----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 23:30:18]------------------------- 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: [2 2 1] Primitive matrix: [-0.5 0.5 0.5] [ 0.5 -0.5 0.5] [ 0.5 0.5 -0.5] Spacegroup: I4_1/a (88) Number of symmetry operations in supercell: 64 ------------------------------ primitive cell ------------------------------ Lattice vectors: a -2.421095910000000 2.421095910000000 5.217882200000000 b 2.421095910000000 -2.421095910000000 5.217882200000000 c 2.421095910000000 2.421095910000000 -5.217882200000000 Atomic positions (fractional): *1 O 0.34163347031914 0.93616154683652 0.94396079236790 15.999 2 O 0.68616154683652 0.24220075446862 0.09452807651738 15.999 3 O 0.14767267795124 0.59163347031914 0.90547192348262 15.999 4 O 0.99220075446862 0.39767267795124 0.05603920763210 15.999 5 O 0.75779924553138 0.85232732204876 0.44396079236790 15.999 6 O 0.60232732204876 0.65836652968086 0.59452807651738 15.999 7 O 0.06383845316348 0.00779924553138 0.40547192348262 15.999 8 O 0.40836652968086 0.31383845316348 0.55603920763210 15.999 *9 Ge 0.50000000000000 0.50000000000000 0.00000000000000 72.640 10 Ge 0.25000000000000 0.75000000000000 0.50000000000000 72.640 *11 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 12 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 -------------------------------- unit cell --------------------------------- Lattice vectors: a 4.842191820000000 0.000000000000000 0.000000000000000 b 0.000000000000000 4.842191820000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.435764400000000 Atomic positions (fractional): *1 O 0.76924443444264 0.17471635792526 0.16691711239388 15.999 > 1 2 O 0.82528364207474 0.26924443444264 0.41691711239388 15.999 > 2 3 O 0.17471635792526 0.73075556555736 0.41691711239388 15.999 > 3 4 O 0.23075556555736 0.82528364207474 0.16691711239388 15.999 > 4 5 O 0.76924443444264 0.67471635792526 0.08308288760612 15.999 > 5 6 O 0.32528364207474 0.26924443444264 0.33308288760612 15.999 > 6 7 O 0.67471635792526 0.73075556555736 0.33308288760612 15.999 > 7 8 O 0.23075556555736 0.32528364207474 0.08308288760612 15.999 > 8 9 O 0.26924443444264 0.67471635792526 0.66691711239388 15.999 > 1 10 O 0.32528364207474 0.76924443444264 0.91691711239388 15.999 > 2 11 O 0.67471635792526 0.23075556555736 0.91691711239388 15.999 > 3 12 O 0.73075556555736 0.32528364207474 0.66691711239388 15.999 > 4 13 O 0.26924443444264 0.17471635792526 0.58308288760612 15.999 > 5 14 O 0.82528364207474 0.76924443444264 0.83308288760612 15.999 > 6 15 O 0.17471635792526 0.23075556555736 0.83308288760612 15.999 > 7 16 O 0.73075556555736 0.82528364207474 0.58308288760612 15.999 > 8 *17 Ge 0.50000000000000 0.50000000000000 0.00000000000000 72.640 > 9 18 Ge 0.50000000000000 0.00000000000000 0.25000000000000 72.640 > 10 19 Ge 0.00000000000000 0.00000000000000 0.50000000000000 72.640 > 9 20 Ge 0.00000000000000 0.50000000000000 0.75000000000000 72.640 > 10 *21 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 11 22 Hf 0.00000000000000 0.50000000000000 0.25000000000000 178.490 > 12 23 Hf 0.50000000000000 0.50000000000000 0.50000000000000 178.490 > 11 24 Hf 0.50000000000000 0.00000000000000 0.75000000000000 178.490 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 9.684383640000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.684383640000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.435764400000000 Atomic positions (fractional): *1 O 0.38462221722132 0.08735817896263 0.16691711239388 15.999 > 1 2 O 0.88462221722132 0.08735817896263 0.16691711239388 15.999 > 1 3 O 0.38462221722132 0.58735817896263 0.16691711239388 15.999 > 1 4 O 0.88462221722132 0.58735817896263 0.16691711239388 15.999 > 1 5 O 0.41264182103737 0.13462221722132 0.41691711239388 15.999 > 2 6 O 0.91264182103737 0.13462221722132 0.41691711239388 15.999 > 2 7 O 0.41264182103737 0.63462221722132 0.41691711239388 15.999 > 2 8 O 0.91264182103737 0.63462221722132 0.41691711239388 15.999 > 2 9 O 0.08735817896263 0.36537778277868 0.41691711239388 15.999 > 3 10 O 0.58735817896263 0.36537778277868 0.41691711239388 15.999 > 3 11 O 0.08735817896263 0.86537778277868 0.41691711239388 15.999 > 3 12 O 0.58735817896263 0.86537778277868 0.41691711239388 15.999 > 3 13 O 0.11537778277868 0.41264182103737 0.16691711239388 15.999 > 4 14 O 0.61537778277868 0.41264182103737 0.16691711239388 15.999 > 4 15 O 0.11537778277868 0.91264182103737 0.16691711239388 15.999 > 4 16 O 0.61537778277868 0.91264182103737 0.16691711239388 15.999 > 4 17 O 0.38462221722132 0.33735817896263 0.08308288760612 15.999 > 5 18 O 0.88462221722132 0.33735817896263 0.08308288760612 15.999 > 5 19 O 0.38462221722132 0.83735817896263 0.08308288760612 15.999 > 5 20 O 0.88462221722132 0.83735817896263 0.08308288760612 15.999 > 5 21 O 0.16264182103737 0.13462221722132 0.33308288760612 15.999 > 6 22 O 0.66264182103737 0.13462221722132 0.33308288760612 15.999 > 6 23 O 0.16264182103737 0.63462221722132 0.33308288760612 15.999 > 6 24 O 0.66264182103737 0.63462221722132 0.33308288760612 15.999 > 6 25 O 0.33735817896263 0.36537778277868 0.33308288760612 15.999 > 7 26 O 0.83735817896263 0.36537778277868 0.33308288760612 15.999 > 7 27 O 0.33735817896263 0.86537778277868 0.33308288760612 15.999 > 7 28 O 0.83735817896263 0.86537778277868 0.33308288760612 15.999 > 7 29 O 0.11537778277868 0.16264182103737 0.08308288760612 15.999 > 8 30 O 0.61537778277868 0.16264182103737 0.08308288760612 15.999 > 8 31 O 0.11537778277868 0.66264182103737 0.08308288760612 15.999 > 8 32 O 0.61537778277868 0.66264182103737 0.08308288760612 15.999 > 8 33 O 0.13462221722132 0.33735817896263 0.66691711239388 15.999 > 1 34 O 0.63462221722132 0.33735817896263 0.66691711239388 15.999 > 1 35 O 0.13462221722132 0.83735817896263 0.66691711239388 15.999 > 1 36 O 0.63462221722132 0.83735817896263 0.66691711239388 15.999 > 1 37 O 0.16264182103737 0.38462221722132 0.91691711239388 15.999 > 2 38 O 0.66264182103737 0.38462221722132 0.91691711239388 15.999 > 2 39 O 0.16264182103737 0.88462221722132 0.91691711239388 15.999 > 2 40 O 0.66264182103737 0.88462221722132 0.91691711239388 15.999 > 2 41 O 0.33735817896263 0.11537778277868 0.91691711239388 15.999 > 3 42 O 0.83735817896263 0.11537778277868 0.91691711239388 15.999 > 3 43 O 0.33735817896263 0.61537778277868 0.91691711239388 15.999 > 3 44 O 0.83735817896263 0.61537778277868 0.91691711239388 15.999 > 3 45 O 0.36537778277868 0.16264182103737 0.66691711239388 15.999 > 4 46 O 0.86537778277868 0.16264182103737 0.66691711239388 15.999 > 4 47 O 0.36537778277868 0.66264182103737 0.66691711239388 15.999 > 4 48 O 0.86537778277868 0.66264182103737 0.66691711239388 