9.349) 20.583 39.128 ( 5.163 4.935 30.291) 31.122 40.446 ( 13.520 16.076 -34.038) 39.997 ======================= Grid point 898 (270/343) ======================= q-point: ( 0.54 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.964 ( 37.802 9.839 6.804) 39.650 7.285 ( 37.721 7.681 -8.180) 39.354 9.270 ( 12.385 11.379 5.248) 17.618 9.339 ( 18.404 5.335 2.064) 19.272 11.115 ( -28.100 -10.963 29.500) 42.190 12.019 ( -25.250 -7.954 -8.939) 27.942 12.918 ( 17.844 0.128 21.919) 28.264 13.824 ( 17.322 -3.233 -14.935) 23.099 14.676 ( -29.254 9.040 20.213) 36.689 15.266 ( -13.181 -1.187 12.158) 17.971 15.981 ( -12.034 -15.828 0.943) 19.906 16.997 ( 2.409 1.168 7.543) 8.004 17.418 ( 1.014 -5.400 -41.642) 42.003 17.805 ( -2.194 1.463 -37.232) 37.325 21.026 ( 19.252 -14.674 31.047) 39.368 22.094 ( 12.965 8.491 -8.770) 17.807 23.310 ( -11.038 -0.718 -5.607) 12.402 23.624 ( -6.384 8.827 -9.868) 14.698 24.623 ( -0.632 -4.765 1.241) 4.964 24.752 ( -0.260 5.670 -7.556) 9.450 25.186 ( -6.936 2.622 -2.709) 7.895 25.421 ( -8.820 8.875 -12.196) 17.473 30.340 ( -8.015 -7.804 18.830) 21.902 30.799 ( 1.616 0.858 -4.354) 4.722 31.637 ( -4.517 -19.034 22.081) 29.500 32.222 ( -0.855 -8.845 -6.997) 11.311 35.288 ( 11.250 0.468 14.949) 18.715 35.721 ( 14.676 7.577 -6.218) 17.648 39.035 ( -3.440 7.221 28.075) 29.192 40.244 ( 4.563 18.799 -30.669) 36.260 ======================= Grid point 899 (271/343) ======================= q-point: (-0.38 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.144 ( 41.190 15.053 9.769) 44.929 7.481 ( 34.963 12.030 -5.028) 37.315 9.171 ( 11.995 14.457 6.319) 19.819 9.321 ( 9.411 12.693 -0.300) 15.804 10.874 ( -37.050 2.842 23.444) 43.936 11.703 ( -41.248 6.448 -12.127) 43.475 12.978 ( 12.575 9.635 27.265) 31.533 13.944 ( 6.715 2.962 -6.815) 10.016 14.295 ( -20.161 6.640 18.250) 27.993 15.228 ( -12.535 -11.431 -1.535) 17.034 16.300 ( -1.036 -27.619 3.696) 27.884 17.009 ( 4.740 2.096 9.842) 11.123 17.487 ( -3.806 -6.003 -41.564) 42.167 17.861 ( 5.885 -4.539 -36.180) 36.936 21.325 ( 20.880 9.738 31.805) 39.273 22.079 ( 11.078 -0.590 7.123) 13.183 23.225 ( -12.764 3.728 -12.707) 18.392 23.529 ( -4.495 -9.612 -18.096) 20.978 24.613 ( 1.163 5.525 -0.296) 5.654 24.753 ( -0.260 -6.319 -0.513) 6.345 25.092 ( -4.491 1.419 -7.279) 8.670 25.303 ( -7.830 -2.864 -12.183) 14.763 30.406 ( -5.871 -8.660 17.229) 20.157 30.795 ( 1.944 1.140 -1.701) 2.823 31.912 ( -0.863 -16.379 18.245) 24.533 32.382 ( 4.956 -7.377 -5.737) 10.578 35.359 ( 9.732 3.609 13.934) 17.375 35.748 ( 14.475 5.558 -4.184) 16.060 38.822 ( -11.303 9.616 25.471) 29.479 39.916 ( -3.074 21.297 -27.448) 34.877 ======================= Grid point 900 (272/343) ======================= q-point: (-0.31 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.272 ( 40.991 18.369 12.439) 46.609 7.562 ( 27.384 14.970 1.081) 31.227 8.974 ( -0.323 21.189 7.693) 22.545 9.166 ( 15.652 16.206 3.104) 22.744 10.326 ( -39.941 14.603 12.249) 44.256 11.045 ( -51.023 16.245 -17.059) 56.198 12.879 ( 8.538 14.130 29.499) 33.805 13.881 ( 5.652 12.675 -6.192) 15.196 14.060 ( -14.035 0.026 23.335) 27.231 15.363 ( -5.719 -12.976 -14.877) 20.553 16.790 ( 6.930 -22.623 6.976) 24.667 17.022 ( -0.853 -4.964 9.400) 10.664 17.628 ( -0.504 -14.948 -30.101) 33.612 18.007 ( 4.387 -5.812 -36.548) 37.266 21.123 ( 9.642 25.982 30.944) 41.540 22.270 ( 17.510 5.752 -14.909) 23.706 23.101 ( -15.017 -13.443 5.191) 20.813 23.732 ( -0.674 -14.134 -16.428) 21.682 24.548 ( 1.028 3.451 5.657) 6.706 24.865 ( -1.200 -6.895 0.262) 7.004 25.059 ( -1.212 -0.463 -11.089) 11.164 25.344 ( -6.337 -11.088 -14.304) 19.176 30.514 ( -2.049 -8.814 15.459) 17.913 30.810 ( 3.708 0.335 1.782) 4.128 32.146 ( -1.058 -12.669 14.829) 19.533 32.547 ( 5.605 -5.758 -5.837) 9.932 35.361 ( 7.837 6.113 16.199) 19.005 35.844 ( 17.194 1.231 -5.610) 18.128 38.500 ( -17.193 12.076 22.913) 31.087 39.484 ( -8.308 23.749 -24.358) 35.020 ======================= Grid point 901 (273/343) ======================= q-point: (-0.23 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.301 ( 23.749 18.338 14.904) 33.503 7.561 ( 31.637 17.492 8.418) 37.118 8.411 ( -27.854 28.094 19.255) 43.998 9.118 ( 28.467 17.568 2.632) 33.555 9.721 ( -18.692 21.011 -2.887) 28.270 10.226 ( -51.321 20.054 -20.393) 58.752 12.686 ( 4.015 16.259 29.092) 33.569 13.605 ( 3.872 23.578 -11.485) 26.511 14.060 ( -6.649 -9.866 28.853) 31.209 15.482 ( -2.054 -5.090 -27.597) 28.138 16.903 ( 3.828 4.600 21.209) 22.037 17.413 ( 1.421 -30.721 3.305) 30.931 17.973 ( 2.507 -24.135 -19.593) 31.188 18.121 ( 0.193 -5.191 -33.661) 34.059 20.774 ( 3.456 22.286 27.136) 35.284 22.132 ( 5.640 19.296 -37.518) 42.565 23.391 ( -3.394 -25.486 15.609) 30.078 23.942 ( 0.519 -10.954 -12.075) 16.312 24.509 ( 0.152 2.260 10.058) 10.310 24.963 ( -1.197 -7.625 4.885) 9.134 25.061 ( -0.851 -0.479 -12.606) 12.644 25.555 ( -2.871 -18.992 -16.953) 25.619 30.644 ( 0.935 -6.797 14.497) 16.038 30.856 ( 3.843 -1.378 5.166) 6.584 32.311 ( -1.754 -8.992 11.585) 14.770 32.673 ( 2.662 -4.292 -6.915) 8.563 35.329 ( 5.595 5.223 21.678) 22.990 36.038 ( 17.545 -3.374 -11.153) 21.062 38.102 ( -17.512 14.389 21.003) 30.901 38.982 ( -8.726 25.825 -21.152) 34.504 ======================= Grid point 902 (274/343) ======================= q-point: (-0.15 0.15 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.124 ( 0.000 15.797 18.524) 24.345 7.573 ( 0.000 34.217 45.449) 56.890 7.650 ( 0.000 9.896 -7.764) 12.578 9.000 ( 0.000 21.068 16.334) 26.658 9.298 ( 0.000 24.979 -38.238) 45.674 9.500 ( 0.000 22.968 -8.004) 24.322 12.427 ( 0.000 16.984 28.886) 33.509 13.236 ( 0.000 21.905 -9.530) 23.888 14.209 ( -0.000 -11.285 21.263) 24.073 15.492 ( 0.000 2.151 -33.693) 33.762 16.860 ( 0.000 2.454 27.942) 28.050 17.911 ( -0.000 -27.262 8.711) 28.620 18.151 ( -0.000 -0.200 -28.363) 28.363 18.458 ( -0.000 -29.414 -15.071) 33.050 20.472 ( 0.000 15.811 20.715) 26.060 21.853 ( 0.000 16.220 -44.982) 47.817 23.729 ( -0.000 -15.466 7.759) 17.303 24.102 ( -0.000 -7.504 -11.468) 13.705 24.474 ( 0.000 1.940 12.515) 12.665 25.045 ( 0.000 1.211 -15.202) 15.250 25.147 ( -0.000 -15.519 15.785) 22.136 25.880 ( -0.000 -20.686 -16.683) 26.574 30.729 ( -0.000 -2.085 15.403) 15.544 30.921 ( -0.000 -3.591 6.392) 7.332 32.423 ( -0.000 -6.003 8.811) 10.662 32.746 ( -0.000 -3.372 -7.593) 8.309 35.296 ( 0.000 2.506 27.251) 27.366 36.238 ( -0.000 -6.688 -17.730) 18.949 37.744 ( 0.000 14.815 18.812) 23.945 38.495 ( 0.000 25.831 -17.425) 31.159 ======================= Grid point 907 (275/343) ======================= q-point: ( 0.23 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.966 ( 4.022 -0.000 3.182) 5.129 6.021 ( 31.733 -0.000 -2.903) 31.866 8.007 ( 37.597 -0.000 29.874) 48.021 9.033 ( 32.576 -0.000 -15.662) 36.146 10.842 ( 34.446 -0.000 16.279) 38.099 11.215 ( 4.388 -0.000 -4.958) 6.621 11.535 ( 18.305 -0.000 25.199) 31.146 12.297 ( 22.979 -0.000 -16.469) 28.271 15.220 ( 9.535 -0.000 0.104) 9.536 15.573 ( 12.639 -0.000 -15.218) 19.782 16.209 ( -16.569 0.000 41.519) 44.703 17.169 ( -23.805 0.000 0.191) 23.805 18.225 ( -21.091 0.000 -0.307) 21.093 18.557 ( -31.112 0.000 -15.628) 34.817 20.188 ( -2.484 0.000 2.709) 3.675 21.469 ( 6.948 -0.000 -59.994) 60.395 23.965 ( -4.673 0.000 5.869) 7.502 24.237 ( 2.647 -0.000 -10.086) 10.428 24.320 ( -1.922 0.000 5.120) 5.469 24.709 ( -4.893 0.000 -11.505) 12.503 26.747 ( -1.816 0.000 12.592) 12.723 26.833 ( -0.327 0.000 8.447) 8.454 29.835 ( -4.548 0.000 11.564) 12.426 30.209 ( -6.919 0.000 -4.457) 8.230 31.518 ( -43.580 0.000 27.436) 51.497 32.302 ( -33.556 0.000 -9.114) 34.771 34.706 ( 17.775 -0.000 22.282) 28.503 35.513 ( 23.646 -0.000 -18.069) 29.760 38.975 ( 25.456 -0.000 35.084) 43.347 40.566 ( 36.481 -0.000 -43.703) 56.928 ======================= Grid point 908 (276/343) ======================= q-point: ( 0.31 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.158 ( 17.394 -9.951 6.758) 21.148 6.420 ( 38.561 -5.094 -8.271) 39.765 8.400 ( 37.572 -3.030 28.758) 47.412 9.337 ( 32.680 2.691 -13.363) 35.409 10.988 ( -3.805 -0.802 13.115) 13.679 11.213 ( -13.489 -8.301 -0.096) 15.839 11.920 ( 43.128 -5.672 19.127) 47.519 12.656 ( 36.354 -6.097 -16.458) 40.369 15.259 ( 3.096 2.933 9.977) 10.851 15.675 ( 5.633 0.946 -5.309) 7.798 16.102 ( -6.641 -1.769 30.033) 30.809 16.941 ( -24.777 -1.789 -2.876) 25.007 17.945 ( -20.908 8.334 -5.572) 23.187 18.259 ( -29.148 -0.699 -19.612) 35.138 20.164 ( -3.989 -1.974 8.583) 9.668 21.575 ( 8.772 -3.529 -58.999) 59.752 23.908 ( -4.865 1.372 7.363) 8.931 24.221 ( 1.128 3.729 -7.269) 8.247 24.333 ( -2.470 -3.300 1.791) 4.495 24.690 ( -4.330 -3.230 -11.446) 12.657 26.420 ( -7.151 24.133 19.013) 31.544 26.844 ( -5.654 4.245 -0.898) 7.127 29.861 ( 1.062 -5.138 14.151) 15.092 30.260 ( -2.109 -10.606 -1.322) 10.894 31.154 ( -34.636 -3.261 24.990) 42.835 31.994 ( -33.031 -3.281 -12.051) 35.314 34.905 ( 19.472 -1.148 23.121) 30.250 35.736 ( 24.650 2.305 -18.525) 30.921 39.187 ( 20.191 1.805 37.289) 42.443 40.834 ( 27.568 5.636 -44.080) 52.296 ======================= Grid point 909 (277/343) ======================= q-point: ( 0.38 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.584 ( 28.406 -12.366 6.793) 31.717 6.912 ( 42.530 -5.140 -10.155) 44.026 8.846 ( 34.836 -7.746 26.207) 44.276 9.564 ( 28.728 6.866 -7.476) 30.469 10.874 ( -18.670 -1.183 11.979) 22.214 11.287 ( -14.657 -17.000 -3.699) 22.749 12.429 ( 38.255 -5.421 17.523) 42.425 13.150 ( 34.790 -9.776 -15.161) 39.189 15.185 ( -8.681 2.339 20.102) 22.021 15.589 ( -10.180 7.268 18.410) 22.258 16.088 ( -4.387 1.277 3.807) 5.947 16.797 ( -13.371 -5.838 -8.395) 16.832 17.599 ( -16.016 8.981 -10.009) 20.912 18.018 ( -21.045 -0.020 -27.490) 34.621 20.211 ( -1.748 -8.134 17.871) 19.713 21.760 ( 11.184 -7.032 -55.602) 57.150 23.816 ( -5.349 4.181 8.138) 10.598 24.135 ( -0.072 7.694 -6.401) 10.009 24.366 ( -4.153 -4.711 3.283) 7.087 24.726 ( -3.244 -5.247 -11.805) 13.320 25.905 ( -9.928 25.518 20.276) 34.071 26.564 ( -9.249 19.236 -10.373) 23.731 29.998 ( 0.178 -8.449 19.992) 21.705 30.467 ( -0.133 -14.490 3.934) 15.015 30.973 ( -20.218 -7.653 17.937) 28.091 31.796 ( -26.485 -9.084 -13.643) 31.146 35.108 ( 17.629 -1.040 22.637) 28.710 35.905 ( 22.322 5.405 -17.274) 28.738 39.302 ( 13.773 4.679 37.603) 40.319 40.921 ( 19.145 11.216 -42.172) 47.653 ======================= Grid point 910 (278/343) ======================= q-point: ( 0.46 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.067 ( 36.905 -5.804 6.249) 37.878 7.393 ( 43.206 -1.273 -9.690) 44.298 9.312 ( 29.939 -8.317 18.754) 36.294 9.664 ( 22.901 11.295 -1.284) 25.567 10.716 ( -23.256 -5.682 18.120) 30.025 11.461 ( -17.529 -21.261 -10.657) 29.544 12.830 ( 29.407 -3.147 18.827) 35.059 13.615 ( 27.009 -8.444 -15.708) 32.365 14.985 ( -22.777 6.064 17.608) 29.421 15.294 ( -20.638 5.056 39.547) 44.894 15.889 ( -18.548 7.290 -13.018) 23.804 16.882 ( 3.311 -7.684 -8.278) 11.770 17.395 ( -3.758 3.438 -19.452) 20.107 17.852 ( -11.990 0.336 -32.915) 35.032 20.428 ( 4.493 -16.747 26.820) 31.937 22.024 ( 14.357 -9.250 -48.671) 51.581 23.631 ( -7.991 11.460 10.130) 17.257 23.962 ( -1.989 11.241 -5.283) 12.579 24.413 ( -5.010 -6.414 6.142) 10.196 24.788 ( -1.527 -4.516 -12.024) 12.934 25.445 ( -9.296 17.041 12.987) 23.355 26.085 ( -9.807 25.222 -14.851) 30.869 30.088 ( -7.654 -6.936 24.615) 26.695 30.711 ( 3.167 -10.550 -1.414) 11.105 31.001 ( -9.873 -14.007 19.348) 25.846 31.801 ( -13.933 -15.268 -13.373) 24.619 35.279 ( 14.515 -0.444 20.940) 25.483 35.992 ( 18.336 8.059 -14.755) 24.877 39.299 ( 6.927 7.889 36.692) 38.164 40.844 ( 11.648 16.086 -39.129) 43.881 ======================= Grid point 911 (279/343) ======================= q-point: ( 0.54 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.476 ( 41.350 3.130 6.746) 42.013 7.777 ( 39.569 4.563 -7.240) 40.484 9.604 ( 16.219 6.151 7.155) 18.764 9.685 ( 26.147 10.779 0.476) 28.285 10.628 ( -25.595 -12.098 27.308) 39.335 11.567 ( -26.364 -14.567 -12.747) 32.707 13.118 ( 22.688 -0.306 20.168) 30.358 13.925 ( 14.841 -2.915 -13.401) 20.207 14.554 ( -28.088 9.824 19.379) 35.510 15.062 ( -24.757 -0.601 26.877) 36.547 15.654 ( -15.623 -5.257 -4.605) 17.115 17.032 ( 7.307 -2.792 -6.024) 9.873 17.370 ( -1.085 -1.172 -33.598) 33.636 17.783 ( -2.262 -0.966 -32.572) 32.664 20.854 ( 12.489 -23.941 31.757) 41.686 22.313 ( 17.751 -3.960 -32.250) 37.024 23.285 ( -13.403 14.348 8.832) 21.529 23.741 ( -4.842 11.728 -8.018) 15.009 24.484 ( -4.336 -7.655 6.991) 11.238 24.827 ( 1.334 0.392 -10.104) 10.199 25.170 ( -8.008 6.172 1.597) 10.236 25.596 ( -7.892 21.321 -15.200) 27.348 30.117 ( -9.638 -7.857 25.017) 27.937 