15.999 > 4 49 O 0.13462221722132 0.08735817896263 0.58308288760612 15.999 > 5 50 O 0.63462221722132 0.08735817896263 0.58308288760612 15.999 > 5 51 O 0.13462221722132 0.58735817896263 0.58308288760612 15.999 > 5 52 O 0.63462221722132 0.58735817896263 0.58308288760612 15.999 > 5 53 O 0.41264182103737 0.38462221722132 0.83308288760612 15.999 > 6 54 O 0.91264182103737 0.38462221722132 0.83308288760612 15.999 > 6 55 O 0.41264182103737 0.88462221722132 0.83308288760612 15.999 > 6 56 O 0.91264182103737 0.88462221722132 0.83308288760612 15.999 > 6 57 O 0.08735817896263 0.11537778277868 0.83308288760612 15.999 > 7 58 O 0.58735817896263 0.11537778277868 0.83308288760612 15.999 > 7 59 O 0.08735817896263 0.61537778277868 0.83308288760612 15.999 > 7 60 O 0.58735817896263 0.61537778277868 0.83308288760612 15.999 > 7 61 O 0.36537778277868 0.41264182103737 0.58308288760612 15.999 > 8 62 O 0.86537778277868 0.41264182103737 0.58308288760612 15.999 > 8 63 O 0.36537778277868 0.91264182103737 0.58308288760612 15.999 > 8 64 O 0.86537778277868 0.91264182103737 0.58308288760612 15.999 > 8 *65 Ge 0.25000000000000 0.25000000000000 0.00000000000000 72.640 > 9 66 Ge 0.75000000000000 0.25000000000000 0.00000000000000 72.640 > 9 67 Ge 0.25000000000000 0.75000000000000 0.00000000000000 72.640 > 9 68 Ge 0.75000000000000 0.75000000000000 0.00000000000000 72.640 > 9 69 Ge 0.25000000000000 0.00000000000000 0.25000000000000 72.640 > 10 70 Ge 0.75000000000000 0.00000000000000 0.25000000000000 72.640 > 10 71 Ge 0.25000000000000 0.50000000000000 0.25000000000000 72.640 > 10 72 Ge 0.75000000000000 0.50000000000000 0.25000000000000 72.640 > 10 73 Ge 0.00000000000000 0.00000000000000 0.50000000000000 72.640 > 9 74 Ge 0.50000000000000 0.00000000000000 0.50000000000000 72.640 > 9 75 Ge 0.00000000000000 0.50000000000000 0.50000000000000 72.640 > 9 76 Ge 0.50000000000000 0.50000000000000 0.50000000000000 72.640 > 9 77 Ge 0.00000000000000 0.25000000000000 0.75000000000000 72.640 > 10 78 Ge 0.50000000000000 0.25000000000000 0.75000000000000 72.640 > 10 79 Ge 0.00000000000000 0.75000000000000 0.75000000000000 72.640 > 10 80 Ge 0.50000000000000 0.75000000000000 0.75000000000000 72.640 > 10 *81 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 11 82 Hf 0.50000000000000 0.00000000000000 0.00000000000000 178.490 > 11 83 Hf 0.00000000000000 0.50000000000000 0.00000000000000 178.490 > 11 84 Hf 0.50000000000000 0.50000000000000 0.00000000000000 178.490 > 11 85 Hf 0.00000000000000 0.25000000000000 0.25000000000000 178.490 > 12 86 Hf 0.50000000000000 0.25000000000000 0.25000000000000 178.490 > 12 87 Hf 0.00000000000000 0.75000000000000 0.25000000000000 178.490 > 12 88 Hf 0.50000000000000 0.75000000000000 0.25000000000000 178.490 > 12 89 Hf 0.25000000000000 0.25000000000000 0.50000000000000 178.490 > 11 90 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 > 11 91 Hf 0.25000000000000 0.75000000000000 0.50000000000000 178.490 > 11 92 Hf 0.75000000000000 0.75000000000000 0.50000000000000 178.490 > 11 93 Hf 0.25000000000000 0.00000000000000 0.75000000000000 178.490 > 12 94 Hf 0.75000000000000 0.00000000000000 0.75000000000000 178.490 > 12 95 Hf 0.25000000000000 0.50000000000000 0.75000000000000 178.490 > 12 96 Hf 0.75000000000000 0.50000000000000 0.75000000000000 178.490 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7867029 -0.0000011 0.0000000 0.0000011 4.7867029 0.0000000 0.0000000 0.0000000 4.5095945 -------------------------- Born effective charges -------------------------- 1 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 2 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 3 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 4 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 5 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 6 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 7 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 8 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 9 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 10 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 11 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 12 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 6624/6624 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 696 Number of blocks in projector: 696 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 4 --- Eigsh_solver_block: 1 / 4 --- Block_size: 280 Use standard eigh solver. --- Eigsh_solver_block: 2 / 4 --- Block_size: 178 Use standard eigh solver. --- Eigsh_solver_block: 3 / 4 --- Block_size: 146 Use standard eigh solver. --- Eigsh_solver_block: 4 / 4 --- Block_size: 92 Use standard eigh solver. Tree of FC basis block matrices: - (696, 682), data: False |-- (92, 89), data: True |-- (146, 143), data: True |-- (178, 174), data: True |-- (280, 276), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 240 - Time: 0.418 Solver_block: 200 / 240 - Time: 0.426 Solver_block: 240 / 240 - Time: 0.193 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 1.050 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 6624/6624 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 696 Number of blocks in projector: 696 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 4 --- Eigsh_solver_block: 1 / 4 --- Block_size: 280 Use standard eigh solver. --- Eigsh_solver_block: 2 / 4 --- Block_size: 178 Use standard eigh solver. --- Eigsh_solver_block: 3 / 4 --- Block_size: 146 Use standard eigh solver. --- Eigsh_solver_block: 4 / 4 --- Block_size: 92 Use standard eigh solver. Tree of FC basis block matrices: - (696, 682), data: False |-- (92, 89), data: True |-- (146, 143), data: True |-- (178, 174), data: True |-- (280, 276), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 23:30:27]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:30:27]------------------------- 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): [2 2 1] Primitive matrix: [-0.5 0.5 0.5] [ 0.5 -0.5 0.5] [ 0.5 0.5 -0.5] Spacegroup: I4_1/a (88) ------------------------------ primitive cell ------------------------------ Lattice vectors: a -2.421095910000000 2.421095910000000 5.217882200000000 b 2.421095910000000 -2.421095910000000 5.217882200000000 c 2.421095910000000 2.421095910000000 -5.217882200000000 Atomic positions (fractional): 1 O 0.34163347031914 0.93616154683652 0.94396079236790 15.999 2 O 0.68616154683652 0.24220075446862 0.09452807651738 15.999 3 O 0.14767267795124 0.59163347031914 0.90547192348262 15.999 4 O 0.99220075446862 0.39767267795124 0.05603920763210 15.999 5 O 0.75779924553138 0.85232732204876 0.44396079236790 15.999 6 O 0.60232732204876 0.65836652968086 0.59452807651738 15.999 7 O 0.06383845316348 0.00779924553138 0.40547192348262 15.999 8 O 0.40836652968086 0.31383845316348 0.55603920763210 15.999 9 Ge 0.50000000000000 0.50000000000000 0.00000000000000 72.640 10 Ge 0.25000000000000 0.75000000000000 0.50000000000000 72.640 11 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 12 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.684383640000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.684383640000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.435764400000000 Atomic positions (fractional): 1 O 0.38462221722132 0.08735817896263 0.16691711239388 15.999 > 1 2 O 0.88462221722132 0.08735817896263 0.16691711239388 15.999 > 1 3 O 0.38462221722132 0.58735817896263 0.16691711239388 15.999 > 1 4 O 0.88462221722132 0.58735817896263 0.16691711239388 15.999 > 1 5 O 0.41264182103737 0.13462221722132 0.41691711239388 15.999 > 5 6 O 0.91264182103737 0.13462221722132 0.41691711239388 15.999 > 5 7 O 0.41264182103737 0.63462221722132 0.41691711239388 15.999 > 5 8 O 0.91264182103737 0.63462221722132 0.41691711239388 15.999 > 5 9 O 0.08735817896263 0.36537778277868 0.41691711239388 15.999 > 9 10 O 0.58735817896263 0.36537778277868 0.41691711239388 15.999 > 9 11 O 0.08735817896263 0.86537778277868 0.41691711239388 15.999 > 9 12 O 0.58735817896263 0.86537778277868 0.41691711239388 15.999 > 9 13 O 0.11537778277868 0.41264182103737 0.16691711239388 15.999 > 13 14 O 0.61537778277868 0.41264182103737 0.16691711239388 15.999 > 13 15 O 0.11537778277868 0.91264182103737 0.16691711239388 15.999 > 13 16 O 0.61537778277868 0.91264182103737 0.16691711239388 15.999 > 13 17 O 0.38462221722132 0.33735817896263 0.08308288760612 15.999 > 17 18 O 0.88462221722132 0.33735817896263 0.08308288760612 15.999 > 17 19 O 0.38462221722132 0.83735817896263 0.08308288760612 15.999 > 17 20 O 0.88462221722132 0.83735817896263 0.08308288760612 15.999 > 17 21 O 0.16264182103737 0.13462221722132 0.33308288760612 15.999 > 21 22 O 0.66264182103737 0.13462221722132 0.33308288760612 15.999 > 21 23 O 0.16264182103737 0.63462221722132 0.33308288760612 15.999 > 21 24 O 0.66264182103737 0.63462221722132 0.33308288760612 15.999 > 21 25 O 0.33735817896263 0.36537778277868 0.33308288760612 15.999 > 25 26 O 0.83735817896263 0.36537778277868 0.33308288760612 15.999 > 25 27 O 0.33735817896263 0.86537778277868 0.33308288760612 15.999 > 25 28 O 0.83735817896263 0.86537778277868 0.33308288760612 15.999 > 25 29 O 0.11537778277868 0.16264182103737 0.08308288760612 15.999 > 29 30 O 0.61537778277868 0.16264182103737 0.08308288760612 15.999 > 29 31 O 0.11537778277868 0.66264182103737 0.08308288760612 15.999 > 29 32 O 0.61537778277868 0.66264182103737 0.08308288760612 15.999 > 29 33 O 0.13462221722132 0.33735817896263 0.66691711239388 15.999 > 1 34 O 0.63462221722132 0.33735817896263 0.66691711239388 15.999 > 1 35 O 0.13462221722132 0.83735817896263 0.66691711239388 15.999 > 1 36 O 0.63462221722132 0.83735817896263 0.66691711239388 15.999 > 1 37 O 0.16264182103737 0.38462221722132 0.91691711239388 15.999 > 5 38 O 0.66264182103737 0.38462221722132 0.91691711239388 15.999 > 5 39 O 0.16264182103737 0.88462221722132 0.91691711239388 15.999 > 5 40 O 0.66264182103737 0.88462221722132 0.91691711239388 15.999 > 5 41 O 0.33735817896263 0.11537778277868 0.91691711239388 15.999 > 9 42 O 0.83735817896263 0.11537778277868 0.91691711239388 15.999 > 9 43 O 0.33735817896263 0.61537778277868 0.91691711239388 15.999 > 9 44 O 0.83735817896263 0.61537778277868 0.91691711239388 15.999 > 9 45 O 0.36537778277868 0.16264182103737 0.66691711239388 15.999 > 13 46 O 0.86537778277868 0.16264182103737 0.66691711239388 15.999 > 13 47 O 0.36537778277868 0.66264182103737 0.66691711239388 15.999 > 13 48 O 0.86537778277868 0.66264182103737 0.66691711239388 15.999 > 13 49 O 0.13462221722132 0.08735817896263 0.58308288760612 15.999 > 17 50 O 0.63462221722132 0.08735817896263 0.58308288760612 15.999 > 17 51 O 0.13462221722132 0.58735817896263 0.58308288760612 15.999 > 17 52 O 0.63462221722132 0.58735817896263 0.58308288760612 15.999 > 17 53 O 0.41264182103737 0.38462221722132 0.83308288760612 15.999 > 21 54 O 0.91264182103737 0.38462221722132 0.83308288760612 15.999 > 21 55 O 0.41264182103737 0.88462221722132 0.83308288760612 15.999 > 21 56 O 0.91264182103737 0.88462221722132 0.83308288760612 15.999 > 21 57 O 0.08735817896263 0.11537778277868 0.83308288760612 15.999 > 25 58 O 0.58735817896263 0.11537778277868 0.83308288760612 15.999 > 25 59 O 0.08735817896263 0.61537778277868 0.83308288760612 15.999 > 25 60 O 0.58735817896263 0.61537778277868 0.83308288760612 15.999 > 25 61 O 0.36537778277868 0.41264182103737 0.58308288760612 15.999 > 29 62 O 0.86537778277868 0.41264182103737 0.58308288760612 15.999 > 29 63 O 0.36537778277868 0.91264182103737 0.58308288760612 15.999 > 29 64 O 0.86537778277868 0.91264182103737 0.58308288760612 15.999 > 29 65 Ge 0.25000000000000 0.25000000000000 0.00000000000000 72.640 > 65 66 Ge 0.75000000000000 0.25000000000000 0.00000000000000 72.640 > 65 67 Ge 0.25000000000000 0.75000000000000 0.00000000000000 72.640 > 65 68 Ge 0.75000000000000 0.75000000000000 0.00000000000000 72.640 > 65 69 Ge 0.25000000000000 0.00000000000000 0.25000000000000 72.640 > 69 70 Ge 0.75000000000000 0.00000000000000 0.25000000000000 72.640 > 69 71 Ge 0.25000000000000 0.50000000000000 0.25000000000000 72.640 > 69 72 Ge 0.75000000000000 0.50000000000000 0.25000000000000 72.640 > 69 73 Ge 0.00000000000000 0.00000000000000 0.50000000000000 72.640 > 65 74 Ge 0.50000000000000 0.00000000000000 0.50000000000000 72.640 > 65 75 Ge 0.00000000000000 0.50000000000000 0.50000000000000 72.640 > 65 76 Ge 0.50000000000000 0.50000000000000 0.50000000000000 72.640 > 65 77 Ge 0.00000000000000 0.25000000000000 0.75000000000000 72.640 > 69 78 Ge 0.50000000000000 0.25000000000000 0.75000000000000 72.640 > 69 79 Ge 0.00000000000000 0.75000000000000 0.75000000000000 72.640 > 69 80 Ge 0.50000000000000 0.75000000000000 0.75000000000000 72.640 > 69 81 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 81 82 Hf 0.50000000000000 0.00000000000000 0.00000000000000 178.490 > 81 83 Hf 0.00000000000000 0.50000000000000 0.00000000000000 178.490 > 81 84 Hf 0.50000000000000 0.50000000000000 0.00000000000000 178.490 > 81 85 Hf 0.00000000000000 0.25000000000000 0.25000000000000 178.490 > 85 86 Hf 0.50000000000000 0.25000000000000 0.25000000000000 178.490 > 85 87 Hf 0.00000000000000 0.75000000000000 0.25000000000000 178.490 > 85 88 Hf 0.50000000000000 0.75000000000000 0.25000000000000 178.490 > 85 89 Hf 0.25000000000000 0.25000000000000 0.50000000000000 178.490 > 81 90 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 > 81 91 Hf 0.25000000000000 