30.804 ( -0.377 -0.992 -9.058) 9.119 31.265 ( -1.604 -21.806 24.555) 32.879 31.995 ( -2.503 -16.229 -11.665) 20.142 35.408 ( 11.375 0.213 18.276) 21.528 36.003 ( 13.850 9.243 -11.444) 20.204 39.177 ( 0.404 11.069 35.066) 36.774 40.624 ( 5.288 20.179 -35.735) 41.378 ======================= Grid point 912 (280/343) ======================= q-point: (-0.38 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.765 ( 38.925 9.983 7.611) 40.899 8.003 ( 31.529 10.154 -2.452) 33.214 9.549 ( 11.598 13.581 6.153) 18.890 9.717 ( 23.426 16.229 -0.644) 28.505 10.530 ( -27.943 -4.439 22.523) 36.164 11.361 ( -39.779 0.513 -12.573) 41.722 13.249 ( 14.301 7.227 23.327) 28.300 13.932 ( -11.633 2.876 14.871) 19.099 14.308 ( 0.257 2.938 -3.307) 4.431 14.882 ( -20.615 -9.117 8.155) 23.971 15.808 ( -6.417 -24.377 5.230) 25.745 17.109 ( 7.034 1.979 1.190) 7.403 17.372 ( -4.809 -2.925 -44.160) 44.517 17.838 ( 3.643 -3.919 -31.919) 32.364 21.429 ( 19.963 -23.980 32.071) 44.744 22.321 ( 7.548 20.716 12.268) 25.232 23.109 ( -7.057 -8.695 -20.982) 23.783 23.461 ( -9.588 12.484 -15.637) 22.188 24.581 ( -2.623 -8.108 5.499) 10.142 24.779 ( 2.522 7.502 -2.114) 8.192 25.066 ( -5.388 -0.988 -8.773) 10.343 25.271 ( -5.395 9.420 -14.351) 17.995 30.182 ( -6.737 -9.947 23.105) 26.042 30.804 ( -0.657 -0.573 -7.044) 7.098 31.614 ( 0.756 -19.548 22.037) 29.467 32.247 ( 2.416 -13.268 -10.192) 16.904 35.493 ( 8.423 1.433 15.403) 17.614 35.974 ( 10.025 7.535 -8.216) 14.992 38.944 ( -4.713 14.081 33.088) 36.268 40.286 ( 0.474 23.600 -32.352) 40.048 ======================= Grid point 913 (281/343) ======================= q-point: (-0.31 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.864 ( 20.157 14.564 9.503) 26.622 8.089 ( 27.685 13.226 0.280) 30.683 9.317 ( -2.749 22.725 18.578) 29.481 9.668 ( 23.616 17.078 6.558) 29.873 10.235 ( -14.853 9.524 -0.334) 17.647 10.812 ( -45.402 13.080 -17.043) 50.229 13.175 ( 6.054 12.694 27.167) 30.592 13.807 ( -9.290 -3.275 33.025) 34.462 14.236 ( 3.814 11.597 -16.136) 20.234 15.014 ( -6.849 -20.432 -1.386) 21.594 16.270 ( -1.297 -33.972 3.161) 34.143 17.098 ( 3.133 5.237 9.491) 11.284 17.419 ( -2.370 -8.302 -42.892) 43.752 17.951 ( 2.648 -5.314 -34.178) 34.690 21.694 ( 13.167 27.842 31.526) 44.073 22.252 ( 4.910 -25.126 24.212) 35.237 22.989 ( -8.642 18.496 -22.395) 30.304 23.440 ( -3.285 -18.160 -24.916) 31.006 24.648 ( 2.119 5.755 4.289) 7.483 24.717 ( -2.543 -6.993 4.078) 8.486 25.073 ( 2.080 -0.681 -13.993) 14.163 25.157 ( -6.214 -2.325 -14.395) 15.850 30.315 ( -2.676 -11.353 20.412) 23.510 30.820 ( 0.594 -1.307 -3.384) 3.675 31.911 ( 0.252 -15.446 18.983) 24.474 32.463 ( 2.475 -9.412 -9.408) 13.536 35.512 ( 4.597 4.303 14.625) 15.923 35.978 ( 7.176 1.609 -7.358) 10.403 38.629 ( -6.317 16.711 30.944) 35.730 39.861 ( -1.857 26.289 -28.998) 39.185 ======================= Grid point 914 (282/343) ======================= q-point: (-0.23 0.23 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.689 ( 0.000 17.038 12.999) 21.430 8.053 ( 0.000 12.770 -4.692) 13.605 8.764 ( 0.000 34.780 36.201) 50.201 9.544 ( 0.000 14.132 14.300) 20.105 10.075 ( 0.000 12.291 -11.955) 17.146 10.153 ( 0.000 23.720 -28.719) 37.249 12.969 ( 0.000 15.101 29.015) 32.709 13.867 ( -0.000 -8.430 35.277) 36.270 13.991 ( 0.000 19.525 -15.084) 24.673 15.301 ( -0.000 -15.372 -15.655) 21.940 16.856 ( -0.000 -35.584 1.585) 35.619 17.015 ( 0.000 5.974 14.992) 16.139 17.619 ( -0.000 -17.301 -30.497) 35.063 18.052 ( -0.000 -4.953 -35.618) 35.961 21.227 ( 0.000 29.531 30.792) 42.665 22.536 ( 0.000 24.072 -32.547) 40.482 22.861 ( -0.000 -33.758 24.195) 41.533 23.721 ( -0.000 -15.726 -17.945) 23.861 24.564 ( 0.000 4.324 8.824) 9.827 24.834 ( -0.000 -7.180 2.928) 7.754 25.072 ( 0.000 1.210 -15.177) 15.225 25.266 ( -0.000 -13.260 -15.825) 20.646 30.492 ( -0.000 -10.814 17.422) 20.505 30.850 ( -0.000 -1.508 1.150) 1.896 32.135 ( -0.000 -11.607 15.362) 19.254 32.603 ( -0.000 -6.065 -8.758) 10.653 35.447 ( 0.000 5.771 17.780) 18.693 36.046 ( -0.000 -3.953 -10.201) 10.940 38.299 ( 0.000 17.851 27.988) 33.197 39.396 ( 0.000 27.633 -25.391) 37.527 ======================= Grid point 921 (283/343) ======================= q-point: ( 0.31 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.276 ( 26.170 -0.000 15.115) 30.222 6.795 ( 44.908 -0.000 -13.457) 46.881 8.722 ( 32.014 -0.000 27.269) 42.054 9.679 ( 30.395 -0.000 -15.153) 33.963 10.938 ( -7.003 0.000 9.325) 11.662 10.967 ( -18.581 0.000 0.920) 18.603 12.322 ( 45.096 -0.000 16.882) 48.153 12.967 ( 36.434 -0.000 -15.242) 39.494 15.235 ( -12.345 0.000 24.273) 27.232 15.725 ( -0.956 0.000 1.919) 2.144 16.103 ( 9.638 -0.000 19.756) 21.982 16.679 ( -23.604 0.000 -8.395) 25.052 17.857 ( -14.468 0.000 -11.674) 18.590 17.925 ( -31.889 0.000 -17.198) 36.231 20.083 ( -8.002 0.000 11.940) 14.373 21.632 ( 9.318 -0.000 -61.343) 62.047 23.876 ( -3.985 0.000 8.554) 9.437 24.262 ( -4.302 0.000 5.484) 6.970 24.273 ( 1.029 -0.000 -12.624) 12.665 24.620 ( -4.090 0.000 -10.658) 11.416 26.623 ( -9.497 0.000 13.863) 16.804 26.738 ( -8.198 0.000 7.936) 11.410 29.868 ( 6.528 -0.000 11.264) 13.019 30.115 ( -5.866 0.000 8.522) 10.346 30.837 ( -22.903 0.000 16.063) 27.974 31.641 ( -31.751 0.000 -14.220) 34.790 35.092 ( 19.487 -0.000 25.091) 31.770 36.002 ( 24.473 -0.000 -20.596) 31.986 39.387 ( 16.656 -0.000 40.066) 43.390 41.119 ( 20.594 -0.000 -45.533) 49.974 ======================= Grid point 922 (284/343) ======================= q-point: ( 0.38 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.674 ( 33.978 -11.388 17.827) 40.025 7.280 ( 46.399 -3.543 -14.806) 48.832 9.021 ( 20.235 -5.177 26.125) 33.448 9.910 ( 20.894 2.637 -12.809) 24.649 10.766 ( -9.501 4.255 4.713) 11.427 10.950 ( -8.500 -7.349 -1.229) 11.303 12.751 ( 37.892 -1.408 16.847) 41.493 13.354 ( 32.341 -5.364 -13.459) 35.438 15.056 ( -21.045 0.700 32.302) 38.559 15.582 ( -17.891 7.055 21.173) 28.604 16.164 ( 4.054 7.542 -4.660) 9.748 16.577 ( -5.731 -9.154 -12.503) 16.522 17.564 ( -18.623 5.797 -13.679) 23.823 17.794 ( -13.758 -3.682 -20.210) 24.724 20.042 ( -8.105 -5.846 19.711) 22.100 21.764 ( 9.972 -4.604 -61.179) 62.157 23.827 ( -3.008 2.012 8.795) 9.511 24.214 ( -2.924 1.230 0.296) 3.185 24.271 ( -2.678 -0.189 -6.572) 7.100 24.614 ( -3.484 -3.719 -10.688) 11.841 26.238 ( -9.980 24.807 19.462) 33.072 26.682 ( -9.467 4.785 -1.430) 10.704 29.920 ( 0.998 -1.030 19.321) 19.374 30.184 ( -5.242 -13.878 17.256) 22.756 30.737 ( -6.810 -5.772 1.727) 9.092 31.398 ( -26.427 -6.204 -15.434) 31.226 35.273 ( 16.792 -0.008 25.682) 30.685 36.200 ( 21.332 3.613 -20.834) 30.036 39.501 ( 12.016 3.493 40.933) 42.803 41.235 ( 14.141 6.463 -44.644) 47.274 ======================= Grid point 923 (285/343) ======================= q-point: ( 0.46 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.267 ( 39.970 -14.265 15.278) 45.105 7.786 ( 43.571 -2.960 -12.387) 45.394 9.292 ( 2.007 -14.041 25.273) 28.981 10.016 ( 14.322 4.299 -7.388) 16.678 10.625 ( 0.429 7.705 5.966) 9.754 11.020 ( -9.573 -11.095 -10.218) 17.865 13.097 ( 30.294 -0.149 18.350) 35.419 13.748 ( 25.680 -6.678 -12.728) 29.429 14.809 ( -26.354 2.058 27.994) 38.503 15.182 ( -28.078 10.612 38.460) 48.787 15.903 ( -15.438 13.876 -20.117) 28.906 16.795 ( 8.586 -10.653 -16.658) 21.557 17.387 ( -6.293 1.214 -14.894) 16.215 17.742 ( -5.661 -1.738 -24.260) 24.972 20.158 ( -3.288 -15.734 28.778) 32.963 21.984 ( 10.728 -9.599 -57.819) 59.584 23.732 ( -3.002 6.852 8.875) 11.607 24.124 ( -0.956 8.659 -8.749) 12.347 24.257 ( -6.460 -4.686 6.779) 10.472 24.671 ( -2.404 -6.381 -11.486) 13.358 25.714 ( -8.492 25.167 19.792) 33.124 26.380 ( -8.430 19.519 -10.817) 23.855 29.919 ( -8.330 -3.718 28.469) 29.895 30.447 ( 1.250 -19.438 18.449) 26.828 30.815 ( -1.609 -4.803 -6.026) 7.872 31.381 ( -14.576 -17.312 -15.029) 27.166 35.415 ( 12.853 0.383 24.732) 27.876 36.295 ( 16.477 7.239 -19.361) 26.434 39.502 ( 7.007 7.645 40.562) 41.867 41.186 ( 8.650 12.643 -42.380) 45.064 ======================= Grid point 924 (286/343) ======================= q-point: ( 0.54 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.855 ( 41.288 -6.109 9.798) 42.872 8.189 ( 34.114 1.339 -7.555) 34.967 9.507 ( -17.042 -20.044 24.601) 36.020 10.102 ( 22.081 5.422 -5.074) 23.296 10.503 ( 5.657 11.045 8.776) 15.199 11.087 ( -19.445 -11.909 -14.451) 26.995 13.357 ( 24.731 1.412 18.011) 30.627 14.037 ( 15.263 -1.318 -8.283) 17.416 14.431 ( -28.235 7.774 18.065) 34.409 14.807 ( -26.097 1.937 40.315) 48.063 15.527 ( -15.723 8.394 -13.360) 22.274 17.026 ( 6.752 -7.420 -28.348) 30.071 17.347 ( -1.771 0.529 -15.775) 15.883 17.746 ( 0.270 -1.913 -25.422) 25.495 20.509 ( 3.421 -25.899 34.380) 43.179 22.289 ( 11.275 -13.844 -50.851) 53.894 23.491 ( -5.824 18.310 12.584) 22.968 23.915 ( -2.325 13.282 -7.749) 15.552 24.307 ( -4.887 -7.752 9.989) 13.556 24.768 ( -0.568 -6.780 -12.490) 14.223 25.290 ( -5.867 16.659 11.879) 21.285 25.926 ( -5.786 24.932 -15.180) 29.757 29.912 ( -8.104 -5.856 29.298) 30.957 30.754 ( 0.997 -6.881 -6.226) 9.333 30.902 ( -2.191 -17.466 17.737) 24.989 31.647 ( -2.748 -22.045 -13.434) 25.962 35.513 ( 8.612 0.521 22.268) 23.881 36.286 ( 10.857 9.729 -16.465) 21.991 39.387 ( 2.447 11.711 39.439) 41.213 40.993 ( 4.245 18.015 -39.498) 43.619 ======================= Grid point 925 (287/343) ======================= q-point: ( 0.62 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.205 ( 25.217 5.294 5.547) 26.357 8.401 ( 21.754 5.486 -3.114) 22.650 9.618 ( -13.867 -11.762 25.436) 31.267 10.248 ( 28.147 13.312 -4.059) 31.399 10.373 ( 4.537 5.946 7.182) 10.369 10.959 ( -34.650 -3.467 -13.418) 37.319 13.504 ( 15.059 6.459 17.910) 24.275 13.907 ( -13.071 9.114 20.857) 26.248 14.325 ( 5.511 -4.110 -1.123) 6.966 14.573 ( -20.390 -2.594 13.485) 24.583 15.437 ( -6.085 -11.232 2.882) 13.095 17.175 ( 5.361 -3.618 -32.972) 33.601 17.305 ( -3.652 1.413 -16.680) 17.133 17.803 ( 1.823 -3.347 -26.894) 27.162 21.054 ( 6.240 -32.732 34.936) 48.279 22.640 ( 13.818 -10.893 -34.943) 39.123 23.024 ( -11.879 23.662 13.611) 29.770 23.653 ( -3.094 15.602 -10.782) 19.215 24.412 ( -2.229 -8.881 9.131) 12.932 24.873 ( 2.812 -3.940 -11.685) 12.647 25.031 ( -5.409 8.722 2.345) 10.528 25.494 ( -2.504 20.684 -15.524) 25.983 29.969 ( -4.287 -8.571 27.447) 29.072 30.777 ( -1.317 -1.101 -11.859) 11.982 31.273 ( 0.894 -22.578 24.329) 33.204 31.990 ( 0.674 -19.312 -12.248) 22.879 35.570 ( 4.464 0.355 18.657) 19.187 36.197 ( 5.288 10.004 -12.664) 16.982 39.170 ( -0.510 15.152 37.771) 40.700 40.681 ( 1.156 22.341 -36.355) 42.687 ======================= Grid point 926 (288/343) ======================= q-point: (-0.31 0.31 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.174 ( 0.000 11.273 7.527) 13.555 8.413 ( 0.000 8.191 -3.520) 8.915 9.597 ( 0.000 8.620 30.087) 31.297 10.055 ( 0.000 17.166 8.763) 19.274 10.433 ( 0.000 10.724 -10.464) 14.983 10.647 ( 0.000 3.525 -14.793) 15.207 13.412 ( 0.000 11.591 22.628) 25.424 13.744 ( 0.000 2.392 30.056) 30.151 14.398 ( 0.000 4.944 -19.021) 19.653 14.622 ( -0.000 -19.103 12.594) 22.881 15.740 ( -0.000 -27.041 5.739) 27.643 17.206 ( 0.000 5.127 5.509) 7.526 17.295 ( -0.000 -5.375 -51.194) 51.475 17.881 ( -0.000 -4.638 -30.345) 30.698 21.672 ( -0.000 -36.116 32.576) 48.637 22.360 ( 0.000 36.556 28.942) 46.626 23.075 ( -0.000 -21.523 -35.186) 41.247 23.327 ( 0.000 21.050 -18.003) 27.699 24.552 ( -0.000 -9.103 6.498) 11.184 24.817 ( 0.000 10.578 3.080) 11.017 24.997 ( -0.000 -5.883 -14.300) 15.463 25.222 ( 0.000 10.543 -14.699) 18.089 30.112 ( -0.000 -10.875 24.431) 26.742 30.794 ( -0.000 -1.658 -8.276) 8.441 31.627 ( -0.000 -19.211 22.281) 29.419 32.277 ( -0.000 -14.400 -11.130) 18.200 35.581 ( 0.000 1.331 15.268) 15.326 36.078 ( 0.000 6.799 -9.121) 11.376 38.891 ( 0.000 17.290 35.331) 39.335 40.287 ( 0.000 25.319 -32.947) 41.551 ======================= Grid point 935 (289/343) ======================= q-point: ( 0.38 0.38 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.925 ( 38.102 -0.000 25.832) 46.034 7.703 ( 45.698 -0.000 -16.544) 48.601 9.060 ( -2.651 0.000 22.830) 22.983 10.010 ( -2.349 0.000 -17.019) 17.180 10.768 ( 2.784 -0.000 2.363) 3.652 10.930 ( 10.979 -0.000 -1.781) 11.123 13.101 ( 34.565 -0.000 18.572) 39.239 13.607 ( 28.228 -0.000 -10.865) 30.247 14.828 ( -25.539 0.000 36.695) 44.707 15.428 ( -26.697 0.000 26.010) 37.273 16.346 ( -10.942 0.000 -27.068) 29.196 16.402 ( 12.234 -0.000 -7.973) 14.603 17.413 ( -15.583 0.000 -10.566) 18.828 17.699 ( -2.107 0.000 -17.553) 17.679 19.889 ( -11.051 0.000 25.645) 27.925 21.815 ( 8.637 -0.000 -64.295) 64.873 23.823 ( -1.119 0.000 8.984) 9.053 24.151 ( -6.661 0.000 8.066) 