0.75000000000000 0.50000000000000 178.490 > 81 92 Hf 0.75000000000000 0.75000000000000 0.50000000000000 178.490 > 81 93 Hf 0.25000000000000 0.00000000000000 0.75000000000000 178.490 > 85 94 Hf 0.75000000000000 0.00000000000000 0.75000000000000 178.490 > 85 95 Hf 0.25000000000000 0.50000000000000 0.75000000000000 178.490 > 85 96 Hf 0.75000000000000 0.50000000000000 0.75000000000000 178.490 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7867029 -0.0000011 0.0000000 0.0000011 4.7867029 0.0000000 0.0000000 0.0000000 4.5095945 -------------------------- Born effective charges -------------------------- 1 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 2 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 3 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 4 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 5 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 6 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 7 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 8 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 9 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 10 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 11 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 12 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 ---------------------------------------------------------------------------- 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[ 65, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 81, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 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: 0.00000006 (zzz) 0.00000006 (zzz) 0.00000006 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000007 (xy) -0.00000007 (xy) 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 23:30:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:30:34]------------------------- 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): [2 2 1] Primitive matrix: [-0.5 0.5 0.5] [ 0.5 -0.5 0.5] [ 0.5 0.5 -0.5] Spacegroup: I4_1/a (88) ------------------------------ primitive cell ------------------------------ Lattice vectors: a -2.421095910000000 2.421095910000000 5.217882200000000 b 2.421095910000000 -2.421095910000000 5.217882200000000 c 2.421095910000000 2.421095910000000 -5.217882200000000 Atomic positions (fractional): 1 O 0.34163347031914 0.93616154683652 0.94396079236790 15.999 2 O 0.68616154683652 0.24220075446862 0.09452807651738 15.999 3 O 0.14767267795124 0.59163347031914 0.90547192348262 15.999 4 O 0.99220075446862 0.39767267795124 0.05603920763210 15.999 5 O 0.75779924553138 0.85232732204876 0.44396079236790 15.999 6 O 0.60232732204876 0.65836652968086 0.59452807651738 15.999 7 O 0.06383845316348 0.00779924553138 0.40547192348262 15.999 8 O 0.40836652968086 0.31383845316348 0.55603920763210 15.999 9 Ge 0.50000000000000 0.50000000000000 0.00000000000000 72.640 10 Ge 0.25000000000000 0.75000000000000 0.50000000000000 72.640 11 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 12 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 -------------------------------- supercell --------------------------------- Lattice vectors: a 9.684383640000000 0.000000000000000 0.000000000000000 b 0.000000000000000 9.684383640000000 0.000000000000000 c 0.000000000000000 0.000000000000000 10.435764400000000 Atomic positions (fractional): 1 O 0.38462221722132 0.08735817896263 0.16691711239388 15.999 > 1 2 O 0.88462221722132 0.08735817896263 0.16691711239388 15.999 > 1 3 O 0.38462221722132 0.58735817896263 0.16691711239388 15.999 > 1 4 O 0.88462221722132 0.58735817896263 0.16691711239388 15.999 > 1 5 O 0.41264182103737 0.13462221722132 0.41691711239388 15.999 > 5 6 O 0.91264182103737 0.13462221722132 0.41691711239388 15.999 > 5 7 O 0.41264182103737 0.63462221722132 0.41691711239388 15.999 > 5 8 O 0.91264182103737 0.63462221722132 0.41691711239388 15.999 > 5 9 O 0.08735817896263 0.36537778277868 0.41691711239388 15.999 > 9 10 O 0.58735817896263 0.36537778277868 0.41691711239388 15.999 > 9 11 O 0.08735817896263 0.86537778277868 0.41691711239388 15.999 > 9 12 O 0.58735817896263 0.86537778277868 0.41691711239388 15.999 > 9 13 O 0.11537778277868 0.41264182103737 0.16691711239388 15.999 > 13 14 O 0.61537778277868 0.41264182103737 0.16691711239388 15.999 > 13 15 O 0.11537778277868 0.91264182103737 0.16691711239388 15.999 > 13 16 O 0.61537778277868 0.91264182103737 0.16691711239388 15.999 > 13 17 O 0.38462221722132 0.33735817896263 0.08308288760612 15.999 > 17 18 O 0.88462221722132 0.33735817896263 0.08308288760612 15.999 > 17 19 O 0.38462221722132 0.83735817896263 0.08308288760612 15.999 > 17 20 O 0.88462221722132 0.83735817896263 0.08308288760612 15.999 > 17 21 O 0.16264182103737 0.13462221722132 0.33308288760612 15.999 > 21 22 O 0.66264182103737 0.13462221722132 0.33308288760612 15.999 > 21 23 O 0.16264182103737 0.63462221722132 0.33308288760612 15.999 > 21 24 O 0.66264182103737 0.63462221722132 0.33308288760612 15.999 > 21 25 O 0.33735817896263 0.36537778277868 0.33308288760612 15.999 > 25 26 O 0.83735817896263 0.36537778277868 0.33308288760612 15.999 > 25 27 O 0.33735817896263 0.86537778277868 0.33308288760612 15.999 > 25 28 O 0.83735817896263 0.86537778277868 0.33308288760612 15.999 > 25 29 O 0.11537778277868 0.16264182103737 0.08308288760612 15.999 > 29 30 O 0.61537778277868 0.16264182103737 0.08308288760612 15.999 > 29 31 O 0.11537778277868 0.66264182103737 0.08308288760612 15.999 > 29 32 O 0.61537778277868 0.66264182103737 0.08308288760612 15.999 > 29 33 O 0.13462221722132 0.33735817896263 0.66691711239388 15.999 > 1 34 O 0.63462221722132 0.33735817896263 0.66691711239388 15.999 > 1 35 O 0.13462221722132 0.83735817896263 0.66691711239388 15.999 > 1 36 O 0.63462221722132 0.83735817896263 0.66691711239388 15.999 > 1 37 O 0.16264182103737 0.38462221722132 0.91691711239388 15.999 > 5 38 O 0.66264182103737 0.38462221722132 0.91691711239388 15.999 > 5 39 O 0.16264182103737 0.88462221722132 0.91691711239388 15.999 > 5 40 O 0.66264182103737 0.88462221722132 0.91691711239388 15.999 > 5 41 O 0.33735817896263 0.11537778277868 0.91691711239388 15.999 > 9 42 O 0.83735817896263 0.11537778277868 0.91691711239388 15.999 > 9 43 O 0.33735817896263 0.61537778277868 0.91691711239388 15.999 > 9 44 O 0.83735817896263 0.61537778277868 0.91691711239388 15.999 > 9 45 O 0.36537778277868 0.16264182103737 0.66691711239388 15.999 > 13 46 O 0.86537778277868 0.16264182103737 0.66691711239388 15.999 > 13 47 O 0.36537778277868 0.66264182103737 0.66691711239388 15.999 > 13 48 O 0.86537778277868 0.66264182103737 0.66691711239388 15.999 > 13 49 O 0.13462221722132 0.08735817896263 0.58308288760612 15.999 > 17 50 O 0.63462221722132 0.08735817896263 0.58308288760612 15.999 > 17 51 O 0.13462221722132 0.58735817896263 0.58308288760612 15.999 > 17 52 O 0.63462221722132 0.58735817896263 0.58308288760612 15.999 > 17 53 O 0.41264182103737 0.38462221722132 0.83308288760612 15.999 > 21 54 O 0.91264182103737 0.38462221722132 0.83308288760612 15.999 > 21 55 O 0.41264182103737 0.88462221722132 0.83308288760612 15.999 > 21 56 O 0.91264182103737 0.88462221722132 0.83308288760612 15.999 > 21 57 O 0.08735817896263 0.11537778277868 0.83308288760612 15.999 > 25 58 O 0.58735817896263 0.11537778277868 0.83308288760612 15.999 > 25 59 O 0.08735817896263 0.61537778277868 0.83308288760612 15.999 > 25 60 O 0.58735817896263 0.61537778277868 0.83308288760612 15.999 > 25 61 O 0.36537778277868 0.41264182103737 0.58308288760612 15.999 > 29 62 O 0.86537778277868 0.41264182103737 0.58308288760612 15.999 > 29 63 O 0.36537778277868 0.91264182103737 0.58308288760612 15.999 > 29 64 O 0.86537778277868 0.91264182103737 0.58308288760612 15.999 > 29 65 Ge 0.25000000000000 0.25000000000000 0.00000000000000 72.640 > 65 66 Ge 0.75000000000000 0.25000000000000 0.00000000000000 72.640 > 65 67 Ge 0.25000000000000 0.75000000000000 0.00000000000000 72.640 > 65 68 Ge 0.75000000000000 0.75000000000000 0.00000000000000 72.640 > 65 69 Ge 0.25000000000000 0.00000000000000 0.25000000000000 72.640 > 69 70 Ge 0.75000000000000 0.00000000000000 0.25000000000000 72.640 > 69 71 Ge 0.25000000000000 0.50000000000000 0.25000000000000 72.640 > 69 72 Ge 0.75000000000000 0.50000000000000 0.25000000000000 72.640 > 69 73 Ge 0.00000000000000 0.00000000000000 0.50000000000000 72.640 > 65 74 Ge 0.50000000000000 0.00000000000000 0.50000000000000 72.640 > 65 75 Ge 0.00000000000000 0.50000000000000 0.50000000000000 72.640 > 65 76 Ge 0.50000000000000 0.50000000000000 0.50000000000000 72.640 > 65 77 Ge 0.00000000000000 0.25000000000000 0.75000000000000 72.640 > 69 78 Ge 0.50000000000000 0.25000000000000 0.75000000000000 72.640 > 69 79 Ge 0.00000000000000 0.75000000000000 0.75000000000000 72.640 > 69 80 Ge 0.50000000000000 0.75000000000000 0.75000000000000 72.640 > 69 81 Hf 0.00000000000000 0.00000000000000 0.00000000000000 178.490 > 81 82 Hf 0.50000000000000 0.00000000000000 0.00000000000000 178.490 > 81 83 Hf 0.00000000000000 0.50000000000000 0.00000000000000 178.490 > 81 84 Hf 0.50000000000000 0.50000000000000 0.00000000000000 178.490 > 81 85 Hf 0.00000000000000 0.25000000000000 0.25000000000000 178.490 > 85 86 Hf 0.50000000000000 0.25000000000000 0.25000000000000 178.490 > 85 87 Hf 0.00000000000000 0.75000000000000 0.25000000000000 178.490 > 85 88 Hf 0.50000000000000 0.75000000000000 0.25000000000000 178.490 > 85 89 Hf 0.25000000000000 0.25000000000000 0.50000000000000 178.490 > 81 90 Hf 0.75000000000000 0.25000000000000 0.50000000000000 178.490 > 81 91 Hf 0.25000000000000 0.75000000000000 0.50000000000000 178.490 > 81 92 Hf 0.75000000000000 0.75000000000000 0.50000000000000 178.490 > 81 93 Hf 0.25000000000000 0.00000000000000 0.75000000000000 178.490 > 85 94 Hf 0.75000000000000 0.00000000000000 0.75000000000000 178.490 > 85 95 Hf 0.25000000000000 0.50000000000000 0.75000000000000 178.490 > 85 96 Hf 0.75000000000000 0.50000000000000 0.75000000000000 178.490 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.7867029 -0.0000011 0.0000000 0.0000011 4.7867029 0.0000000 0.0000000 0.0000000 4.5095945 -------------------------- Born effective charges -------------------------- 1 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 2 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 3 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 4 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 5 O -2.3181756 -0.5077610 -0.3013763 -0.4839860 -2.3225597 0.4101445 -0.3121075 0.2490982 -2.1566841 6 O -2.3225597 0.4839860 -0.4101445 0.5077610 -2.3181756 -0.3013763 -0.2490982 -0.3121075 -2.1566841 7 O -2.3225597 0.4839860 0.4101445 0.5077610 -2.3181756 0.3013763 0.2490982 0.3121075 -2.1566841 8 O -2.3181756 -0.5077610 0.3013763 -0.4839860 -2.3225597 -0.4101445 0.3121075 -0.2490982 -2.1566841 9 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 10 Ge 4.1644906 -0.0023836 0.0000000 0.0023836 4.1644906 0.0000000 0.0000000 0.0000000 3.5779726 11 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 12 Hf 5.1169800 0.0499337 0.0000000 -0.0499337 5.1169800 0.0000000 0.0000000 0.0000000 5.0487638 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000006 (zzz) 0.00000006 (zzz) 0.00000006 (zzz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- 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 ... Generalized regular grid: [ 5 10 20 ] Grid generation matrix: [ 0 10 10 ] [ 10 0 10 ] [ 5 5 0 ] 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: 0.84, Number of G-points: 297, Lambda: 0.19 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/156) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 156 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 4.254 ( 0.000 0.000 0.000) 0.000 4.276 ( -0.000 0.000 0.000) 0.000 4.276 ( 0.000 -0.000 0.000) 0.000 4.888 ( -0.000 0.000 0.000) 0.000 5.766 ( -0.000 0.000 0.000) 0.000 5.766 ( -0.000 0.000 -0.000) 0.000 6.980 ( -0.000 0.000 -0.000) 0.000 6.980 ( 0.000 0.000 -0.000) 0.000 7.654 ( -0.000 0.000 0.000) 0.000 7.689 ( 0.000 0.000 0.000) 0.000 7.689 ( 0.000 0.000 -0.000) 0.000 8.035 ( 0.000 0.000 0.000) 0.000 8.612 ( 0.000 0.000 -0.000) 0.000 10.260 ( -0.000 0.000 0.000) 0.000 11.025 ( 0.000 -0.000 0.000) 0.000 11.025 ( 0.000 0.000 0.000) 0.000 11.525 ( -0.000 0.000 0.000) 0.000 11.851 ( 0.000 -0.000 -0.000) 0.000 13.154 ( -0.000 -0.000 -0.000) 0.000 13.154 ( 0.000 0.000 -0.000) 0.000 14.886 ( 0.000 0.000 0.000) 0.000 14.886 ( -0.000 -0.000 -0.000) 0.000 15.214 ( 0.000 0.000 0.000) 0.000 16.836 ( -0.000 0.000 0.000) 0.000 18.944 ( 0.000 -0.000 -0.000) 0.000 19.987 ( 0.000 0.000 -0.000) 0.000 19.987 ( 0.000 -0.000 -0.000) 0.000 20.453 ( -0.000 0.000 -0.000) 0.000 21.145 ( 0.000 -0.000 0.000) 0.000 22.194 ( 0.000 0.000 0.000) 0.000 22.875 ( 0.000 0.000 0.000) 0.000 22.875 ( 0.000 0.000 -0.000) 0.000 23.173 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/156) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( 25.720 9.636 11.360) 29.723 1.592 ( 26.334 3.698 23.188) 35.282 2.925 ( 54.600 -9.151 12.043) 56.656 4.138 ( -3.337 -0.823 -3.039) 4.588 4.322 ( 3.336 0.048 -4.015) 5.221 4.456 ( 6.645 7.919 -0.787) 10.367 5.053 ( 11.872 -1.681 -2.089) 12.171 6.083 ( 12.576 6.726 -3.878) 14.780 6.666 ( -8.922 -7.585 -0.913) 11.746 6.768 ( 0.678 3.162 -15.970) 16.294 7.073 ( 11.825 1.807 -23.632) 26.488 7.290 ( -7.405 -0.367 -3.839) 8.349 7.562 ( -9.083 -9.573 -0.212) 13.198 