10.461 24.281 ( 0.022 -0.000 -14.956) 14.956 24.548 ( -3.306 0.000 -10.425) 10.936 26.432 ( -8.712 0.000 14.222) 16.678 26.564 ( -8.321 0.000 7.554) 11.238 29.910 ( -12.619 0.000 29.481) 32.068 30.032 ( 8.942 -0.000 11.737) 14.755 30.645 ( -0.413 0.000 -5.571) 5.586 31.104 ( -22.243 0.000 -16.464) 27.673 35.425 ( 13.690 -0.000 27.473) 30.695 36.424 ( 17.618 -0.000 -22.667) 28.709 39.636 ( 8.986 -0.000 42.324) 43.268 41.405 ( 9.425 -0.000 -44.994) 45.971 ======================= Grid point 936 (290/343) ======================= q-point: ( 0.46 0.38 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.424 ( 40.553 -12.914 27.788) 50.828 8.152 ( 39.863 -2.078 -13.659) 42.190 8.992 ( -21.731 -6.876 19.849) 30.225 9.973 ( -12.534 -7.297 -19.653) 24.425 10.810 ( 11.441 4.763 3.202) 12.800 11.028 ( 13.232 4.588 -5.447) 15.027 13.410 ( 30.498 1.398 21.365) 37.263 13.897 ( 22.758 -4.050 -8.332) 24.571 14.563 ( -27.632 0.732 33.683) 43.574 15.074 ( -28.170 8.713 31.906) 43.445 16.036 ( -11.201 17.550 -24.828) 32.402 16.649 ( 1.827 -14.317 -27.380) 30.951 17.347 ( 0.202 -0.499 -5.070) 5.098 17.702 ( 0.678 -0.705 -19.194) 19.218 19.873 ( -8.054 -10.602 33.563) 36.108 21.939 ( 7.072 -5.753 -63.946) 64.592 23.798 ( 0.073 2.939 8.153) 8.667 24.108 ( -6.123 -2.824 9.997) 12.058 24.247 ( -0.475 4.271 -14.561) 15.182 24.554 ( -2.539 -4.223 -10.953) 12.010 26.072 ( -6.202 24.839 19.555) 32.216 26.520 ( -6.180 4.842 -1.548) 8.002 29.801 ( -8.404 -0.839 31.486) 32.599 30.209 ( 5.105 -11.196 16.416) 20.516 30.733 ( 2.115 -6.048 -11.206) 12.908 30.989 ( -14.644 -10.671 -15.779) 24.027 35.534 ( 9.380 0.524 27.612) 29.166 36.536 ( 12.213 4.305 -22.577) 26.027 39.669 ( 5.398 4.633 42.451) 43.043 41.420 ( 5.460 6.894 -43.905) 44.777 ======================= Grid point 937 (291/343) ======================= q-point: ( 0.54 0.38 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1014 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.095 ( 42.836 -15.036 20.347) 49.749 8.488 ( 22.910 0.571 -7.023) 23.970 8.891 ( -35.025 -16.384 23.092) 45.038 10.077 ( -5.246 -16.730 -22.511) 28.533 10.795 ( 9.180 10.116 3.582) 14.122 11.005 ( 4.437 8.989 -6.545) 11.972 13.654 ( 27.197 3.479 18.977) 33.345 14.144 ( 5.968 -2.533 7.774) 10.122 14.266 ( -17.691 2.642 12.977) 22.099 14.658 ( -22.150 9.353 38.166) 45.108 15.620 ( -9.483 17.529 -19.370) 27.792 16.889 ( 0.250 -13.016 -41.170) 43.179 17.368 ( 2.615 1.215 -2.977) 4.144 17.729 ( 1.243 -1.273 -20.641) 20.718 20.102 ( -1.828 -22.484 38.313) 44.461 22.143 ( 4.636 -11.772 -59.675) 61.002 23.698 ( -0.656 9.798 8.441) 12.949 24.109 ( -0.185 8.824 -8.695) 12.390 24.146 ( -3.893 -4.464 8.793) 10.602 24.635 ( -1.082 -7.373 -12.192) 14.289 25.597 ( -3.119 24.836 19.710) 31.860 26.262 ( -3.141 19.334 -10.829) 22.382 29.773 ( -4.500 -3.330 31.646) 32.137 30.505 ( 2.800 -19.466 21.312) 28.999 30.764 ( -2.976 -0.728 -15.354) 15.656 31.232 ( -2.225 -23.999 -13.143) 27.452 35.591 ( 4.642 0.899 25.972) 26.399 36.521 ( 6.046 8.074 -20.624) 22.959 39.589 ( 2.067 9.336 41.754) 42.835 41.289 ( 2.310 13.326 -41.977) 44.102 ======================= Grid point 938 (292/343) ======================= q-point: (-0.38 -0.62 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.432 ( 0.000 4.700 2.122) 5.157 8.590 ( 0.000 2.832 -5.010) 5.755 9.088 ( -0.000 -33.192 38.522) 50.850 10.386 ( -0.000 -18.388 -20.616) 27.625 10.629 ( 0.000 15.384 4.466) 16.019 10.823 ( 0.000 12.624 -6.198) 14.063 13.747 ( 0.000 8.593 11.075) 14.018 13.940 ( 0.000 5.649 24.601) 25.241 14.371 ( 0.000 4.285 45.854) 46.054 14.387 ( -0.000 -4.205 -16.008) 16.552 15.359 ( 0.000 6.161 -7.288) 9.543 17.078 ( -0.000 -9.364 -50.212) 51.077 17.343 ( 0.000 3.027 -0.055) 3.028 17.765 ( -0.000 -2.302 -22.866) 22.981 20.545 ( -0.000 -30.328 37.817) 48.476 22.410 ( -0.000 -17.004 -52.497) 55.182 23.428 ( 0.000 22.676 14.227) 26.769 23.889 ( 0.000 14.499 -8.638) 16.877 24.254 ( -0.000 -8.501 11.276) 14.121 24.763 ( -0.000 -8.168 -13.419) 15.709 25.230 ( 0.000 17.021 12.189) 20.935 25.869 ( 0.000 24.606 -15.161) 28.902 29.826 ( -0.000 -5.899 30.201) 30.772 30.754 ( -0.000 -0.647 -15.278) 15.292 30.888 ( -0.000 -23.636 24.744) 34.219 31.631 ( -0.000 -23.769 -12.978) 27.081 35.599 ( 0.000 0.678 22.730) 22.740 36.396 ( 0.000 10.233 -17.112) 19.938 39.409 ( 0.000 13.172 40.324) 42.421 41.031 ( 0.000 18.671 -39.481) 43.673 ======================= Grid point 950 (293/343) ======================= q-point: ( 0.46 0.46 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.674 ( 33.427 -0.000 40.054) 52.170 8.485 ( 28.882 -0.000 -10.778) 30.827 8.696 ( -25.820 0.000 9.673) 27.572 9.727 ( -17.591 0.000 -27.728) 32.837 10.965 ( 9.662 -0.000 3.605) 10.312 11.204 ( 10.100 -0.000 -5.883) 11.688 13.721 ( 29.630 -0.000 28.880) 41.376 14.057 ( 16.028 -0.000 -6.148) 17.167 14.295 ( -28.182 0.000 30.741) 41.704 14.905 ( -20.398 0.000 29.103) 35.540 16.191 ( -4.630 0.000 -29.910) 30.267 16.422 ( -4.730 0.000 -29.607) 29.983 17.383 ( 5.541 -0.000 -2.188) 5.957 17.710 ( 1.333 -0.000 -18.299) 18.348 19.701 ( -6.239 0.000 39.410) 39.901 21.942 ( 3.667 -0.000 -66.756) 66.856 23.832 ( 1.418 -0.000 7.211) 7.349 24.027 ( -4.757 0.000 11.780) 12.705 24.282 ( 0.122 -0.000 -15.990) 15.991 24.495 ( -1.698 0.000 -10.880) 11.012 26.312 ( -3.209 0.000 14.112) 14.473 26.446 ( -3.249 0.000 7.660) 8.321 29.725 ( -5.063 0.000 32.831) 33.219 30.177 ( 4.750 -0.000 13.196) 14.024 30.674 ( 1.454 -0.000 -9.883) 9.989 30.791 ( -8.912 0.000 -18.259) 20.318 35.610 ( 4.879 -0.000 28.910) 29.319 36.665 ( 6.407 -0.000 -23.934) 24.776 39.750 ( 2.785 -0.000 43.066) 43.156 41.517 ( 2.559 -0.000 -44.137) 44.211 ======================= Grid point 951 (294/343) ======================= q-point: (-0.46 -0.54 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 546 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.051 ( -0.000 -20.541 48.831) 52.976 8.522 ( 0.000 1.147 -0.397) 1.214 8.638 ( 0.000 0.494 -6.765) 6.783 9.743 ( -0.000 -13.604 -30.995) 33.849 10.972 ( 0.000 5.145 3.454) 6.197 11.194 ( 0.000 7.164 -5.803) 9.220 13.982 ( 0.000 5.582 0.616) 5.616 13.985 ( -0.000 -0.662 58.152) 58.156 14.206 ( -0.000 -5.485 -8.612) 10.210 14.710 ( 0.000 9.512 32.718) 34.073 15.902 ( 0.000 20.779 -25.085) 32.573 16.629 ( -0.000 -17.146 -37.123) 40.891 17.407 ( 0.000 0.921 -2.587) 2.746 17.721 ( -0.000 -0.531 -18.748) 18.755 19.782 ( -0.000 -13.255 41.353) 43.426 22.013 ( -0.000 -6.268 -65.213) 65.513 23.809 ( 0.000 4.010 6.587) 7.712 24.034 ( -0.000 -3.841 12.864) 13.425 24.243 ( 0.000 4.977 -15.219) 16.012 24.526 ( -0.000 -4.575 -11.373) 12.259 26.010 ( 0.000 24.806 19.587) 31.607 26.458 ( 0.000 4.802 -1.509) 5.033 29.712 ( -0.000 -1.430 32.671) 32.702 30.272 ( -0.000 -9.406 17.415) 19.793 30.746 ( -0.000 -0.024 -18.504) 18.504 30.851 ( -0.000 -18.410 -11.371) 21.639 35.628 ( 0.000 0.680 28.345) 28.353 36.658 ( 0.000 4.524 -23.247) 23.683 39.721 ( 0.000 5.043 42.826) 43.122 41.471 ( 0.000 7.031 -43.460) 44.025 ======================= Grid point 1038 (295/343) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 196 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.372 ( 0.000 0.000 -52.221) 52.221 7.372 ( 0.000 0.000 52.221) 52.221 7.403 ( 0.000 0.000 -33.173) 33.173 7.403 ( 0.000 0.000 33.173) 33.173 7.590 ( 0.000 0.000 -4.474) 4.474 7.590 ( 0.000 0.000 4.474) 4.474 12.321 ( 0.000 0.000 -22.114) 22.114 12.321 ( 0.000 0.000 22.114) 22.114 14.794 ( 0.000 0.000 -5.020) 5.020 14.794 ( 0.000 0.000 5.020) 5.020 17.681 ( 0.000 0.000 -25.811) 25.811 17.681 ( 0.000 0.000 25.811) 25.811 19.317 ( 0.000 0.000 -18.627) 18.627 19.317 ( 0.000 0.000 18.627) 18.627 20.342 ( 0.000 0.000 -32.250) 32.250 20.342 ( 0.000 0.000 32.250) 32.250 24.015 ( 0.000 0.000 -0.257) 0.257 24.015 ( 0.000 0.000 0.257) 0.257 24.652 ( 0.000 0.000 -13.078) 13.078 24.652 ( 0.000 0.000 13.078) 13.078 26.514 ( 0.000 0.000 -2.030) 2.030 26.514 ( 0.000 0.000 2.030) 2.030 30.971 ( 0.000 0.000 -8.103) 8.103 30.971 ( 0.000 0.000 8.103) 8.103 32.726 ( 0.000 0.000 -8.200) 8.200 32.726 ( 0.000 0.000 8.200) 8.200 35.976 ( 0.000 0.000 -30.772) 30.772 35.976 ( 0.000 0.000 30.772) 30.772 37.337 ( 0.000 0.000 -0.385) 0.385 37.337 ( 0.000 0.000 0.385) 0.385 ======================= Grid point 1040 (296/343) ======================= q-point: ( 0.08 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.924 ( -45.877 -2.636 -28.262) 53.949 6.924 ( -45.877 -2.636 28.262) 53.949 7.504 ( 7.917 -6.372 -34.831) 36.284 7.504 ( 7.917 -6.372 34.831) 36.284 8.276 ( 58.969 -18.254 -23.479) 66.044 8.276 ( 58.969 -18.254 23.479) 66.044 12.332 ( -4.254 -4.025 -21.079) 21.878 12.332 ( -4.254 -4.025 21.079) 21.878 14.810 ( 3.141 -0.048 -10.299) 10.767 14.810 ( 3.141 -0.048 10.299) 10.767 17.639 ( -4.972 1.999 -28.043) 28.551 17.639 ( -4.972 1.999 28.043) 28.551 19.208 ( -5.404 9.665 -17.712) 20.889 19.208 ( -5.404 9.665 17.712) 20.889 20.393 ( 0.596 -5.476 -32.368) 32.834 20.393 ( 0.596 -5.476 32.368) 32.834 24.021 ( 0.811 -0.164 -2.601) 2.729 24.021 ( 0.811 -0.164 2.601) 2.729 24.656 ( -1.295 -1.308 -13.266) 13.393 24.656 ( -1.295 -1.308 13.266) 13.393 26.456 ( 4.766 9.841 -8.295) 13.724 26.456 ( 4.766 9.841 8.295) 13.724 30.910 ( -12.751 -0.930 -8.288) 15.236 30.910 ( -12.751 -0.930 8.288) 15.236 32.757 ( 7.220 1.438 -6.998) 10.157 32.757 ( 7.220 1.438 6.998) 10.157 35.758 ( -35.223 0.127 -23.856) 42.542 35.758 ( -35.223 0.127 23.856) 42.542 37.608 ( 38.367 -4.936 -7.799) 39.461 37.608 ( 38.367 -4.936 7.799) 39.461 ======================= Grid point 1042 (297/343) ======================= q-point: ( 0.15 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.624 ( -36.052 -9.020 -23.844) 44.155 6.624 ( -36.052 -9.020 23.844) 44.155 7.773 ( 11.920 -13.834 -29.022) 34.289 7.773 ( 11.920 -13.834 29.022) 34.289 9.224 ( 62.049 -22.914 -23.448) 70.178 9.224 ( 62.049 -22.914 23.448) 70.178 12.379 ( -7.831 -9.076 -18.641) 22.163 12.379 ( -7.831 -9.076 18.641) 22.163 14.858 ( 6.328 -0.067 -17.957) 19.040 14.858 ( 6.328 -0.067 17.957) 19.040 17.525 ( -9.145 3.166 -31.541) 32.993 17.525 ( -9.145 3.166 31.541) 32.993 18.906 ( -9.552 17.231 -15.645) 25.157 18.906 ( -9.552 17.231 15.645) 25.157 20.526 ( 0.352 -9.812 -33.045) 34.472 20.526 ( 0.352 -9.812 33.045) 34.472 24.027 ( 0.967 0.856 -4.607) 4.785 24.027 ( 0.967 0.856 4.607) 4.785 24.668 ( -2.195 -2.038 -13.539) 13.867 24.668 ( -2.195 -2.038 13.539) 13.867 26.278 ( 6.703 18.289 -14.844) 24.491 26.278 ( 6.703 18.289 14.844) 24.491 30.787 ( -16.742 -2.721 -8.150) 18.818 30.787 ( -16.742 -2.721 8.150) 18.818 32.781 ( 4.690 3.824 -4.910) 7.793 32.781 ( 4.690 3.824 4.910) 7.793 35.427 ( -34.065 -3.604 -17.222) 38.341 35.427 ( -34.065 -3.604 17.222) 38.341 38.117 ( 43.352 -5.795 -15.376) 46.362 38.117 ( 43.352 -5.795 15.376) 46.362 ======================= Grid point 1044 (298/343) ======================= q-point: ( 0.23 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.488 ( -26.441 -10.626 -19.426) 34.488 6.488 ( -26.441 -10.626 19.426) 34.488 8.170 ( 13.693 -17.668 -20.854) 30.571 8.170 ( 13.693 -17.668 20.854) 30.571 10.208 ( 59.651 -22.279 -21.818) 67.310 10.208 ( 59.651 -22.279 21.818) 67.310 12.491 ( -9.873 -15.163 -17.664) 25.286 12.491 ( -9.873 -15.163 17.664) 25.286 14.937 ( 9.644 -0.061 -24.363) 26.203 14.937 ( 9.644 -0.061 24.363) 26.203 17.363 ( -12.231 3.432 -32.013) 34.442 17.363 ( -12.231 3.432 32.013) 34.442 18.469 ( -12.336 21.818 -12.893) 28.186 18.469 ( -12.336 21.818 12.893) 28.186 20.720 ( -0.021 -13.288 -33.994) 36.499 20.720 ( -0.021 -13.288 33.994) 36.499 23.998 ( 0.124 3.768 -5.292) 6.498 23.998 ( 0.124 3.768 5.293) 6.498 24.677 ( -2.513 -1.657 -13.294) 13.630 24.677 ( -2.513 -1.657 13.294) 13.630 25.992 ( 5.493 22.522 -18.053) 29.383 25.992 ( 5.493 22.522 18.053) 29.383 30.695 ( -13.235 -4.114 -7.021) 15.536 30.695 ( -13.235 -4.114 7.021) 15.536 32.706 ( -4.326 5.213 -4.904) 8.363 32.706 ( -4.326 5.213 4.904) 8.363 35.244 ( -20.982 -6.775 -13.650) 25.932 35.244 ( -20.982 -6.775 13.650) 25.932 38.610 ( 37.504 -5.043 -19.360) 42.506 38.610 ( 37.504 -5.043 19.360) 42.506 ======================= Grid point 1046 (299/343) ======================= q-point: ( 0.31 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.437 ( -17.869 -9.009 -15.354) 25.223 6.437 ( -17.869 -9.009 15.354) 25.223 8.584 ( 12.242 -15.554 -12.858) 23.604 8.584 ( 12.242 -15.554 12.858) 23.604 11.096 ( 50.850 -18.450 -20.122) 57.715 11.096 ( 50.850 -18.450 20.122) 57.715 12.688 ( -9.451 -19.554 -21.385) 30.479 12.688 ( -9.451 -19.554 21.385) 30.479 15.049 ( 12.901 -0.100 -27.726) 30.580 15.049 ( 12.901 -0.100 27.726) 30.580 17.176 ( -14.507 3.338 -27.906) 31.629 17.176 ( -14.507 3.338 27.906) 31.629 17.968 ( -12.934 22.429 -9.749) 27.666 17.968 ( -12.934 22.429 9.749) 27.666 20.964 ( 0.137 -15.839 -34.272) 37.755 20.964 ( 0.137 -15.839 34.272) 37.755 23.892 ( -1.408 8.501 -5.082) 10.004 23.892 ( -1.408 8.501 5.082) 10.004 24.666 ( -2.449 0.230 -11.840) 12.093 24.666 ( -2.449 0.230 11.840) 12.093 25.675 ( 3.318 19.492 -15.840) 25.335 25.675 ( 3.318 19.492 15.840) 25.335 30.664 ( -7.161 -3.981 -5.273) 9.743 30.664 ( -7.161 -3.981 5.273) 9.743 32.547 ( -10.455 4.267 -5.593) 12.602 32.547 ( -10.455 4.267 5.593) 12.602 35.217 ( -9.424 -6.972 -10.603) 15.807 35.217 ( -9.424 -6.972 10.603) 15.807 39.006 ( 28.032 -3.727 -20.983) 35.214 39.006 ( 28.032 -3.727 20.983) 35.214 ======================= Grid point 1048 (300/343) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.425 ( -10.292 -5.865 -11.677) 16.634 6.425 ( -10.292 -5.865 11.677) 16.634 8.896 ( 8.145 -9.422 -6.681) 14.133 8.896 ( 8.145 -9.422 6.681) 14.133 11.787 ( 34.774 -13.160 -20.020) 42.228 11.787 ( 34.774 -13.160 20.020) 42.228 12.927 ( -6.595 -17.464 -25.970) 31.983 12.927 ( -6.595 -17.464 25.970) 31.983 15.188 ( 14.197 -0.229 -25.255) 28.973 15.188 ( 14.197 -0.229 25.255) 28.973 16.964 ( -15.994 4.164 -24.793) 29.797 16.964 ( -15.994 4.164 24.793) 29.797 17.520 ( -8.997 16.603 -10.791) 21.750 17.520 ( -8.997 16.603 10.791) 21.750 21.235 ( 0.683 -15.427 -32.397) 35.889 21.235 ( 0.683 -15.427 32.397) 35.889 23.693 ( -2.540 12.178 -7.564) 14.559 23.693 ( -2.540 12.178 7.564) 14.559 24.623 ( -1.936 2.007 -8.430) 8.879 24.623 ( -1.936 2.007 8.430) 8.879 25.446 ( 1.828 10.704 -9.723) 14.575 25.446 ( 1.828 10.704 9.723) 14.575 30.675 ( -2.399 -2.636 -3.912) 5.292 30.675 ( -2.399 -2.636 3.912) 5.292 32.387 ( -9.842 2.325 -5.062) 11.309 32.387 ( -9.842 2.325 5.062) 11.309 35.259 ( -3.238 -4.876 -7.792) 9.745 35.259 ( -3.238 -4.876 7.792) 9.745 39.278 ( 17.151 -2.246 -21.338) 27.468 39.278 ( 17.151 -2.246 21.338) 27.468 ======================= Grid point 1050 (301/343) ======================= q-point: ( 0.46 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.425 ( -3.358 -2.028 -9.003) 9.820 6.425 ( -3.358 -2.028 9.003) 9.820 9.052 ( 2.803 -2.965 -2.118) 4.598 9.052 ( 2.803 -2.965 2.118) 4.598 12.179 ( 12.437 -5.027 -20.327) 24.354 12.179 ( 12.437 -5.027 20.327) 24.354 13.098 ( -2.320 -7.222 -25.794) 26.886 13.098 ( -2.320 -7.222 25.794) 26.886 15.309 ( 7.508 -0.224 -14.942) 16.724 15.309 ( 7.508 -0.224 14.942) 16.724 16.759 ( -8.950 3.167 -30.875) 32.301 16.759 ( -8.950 3.167 30.875) 32.302 17.281 ( -2.586 5.308 -12.751) 14.051 17.281 ( -2.586 5.308 12.751) 14.051 21.445 ( 0.544 -7.329 -27.633) 28.593 21.445 ( 0.544 -7.329 27.633) 28.593 23.496 ( -1.456 6.782 -6.046) 9.202 23.496 ( -1.456 6.782 6.046) 9.202 24.580 ( -0.734 1.104 -4.895) 5.071 24.580 ( -0.734 1.104 4.895) 5.071 25.349 ( 0.624 2.959 -5.612) 6.375 25.349 ( 0.624 2.959 5.612) 6.375 30.693 ( -0.344 -0.888 -3.411) 3.542 30.693 ( -0.344 -0.888 3.411) 3.542 32.292 ( -3.944 0.676 -3.714) 5.460 32.292 ( -3.944 0.676 3.714) 5.460 35.298 ( -0.693 -1.722 -5.972) 6.253 35.298 ( -0.693 -1.722 5.972) 6.253 39.416 ( 5.757 -0.746 -21.273) 22.051 39.416 ( 5.757 -0.746 21.273) 22.051 ======================= Grid point 1066 (302/343) ======================= q-point: ( 0.08 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.445 ( -40.725 0.000 -25.394) 47.993 6.445 ( -40.725 0.000 25.394) 47.993 7.566 ( 14.543 -0.000 -32.302) 35.425 7.566 ( 14.543 -0.000 32.302) 35.425 8.778 ( 69.152 -0.000 -25.918) 73.849 8.778 ( 69.152 -0.000 25.918) 73.849 12.238 ( -8.126 0.000 -20.583) 22.129 12.238 ( -8.126 0.000 20.583) 22.129 14.855 ( 6.164 -0.000 -5.788) 8.456 14.855 ( 6.164 -0.000 5.788) 8.456 17.584 ( -9.617 0.000 -26.215) 27.923 17.584 ( -9.617 0.000 26.215) 27.923 19.202 ( -11.988 0.000 -16.516) 20.408 19.202 ( -11.988 0.000 16.516) 20.408 20.362 ( 2.135 -0.000 -30.743) 30.818 20.362 ( 2.135 -0.000 30.743) 30.818 24.031 ( 1.499 -0.000 -0.858) 1.727 24.031 ( 1.499 -0.000 0.858) 1.727 24.626 ( -2.490 0.000 -12.784) 13.025 24.626 ( -2.490 0.000 12.784) 13.025 26.610 ( 8.955 -0.000 -1.872) 9.148 26.610 ( 8.955 -0.000 1.872) 9.148 30.726 ( -21.112 0.000 -8.939) 22.926 30.726 ( -21.112 0.000 8.939) 22.926 32.849 ( 6.644 -0.000 -3.740) 7.624 32.849 ( 6.644 -0.000 3.740) 7.624 35.358 ( -40.131 0.000 -16.329) 43.326 35.358 ( -40.131 0.000 16.329) 43.326 38.028 ( 50.192 -0.000 -17.862) 53.275 38.028 ( 50.192 -0.000 17.862) 53.275 ======================= Grid point 1068 (303/343) ======================= q-point: ( 0.15 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.172 ( -26.478 -6.815 -21.070) 34.518 6.172 ( -26.478 -6.815 21.070) 34.518 7.781 ( 20.445 -4.996 -30.805) 37.308 7.781 ( 20.445 -4.996 30.805) 37.308 9.566 ( 67.324 -12.497 -24.184) 72.620 9.566 ( 67.324 -12.497 24.184) 72.620 12.177 ( -10.899 -4.194 -18.354) 21.754 12.177 ( -10.899 -4.194 18.354) 21.754 14.932 ( 9.137 -0.139 -10.469) 13.896 14.932 ( 9.137 -0.139 10.469) 13.896 17.456 ( -13.238 1.685 -28.142) 31.146 17.456 ( -13.238 1.685 28.142) 31.146 18.985 ( -17.530 8.226 -14.660) 24.287 18.985 ( -17.530 8.226 14.660) 24.287 20.425 ( 2.925 -4.421 -30.603) 31.059 20.425 ( 2.925 -4.421 30.603) 31.059 24.046 ( 1.455 0.174 -2.703) 3.075 24.046 ( 1.455 0.174 2.703) 3.075 24.610 ( -3.187 -1.508 -12.618) 13.101 24.610 ( -3.187 -1.508 12.618) 13.101 26.610 ( 9.419 11.366 -8.810) 17.191 26.610 ( 9.419 11.366 8.810) 17.191 30.540 ( -20.977 -3.627 -9.448) 23.290 30.540 ( -20.977 -3.627 9.448) 23.290 32.839 ( -6.119 2.368 -3.612) 7.490 32.839 ( -6.119 2.368 3.612) 7.490 35.058 ( -24.317 -3.403 -14.354) 28.442 35.058 ( -24.317 -3.403 14.354) 28.442 38.525 ( 47.704 -0.765 -24.825) 53.782 38.525 ( 47.704 -0.765 24.825) 53.782 ======================= Grid point 1070 (304/343) ======================= q-point: ( 0.23 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.130 ( -11.862 -9.693 -17.112) 22.967 6.130 ( -11.862 -9.693 17.112) 22.967 8.123 ( 23.277 -9.709 -26.125) 36.313 8.123 ( 23.277 -9.709 26.125) 36.313 10.455 ( 59.393 -17.880 -21.226) 65.557 10.455 ( 59.393 -17.880 21.226) 65.557 12.179 ( -11.040 -9.711 -16.147) 21.838 12.179 ( -11.040 -9.711 16.147) 21.838 15.039 ( 12.013 -0.332 -16.551) 20.453 15.039 ( 12.013 -0.332 16.551) 20.453 17.277 ( -15.609 2.528 -30.039) 33.946 17.277 ( -15.609 2.528 30.039) 33.946 18.602 ( -21.406 14.219 -13.208) 28.894 18.602 ( -21.406 14.219 13.208) 28.894 20.561 ( 3.450 -8.170 -32.245) 33.442 20.561 ( 3.450 -8.170 32.245) 33.442 24.042 ( 0.241 1.717 -3.859) 4.230 24.042 ( 0.241 1.717 3.859) 4.230 24.614 ( -3.008 -2.533 -12.330) 12.942 24.614 ( -3.008 -2.533 12.330) 12.942 26.411 ( 5.170 20.855 -15.466) 26.474 26.411 ( 5.170 20.855 15.466) 26.474 30.458 ( -14.124 -7.415 -9.545) 18.589 30.458 ( -14.124 -7.415 9.545) 18.589 32.659 ( -20.164 2.531 -9.807) 22.565 32.659 ( -20.164 2.531 9.807) 22.565 34.995 ( -5.485 -5.527 -14.430) 16.397 34.995 ( -5.485 -5.527 14.430) 16.397 38.963 ( 40.080 0.402 -28.212) 49.015 38.963 ( 40.080 0.402 28.212) 49.015 ======================= Grid point 1072 (305/343) ======================= q-point: ( 0.31 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.225 ( 0.926 -7.322 -13.147) 15.077 6.225 ( 0.926 -7.322 13.147) 15.077 8.529 ( 22.445 -10.990 -18.259) 30.951 8.529 ( 22.445 -10.990 18.259) 30.951 11.258 ( 41.144 -17.263 -18.098) 48.150 11.258 ( 41.144 -17.263 18.098) 48.150 12.313 ( -3.764 -16.093 -18.527) 24.827 12.313 ( -3.764 -16.093 18.527) 24.827 15.175 ( 14.023 -0.471 -20.487) 24.831 15.175 ( 14.023 -0.471 20.487) 24.831 17.072 ( -17.168 2.766 -28.574) 33.449 17.072 ( -17.168 2.766 28.574) 33.449 18.119 ( -22.597 16.872 -12.073) 30.677 18.119 ( -22.597 16.872 12.073) 30.677 20.765 ( 4.847 -11.542 -34.006) 36.237 20.765 ( 4.847 -11.542 34.006) 36.237 23.982 ( -2.012 4.889 -2.568) 5.878 23.982 ( -2.012 4.889 2.568) 5.878 24.630 ( -2.020 -2.110 -11.270) 11.642 24.630 ( -2.020 -2.110 11.270) 11.642 26.051 ( -0.641 23.718 -17.364) 29.402 26.051 ( -0.641 23.718 17.364) 29.402 30.496 ( -5.800 -8.158 -8.799) 13.327 30.496 ( -5.800 -8.158 8.799) 13.327 32.410 ( -24.524 -0.345 -13.186) 27.847 32.410 ( -24.524 -0.345 13.186) 27.847 35.088 ( 4.808 -4.811 -13.212) 14.860 35.088 ( 4.808 -4.811 13.212) 14.860 39.288 ( 30.261 2.227 -28.940) 41.931 39.288 ( 30.261 2.227 28.940) 41.931 ======================= Grid point 1074 (306/343) ======================= q-point: ( 0.38 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.369 ( 11.225 -2.426 -9.852) 15.131 6.369 ( 11.225 -2.426 9.852) 15.131 8.885 ( 18.027 -6.893 -9.503) 21.513 8.885 ( 18.027 -6.893 9.503) 21.513 11.796 ( 12.571 -16.070 -17.996) 27.206 11.796 ( 12.571 -16.070 17.996) 27.206 12.640 ( 11.664 -16.897 -23.441) 31.162 12.640 ( 11.664 -16.897 23.441) 31.162 15.314 ( 11.958 0.058 -19.720) 23.063 15.314 ( 11.958 0.058 19.720) 23.063 16.851 ( -18.106 2.705 -26.836) 32.485 16.851 ( -18.106 2.705 26.836) 32.485 17.646 ( -18.124 14.326 -13.850) 26.936 17.646 ( -18.124 14.326 13.850) 26.936 21.038 ( 7.615 -13.709 -34.229) 37.650 21.038 ( 7.615 -13.709 34.229) 37.650 23.832 ( -4.772 9.176 -2.418) 10.621 23.832 ( -4.772 9.176 2.418) 10.621 24.635 ( -0.633 0.177 -8.697) 8.722 24.635 ( -0.633 0.177 8.697) 8.722 25.666 ( -4.607 17.892 -13.347) 22.793 25.666 ( -4.607 17.892 13.347) 22.793 30.587 ( -0.750 -5.894 -7.743) 9.760 30.587 ( -0.750 -5.894 7.743) 9.760 32.223 ( -20.274 -4.202 -13.518) 24.727 32.223 ( -20.274 -4.202 13.518) 24.727 35.219 ( 8.269 -2.598 -11.041) 14.036 35.219 ( 8.269 -2.598 11.041) 14.036 39.479 ( 19.561 4.153 -27.931) 34.351 39.479 ( 19.561 4.153 27.931) 34.351 ======================= Grid point 1076 (307/343) ======================= q-point: ( 0.46 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.517 ( 19.271 2.775 -8.201) 21.126 6.517 ( 19.271 2.775 8.201) 21.126 9.092 ( 11.567 -0.432 -2.528) 11.848 9.092 ( 11.567 -0.432 2.528) 11.848 12.058 ( -8.001 -12.462 -21.152) 25.821 12.058 ( -8.001 -12.462 21.152) 25.821 13.021 ( 16.951 -9.946 -24.764) 31.615 13.021 ( 16.951 -9.946 24.764) 31.615 15.361 ( -0.657 2.474 -13.771) 14.007 15.361 ( -0.657 2.474 13.771) 14.007 16.668 ( -11.934 -0.886 -34.558) 36.571 16.668 ( -11.934 -0.886 34.558) 36.571 17.335 ( -8.129 7.034 -17.871) 20.855 17.335 ( -8.129 7.034 17.871) 20.855 21.349 ( 11.071 -11.509 -31.125) 34.983 21.349 ( 11.071 -11.509 31.125) 34.983 23.598 ( -7.213 10.561 -7.143) 14.649 23.598 ( -7.213 10.561 7.143) 14.649 24.614 ( 1.027 2.142 -4.327) 4.936 24.614 ( 1.027 2.142 4.327) 4.936 25.400 ( -6.311 7.442 -7.160) 12.103 25.400 ( -6.311 7.442 7.160) 12.103 30.660 ( 0.119 -2.991 -6.834) 7.461 30.660 ( 0.119 -2.991 6.834) 7.461 32.162 ( -11.294 -7.016 -11.372) 17.496 32.162 ( -11.294 -7.016 11.372) 17.496 35.325 ( 8.809 0.122 -8.831) 12.474 35.325 ( 8.809 0.123 8.831) 12.474 39.533 ( 8.662 6.029 -25.996) 28.057 39.533 ( 8.662 6.029 25.996) 28.057 ======================= Grid point 1078 (308/343) ======================= q-point: (-0.46 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.652 ( 25.530 7.433 -8.915) 28.045 6.652 ( 25.530 7.433 8.915) 28.045 9.133 ( 5.446 5.301 -2.308) 7.943 9.133 ( 5.446 5.301 2.308) 7.943 12.019 ( -24.765 -1.246 -22.441) 33.443 12.019 ( -24.765 -1.246 22.441) 33.443 13.259 ( 14.809 0.909 -26.379) 30.265 13.259 ( 14.809 0.909 26.379) 30.265 15.221 ( -15.390 2.781 -18.532) 24.249 15.221 ( -15.390 2.781 18.532) 24.249 16.708 ( 2.126 -9.673 -35.351) 36.712 16.708 ( 2.126 -9.673 35.351) 36.712 17.241 ( -0.275 -0.081 -16.844) 16.846 17.241 ( -0.275 -0.081 16.844) 16.846 21.576 ( 12.502 0.414 -25.625) 28.515 21.576 ( 12.502 0.414 25.625) 28.515 23.413 ( -7.116 0.729 -6.036) 9.360 23.413 ( -7.116 0.729 6.036) 9.360 24.600 ( 2.677 1.344 -4.168) 5.133 24.600 ( 2.677 1.344 4.168) 5.133 25.281 ( -7.111 -0.357 -5.755) 9.155 25.281 ( -7.111 -0.357 5.755) 9.155 30.693 ( -0.077 -1.281 -5.735) 5.877 30.693 ( -0.077 -1.281 5.735) 5.877 32.223 ( -2.411 -7.898 -8.100) 11.567 32.223 ( -2.411 -7.898 8.100) 11.567 35.387 ( 9.011 2.795 -7.485) 12.043 35.387 ( 9.011 2.795 7.485) 12.043 39.450 ( -2.047 7.885 -23.725) 25.084 39.450 ( -2.047 7.885 23.725) 25.084 ======================= Grid point 1080 (309/343) ======================= q-point: (-0.38 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.772 ( 30.296 11.120 -11.069) 34.118 6.772 ( 30.296 11.120 11.069) 34.118 9.029 ( 0.873 10.843 -5.153) 12.037 9.029 ( 0.873 10.843 5.153) 12.037 11.606 ( -41.669 10.928 -21.361) 48.084 11.606 ( -41.669 10.928 21.361) 48.084 13.274 ( 11.573 12.361 -27.770) 32.526 13.274 ( 11.573 12.361 27.770) 