7.801 ( 0.725 7.500 -2.853) 8.057 8.822 ( -13.887 1.784 39.899) 42.284 9.083 ( -5.860 -1.377 7.710) 9.782 9.454 ( -24.392 -8.196 -0.105) 25.733 11.076 ( 4.271 3.069 -8.141) 9.692 11.313 ( 5.536 -1.198 -7.042) 9.038 11.553 ( -8.911 -1.346 7.486) 11.716 11.994 ( 11.790 -4.733 6.332) 14.196 13.361 ( 9.171 14.911 -3.753) 17.904 14.621 ( 17.800 -6.545 -30.777) 36.151 14.864 ( -3.673 2.133 8.309) 9.332 15.081 ( 6.001 -0.174 6.567) 8.898 16.314 ( -20.523 -2.903 42.527) 47.309 16.631 ( -5.767 0.112 -7.013) 9.080 18.525 ( -15.614 0.677 -3.671) 16.054 19.715 ( -10.317 12.392 -0.976) 16.154 20.408 ( 1.347 -1.280 -5.813) 6.103 21.335 ( 5.207 -13.641 -1.962) 14.733 21.891 ( -10.897 -1.434 7.766) 13.457 22.770 ( -4.619 6.354 -10.847) 13.393 22.930 ( 0.177 -1.103 1.395) 1.787 23.142 ( 4.593 -0.263 3.712) 5.911 23.937 ( 15.387 -0.295 -19.015) 24.463 ======================= Grid point 2 (3/156) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 12.223 6.962 6.162) 15.358 2.973 ( 20.295 1.647 13.945) 24.679 3.627 ( -6.682 -3.356 -3.681) 8.335 4.154 ( -3.399 -2.766 -3.999) 5.933 4.637 ( 3.163 5.378 0.657) 6.273 5.118 ( 23.863 -1.412 -0.092) 23.905 5.669 ( 14.548 -2.588 0.056) 14.777 6.123 ( -3.280 -0.094 -5.801) 6.664 6.368 ( 4.791 -3.738 -8.952) 10.820 6.706 ( -6.245 7.596 2.110) 10.057 7.008 ( -4.391 6.019 -4.132) 8.520 7.056 ( -5.017 -4.133 -3.267) 7.275 7.300 ( 8.093 0.430 6.137) 10.166 7.732 ( -2.218 5.225 -2.048) 6.035 8.396 ( -17.387 -3.895 -1.713) 17.900 9.041 ( 4.042 -4.696 -4.728) 7.794 9.221 ( -5.757 -7.945 26.889) 28.623 10.821 ( -5.354 6.533 -10.505) 13.480 11.198 ( -2.632 -1.681 -5.801) 6.588 11.387 ( -0.720 -1.516 1.108) 2.011 12.780 ( 13.612 -6.474 11.873) 19.188 13.434 ( -1.518 14.677 -11.351) 18.617 14.783 ( 8.076 -6.834 -9.953) 14.525 14.975 ( -0.790 1.945 12.405) 12.581 15.472 ( 4.233 1.442 7.911) 9.088 16.051 ( -9.420 -0.447 -5.675) 11.006 16.448 ( -1.078 -2.954 6.958) 7.635 17.838 ( -10.304 1.404 -3.248) 10.895 19.308 ( -6.261 6.761 -0.668) 9.239 20.346 ( 0.823 -1.783 -4.562) 4.967 21.209 ( -3.793 -4.107 -1.784) 5.868 21.980 ( 1.795 -10.433 9.335) 14.114 22.425 ( -2.492 9.688 -7.447) 12.471 22.959 ( -0.567 1.009 1.815) 2.152 23.335 ( 1.575 -0.199 1.695) 2.322 24.104 ( 4.367 -0.753 -5.759) 7.266 ======================= Grid point 5 (4/156) ======================= q-point: ( 0.00 0.00 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( 22.861 22.809 -0.000) 32.294 1.098 ( 37.479 12.841 -0.000) 39.618 1.941 ( 35.068 50.521 0.000) 61.499 4.155 ( -5.786 -4.966 0.000) 7.624 4.319 ( 5.799 1.158 -0.000) 5.914 4.459 ( 7.749 5.006 -0.000) 9.225 4.962 ( 4.359 5.340 0.000) 6.893 5.906 ( 8.980 4.221 -0.000) 9.922 6.743 ( -10.924 -8.339 0.000) 13.743 7.047 ( 4.442 1.537 -0.000) 4.700 7.388 ( -2.235 -5.555 -0.000) 5.988 7.517 ( -9.217 2.189 0.000) 9.473 7.853 ( 11.541 -1.035 -0.000) 11.588 7.987 ( -3.772 -4.492 -0.000) 5.865 8.056 ( -10.867 -1.069 0.000) 10.919 8.990 ( 5.809 10.454 0.000) 11.960 9.780 ( -18.082 -14.928 0.000) 23.448 11.075 ( 3.008 1.269 -0.000) 3.265 11.307 ( 7.990 8.153 0.000) 11.415 11.566 ( 3.523 0.309 -0.000) 3.537 11.705 ( -10.888 -0.649 0.000) 10.908 13.319 ( 14.967 -0.714 -0.000) 14.984 14.863 ( 1.267 -3.357 -0.000) 3.588 14.908 ( -0.836 3.372 0.000) 3.474 15.225 ( 0.085 0.663 0.000) 0.669 15.550 ( -0.097 5.883 0.000) 5.884 16.769 ( -3.176 -3.117 0.000) 4.450 18.729 ( -9.987 -10.302 -0.000) 14.348 19.964 ( 8.300 -10.382 -0.000) 13.292 20.463 ( 0.583 0.824 0.000) 1.010 21.135 ( -10.322 9.039 0.000) 13.720 21.963 ( -9.928 -9.103 0.000) 13.470 22.908 ( 2.879 -0.141 -0.000) 2.883 22.996 ( 3.301 5.210 0.000) 6.168 23.024 ( -4.795 -6.220 -0.000) 7.854 24.079 ( 3.737 3.551 -0.000) 5.155 ======================= Grid point 6 (5/156) ======================= q-point: ( 0.00 0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.188 ( 24.417 13.133 11.917) 30.177 2.397 ( 22.891 16.404 6.859) 28.985 3.604 ( 19.841 -4.725 -0.525) 20.403 3.952 ( 0.934 -6.274 3.418) 7.205 4.573 ( 7.794 0.696 -7.702) 10.980 4.782 ( 11.778 5.869 1.435) 13.238 5.369 ( 12.407 2.878 -2.162) 12.918 6.241 ( -4.446 -2.629 -4.130) 6.614 6.521 ( 2.082 4.046 -1.629) 4.833 6.881 ( 6.194 -7.116 -6.414) 11.408 7.061 ( -12.326 -1.345 1.064) 12.445 7.113 ( -6.000 1.961 -1.280) 6.441 7.437 ( 4.861 5.755 -14.096) 15.983 7.979 ( -0.549 7.490 -3.303) 8.205 8.543 ( -9.081 -8.978 16.340) 20.738 8.784 ( -15.371 5.457 14.128) 21.579 9.085 ( -6.266 5.117 5.514) 9.790 11.205 ( 0.427 0.649 -6.081) 6.131 11.300 ( -5.878 0.297 0.117) 5.886 11.441 ( 2.190 1.905 -8.732) 9.202 12.134 ( 14.375 -7.783 9.106) 18.712 13.898 ( 11.675 12.802 -7.852) 19.022 14.636 ( 1.088 -7.135 -14.708) 16.383 14.942 ( -0.693 5.421 4.174) 6.877 15.251 ( 8.053 2.835 5.715) 10.274 15.958 ( -6.550 -4.290 25.041) 26.236 16.468 ( -7.019 -2.716 -6.207) 9.755 18.086 ( -15.848 -10.830 -3.153) 19.452 19.855 ( -11.454 19.996 -3.291) 23.278 20.396 ( 1.615 -3.294 -8.316) 9.089 21.069 ( 4.404 -16.225 0.021) 16.812 21.522 ( -11.145 -11.252 10.441) 18.969 22.795 ( -1.587 3.412 -4.320) 5.730 23.001 ( 0.402 5.115 0.496) 5.155 23.217 ( 4.101 -1.290 2.177) 4.819 24.103 ( 3.269 -2.737 -8.292) 9.324 ======================= Grid point 7 (6/156) ======================= q-point: ( 0.00 0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -0.765 13.371 -6.553) 14.910 3.344 ( 2.130 1.939 2.944) 4.119 3.547 ( 6.200 4.471 -2.314) 7.987 4.067 ( -2.109 1.101 2.719) 3.613 4.578 ( -7.803 -7.198 4.266) 11.441 5.229 ( 4.685 -13.607 -6.640) 15.849 5.745 ( 6.747 -7.573 5.576) 11.574 5.956 ( -12.468 -8.048 0.023) 14.840 6.511 ( 12.173 7.085 -7.714) 16.059 6.644 ( -14.697 -0.794 5.238) 15.623 6.782 ( -1.180 4.048 0.030) 4.217 7.305 ( 1.712 15.905 -1.455) 16.063 7.520 ( -6.986 0.628 -2.428) 7.423 7.715 ( -4.496 5.335 -0.122) 6.978 8.043 ( 8.675 -8.399 1.327) 12.147 9.006 ( -2.264 -2.491 7.215) 7.962 9.511 ( 16.423 20.611 8.944) 27.830 10.793 ( -9.248 6.851 -5.774) 12.876 11.109 ( -1.447 -2.156 0.544) 2.653 11.455 ( 5.134 1.228 -9.254) 10.653 12.802 ( 6.926 -11.116 9.179) 15.993 13.546 ( -12.428 9.256 -14.722) 21.374 14.745 ( 5.087 -8.799 -6.433) 12.028 15.090 ( 2.151 6.679 6.987) 9.902 15.592 ( 1.008 4.118 6.218) 7.526 15.907 ( -5.004 1.541 -0.879) 5.310 16.383 ( 5.017 -6.935 4.207) 9.537 17.586 ( -2.733 -12.057 -1.673) 12.475 19.355 ( -4.132 7.857 -6.492) 10.998 20.337 ( -1.102 1.095 1.620) 2.244 21.153 ( 2.712 -1.261 -0.495) 3.031 21.634 ( 1.745 -20.667 12.695) 24.317 22.666 ( -0.673 12.745 -7.770) 14.942 22.985 ( 0.668 1.107 -2.763) 3.051 23.348 ( 1.194 -1.129 -0.292) 1.669 24.044 ( -3.022 -5.997 2.306) 7.100 ======================= Grid point 8 (7/156) ======================= q-point: ( 0.00 -0.40 