32.526 15.038 ( -16.217 -0.464 -29.586) 33.742 15.038 ( -16.217 -0.464 29.586) 33.742 16.979 ( 10.347 -12.915 -25.000) 29.981 16.979 ( 10.347 -12.915 25.001) 29.981 17.325 ( 2.206 -9.542 -14.923) 17.849 17.325 ( 2.206 -9.542 14.923) 17.849 21.542 ( 9.436 15.869 -28.741) 34.160 21.542 ( 9.436 15.869 28.741) 34.160 23.475 ( -3.394 -13.293 -11.378) 17.823 23.475 ( -3.394 -13.293 11.378) 17.823 24.627 ( 3.855 -0.606 -8.194) 9.076 24.627 ( 3.855 -0.606 8.194) 9.076 25.261 ( -7.576 -6.072 -8.112) 12.652 25.261 ( -7.576 -6.072 8.112) 12.652 30.714 ( 1.692 -0.672 -4.350) 4.715 30.714 ( 1.692 -0.672 4.350) 4.715 32.357 ( 2.514 -7.609 -5.572) 9.760 32.357 ( 2.514 -7.609 5.572) 9.760 35.417 ( 10.716 4.843 -8.205) 14.339 35.417 ( 10.716 4.843 8.205) 14.339 39.232 ( -12.199 9.785 -21.398) 26.503 39.232 ( -12.199 9.785 21.398) 26.503 ======================= Grid point 1082 (310/343) ======================= q-point: (-0.31 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.881 ( 33.489 13.312 -12.944) 38.292 6.881 ( 33.489 13.312 12.944) 38.292 8.790 ( -1.947 17.312 -7.743) 19.064 8.790 ( -1.947 17.312 7.743) 19.064 10.887 ( -53.130 17.987 -20.233) 59.630 10.887 ( -53.130 17.987 20.233) 59.630 13.106 ( 9.133 18.861 -24.928) 32.566 13.106 ( 9.133 18.861 24.928) 32.566 14.920 ( -11.528 -1.388 -34.395) 36.302 14.920 ( -11.528 -1.388 34.395) 36.302 17.243 ( 11.949 -4.867 -22.510) 25.946 17.243 ( 11.949 -4.867 22.510) 25.946 17.642 ( 2.952 -24.808 -6.245) 25.752 17.642 ( 2.952 -24.808 6.245) 25.752 21.297 ( 5.737 20.755 -33.446) 39.779 21.297 ( 5.737 20.755 33.446) 39.779 23.707 ( -0.797 -14.644 -11.145) 18.421 23.707 ( -0.797 -14.644 11.145) 18.421 24.683 ( 3.817 -0.995 -11.895) 12.532 24.683 ( 3.817 -0.995 11.895) 12.532 25.348 ( -7.081 -13.543 -13.037) 20.087 25.348 ( -7.081 -13.543 13.037) 20.087 30.757 ( 5.390 -0.487 -3.546) 6.470 30.757 ( 5.390 -0.487 3.546) 6.470 32.507 ( 2.401 -6.936 -5.059) 8.915 32.507 ( 2.401 -6.936 5.059) 8.915 35.454 ( 15.107 5.410 -11.448) 19.712 35.454 ( 15.107 5.410 11.448) 19.712 38.889 ( -21.086 11.729 -18.963) 30.689 38.889 ( -21.086 11.729 18.963) 30.689 ======================= Grid point 1084 (311/343) ======================= q-point: (-0.23 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.991 ( 34.192 13.232 -13.584) 39.099 6.991 ( 34.192 13.232 13.584) 39.099 8.427 ( -2.789 22.750 -14.985) 27.384 8.427 ( -2.789 22.750 14.985) 27.384 10.015 ( -54.930 21.992 -19.399) 62.268 10.015 ( -54.930 21.992 19.399) 62.268 12.862 ( 6.937 19.025 -20.528) 28.835 12.862 ( 6.937 19.025 20.528) 28.835 14.849 ( -7.058 -0.873 -32.409) 33.180 14.849 ( -7.058 -0.873 32.409) 33.180 17.408 ( 8.770 -3.459 -31.735) 33.106 17.408 ( 8.770 -3.459 31.735) 33.106 18.130 ( 4.023 -27.979 -12.184) 30.781 18.130 ( 4.023 -27.979 12.184) 30.781 21.005 ( 3.121 18.933 -34.743) 39.689 21.005 ( 3.121 18.933 34.743) 39.689 23.898 ( -0.396 -8.610 -8.224) 11.913 23.898 ( -0.396 -8.610 8.224) 11.913 24.719 ( 2.480 0.570 -13.794) 14.027 24.719 ( 2.480 0.570 13.794) 14.027 25.575 ( -5.433 -20.604 -18.150) 27.990 25.575 ( -5.433 -20.604 18.150) 27.990 30.836 ( 8.760 -0.466 -4.526) 9.871 30.836 ( 8.760 -0.466 4.526) 9.871 32.619 ( -1.311 -5.674 -5.876) 8.273 32.619 ( -1.311 -5.674 5.876) 8.273 35.553 ( 21.114 3.547 -16.604) 27.094 35.553 ( 21.114 3.547 16.604) 27.094 38.439 ( -26.935 13.560 -16.143) 34.205 38.439 ( -26.935 13.560 16.143) 34.205 ======================= Grid point 1086 (312/343) ======================= q-point: (-0.15 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.113 ( 28.590 9.394 -14.222) 33.285 7.113 ( 28.590 9.394 14.222) 33.285 8.017 ( -1.128 23.016 -30.613) 38.317 8.017 ( -1.128 23.016 30.613) 38.317 9.116 ( -43.338 26.728 -16.669) 53.576 9.116 ( -43.338 26.728 16.669) 53.576 12.633 ( 3.936 14.574 -18.766) 24.084 12.633 ( 3.936 14.574 18.766) 24.084 14.808 ( -3.332 -0.332 -26.411) 26.622 14.808 ( -3.332 -0.332 26.411) 26.622 17.534 ( 4.693 -3.706 -34.209) 34.728 17.534 ( 4.693 -3.706 34.209) 34.728 18.612 ( 3.037 -25.002 -15.111) 29.370 18.612 ( 3.037 -25.002 15.111) 29.371 20.740 ( 1.103 15.211 -34.509) 37.728 20.740 ( 1.103 15.211 34.509) 37.728 23.989 ( -0.420 -3.321 -6.758) 7.541 23.989 ( -0.420 -3.321 6.758) 7.541 24.716 ( 1.182 1.706 -14.231) 14.381 24.716 ( 1.182 1.706 14.231) 14.381 25.892 ( -3.343 -21.664 -18.542) 28.711 25.892 ( -3.343 -21.664 18.542) 28.711 30.931 ( 8.114 -0.448 -6.206) 10.225 30.931 ( 8.114 -0.448 6.206) 10.225 32.669 ( -3.869 -3.696 -6.744) 8.609 32.669 ( -3.869 -3.696 6.744) 8.609 35.746 ( 21.688 -0.520 -23.339) 31.864 35.746 ( 21.688 -0.520 23.339) 31.864 37.939 ( -24.606 14.719 -12.913) 31.446 37.939 ( -24.606 14.719 12.913) 31.446 ======================= Grid point 1088 (313/343) ======================= q-point: (-0.08 0.08 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.199 ( 0.000 0.680 -18.829) 18.842 7.199 ( 0.000 0.680 18.829) 18.842 7.671 ( 0.000 17.493 -49.649) 52.640 7.671 ( 0.000 17.493 49.649) 52.640 8.378 ( 0.000 30.631 -15.000) 34.107 8.378 ( 0.000 30.631 15.000) 34.107 12.459 ( 0.000 8.888 -19.917) 21.810 12.459 ( 0.000 8.888 19.917) 21.810 14.795 ( -0.000 -0.039 -18.498) 18.498 14.795 ( -0.000 -0.039 18.498) 18.498 17.618 ( -0.000 -3.362 -32.099) 32.275 17.618 ( -0.000 -3.362 32.099) 32.275 18.995 ( -0.000 -18.611 -17.026) 25.224 18.995 ( -0.000 -18.611 17.026) 25.224 20.528 ( 0.000 10.795 -33.685) 35.373 20.528 ( 0.000 10.795 33.685) 35.373 24.016 ( -0.000 -0.593 -4.961) 4.997 24.016 ( -0.000 -0.593 4.961) 4.997 24.691 ( 0.000 1.925 -13.910) 14.042 24.691 ( 0.000 1.925 13.910) 14.042 26.204 ( -0.000 -17.338 -14.643) 22.694 26.204 ( -0.000 -17.338 14.643) 22.694 30.982 ( 0.000 0.090 -7.463) 7.464 30.982 ( 0.000 0.090 7.463) 7.464 32.691 ( -0.000 -2.119 -7.476) 7.770 32.691 ( -0.000 -2.119 7.476) 7.770 35.916 ( -0.000 -3.099 -29.182) 29.346 35.916 ( -0.000 -3.099 29.182) 29.346 37.557 ( 0.000 12.737 -9.486) 15.881 37.557 ( 0.000 12.737 9.486) 15.881 ======================= Grid point 1094 (314/343) ======================= q-point: ( 0.15 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.922 ( -11.594 0.000 -13.661) 17.918 5.922 ( -11.594 0.000 13.661) 17.918 7.979 ( 26.988 -0.000 -29.730) 40.153 7.979 ( 26.988 -0.000 29.730) 40.153 10.116 ( 64.595 -0.000 -21.519) 68.085 10.116 ( 64.595 -0.000 21.519) 68.085 12.028 ( -11.930 0.000 -17.010) 20.777 12.028 ( -11.930 0.000 17.010) 20.777 15.033 ( 11.832 -0.000 -7.602) 14.064 15.033 ( 11.832 -0.000 7.602) 14.064 17.323 ( -16.481 0.000 -26.902) 31.549 17.323 ( -16.481 0.000 26.902) 31.549 18.846 ( -23.864 0.000 -12.525) 26.952 18.846 ( -23.864 0.000 12.525) 26.952 20.426 ( 4.184 -0.000 -29.228) 29.526 20.426 ( 4.184 -0.000 29.228) 29.526 24.063 ( 1.380 -0.000 -2.816) 3.136 24.063 ( 1.380 -0.000 2.816) 3.136 24.562 ( -3.786 0.000 -11.841) 12.432 24.562 ( -3.786 0.000 11.841) 12.432 26.805 ( 9.017 -0.000 -1.762) 9.188 26.805 ( 9.017 -0.000 1.762) 9.188 30.301 ( -19.137 0.000 -9.825) 21.512 30.301 ( -19.137 0.000 9.825) 21.512 32.704 ( -25.054 0.000 -10.030) 26.987 32.704 ( -25.054 0.000 10.030) 26.987 34.897 ( -2.488 0.000 -16.098) 16.289 34.897 ( -2.488 0.000 16.098) 16.289 38.979 ( 44.332 -0.000 -31.753) 54.531 38.979 ( 44.332 -0.000 31.753) 54.531 ======================= Grid point 1096 (315/343) ======================= q-point: ( 0.23 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.946 ( 3.589 -6.925 -8.470) 11.514 5.946 ( 3.589 -6.925 8.470) 11.514 8.291 ( 30.785 -2.935 -27.390) 41.310 8.291 ( 30.785 -2.935 27.390) 41.310 10.779 ( 50.782 -8.952 -16.965) 54.284 10.779 ( 50.782 -8.952 16.965) 54.284 11.967 ( -6.237 -4.845 -15.899) 17.753 11.967 ( -6.237 -4.845 15.899) 17.753 15.163 ( 14.169 -0.214 -10.866) 17.857 15.163 ( 14.169 -0.214 10.866) 17.857 17.140 ( -18.519 1.127 -27.538) 33.205 17.140 ( -18.519 1.127 27.538) 33.205 18.532 ( -27.818 6.823 -11.590) 30.899 18.532 ( -27.818 6.823 11.590) 30.899 20.503 ( 4.662 -4.053 -30.895) 31.506 20.503 ( 4.662 -4.053 30.895) 31.506 24.066 ( 0.271 0.879 -4.405) 4.500 24.066 ( 0.271 0.879 4.405) 4.500 24.541 ( -3.580 -2.001 -11.234) 11.960 24.541 ( -3.580 -2.001 11.234) 11.960 26.754 ( 3.620 13.972 -9.841) 17.469 26.754 ( 3.620 13.972 9.841) 17.469 30.204 ( -11.419 -6.892 -10.454) 16.946 30.204 ( -11.419 -6.892 10.454) 16.946 32.395 ( -35.464 -0.339 -16.057) 38.932 32.395 ( -35.464 -0.339 16.057) 38.932 34.973 ( 12.254 -1.825 -17.677) 21.586 34.973 ( 12.254 -1.825 17.677) 21.586 39.369 ( 37.344 1.783 -35.382) 51.475 39.369 ( 37.344 1.783 35.382) 51.475 ======================= Grid point 1098 (316/343) ======================= q-point: ( 0.31 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.185 ( 16.794 -8.453 -6.476) 19.885 6.185 ( 16.794 -8.453 6.476) 19.885 8.665 ( 31.236 -4.815 -22.157) 38.598 8.665 ( 31.236 -4.815 22.157) 38.598 11.290 ( 13.550 -11.914 -12.227) 21.796 11.290 ( 13.550 -11.914 12.227) 21.796 12.149 ( 19.188 -11.185 -18.856) 29.134 12.149 ( 19.188 -11.185 18.856) 29.134 15.311 ( 14.659 -0.129 -14.615) 20.700 15.311 ( 14.659 -0.129 14.615) 20.700 16.928 ( -19.627 1.683 -26.746) 33.218 16.928 ( -19.627 1.683 26.746) 33.218 18.098 ( -28.421 11.168 -12.174) 32.873 18.098 ( -28.421 11.168 12.174) 32.873 20.657 ( 6.013 -8.409 -34.059) 35.594 20.657 ( 6.013 -8.409 34.059) 35.594 24.028 ( -1.794 3.129 -5.172) 6.306 24.028 ( -1.794 3.129 5.172) 6.306 24.558 ( -2.584 -3.527 -10.493) 11.368 24.558 ( -2.584 -3.527 10.493) 11.368 26.430 ( -3.682 23.626 -16.275) 28.924 26.430 ( -3.682 23.626 16.275) 28.924 30.293 ( -2.430 -10.871 -11.198) 15.795 30.293 ( -2.430 -10.871 11.198) 15.795 32.074 ( -34.838 -3.816 -19.238) 39.979 32.074 ( -34.838 -3.816 19.238) 39.979 35.151 ( 17.022 -1.292 -17.273) 24.285 35.151 ( 17.022 -1.292 17.273) 24.285 39.641 ( 28.679 4.632 -36.253) 46.457 39.641 ( 28.679 4.632 36.253) 46.457 ======================= Grid point 1100 (317/343) ======================= q-point: ( 0.38 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.515 ( 27.180 -4.286 -6.195) 28.205 6.515 ( 27.180 -4.286 6.195) 28.205 9.029 ( 27.813 -2.949 -13.461) 31.039 9.029 ( 27.813 -2.949 13.461) 31.039 11.502 ( -12.123 -16.474 -16.120) 26.042 11.502 ( -12.123 -16.474 16.120) 26.042 12.627 ( 31.480 -12.029 -21.524) 39.987 12.627 ( 31.480 -12.029 21.524) 39.987 15.427 ( 8.759 1.360 -15.706) 18.035 15.427 ( 8.759 1.360 15.706) 18.035 16.702 ( -19.906 1.855 -26.579) 33.259 16.702 ( -19.906 1.855 26.579) 33.259 17.652 ( -22.160 10.761 -14.244) 28.457 17.652 ( -22.160 10.761 14.244) 28.457 20.906 ( 9.198 -12.712 -36.223) 39.476 20.906 ( 9.198 -12.712 36.223) 39.476 23.918 ( -4.374 6.806 -4.820) 9.417 23.918 ( -4.374 6.806 4.820) 9.417 24.599 ( -1.268 -3.368 -9.310) 9.982 24.599 ( -1.268 -3.368 9.310) 9.982 25.955 ( -8.521 24.419 -16.930) 30.912 25.955 ( -8.521 24.419 16.930) 30.912 30.468 ( 1.774 -9.028 -11.420) 14.665 30.468 ( 1.774 -9.028 11.420) 14.665 31.871 ( -27.038 -9.120 -19.952) 34.818 31.871 ( -27.038 -9.120 19.952) 34.818 35.329 ( 16.809 0.331 -15.552) 22.902 35.329 ( 16.809 0.331 15.552) 22.902 39.775 ( 19.405 7.663 -35.192) 40.912 39.775 ( 19.405 7.663 35.192) 40.912 ======================= Grid point 1102 (318/343) ======================= q-point: ( 0.46 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.839 ( 34.640 2.121 -7.019) 35.408 6.839 ( 34.640 2.121 7.019) 35.408 9.273 ( 20.879 3.014 -4.209) 21.511 9.273 ( 20.879 3.014 4.209) 21.511 11.647 ( -19.549 -18.778 -22.479) 35.215 11.647 ( -19.549 -18.778 22.479) 35.215 13.086 ( 25.981 -8.421 -23.371) 35.946 13.086 ( 25.981 -8.421 23.371) 35.946 15.379 ( -9.165 5.536 -15.914) 19.181 15.379 ( -9.165 5.536 15.914) 19.181 16.516 ( -14.298 -1.580 -38.099) 40.725 16.516 ( -14.298 -1.580 38.099) 40.725 17.357 ( -8.749 5.877 -17.299) 20.257 17.357 ( -8.749 5.877 17.299) 20.257 21.256 ( 14.128 -15.224 -35.481) 41.113 21.256 ( 14.128 -15.224 35.481) 41.113 23.707 ( -7.824 11.385 -7.520) 15.728 23.707 ( -7.824 11.385 7.520) 15.728 24.636 ( 0.459 -1.354 -6.787) 6.936 24.636 ( 0.459 -1.354 6.787) 6.936 25.511 ( -10.201 16.628 -11.974) 22.890 25.511 ( -10.201 16.628 11.974) 22.890 30.594 ( -0.183 -4.945 -11.719) 12.721 30.594 ( -0.183 -4.945 11.719) 12.721 31.858 ( -14.575 -13.534 -18.027) 26.843 31.858 ( -14.575 -13.534 18.027) 26.843 35.463 ( 14.765 2.129 -13.173) 19.902 35.463 ( 14.765 2.129 13.173) 19.902 39.769 ( 10.164 10.545 -33.007) 36.110 39.769 ( 10.164 10.545 33.007) 36.110 ======================= Grid point 1104 (319/343) ======================= q-point: ( 0.54 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.117 ( 39.216 8.122 -8.220) 40.883 7.117 ( 39.216 8.122 8.220) 40.883 9.342 ( 13.863 8.630 -1.898) 16.440 9.342 ( 13.863 8.630 1.898) 16.440 11.668 ( -28.460 -9.335 -24.021) 38.394 11.668 ( -28.460 -9.335 24.021) 38.394 13.406 ( 19.348 -3.132 -24.654) 31.496 13.406 ( 19.348 -3.132 24.654) 31.496 15.101 ( -22.829 5.547 -20.492) 31.175 15.101 ( -22.829 5.547 20.492) 31.175 16.512 ( -6.213 -10.010 -42.104) 43.722 16.512 ( -6.213 -10.010 42.104) 43.722 17.269 ( 2.050 1.821 -17.449) 17.663 17.269 ( 2.050 1.821 17.449) 17.663 21.656 ( 19.448 -11.168 -29.815) 37.308 21.656 ( 19.448 -11.168 29.815) 37.308 23.409 ( -12.145 10.861 -10.771) 19.531 23.409 ( -12.145 10.861 10.771) 19.531 24.654 ( 2.748 0.785 -2.558) 3.835 24.654 ( 2.748 0.785 2.558) 3.835 25.226 ( -10.308 5.597 -6.445) 13.383 25.226 ( -10.308 5.597 6.445) 13.383 30.643 ( -2.448 -3.305 -11.293) 12.018 30.643 ( -2.448 -3.305 11.293) 12.018 32.005 ( -3.955 -13.967 -14.525) 20.535 32.005 ( -3.955 -13.967 14.525) 20.535 35.550 ( 12.661 3.515 -10.828) 17.027 35.550 ( 12.661 3.515 10.828) 17.027 39.627 ( 1.443 13.271 -30.318) 33.127 39.627 ( 1.443 13.271 30.318) 33.127 ======================= Grid point 1106 (320/343) ======================= q-point: (-0.38 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.336 ( 40.484 12.734 -8.858) 43.354 7.336 ( 40.484 12.734 8.858) 43.354 9.278 ( 10.299 12.814 -3.978) 16.914 9.278 ( 10.299 12.814 3.978) 16.914 11.340 ( -42.660 6.804 -21.952) 48.457 11.340 ( -42.660 6.804 21.952) 48.457 13.549 ( 13.355 5.963 -27.101) 30.796 13.549 ( 13.355 5.963 27.101) 30.796 14.850 ( -18.833 -1.445 -29.638) 35.145 14.850 ( -18.833 -1.445 29.638) 35.145 16.717 ( -2.254 -19.432 -33.030) 38.388 16.717 ( -2.254 -19.432 33.030) 38.388 17.303 ( 5.734 -0.523 -19.909) 20.725 17.303 ( 5.734 -0.523 19.909) 20.725 21.905 ( 19.925 8.151 -22.896) 31.427 21.905 ( 19.925 8.151 22.896) 31.427 23.216 ( -12.801 -6.322 -11.057) 18.058 23.216 ( -12.801 -6.322 11.057) 18.058 24.675 ( 4.720 0.857 -5.574) 7.354 24.675 ( 4.720 0.857 5.574) 7.354 25.102 ( -10.060 -2.051 -6.913) 12.377 25.102 ( -10.060 -2.051 6.913) 12.377 30.679 ( -1.304 -3.744 -9.759) 10.534 30.679 ( -1.304 -3.744 9.759) 10.534 32.210 ( 0.846 -11.678 -11.531) 16.433 32.210 ( 0.846 -11.678 11.531) 16.433 35.604 ( 11.590 3.966 -9.958) 15.787 35.604 ( 11.590 3.966 9.958) 15.787 39.360 ( -6.124 15.935 -27.520) 32.385 39.360 ( -6.124 15.935 27.520) 32.385 ======================= Grid point 1108 (321/343) ======================= q-point: (-0.31 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.484 ( 36.837 15.331 -8.003) 40.695 7.484 ( 36.837 15.331 8.003) 40.695 9.126 ( 11.242 18.221 -6.111) 22.265 9.126 ( 11.242 18.221 6.111) 22.265 10.657 ( -52.291 16.748 -19.461) 58.254 10.657 ( -52.291 16.748 19.461) 58.254 13.473 ( 7.781 14.868 -27.348) 32.086 13.473 ( 7.781 14.868 27.348) 32.086 14.768 ( -10.068 -4.415 -37.856) 39.420 14.768 ( -10.068 -4.415 37.856) 39.420 17.099 ( 2.175 -25.455 -20.782) 32.933 17.099 ( 2.175 -25.455 20.782) 32.933 17.385 ( 3.510 -3.997 -23.336) 23.935 17.385 ( 3.510 -3.997 23.336) 23.935 21.756 ( 10.480 24.495 -30.796) 40.721 21.756 ( 10.480 24.495 30.796) 40.721 23.383 ( -5.085 -20.664 -17.672) 27.662 23.383 ( -5.085 -20.664 17.673) 27.662 24.718 ( 4.985 0.124 -10.736) 11.837 24.718 ( 4.985 0.124 10.736) 11.837 25.091 ( -8.591 -8.025 -10.070) 15.480 25.091 ( -8.591 -8.025 10.070) 15.480 30.749 ( 1.519 -4.474 -7.594) 8.944 30.749 ( 1.519 -4.474 7.594) 8.944 32.391 ( 1.029 -8.689 -9.770) 13.115 32.391 ( 1.029 -8.689 9.770) 13.115 35.657 ( 11.591 2.941 -12.551) 17.335 35.657 ( 11.591 2.941 12.551) 17.335 38.985 ( -11.286 18.534 -24.821) 32.969 38.985 ( -11.286 18.534 24.821) 32.969 ======================= Grid point 1110 (322/343) ======================= q-point: (-0.23 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.537 ( 24.746 15.152 -8.029) 30.107 7.537 ( 24.746 15.152 8.029) 30.107 8.880 ( 12.661 26.394 -22.671) 37.026 8.880 ( 12.661 26.394 22.671) 37.026 9.861 ( -44.413 18.436 -14.631) 50.264 9.861 ( -44.413 18.436 14.631) 50.264 13.238 ( 3.673 19.245 -24.116) 31.072 13.238 ( 3.673 19.245 24.116) 31.072 14.764 ( -4.082 -2.930 -38.708) 39.033 14.764 ( -4.082 -2.930 38.708) 39.033 17.423 ( 5.766 -3.577 -27.634) 28.454 17.423 ( 5.766 -3.577 27.634) 28.454 17.648 ( -1.318 -30.344 -11.964) 32.644 17.648 ( -1.318 -30.344 11.964) 32.644 21.402 ( 3.548 24.565 -34.347) 42.376 21.402 ( 3.548 24.565 34.347) 42.376 23.683 ( -0.985 -16.827 -13.549) 21.626 23.683 ( -0.985 -16.827 13.549) 21.626 24.751 ( 2.356 0.593 -13.608) 13.823 24.751 ( 2.356 0.593 13.608) 13.823 25.222 ( -4.271 -15.638 -15.310) 22.297 25.222 ( -4.271 -15.638 15.310) 22.297 30.849 ( 2.983 -4.527 -5.587) 7.785 30.849 ( 2.983 -4.527 5.587) 7.785 32.514 ( -0.543 -5.904 -8.855) 10.657 32.514 ( -0.543 -5.904 8.855) 10.657 35.738 ( 10.052 0.302 -18.199) 20.793 35.738 ( 10.052 0.302 18.199) 20.793 38.542 ( -11.203 20.653 -22.232) 32.346 38.542 ( -11.203 20.653 22.232) 32.346 ======================= Grid point 1112 (323/343) ======================= q-point: (-0.15 0.15 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.438 ( 0.000 12.287 -12.998) 17.887 7.438 ( 0.000 12.287 12.998) 17.887 8.471 ( 0.000 29.273 -43.353) 52.311 8.471 ( 0.000 29.273 43.353) 52.311 9.293 ( 0.000 21.703 -12.549) 25.069 9.293 ( 0.000 21.703 12.549) 25.069 12.934 ( 0.000 18.810 -20.527) 27.842 12.934 ( 0.000 18.810 20.527) 27.842 14.779 ( -0.000 -1.271 -33.980) 34.004 14.779 ( -0.000 -1.271 33.980) 34.004 17.499 ( -0.000 -3.248 -34.026) 34.181 17.499 ( -0.000 -3.248 34.026) 34.181 18.161 ( -0.000 -30.125 -14.362) 33.374 18.161 ( -0.000 -30.125 14.362) 33.374 21.043 ( 0.000 20.249 -34.966) 40.406 21.043 ( 0.000 20.249 34.966) 40.406 23.891 ( -0.000 -8.794 -9.110) 12.662 23.891 ( -0.000 -8.794 9.110) 12.662 24.746 ( 0.000 1.156 -14.340) 14.386 24.746 ( 0.000 1.156 14.340) 14.386 25.514 ( -0.000 -21.104 -19.113) 28.473 25.514 ( -0.000 -21.104 19.113) 28.473 30.935 ( -0.000 -3.272 -4.917) 5.906 30.935 ( -0.000 -3.272 4.917) 5.906 32.589 ( -0.000 -4.049 -7.926) 8.900 32.589 ( -0.000 -4.049 7.926) 8.900 35.817 ( -0.000 -2.269 -23.801) 23.909 35.817 ( -0.000 -2.269 23.801) 23.909 38.127 ( 0.000 20.573 -18.900) 27.937 38.127 ( 0.000 20.573 18.900) 27.937 ======================= Grid point 1122 (324/343) ======================= q-point: ( 0.23 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 5.989 ( 17.425 -0.000 -0.583) 17.434 5.989 ( 17.425 -0.000 0.583) 17.434 8.594 ( 34.559 -0.000 -26.738) 43.696 8.594 ( 34.559 -0.000 26.738) 43.696 11.086 ( 21.404 -0.000 -8.631) 23.079 11.086 ( 21.404 -0.000 8.631) 23.079 11.956 ( 16.739 -0.000 -17.850) 24.470 11.956 ( 16.739 -0.000 17.850) 24.470 15.309 ( 15.588 -0.000 -9.398) 18.202 15.309 ( 15.588 -0.000 9.398) 18.202 16.956 ( -20.463 0.000 -25.602) 32.775 16.956 ( -20.463 0.000 25.602) 32.775 18.297 ( -30.865 0.000 -8.729) 32.076 18.297 ( -30.865 0.000 8.729) 32.076 20.513 ( 4.367 -0.000 -31.988) 32.285 20.513 ( 4.367 -0.000 31.988) 32.285 24.074 ( -0.347 0.000 -6.151) 6.161 24.074 ( -0.346 0.000 6.151) 6.161 24.487 ( -3.678 0.000 -10.293) 10.930 24.487 ( -3.678 0.000 10.293) 10.930 26.896 ( -0.659 0.000 -2.167) 2.265 26.896 ( -0.659 0.000 2.167) 2.265 30.053 ( -5.320 0.000 -9.813) 11.162 30.053 ( -5.320 0.000 9.813) 11.162 32.008 ( -40.130 0.000 -19.954) 44.817 32.008 ( -40.130 0.000 19.954) 44.817 35.131 ( 20.737 -0.000 -19.931) 28.763 35.131 ( 20.737 -0.000 19.931) 28.763 39.728 ( 31.696 -0.000 -39.547) 50.681 39.728 ( 31.696 -0.000 39.547) 50.681 ======================= Grid point 1124 (325/343) ======================= q-point: ( 0.31 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.277 ( 28.528 -6.655 -6.032) 29.909 6.277 ( 28.528 -6.655 6.032) 29.909 8.948 ( 34.669 -1.331 -24.293) 42.354 8.948 ( 34.669 -1.331 24.293) 42.354 11.159 ( -9.911 -4.186 -5.238) 11.966 11.159 ( -9.911 -4.186 5.238) 11.966 12.304 ( 38.484 -6.000 -18.402) 43.077 12.304 ( 38.484 -6.000 18.402) 43.077 15.456 ( 14.031 0.435 -11.579) 18.198 15.456 ( 14.031 0.435 11.579) 18.198 16.745 ( -21.403 0.583 -22.661) 31.176 16.745 ( -21.403 0.583 22.661) 31.176 17.947 ( -29.662 5.403 -8.222) 31.250 17.947 ( -29.662 5.403 8.222) 31.251 20.597 ( 4.718 -5.100 -35.650) 36.321 20.597 ( 4.718 -5.100 35.650) 36.321 24.052 ( -1.617 1.752 -7.704) 8.064 24.052 ( -1.617 1.752 7.704) 8.064 24.475 ( -3.254 -2.663 -9.712) 10.583 24.475 ( -3.254 -2.663 9.712) 10.583 26.723 ( -6.363 16.081 -10.817) 20.398 26.723 ( -6.363 16.081 10.817) 20.398 30.116 ( 1.762 -8.934 -10.738) 14.079 30.116 ( 1.762 -8.934 10.738) 14.079 31.650 ( -36.943 -3.458 -21.779) 43.024 31.650 ( -36.943 -3.458 21.779) 43.024 35.345 ( 22.110 0.415 -20.530) 30.175 35.345 ( 22.110 0.415 20.530) 30.175 39.977 ( 24.669 3.565 -40.971) 47.958 39.977 ( 24.669 3.565 40.971) 47.958 ======================= Grid point 1126 (326/343) ======================= q-point: ( 0.38 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.729 ( 36.608 -7.790 -7.961) 38.265 6.729 ( 36.608 -7.790 7.961) 38.265 9.302 ( 31.804 -1.248 -18.225) 36.677 9.302 ( 31.804 -1.248 18.225) 36.677 11.113 ( -19.530 -9.384 -11.469) 24.516 11.113 ( -19.530 -9.384 11.469) 24.516 12.802 ( 36.283 -7.737 -18.625) 41.512 12.802 ( 36.283 -7.737 18.625) 41.512 15.529 ( 3.893 3.201 -15.152) 15.968 15.529 ( 3.893 3.201 15.152) 15.968 16.523 ( -20.930 0.718 -23.845) 31.736 16.523 ( -20.930 0.718 23.845) 31.736 17.584 ( -20.573 6.744 -11.035) 24.301 17.584 ( -20.573 6.744 11.035) 24.301 20.787 ( 6.970 -11.176 -39.339) 41.485 20.787 ( 6.970 -11.176 39.339) 41.485 23.977 ( -3.101 4.771 -8.174) 9.959 23.977 ( -3.101 4.771 8.174) 9.959 24.508 ( -2.714 -4.704 -9.570) 11.003 24.508 ( -2.714 -4.704 9.570) 11.003 26.286 ( -9.842 25.103 -16.865) 31.803 26.286 ( -9.842 25.103 16.865) 31.803 30.329 ( 4.429 -10.864 -12.869) 17.415 30.329 ( 4.429 -10.864 12.869) 17.415 31.431 ( -28.411 -9.904 -22.163) 37.369 31.431 ( -28.411 -9.904 22.163) 37.369 35.534 ( 19.975 1.927 -19.674) 28.103 35.534 ( 19.975 1.927 19.674) 28.103 40.089 ( 17.235 7.734 -40.381) 44.581 40.089 ( 17.235 7.734 40.381) 44.581 ======================= Grid point 1128 (327/343) ======================= q-point: ( 0.46 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.211 ( 41.415 -3.212 -8.158) 42.333 7.211 ( 41.415 -3.212 8.158) 42.333 9.576 ( 26.065 3.620 -8.061) 27.522 9.576 ( 26.065 3.620 8.061) 27.522 11.122 ( -22.754 -16.749 -20.528) 34.924 11.122 ( -22.754 -16.749 20.528) 34.924 13.234 ( 28.118 -5.818 -20.568) 35.320 13.234 ( 28.118 -5.818 20.568) 35.320 15.368 ( -17.115 8.798 -19.225) 27.202 15.368 ( -17.115 8.798 19.225) 27.202 16.343 ( -15.352 -1.624 -41.089) 43.893 16.343 ( -15.352 -1.624 41.089) 43.893 17.367 ( -5.317 3.796 -13.501) 14.999 17.367 ( -5.317 3.796 13.501) 14.999 21.111 ( 11.102 -17.114 -40.532) 45.376 21.111 ( 11.102 -17.114 40.532) 45.376 23.820 ( -5.282 9.724 -8.477) 13.940 23.820 ( -5.282 9.724 8.477) 13.940 24.570 ( -1.920 -5.248 -9.468) 10.995 24.570 ( -1.920 -5.248 9.468) 10.995 25.759 ( -10.189 24.686 -16.871) 31.589 25.759 ( -10.189 24.686 16.871) 31.589 30.495 ( -0.792 -6.076 -15.935) 17.072 30.495 ( -0.792 -6.076 15.935) 17.072 31.453 ( -13.901 -17.654 -20.885) 30.677 31.453 ( -13.901 -17.654 20.885) 30.677 35.667 ( 16.322 3.512 -17.618) 24.273 35.667 ( 16.322 3.512 17.618) 24.273 40.059 ( 10.019 11.820 -38.575) 41.571 40.059 ( 10.019 11.820 38.575) 41.571 ======================= Grid point 1130 (328/343) ======================= q-point: ( 0.54 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.624 ( 42.022 3.353 -7.731) 42.858 7.624 ( 42.022 3.353 7.731) 42.858 9.680 ( 20.031 10.488 -1.598) 22.667 9.680 ( 20.031 10.488 1.598) 22.667 11.172 ( -27.587 -15.797 -24.860) 40.356 11.172 ( -27.587 -15.797 24.860) 40.356 13.547 ( 20.767 -3.164 -21.729) 30.223 13.547 ( 20.767 -3.164 21.729) 30.223 14.968 ( -28.212 8.955 -20.753) 36.150 14.968 ( -28.212 8.955 20.753) 36.150 16.290 ( -9.776 -6.801 -48.847) 50.278 16.290 ( -9.776 -6.801 48.847) 50.278 17.327 ( 3.910 1.418 -13.870) 14.480 17.327 ( 3.910 1.418 13.870) 14.480 21.563 ( 15.943 -20.670 -37.894) 46.015 21.563 ( 15.943 -20.670 37.894) 46.015 23.535 ( -9.281 16.116 -12.400) 22.352 23.535 ( -9.281 16.116 12.400) 22.352 24.640 ( -0.315 -4.346 -8.506) 9.557 24.640 ( -0.315 -4.346 8.506) 9.557 25.315 ( -8.603 16.773 -11.758) 22.218 25.315 ( -8.603 16.773 11.758) 22.218 30.541 ( -4.876 -4.215 -17.034) 18.213 30.541 ( -4.876 -4.215 17.034) 18.213 31.695 ( -2.606 -19.240 -18.108) 26.549 31.695 ( -2.606 -19.240 18.108) 26.549 35.741 ( 12.356 4.417 -14.742) 19.736 35.741 ( 12.356 4.417 14.742) 19.736 39.897 ( 3.562 15.564 -36.184) 39.550 39.897 ( 3.562 15.564 36.184) 39.550 ======================= Grid point 1132 (329/343) ======================= q-point: (-0.38 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.910 ( 36.566 8.964 -6.390) 38.187 7.910 ( 36.566 8.964 6.390) 38.187 9.660 ( 20.135 14.415 -4.550) 25.178 9.660 ( 20.135 14.415 4.550) 25.178 10.993 ( -39.228 -0.125 -22.150) 45.050 10.993 ( -39.228 -0.125 22.150) 45.050 13.742 ( 14.512 1.420 -23.667) 27.798 13.742 ( 14.512 1.420 23.667) 27.798 14.631 ( -21.657 -0.342 -24.944) 33.035 14.631 ( -21.657 -0.342 24.944) 33.035 16.384 ( -5.997 -14.356 -43.278) 45.989 16.384 ( -5.997 -14.356 43.278) 45.989 17.362 ( 5.234 0.513 -16.179) 17.012 17.362 ( 5.234 0.513 16.179) 17.012 22.072 ( 21.493 -16.362 -29.617) 40.086 22.072 ( 21.493 -16.362 29.618) 40.086 23.127 ( -15.945 15.828 -15.898) 27.524 23.127 ( -15.945 15.828 15.898) 27.524 24.709 ( 2.453 -2.789 -6.083) 7.128 24.709 ( 2.453 -2.789 6.083) 7.128 25.041 ( -7.578 7.021 -6.955) 12.454 25.041 ( -7.578 7.021 6.955) 12.454 30.574 ( -3.607 -5.363 -15.620) 16.905 30.574 ( -3.607 -5.363 15.620) 16.905 31.990 ( 1.194 -16.108 -15.531) 22.408 31.990 ( 1.194 -16.108 15.531) 22.408 35.771 ( 8.781 4.148 -12.022) 15.455 35.771 ( 8.781 4.148 12.022) 15.455 39.619 ( -1.367 18.887 -33.588) 38.558 39.619 ( -1.367 18.887 33.588) 38.558 ======================= Grid point 1134 (330/343) ======================= q-point: (-0.31 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.025 ( 22.541 12.700 -6.084) 26.578 8.025 ( 22.541 12.700 6.084) 26.578 9.627 ( 28.600 17.992 -10.450) 35.368 9.627 ( 28.600 17.992 10.450) 35.368 10.424 ( -47.634 14.450 -17.939) 52.912 10.424 ( -47.634 14.450 17.939) 52.912 13.747 ( 5.926 10.070 -27.745) 30.105 13.747 ( 5.926 10.070 27.745) 30.105 14.572 ( -8.065 -8.262 -35.524) 37.353 14.572 ( -8.065 -8.262 35.524) 37.353 16.661 ( -2.100 -23.746 -31.208) 39.272 16.661 ( -2.100 -23.746 31.208) 39.272 17.401 ( 3.016 -0.180 -20.657) 20.877 17.401 ( 3.016 -0.180 20.657) 20.877 22.291 ( 16.204 22.682 -24.957) 37.415 22.291 ( 16.204 22.682 24.957) 37.415 22.939 ( -13.081 -20.805 -22.150) 33.085 22.939 ( -13.081 -20.805 22.150) 33.085 24.780 ( 5.998 -0.166 -6.177) 8.612 24.780 ( 5.998 -0.166 6.177) 8.612 24.918 ( -8.262 -1.888 -6.614) 10.750 24.918 ( -8.262 -1.888 6.614) 10.750 30.653 ( -0.899 -6.648 -12.854) 14.499 30.653 ( -0.899 -6.648 12.854) 14.499 32.234 ( 1.033 -11.751 -13.451) 17.891 32.234 ( 1.033 -11.751 13.451) 17.891 35.783 ( 5.348 2.606 -11.878) 13.285 35.783 ( 5.348 2.606 11.878) 13.285 39.255 ( -3.364 21.583 -30.865) 37.813 39.255 ( -3.364 21.583 30.865) 37.813 ======================= Grid point 1136 (331/343) ======================= q-point: (-0.23 0.23 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.913 ( 0.000 14.628 -9.119) 17.237 7.913 ( 0.000 14.628 9.119) 17.237 9.493 ( 0.000 29.651 -35.489) 46.246 9.493 ( 0.000 29.651 35.489) 46.246 9.822 ( 0.000 12.164 -13.229) 17.971 9.822 ( 0.000 12.164 13.229) 17.971 13.553 ( 0.000 15.938 -27.107) 31.445 13.553 ( 0.000 15.938 27.107) 31.445 14.667 ( -0.000 -6.366 -40.663) 41.158 14.667 ( -0.000 -6.366 40.663) 41.158 17.112 ( -0.000 -30.542 -20.483) 36.774 17.112 ( -0.000 -30.542 20.483) 36.774 17.425 ( -0.000 -1.070 -25.919) 25.941 17.425 ( -0.000 -1.070 25.919) 25.941 21.874 ( 0.000 29.322 -32.902) 44.071 21.874 ( 0.000 29.322 32.902) 44.071 23.323 ( -0.000 -25.167 -21.486) 33.091 23.323 ( -0.000 -25.167 21.486) 33.091 24.786 ( 0.000 2.051 -12.912) 13.073 24.786 ( 0.000 2.051 12.912) 13.074 24.984 ( -0.000 -10.170 -11.429) 15.299 24.984 ( -0.000 -10.170 11.429) 15.299 30.765 ( -0.000 -6.644 -9.274) 11.408 30.765 ( -0.000 -6.644 9.274) 11.408 32.401 ( -0.000 -7.929 -11.432) 13.913 32.401 ( -0.000 -7.929 11.432) 13.913 35.786 ( 0.000 0.574 -15.313) 15.324 35.786 ( 0.000 0.574 15.313) 15.324 38.861 ( 0.000 22.836 -27.544) 35.779 38.861 ( 0.000 22.836 27.544) 35.779 ======================= Grid point 1150 (332/343) ======================= q-point: ( 0.31 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.541 ( 36.816 -0.000 -12.199) 38.785 6.541 ( 36.816 -0.000 12.199) 38.785 9.262 ( 30.378 -0.000 -24.964) 39.319 9.262 ( 30.378 -0.000 24.964) 39.319 10.997 ( -15.208 0.000 -0.977) 15.240 10.997 ( -15.208 0.000 0.977) 15.240 12.654 ( 40.952 -0.000 -15.870) 43.920 12.654 ( 40.952 -0.000 15.870) 43.920 15.583 ( 9.575 -0.000 -12.863) 16.035 15.583 ( 9.575 -0.000 12.863) 16.035 16.534 ( -22.291 0.000 -13.848) 26.242 16.534 ( -22.291 0.000 13.848) 26.242 17.714 ( -25.496 0.000 -0.870) 25.511 17.714 ( -25.496 0.000 0.870) 25.511 20.591 ( 3.502 -0.000 -39.441) 39.596 20.591 ( 3.502 -0.000 39.441) 39.596 24.051 ( -1.778 0.000 -9.492) 9.658 24.051 ( -1.778 0.000 9.492) 9.658 24.417 ( -3.614 0.000 -9.328) 10.004 24.417 ( -3.614 0.000 9.328) 10.004 26.791 ( -8.815 0.000 -2.814) 9.253 26.791 ( -8.815 0.000 2.814) 9.253 30.071 ( 5.558 -0.000 -8.143) 9.859 30.071 ( 5.558 -0.000 8.143) 9.859 31.270 ( -33.302 0.000 -21.968) 39.895 31.270 ( -33.302 0.000 21.968) 39.895 35.570 ( 22.063 -0.000 -22.470) 31.491 35.570 ( 22.063 -0.000 22.470) 31.491 40.226 ( 19.409 -0.000 -43.081) 47.251 40.226 ( 19.409 -0.000 43.081) 47.251 ======================= Grid point 1152 (333/343) ======================= q-point: ( 0.38 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 6.989 ( 42.099 -6.522 -14.407) 44.971 6.989 ( 42.099 -6.522 14.407) 44.971 9.534 ( 19.457 -3.252 -23.348) 30.567 9.534 ( 19.457 -3.252 23.348) 30.567 10.867 ( -11.833 -0.534 -5.456) 13.041 10.867 ( -11.833 -0.534 5.456) 13.041 13.068 ( 36.062 -3.281 -14.822) 39.127 13.068 ( 36.062 -3.281 14.822) 39.127 15.595 ( -3.852 3.938 -19.585) 20.345 15.595 ( -3.852 3.938 19.585) 20.345 16.319 ( -20.913 -0.361 -17.223) 27.095 16.319 ( -20.913 -0.361 17.223) 27.095 17.488 ( -13.854 2.572 -7.590) 16.005 17.488 ( -13.854 2.572 7.590) 16.005 20.683 ( 3.985 -7.196 -43.981) 44.744 20.683 ( 3.985 -7.196 43.981) 44.744 24.013 ( -1.993 2.503 -10.210) 10.699 24.013 ( -1.993 2.503 10.210) 10.699 24.407 ( -3.786 -3.178 -9.679) 10.868 24.407 ( -3.786 -3.178 9.679) 10.868 26.551 ( -9.744 16.837 -11.282) 22.488 26.551 ( -9.744 16.837 11.282) 22.488 30.215 ( 6.554 -8.519 -9.869) 14.591 30.215 ( 6.554 -8.519 9.869) 14.591 31.022 ( -25.910 -6.250 -20.661) 33.724 31.022 ( -25.910 -6.250 20.661) 33.724 35.761 ( 19.118 1.691 -22.889) 29.871 35.761 ( 19.118 1.691 22.889) 29.871 40.350 ( 13.782 4.831 -43.175) 45.578 40.350 ( 13.782 4.831 43.175) 45.578 ======================= Grid point 1154 (334/343) ======================= q-point: ( 0.46 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.539 ( 43.877 -7.215 -12.412) 46.166 7.539 ( 43.877 -7.215 12.412) 46.166 9.753 ( 6.680 -7.539 -18.852) 21.374 9.753 ( 6.680 -7.539 18.852) 21.374 10.787 ( -6.837 -0.964 -10.614) 12.663 10.787 ( -6.837 -0.964 10.614) 12.663 13.442 ( 28.896 -2.873 -16.423) 33.361 13.442 ( 28.896 -2.873 16.423) 33.361 15.335 ( -23.099 10.826 -23.565) 34.728 15.335 ( -23.099 10.826 23.565) 34.728 16.162 ( -14.764 -2.216 -41.080) 43.709 16.162 ( -14.764 -2.216 41.080) 43.709 17.383 ( -0.653 1.734 -10.803) 10.961 17.383 ( -0.653 1.734 10.803) 10.961 20.920 ( 6.228 -15.406 -46.342) 49.232 20.920 ( 6.228 -15.406 46.342) 49.232 23.919 ( -2.547 6.618 -9.963) 12.229 23.919 ( -2.547 6.618 9.963) 12.229 24.447 ( -3.492 -5.753 -10.650) 12.598 24.447 ( -3.492 -5.753 10.650) 12.598 26.095 ( -8.549 25.434 -17.100) 31.818 26.095 ( -8.549 25.434 17.100) 31.818 30.388 ( -0.213 -5.942 -17.654) 18.628 30.388 ( -0.213 -5.942 17.654) 18.628 31.025 ( -11.922 -17.674 -19.358) 28.796 31.025 ( -11.922 -17.674 19.358) 28.796 35.883 ( 14.657 3.649 -21.729) 26.463 35.883 ( 14.657 3.649 21.729) 26.463 40.335 ( 8.404 9.919 -41.981) 43.948 40.335 ( 8.404 9.919 41.981) 43.948 ======================= Grid point 1156 (335/343) ======================= q-point: ( 0.54 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.032 ( 38.749 -1.715 -8.159) 39.636 8.032 ( 38.749 -1.715 8.159) 39.636 9.914 ( 3.232 -6.270 -14.583) 16.200 9.914 ( 3.232 -6.270 14.583) 16.200 10.752 ( -9.837 -3.293 -16.043) 19.104 10.752 ( -9.837 -3.293 16.043) 19.104 13.722 ( 22.078 -0.823 -18.424) 28.767 13.722 ( 22.078 -0.823 18.424) 28.767 14.858 ( -29.617 12.350 -21.727) 38.752 14.858 ( -29.617 12.350 21.727) 38.752 16.101 ( -9.335 -4.620 -52.194) 53.223 16.101 ( -9.335 -4.620 52.194) 53.223 17.388 ( 4.259 0.877 -10.934) 11.767 17.388 ( 4.259 0.877 10.934) 11.767 21.312 ( 8.414 -22.702 -44.933) 51.041 21.312 ( 8.414 -22.702 44.933) 51.041 23.724 ( -3.996 13.521 -10.681) 17.688 23.724 ( -3.996 13.521 10.681) 17.688 24.525 ( -2.329 -6.959 -11.580) 13.710 24.525 ( -2.329 -6.959 11.580) 13.710 25.596 ( -5.822 24.565 -16.887) 30.373 25.596 ( -5.822 24.565 16.887) 30.373 30.424 ( -4.982 -3.581 -21.414) 22.276 30.424 ( -4.981 -3.581 21.414) 22.276 31.322 ( -1.378 -22.947 -18.883) 29.749 31.322 ( -1.378 -22.947 18.883) 29.749 35.929 ( 9.645 4.972 -19.123) 21.987 35.929 ( 9.645 4.972 19.123) 21.987 40.190 ( 3.789 14.621 -40.078) 42.830 40.190 ( 3.789 14.621 40.078) 42.830 ======================= Grid point 1158 (336/343) ======================= q-point: ( 0.62 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.315 ( 22.634 4.578 -5.176) 23.665 8.315 ( 22.634 4.578 5.176) 23.665 10.045 ( 16.733 1.512 -15.583) 22.915 10.045 ( 16.733 1.512 15.583) 22.915 10.627 ( -24.603 0.564 -16.569) 29.668 10.627 ( -24.603 0.564 16.569) 29.668 13.906 ( 15.298 1.286 -20.333) 25.478 13.906 ( 15.298 1.286 20.333) 25.478 14.445 ( -21.195 4.439 -21.122) 30.250 14.445 ( -21.195 4.439 21.122) 30.250 16.141 ( -4.427 -8.726 -52.296) 53.203 16.141 ( -4.427 -8.726 52.296) 53.203 17.413 ( 3.031 0.687 -12.646) 13.022 17.413 ( 3.031 0.687 12.646) 13.022 21.818 ( 8.041 -27.725 -40.568) 49.790 21.818 ( 8.041 -27.725 40.568) 49.790 23.379 ( -5.194 22.597 -16.305) 28.345 23.379 ( -5.194 22.597 16.305) 28.345 24.626 ( -0.659 -6.864 -11.827) 13.691 24.626 ( -0.659 -6.864 11.827) 13.691 25.201 ( -2.831 17.405 -12.675) 21.717 25.201 ( -2.831 17.405 12.675) 21.717 30.452 ( -2.946 -4.966 -20.245) 21.052 30.452 ( -2.946 -4.966 20.245) 21.052 31.693 ( 0.767 -20.855 -17.585) 27.290 31.693 ( 0.767 -20.855 17.585) 27.290 35.914 ( 4.739 5.062 -15.545) 17.022 35.914 ( 4.739 5.062 15.545) 17.022 39.933 ( 0.620 18.522 -37.752) 42.055 39.933 ( 0.620 18.522 37.752) 42.055 ======================= Grid point 1160 (337/343) ======================= q-point: (-0.31 0.31 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.315 ( 0.000 8.759 -6.142) 10.698 8.315 ( 0.000 8.759 6.142) 10.698 10.192 ( 0.000 7.477 -27.825) 28.812 10.192 ( 0.000 7.477 27.825) 28.812 10.236 ( 0.000 13.781 -9.288) 16.619 10.236 ( 0.000 13.781 9.288) 16.619 13.921 ( 0.000 6.495 -26.433) 27.220 13.921 ( 0.000 6.495 26.433) 27.220 14.376 ( -0.000 -7.755 -28.573) 29.607 14.376 ( -0.000 -7.756 28.573) 29.607 16.319 ( -0.000 -15.656 -43.807) 46.521 16.319 ( -0.000 -15.656 43.807) 46.521 17.419 ( 0.000 0.443 -16.134) 16.140 17.419 ( 0.000 0.443 16.134) 16.140 22.359 ( -0.000 -30.615 -35.258) 46.695 22.359 ( -0.000 -30.615 35.258) 46.695 22.898 ( 0.000 29.924 -24.300) 38.548 22.898 ( 0.000 29.924 24.300) 38.548 24.736 ( -0.000 -6.513 -11.356) 13.091 24.736 ( -0.000 -6.513 11.356) 13.091 24.961 ( 0.000 10.014 -10.640) 14.611 24.961 ( 0.000 10.014 10.640) 14.611 30.534 ( -0.000 -6.520 -17.235) 18.427 30.534 ( -0.000 -6.520 17.235) 18.427 32.008 ( -0.000 -16.341 -15.878) 22.785 32.008 ( -0.000 -16.341 15.878) 22.785 35.862 ( 0.000 3.930 -12.419) 13.026 35.862 ( 0.000 3.930 12.419) 13.026 39.602 ( 0.000 21.140 -34.894) 40.798 39.602 ( 0.000 21.140 34.894) 40.798 ======================= Grid point 1178 (338/343) ======================= q-point: ( 0.38 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.360 ( 44.957 -0.000 -18.333) 48.552 7.360 ( 44.957 -0.000 18.333) 48.552 9.560 ( -6.171 0.000 -25.368) 26.108 9.560 ( -6.171 0.000 25.368) 26.108 10.848 ( 5.469 -0.000 -4.986) 7.401 10.848 ( 5.469 -0.000 4.986) 7.401 13.386 ( 33.239 -0.000 -11.451) 35.156 13.386 ( 33.239 -0.000 11.451) 35.156 15.544 ( -15.614 0.000 -27.496) 31.620 15.544 ( -15.614 0.000 27.496) 31.620 16.117 ( -18.199 0.000 -15.362) 23.816 16.117 ( -18.199 0.000 15.362) 23.816 17.418 ( -3.910 0.000 -9.375) 10.158 17.418 ( -3.910 0.000 9.375) 10.158 20.648 ( 2.343 -0.000 -49.349) 49.404 20.648 ( 2.343 -0.000 49.349) 49.404 24.019 ( -1.144 0.000 -11.071) 11.130 24.019 ( -1.144 0.000 11.071) 11.130 24.340 ( -4.225 0.000 -10.153) 10.997 24.340 ( -4.225 0.000 10.153) 10.997 26.608 ( -8.527 0.000 -3.251) 9.126 26.608 ( -8.527 0.000 3.251) 9.126 30.205 ( 6.693 -0.000 -2.279) 7.070 30.205 ( 6.693 -0.000 2.279) 7.070 30.738 ( -20.335 0.000 -16.770) 26.358 30.738 ( -20.335 0.000 16.770) 26.358 35.949 ( 15.714 -0.000 -24.690) 29.267 35.949 ( 15.714 -0.000 24.690) 29.267 40.507 ( 9.783 -0.000 -44.042) 45.115 40.507 ( 9.783 -0.000 44.042) 45.115 ======================= Grid point 1180 (339/343) ======================= q-point: ( 0.46 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 7.858 ( 44.707 -5.811 -16.634) 48.054 7.858 ( 44.707 -5.811 16.634) 48.054 9.479 ( -23.375 -9.615 -26.690) 36.759 9.479 ( -23.375 -9.615 26.690) 36.759 10.905 ( 12.490 5.257 -5.982) 14.813 10.905 ( 12.490 5.257 5.982) 14.813 13.697 ( 27.929 -0.631 -10.864) 29.974 13.697 ( 27.929 -0.631 10.864) 29.974 15.263 ( -25.662 8.744 -27.414) 38.555 15.263 ( -25.662 8.744 27.414) 38.555 15.988 ( -11.952 -2.429 -31.938) 34.188 15.988 ( -11.952 -2.429 31.938) 34.188 17.412 ( 2.752 0.481 -9.564) 9.964 17.412 ( 2.752 0.481 9.564) 9.964 20.748 ( 2.493 -9.501 -52.627) 53.535 20.748 ( 2.493 -9.501 52.627) 53.535 23.985 ( -0.716 3.254 -10.900) 11.398 23.985 ( -0.716 3.254 10.900) 11.398 24.330 ( -3.696 -3.601 -11.187) 12.320 24.330 ( -3.696 -3.601 11.187) 12.320 26.387 ( -6.167 16.888 -11.386) 21.281 26.387 ( -6.167 16.888 11.386) 21.281 30.307 ( 1.501 -4.150 -15.602) 16.214 30.307 ( 1.501 -4.150 15.602) 16.214 30.666 ( -9.768 -11.525 -12.575) 19.656 30.666 ( -9.768 -11.525 12.575) 19.656 36.061 ( 10.826 2.342 -24.750) 27.116 36.061 ( 10.826 2.342 24.750) 27.116 40.537 ( 5.835 5.623 -43.610) 44.356 40.537 ( 5.835 5.623 43.610) 44.356 ======================= Grid point 1182 (340/343) ======================= q-point: ( 0.54 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 592 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.343 ( 32.784 -2.695 -7.899) 33.830 8.343 ( 32.784 -2.695 7.899) 33.830 9.498 ( -22.188 -22.421 -32.572) 45.342 9.498 ( -22.188 -22.421 32.572) 45.342 10.885 ( 8.094 10.078 -5.291) 13.967 10.885 ( 8.094 10.078 5.291) 13.967 13.936 ( 19.775 0.411 -12.981) 23.659 13.936 ( 19.775 0.411 12.981) 23.659 14.812 ( -23.304 14.119 -24.455) 36.612 14.812 ( -23.304 14.119 24.456) 36.612 15.954 ( -5.860 -3.885 -47.591) 48.107 15.954 ( -5.860 -3.885 47.591) 48.107 17.436 ( 2.918 0.564 -8.863) 9.348 17.436 ( 2.918 0.564 8.863) 9.348 21.012 ( 2.675 -18.804 -51.518) 54.908 21.012 ( 2.675 -18.804 51.518) 54.908 23.884 ( -0.884 8.330 -10.378) 13.337 23.884 ( -0.884 8.330 10.378) 13.337 24.387 ( -1.937 -6.511 -12.326) 14.074 24.387 ( -1.937 -6.511 12.326) 14.074 25.977 ( -3.100 25.269 -17.107) 30.672 25.977 ( -3.100 25.269 17.107) 30.672 30.336 ( -2.747 -2.140 -24.118) 24.369 30.336 ( -2.747 -2.140 24.118) 24.369 30.925 ( -0.893 -22.617 -17.408) 28.555 30.925 ( -0.893 -22.617 17.408) 28.555 36.083 ( 5.338 4.390 -23.007) 24.023 36.083 ( 5.338 4.390 23.007) 24.023 40.438 ( 2.400 11.091 -42.365) 43.858 40.438 ( 2.400 11.091 42.365) 43.858 ======================= Grid point 1184 (341/343) ======================= q-point: (-0.38 -0.62 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.497 ( 0.000 2.788 -4.114) 4.970 8.497 ( 0.000 2.788 4.114) 4.970 9.822 ( -0.000 -26.022 -33.510) 42.427 9.822 ( -0.000 -26.022 33.510) 42.427 10.718 ( 0.000 13.993 -4.547) 14.713 10.718 ( 0.000 13.993 4.547) 14.713 14.037 ( 0.000 1.338 -17.103) 17.155 14.037 ( 0.000 1.338 17.103) 17.155 14.445 ( 0.000 12.007 -22.802) 25.770 14.445 ( 0.000 12.007 22.802) 25.770 16.003 ( -0.000 -5.474 -54.458) 54.732 16.003 ( -0.000 -5.474 54.458) 54.732 17.441 ( 0.000 0.699 -10.027) 10.051 17.441 ( 0.000 0.699 10.027) 10.051 21.401 ( -0.000 -25.486 -46.847) 53.331 21.401 ( -0.000 -25.486 46.847) 53.331 23.682 ( 0.000 15.650 -11.472) 19.404 23.682 ( 0.000 15.650 11.472) 19.404 24.498 ( -0.000 -7.622 -12.779) 14.880 24.498 ( -0.000 -7.622 12.779) 14.880 25.539 ( 0.000 24.333 -16.915) 29.635 25.539 ( 0.000 24.333 16.915) 29.635 30.366 ( -0.000 -3.417 -23.182) 23.432 30.366 ( -0.000 -3.417 23.182) 23.432 31.320 ( -0.000 -23.984 -18.222) 30.121 31.320 ( -0.000 -23.984 18.222) 30.121 36.026 ( 0.000 5.372 -19.692) 20.412 36.026 ( 0.000 5.372 19.692) 20.412 40.224 ( 0.000 15.638 -40.482) 43.398 40.224 ( 0.000 15.638 40.482) 43.398 ======================= Grid point 1208 (342/343) ======================= q-point: ( 0.46 0.46 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.240 ( 42.492 -0.000 -16.409) 45.550 8.240 ( 42.492 -0.000 16.409) 45.550 9.101 ( -33.796 0.000 -30.039) 45.216 9.101 ( -33.796 0.000 30.039) 45.216 11.072 ( 9.640 -0.000 -6.552) 11.656 11.072 ( 9.640 -0.000 6.552) 11.656 13.939 ( 20.463 -0.000 -5.402) 21.164 13.939 ( 20.463 -0.000 5.402) 21.164 15.107 ( -20.637 0.000 -27.755) 34.587 15.107 ( -20.637 0.000 27.755) 34.587 15.872 ( -6.499 0.000 -15.917) 17.193 15.872 ( -6.499 0.000 15.917) 17.193 17.446 ( 2.811 -0.000 -8.107) 8.580 17.446 ( 2.811 -0.000 8.107) 8.580 20.680 ( 0.858 -0.000 -56.974) 56.981 20.680 ( 0.858 -0.000 56.974) 56.981 24.010 ( 0.067 -0.000 -11.009) 11.009 24.010 ( 0.067 -0.000 11.009) 11.009 24.267 ( -2.468 0.000 -11.745) 12.001 24.267 ( -2.468 0.000 11.745) 12.001 26.489 ( -3.225 0.000 -3.380) 4.672 26.489 ( -3.225 0.000 3.380) 4.672 30.289 ( 1.358 -0.000 -18.491) 18.541 30.289 ( 1.358 -0.000 18.491) 18.541 30.486 ( -5.414 0.000 -4.309) 6.920 30.486 ( -5.414 0.000 4.309) 6.920 36.163 ( 5.663 -0.000 -26.083) 26.691 36.163 ( 5.663 -0.000 26.083) 26.691 40.628 ( 2.882 -0.000 -44.017) 44.111 40.628 ( 2.882 -0.000 44.017) 44.111 ======================= Grid point 1210 (343/343) ======================= q-point: (-0.46 -0.54 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 322 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 8.543 ( 0.000 0.478 -2.706) 2.748 8.543 ( 0.000 0.478 2.706) 2.748 8.981 ( -0.000 -16.923 -42.973) 46.185 8.981 ( -0.000 -16.923 42.973) 46.185 11.071 ( 0.000 5.995 -5.959) 8.452 11.071 ( 0.000 5.995 5.959) 8.452 14.051 ( -0.000 -0.053 -6.052) 6.052 14.051 ( -0.000 -0.053 6.052) 6.052 14.901 ( 0.000 10.438 -27.694) 29.596 14.901 ( 0.000 10.438 27.694) 29.596 15.866 ( -0.000 -2.877 -31.995) 32.124 15.866 ( -0.000 -2.877 31.995) 32.124 17.459 ( 0.000 0.310 -7.633) 7.639 17.459 ( 0.000 0.310 7.633) 7.639 20.774 ( -0.000 -10.567 -56.474) 57.454 20.774 ( -0.000 -10.567 56.474) 57.454 23.981 ( 0.000 3.756 -10.739) 11.377 23.981 ( 0.000 3.756 10.739) 11.377 24.288 ( -0.000 -3.909 -12.249) 12.858 24.288 ( -0.000 -3.909 12.249) 12.858 26.325 ( 0.000 16.830 -11.380) 20.316 26.325 ( 0.000 16.830 11.380) 20.316 30.300 ( -0.000 -0.794 -25.713) 25.726 30.300 ( -0.000 -0.794 25.713) 25.726 30.594 ( -0.000 -15.121 -14.354) 20.849 30.594 ( -0.000 -15.121 14.354) 20.849 36.169 ( 0.000 2.544 -25.477) 25.604 36.169 ( 0.000 2.544 25.477) 25.604 40.593 ( 0.000 5.898 -43.582) 43.979 40.593 ( 0.000 5.898 43.582) 43.979 =================== 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 3/60840 10.0 2479.481 1052.572 1063.400 0.000 0.000 -0.000 3/60840 20.0 10542.607 6608.279 5839.774 0.000 0.000 -0.000 3/60840 30.0 8813.177 7110.953 6413.340 0.000 0.000 -0.000 3/60840 40.0 5922.538 5314.386 5132.967 0.000 0.000 -0.000 3/60840 50.0 3661.949 3370.456 3556.256 0.000 0.000 -0.000 3/60840 60.0 2339.966 2200.844 2429.343 0.000 0.000 -0.000 3/60840 70.0 1615.851 1544.995 1724.663 0.000 0.000 -0.000 3/60840 80.0 1198.533 1151.109 1282.405 0.000 0.000 -0.000 3/60840 90.0 937.503 895.810 992.555 0.000 0.000 -0.000 3/60840 100.0 761.367 719.864 793.237 0.000 0.000 -0.000 3/60840 110.0 635.187 592.769 650.208 0.000 0.000 -0.000 3/60840 120.0 540.624 497.566 543.862 0.000 0.000 -0.000 3/60840 130.0 467.301 424.179 462.455 0.000 0.000 -0.000 3/60840 140.0 408.940 366.296 398.643 0.000 0.000 -0.000 3/60840 150.0 361.531 319.778 347.642 0.000 0.000 -0.000 3/60840 160.0 322.386 281.816 306.224 0.000 0.000 -0.000 3/60840 170.0 289.638 250.435 272.137 0.000 0.000 -0.000 3/60840 180.0 261.940 224.210 243.764 0.000 0.000 -0.000 3/60840 190.0 238.297 202.085 219.913 0.000 0.000 -0.000 3/60840 200.0 217.954 183.264 199.689 0.000 0.000 -0.000 3/60840 210.0 200.327 167.135 182.406 0.000 0.000 -0.000 3/60840 220.0 184.957 153.217 167.530 0.000 0.000 -0.000 3/60840 230.0 171.479 141.134 154.641 0.000 0.000 -0.000 3/60840 240.0 159.598 130.582 143.406 0.000 0.000 -0.000 3/60840 250.0 149.073 121.317 133.555 0.000 0.000 -0.000 3/60840 260.0 139.706 113.141 124.871 0.000 0.000 -0.000 3/60840 270.0 131.335 105.891 117.176 0.000 0.000 -0.000 3/60840 280.0 123.823 99.433 110.325 0.000 0.000 -0.000 3/60840 290.0 117.057 93.655 104.197 0.000 0.000 -0.000 3/60840 300.0 110.940 88.465 98.691 0.000 0.000 -0.000 3/60840 310.0 105.390 83.784 93.725 0.000 0.000 -0.000 3/60840 320.0 100.340 79.546 89.227 0.000 0.000 -0.000 3/60840 330.0 95.728 75.697 85.139 0.000 0.000 -0.000 3/60840 340.0 91.505 72.189 81.410 0.000 0.000 -0.000 3/60840 350.0 87.628 68.982 77.997 0.000 0.000 -0.000 3/60840 360.0 84.057 66.040 74.863 0.000 0.000 -0.000 3/60840 370.0 80.761 63.335 71.977 0.000 0.000 -0.000 3/60840 380.0 77.710 60.839 69.311 0.000 0.000 -0.000 3/60840 390.0 74.880 58.532 66.843 0.000 0.000 -0.000 3/60840 400.0 72.248 56.393 64.551 0.000 0.000 -0.000 3/60840 410.0 69.797 54.405 62.418 0.000 0.000 -0.000 3/60840 420.0 67.507 52.554 60.428 0.000 0.000 -0.000 3/60840 430.0 65.366 50.826 58.567 0.000 0.000 -0.000 3/60840 440.0 63.358 49.211 56.824 0.000 0.000 -0.000 3/60840 450.0 61.473 47.697 55.187 0.000 0.000 -0.000 3/60840 460.0 59.700 46.275 53.648 0.000 0.000 -0.000 3/60840 470.0 58.029 44.938 52.197 0.000 0.000 -0.000 3/60840 480.0 56.453 43.679 50.828 0.000 0.000 -0.000 3/60840 490.0 54.963 42.490 49.533 0.000 0.000 -0.000 3/60840 500.0 53.552 41.367 48.307 0.000 0.000 -0.000 3/60840 510.0 52.215 40.304 47.144 0.000 0.000 -0.000 3/60840 520.0 50.946 39.296 46.040 0.000 0.000 -0.000 3/60840 530.0 49.740 38.339 44.990 0.000 0.000 -0.000 3/60840 540.0 48.592 37.430 43.990 0.000 0.000 -0.000 3/60840 550.0 47.499 36.565 43.036 0.000 0.000 -0.000 3/60840 560.0 46.456 35.741 42.126 0.000 0.000 -0.000 3/60840 570.0 45.460 34.955 41.256 0.000 0.000 -0.000 3/60840 580.0 44.509 34.204 40.424 0.000 0.000 -0.000 3/60840 590.0 43.598 33.486 39.627 0.000 0.000 -0.000 3/60840 600.0 42.726 32.800 38.863 0.000 0.000 -0.000 3/60840 610.0 41.890 32.142 38.130 0.000 0.000 -0.000 3/60840 620.0 41.087 31.511 37.426 0.000 0.000 -0.000 3/60840 630.0 40.317 30.906 36.749 0.000 0.000 -0.000 3/60840 640.0 39.576 30.325 36.097 0.000 0.000 -0.000 3/60840 650.0 38.864 29.767 35.470 0.000 0.000 -0.000 3/60840 660.0 38.178 29.230 34.866 0.000 0.000 -0.000 3/60840 670.0 37.517 28.712 34.283 0.000 0.000 -0.000 3/60840 680.0 36.880 28.214 33.721 0.000 0.000 -0.000 3/60840 690.0 36.265 27.733 33.178 0.000 0.000 -0.000 3/60840 700.0 35.672 27.270 32.653 0.000 0.000 -0.000 3/60840 710.0 35.099 26.822 32.145 0.000 0.000 -0.000 3/60840 720.0 34.545 26.390 31.654 0.000 0.000 -0.000 3/60840 730.0 34.009 25.972 31.179 0.000 0.000 -0.000 3/60840 740.0 33.490 25.568 30.718 0.000 0.000 -0.000 3/60840 750.0 32.988 25.176 30.272 0.000 0.000 -0.000 3/60840 760.0 32.501 24.797 29.839 0.000 0.000 -0.000 3/60840 770.0 32.029 24.430 29.419 0.000 0.000 -0.000 3/60840 780.0 31.571 24.074 29.011 0.000 0.000 -0.000 3/60840 790.0 31.127 23.729 28.615 0.000 0.000 -0.000 3/60840 800.0 30.696 23.394 28.231 0.000 0.000 -0.000 3/60840 810.0 30.277 23.069 27.857 0.000 0.000 -0.000 3/60840 820.0 29.870 22.753 27.493 0.000 0.000 -0.000 3/60840 830.0 29.474 22.446 27.139 0.000 0.000 -0.000 3/60840 840.0 29.089 22.148 26.794 0.000 0.000 -0.000 3/60840 850.0 28.715 21.858 26.459 0.000 0.000 -0.000 3/60840 860.0 28.350 21.575 26.132 0.000 0.000 -0.000 3/60840 870.0 27.995 21.300 25.814 0.000 0.000 -0.000 3/60840 880.0 27.649 21.033 25.503 0.000 0.000 -0.000 3/60840 890.0 27.312 20.772 25.200 0.000 0.000 -0.000 3/60840 900.0 26.984 20.518 24.905 0.000 0.000 -0.000 3/60840 910.0 26.663 20.270 24.617 0.000 0.000 -0.000 3/60840 920.0 26.351 20.029 24.335 0.000 0.000 -0.000 3/60840 930.0 26.046 19.793 24.061 0.000 0.000 -0.000 3/60840 940.0 25.748 19.563 23.792 0.000 0.000 -0.000 3/60840 950.0 25.457 19.339 23.530 0.000 0.000 -0.000 3/60840 960.0 25.173 19.120 23.274 0.000 0.000 -0.000 3/60840 970.0 24.896 18.906 23.023 0.000 0.000 -0.000 3/60840 980.0 24.624 18.697 22.778 0.000 0.000 -0.000 3/60840 990.0 24.359 18.492 22.538 0.000 0.000 -0.000 3/60840 1000.0 24.100 18.293 22.304 0.000 0.000 -0.000 3/60840 Thermal conductivity related properties were written into "kappa-m131312.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:41:15]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|