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -15.882 10.495 -13.526) 23.353 2.603 ( -21.181 8.007 -18.800) 29.432 3.712 ( -2.684 -2.416 4.369) 5.668 4.228 ( -5.876 -1.370 6.527) 8.888 4.379 ( -14.290 -8.386 0.399) 16.574 4.564 ( -9.441 7.229 -13.017) 17.630 5.408 ( -15.892 5.864 4.341) 17.486 6.106 ( -10.664 1.874 6.976) 12.880 6.349 ( 5.896 -3.170 17.343) 18.590 6.650 ( -0.911 -4.164 -0.337) 4.276 6.931 ( 4.093 2.832 2.862) 5.742 7.115 ( -0.797 1.342 3.267) 3.620 7.594 ( -1.949 -3.772 1.656) 4.557 7.641 ( 6.533 10.609 2.877) 12.787 8.685 ( 16.303 -7.685 -0.297) 18.025 9.100 ( 1.924 0.417 -2.655) 3.305 9.736 ( 5.823 19.029 -22.911) 30.347 10.797 ( 3.376 -1.723 12.274) 12.846 11.266 ( 0.397 1.464 8.678) 8.809 11.502 ( 5.728 -1.239 -5.473) 8.019 12.514 ( -13.972 -2.875 -16.843) 22.072 13.175 ( -2.347 -2.423 7.933) 8.620 14.646 ( -11.164 0.191 11.316) 15.897 15.060 ( 1.445 6.179 -11.481) 13.118 15.365 ( -6.135 1.212 -7.816) 10.010 16.257 ( 8.542 -0.721 12.041) 14.780 16.541 ( 9.473 -4.687 -16.751) 19.806 17.954 ( 15.866 -12.712 5.439) 21.045 19.402 ( 9.560 2.320 -1.328) 9.927 20.350 ( -3.166 1.649 8.139) 8.888 21.368 ( 4.567 -3.972 1.502) 6.236 21.866 ( 1.229 -11.733 -0.726) 11.819 22.498 ( 1.082 7.396 0.130) 7.476 22.999 ( 2.841 2.095 -4.300) 5.563 23.287 ( -2.907 -0.391 -2.882) 4.112 23.926 ( -10.370 -1.061 12.822) 16.525 ======================= Grid point 9 (8/156) ======================= q-point: ( 0.00 -0.20 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -13.302 26.585 -17.366) 34.428 1.278 ( -18.569 21.579 -21.002) 35.377 2.172 ( -40.609 30.248 -24.777) 56.373 4.105 ( 5.363 -4.843 4.911) 8.737 4.296 ( -3.251 3.023 3.103) 5.417 4.441 ( -4.226 9.001 1.240) 10.020 4.942 ( -5.271 4.364 1.991) 7.127 5.883 ( -3.633 9.131 2.391) 10.114 6.672 ( 3.217 -4.899 9.065) 10.795 6.816 ( -14.314 6.663 31.025) 34.811 6.988 ( -6.073 11.079 13.984) 18.846 7.403 ( 4.981 -5.083 5.037) 8.719 7.573 ( 4.281 -8.166 -1.210) 9.299 7.850 ( -2.631 5.916 4.163) 7.698 8.845 ( -4.319 4.089 -9.777) 11.444 9.373 ( 25.842 -25.334 -38.896) 53.127 9.802 ( 10.454 -16.820 -5.315) 20.504 11.014 ( -0.401 2.495 5.729) 6.261 11.238 ( -7.754 7.152 6.571) 12.428 11.690 ( 5.733 -5.413 -1.192) 7.974 11.750 ( -5.235 -1.773 -15.770) 16.711 13.282 ( 1.974 14.457 3.326) 14.966 14.330 ( -23.205 16.132 38.028) 47.380 14.959 ( 1.534 3.474 -7.149) 8.095 14.978 ( -3.552 -0.675 -6.715) 7.627 16.633 ( 19.057 -21.672 -36.331) 46.398 16.725 ( 11.084 -10.855 -13.756) 20.734 18.686 ( 10.333 -9.803 4.149) 14.835 19.951 ( 10.748 8.398 1.384) 13.710 20.373 ( -3.162 -0.691 8.668) 9.252 21.157 ( -7.867 -9.960 -2.068) 12.860 22.018 ( 8.690 -9.176 -5.477) 13.773 22.794 ( 2.616 3.243 11.772) 12.488 23.005 ( -6.273 2.305 -0.884) 6.741 23.050 ( 1.372 0.659 -1.825) 2.376 23.675 ( -18.266 18.428 28.748) 38.726 ======================= Grid point 10 (9/156) ======================= q-point: ( 0.00 0.00 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 23.133 22.984 -0.000) 32.610 2.029 ( 30.107 8.844 -0.000) 31.379 3.362 ( 16.093 33.217 0.000) 36.910 3.895 ( -6.824 -5.776 0.000) 8.940 4.548 ( 11.263 1.923 -0.000) 11.426 4.563 ( 3.244 -6.384 -0.000) 7.161 5.357 ( 8.880 12.954 0.000) 15.706 6.303 ( 17.224 7.836 -0.000) 18.923 6.369 ( -7.905 -2.859 0.000) 8.406 7.004 ( -21.339 -12.026 0.000) 24.495 7.171 ( 7.747 -5.650 -0.000) 9.589 7.192 ( -5.708 -3.600 0.000) 6.749 7.619 ( -11.790 -10.668 0.000) 15.900 8.043 ( 7.230 -0.734 -0.000) 7.267 8.325 ( 11.298 14.145 0.000) 18.103 9.187 ( -18.477 -3.701 0.000) 18.844 9.228 ( -0.863 11.178 0.000) 11.212 11.162 ( 3.634 -0.750 -0.000) 3.710 11.405 ( -3.524 -9.896 -0.000) 10.505 11.533 ( 3.437 2.141 -0.000) 4.049 11.765 ( 0.924 12.259 0.000) 12.294 13.673 ( 20.461 -1.548 -0.000) 20.519 14.774 ( 0.356 -8.244 -0.000) 8.252 15.002 ( -2.164 8.178 0.000) 8.459 15.256 ( 1.739 1.846 0.000) 2.536 15.699 ( -1.336 9.002 0.000) 9.100 16.595 ( -5.334 -4.475 0.000) 6.963 18.152 ( -16.248 -17.711 -0.000) 24.035 19.906 ( 14.135 -17.484 -0.000) 22.483 20.525 ( 1.862 2.800 0.000) 3.363 21.079 ( -19.443 15.191 0.000) 24.674 21.498 ( -13.737 -11.132 0.000) 17.681 22.837 ( -0.148 -5.373 -0.000) 5.375 22.962 ( 4.442 -2.419 -0.000) 5.057 23.146 ( 1.663 3.695 0.000) 4.052 24.168 ( -1.078 1.086 0.000) 1.531 ======================= Grid point 11 (10/156) ======================= q-point: ( 0.00 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.942 ( 18.749 13.744 5.829) 23.966 3.044 ( 17.623 5.155 3.681) 18.727 3.636 ( -0.052 -2.218 -9.495) 9.751 4.013 ( 2.530 1.758 8.812) 9.335 4.460 ( -5.970 -12.917 -2.942) 14.531 4.971 ( 4.967 -11.334 -2.281) 12.583 5.410 ( -0.021 -3.193 1.208) 3.414 6.115 ( -15.965 -7.699 -0.856) 17.745 6.549 ( 11.818 10.067 -5.820) 16.580 6.803 ( -6.020 1.651 3.903) 7.362 7.114 ( -6.583 7.480 -4.616) 10.982 7.340 ( 12.580 6.721 0.866) 14.289 7.423 ( 11.749 -3.937 3.177) 12.792 8.054 ( -5.380 5.244 -2.515) 7.923 8.154 ( -18.452 6.033 -8.288) 21.108 8.772 ( -2.832 -7.045 10.743) 13.156 9.463 ( 11.856 29.037 13.011) 33.956 11.138 ( -3.652 -3.225 -3.114) 5.782 11.221 ( -5.929 5.088 -0.275) 7.817 11.577 ( 6.008 0.198 -12.511) 13.880 12.259 ( 11.024 -4.599 8.301) 14.546 14.276 ( -7.509 9.119 -14.376) 18.607 14.479 ( 12.089 -11.696 -10.640) 19.903 15.013 ( -0.830 4.229 11.016) 11.829 15.501 ( 6.545 5.638 5.663) 10.329 15.832 ( -1.555 -1.147 15.499) 15.619 16.260 ( -6.577 -2.890 -5.601) 9.109 17.482 ( -11.728 -18.253 -2.794) 21.875 19.988 ( -13.604 15.390 -12.200) 23.890 20.337 ( 3.894 -5.098 -4.412) 7.786 20.918 ( 0.646 -12.940 16.993) 21.368 21.070 ( -2.875 -7.760 0.157) 8.277 22.867 ( 3.081 1.900 -2.228) 4.250 23.107 ( 0.449 4.123 -0.520) 4.180 23.257 ( 3.347 -2.176 0.458) 4.019 23.972 ( -5.430 -7.200 -2.369) 9.324 ======================= Grid point 12 (11/156) ======================= q-point: ( 0.00 -0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.897 ( -10.903 11.210 -11.226) 19.250 3.337 ( -9.254 6.849 -4.716) 12.441 3.643 ( -2.049 -5.349 -2.542) 6.267 4.088 ( 2.060 -4.086 3.600) 5.822 4.321 ( -1.380 -0.005 10.425) 10.516 4.899 ( -0.618 -12.587 -10.410) 16.346 5.601 ( -6.611 -2.311 0.048) 7.003 5.779 ( 7.657 -8.707 10.756) 15.816 6.298 ( -14.877 1.689 6.503) 16.324 6.722 ( -8.305 9.566 9.318) 15.726 6.998 ( 7.509 7.885 -12.797) 16.803 7.367 ( -11.397 8.368 -1.687) 14.239 7.606 ( -7.706 1.184 -0.320) 7.803 7.732 ( 4.729 10.868 1.321) 11.926 8.214 ( 7.776 -2.278 10.814) 13.513 8.979 ( 9.800 -4.767 -1.340) 10.980 10.311 ( 13.553 19.721 2.637) 24.074 10.734 ( -10.038 5.269 -6.459) 13.048 11.078 ( 1.328 -1.822 3.053) 3.795 11.532 ( 1.021 -2.225 -7.970) 8.337 12.724 ( 4.236 -2.903 3.018) 5.956 13.377 ( -13.317 4.235 -12.809) 18.956 14.615 ( -3.376 -6.231 0.647) 7.116 15.311 ( 5.492 5.900 -4.969) 9.469 15.647 ( -4.192 4.503 1.052) 6.241 15.898 ( -0.541 1.790 8.532) 8.735 16.384 ( 10.617 -8.543 0.346) 13.632 17.287 ( 6.210 -18.401 1.342) 19.467 19.480 ( 0.923 7.681 -7.221) 10.583 20.310 ( -6.494 2.471 9.943) 12.131 21.050 ( 3.891 -16.079 1.188) 16.586 21.471 ( 9.677 -5.323 4.076) 11.773 22.845 ( -4.019 7.351 -8.085) 11.643 23.042 ( 3.738 0.819 -4.308) 5.762 23.344 ( 0.631 -1.098 -2.082) 2.437 23.791 ( -6.049 -6.600 9.818) 13.287 ======================= Grid point 13 (12/156) ======================= q-point: ( 0.00 -0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -8.737 23.258 -10.755) 27.074 2.428 ( -19.267 15.192 -17.035) 29.870 3.512 ( -9.327 2.459 -3.925) 10.413 3.914 ( -6.159 3.782 -7.477) 10.399 4.306 ( -0.187 2.168 8.078) 8.366 4.712 ( -2.441 9.961 -3.789) 10.934 5.260 ( -12.641 8.692 4.595) 16.014 6.056 ( -1.754 4.890 9.726) 11.027 6.427 ( 5.876 4.759 7.996) 11.004 6.506 ( -6.377 -2.539 12.523) 14.280 7.126 ( 1.261 -1.636 2.957) 3.607 7.148 ( -0.897 9.058 4.576) 10.188 7.381 ( -3.035 -7.660 1.007) 8.301 7.891 ( -1.756 5.979 7.787) 9.973 8.718 ( 12.724 -18.109 3.558) 22.416 9.161 ( 3.116 0.262 -13.009) 13.379 9.895 ( -7.973 -4.996 -22.516) 24.403 10.910 ( 2.671 5.080 9.649) 11.227 11.257 ( -2.500 -0.335 10.306) 10.610 11.433 ( 0.373 -8.129 1.208) 8.227 12.292 ( -3.130 1.672 -26.757) 26.991 13.421 ( 7.854 17.927 7.730) 21.043 14.368 ( -14.046 -0.504 14.914) 20.493 15.213 ( -0.957 2.784 -10.571) 10.973 15.281 ( -5.304 6.400 -8.491) 11.883 16.319 ( 3.052 -4.430 14.773) 15.722 16.584 ( 12.622 -15.138 -24.254) 31.253 18.011 ( 18.093 -15.642 6.436) 24.768 19.824 ( 15.573 10.610 4.253) 19.317 20.221 ( -8.554 -5.107 11.144) 14.948 21.099 ( -5.436 -11.276 -0.384) 12.524 21.775 ( 9.212 -11.202 -10.645) 17.990 22.659 ( 1.204 5.310 4.048) 6.785 23.138 ( 3.100 3.098 -4.547) 6.315 23.181 ( -6.296 -0.747 -1.336) 6.480 23.776 ( -6.329 6.775 14.377) 17.107 ======================= Grid point 15 (13/156) ======================= q-point: ( 0.00 0.00 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 19.254 5.402 -0.000) 19.997 2.758 ( 18.937 17.810 -0.000) 25.996 3.711 ( -1.948 -1.400 0.000) 2.399 4.010 ( -0.415 15.292 0.000) 15.297 4.340 ( -4.545 -15.472 -0.000) 16.126 4.666 ( 3.840 -7.864 -0.000) 8.751 5.483 ( -5.629 0.642 0.000) 5.665 6.246 ( -17.660 -15.568 0.000) 23.542 6.584 ( 12.624 9.088 -0.000) 15.555 6.868 ( 6.905 8.240 0.000) 10.750 6.909 ( 4.249 -14.729 -0.000) 15.330 7.223 ( 9.374 11.230 0.000) 14.628 7.515 ( 0.124 6.673 0.000) 6.675 8.148 ( 4.384 -1.402 -0.000) 4.603 8.529 ( -0.670 -7.717 -0.000) 7.746 8.837 ( -19.315 6.082 0.000) 20.250 9.718 ( 9.444 27.913 0.000) 29.467 11.147 ( -0.314 -4.663 -0.000) 4.674 11.169 ( 2.889 -11.624 -0.000) 11.978 11.569 ( 2.599 -3.695 -0.000) 4.518 12.129 ( 3.366 18.392 0.000) 18.698 14.079 ( 22.964 -2.632 -0.000) 23.114 14.493 ( -6.269 -13.302 -0.000) 14.705 15.102 ( -7.003 10.132 0.000) 12.317 15.420 ( 7.085 4.212 -0.000) 8.242 15.818 ( -3.868 6.607 0.000) 7.656 16.410 ( -5.546 -1.271 0.000) 5.690 17.401 ( -16.632 -20.210 -0.000) 26.174 19.840 ( 15.937 -18.503 -0.000) 24.420 20.624 ( -1.526 3.761 0.000) 4.059 20.975 ( -21.559 16.609 0.000) 27.215 20.986 ( -10.619 -11.337 -0.000) 15.534 22.815 ( 4.422 -1.441 -0.000) 4.651 22.998 ( 6.564 -4.252 -0.000) 7.821 23.210 ( -0.153 1.011 0.000) 1.022 24.057 ( -8.133 -2.505 0.000) 8.509 ======================= Grid point 16 (14/156) ======================= q-point: ( 0.00 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.296 ( 5.455 -0.766 -0.556) 5.537 3.405 ( 6.259 0.266 2.277) 6.666 3.614 ( -2.777 -2.295 -7.557) 8.372 3.920 ( -7.599 -14.599 -2.414) 16.634 4.088 ( 4.394 1.580 11.415) 12.333 4.709 ( 0.557 -12.374 -2.317) 12.602 5.428 ( 2.507 0.593 2.216) 3.398 5.733 ( -8.803 -3.994 1.796) 9.832 6.564 ( -12.036 3.600 -0.967) 12.600 6.855 ( -1.635 5.066 6.604) 8.482 7.383 ( -0.675 11.073 -10.234) 15.093 7.510 ( 12.338 6.136 2.159) 13.948 7.913 ( 0.336 10.213 2.038) 10.419 7.966 ( -11.512 5.188 -1.724) 12.744 8.051 ( -4.937 8.699 1.828) 10.168 8.574 ( 10.562 -11.422 1.809) 15.661 10.305 ( 12.812 21.522 6.333) 25.836 10.924 ( -7.149 -4.967 0.058) 8.705 11.215 ( -2.384 -0.916 -3.401) 4.253 11.635 ( 2.007 -3.866 -8.773) 9.795 12.514 ( 10.495 11.037 5.122) 16.069 13.930 ( -15.628 -7.559 -8.355) 19.266 14.610 ( -0.853 -0.147 -9.012) 9.054 15.191 ( 15.280 0.673 3.957) 15.798 15.675 ( -2.603 4.076 5.609) 7.406 15.824 ( 5.683 -2.073 11.464) 12.962 16.112 ( -5.969 1.568 -4.016) 7.363 16.936 ( -3.654 -17.302 -2.204) 17.821 19.900 ( -10.311 2.258 -11.716) 15.769 20.411 ( -10.259 9.966 7.993) 16.384 20.510 ( 7.737 -17.458 4.668) 19.658 21.141 ( 10.541 -3.250 0.754) 11.056 22.989 ( 4.807 1.643 -1.110) 5.200 23.162 ( -2.019 0.591 -2.539) 3.297 23.304 ( 5.561 -0.222 -1.716) 5.824 23.628 ( -9.745 -8.659 3.032) 13.384 ======================= Grid point 17 (15/156) ======================= q-point: ( 0.00 -0.60 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( -6.687 11.862 -5.513) 14.690 3.238 ( -13.459 6.789 -2.246) 15.241 3.469 ( -1.302 -2.671 -3.988) 4.974 4.059 ( 5.860 -5.510 6.849) 10.565 4.372 ( 0.720 5.929 -6.233) 8.632 4.849 ( 5.724 -5.118 -1.768) 7.880 5.409 ( -4.596 -0.975 1.478) 4.925 5.818 ( 6.346 -4.579 11.125) 13.602 6.117 ( -10.394 4.721 13.932) 18.011 6.847 ( -4.626 19.313 7.324) 21.167 7.216 ( 3.517 -0.394 -10.359) 10.947 7.341 ( -13.406 10.027 -0.181) 16.742 7.417 ( -7.379 2.096 -1.526) 7.821 7.925 ( -4.357 3.944 5.672) 8.168 8.178 ( 2.219 -8.280 7.427) 11.342 9.189 ( 13.534 -3.147 -10.183) 17.227 10.508 ( -16.326 -0.159 -11.232) 19.817 10.809 ( 4.660 9.790 7.781) 13.345 10.999 ( 1.668 -6.272 2.845) 7.086 11.375 ( -8.732 -4.716 1.755) 10.078 12.837 ( 1.333 1.594 -20.579) 20.684 13.459 ( 7.821 14.877 3.926) 17.260 14.328 ( -10.321 -7.914 5.357) 14.066 15.464 ( -0.142 0.827 -9.368) 9.406 15.681 ( -3.022 8.323 -3.363) 9.472 15.895 ( -0.955 -1.387 14.071) 14.171 16.439 ( 11.350 -9.254 -9.086) 17.234 17.158 ( 16.381 -15.614 6.601) 23.574 19.637 ( 1.305 -0.022 5.267) 5.426 20.182 ( -6.272 3.313 6.366) 9.531 20.919 ( 6.370 -5.522 0.643) 8.455 21.562 ( 10.679 -8.418 -8.950) 16.279 22.794 ( -6.870 1.645 -2.632) 7.538 23.169 ( 4.632 1.272 -2.273) 5.314 23.248 ( -5.384 -4.865 1.650) 7.442 23.709 ( 3.135 3.747 5.867) 7.635 ======================= Grid point 18 (16/156) ======================= q-point: ( 0.00 -0.40 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.392 ( -17.098 16.431 -8.954) 25.348 2.608 ( -6.100 23.797 -13.057) 27.821 3.576 ( 5.018 3.363 2.009) 6.366 4.074 ( 4.155 6.826 -7.277) 10.808 4.441 ( 2.023 14.183 3.578) 14.766 4.776 ( -8.049 8.091 2.217) 11.626 5.319 ( -2.706 14.216 2.726) 14.726 6.125 ( 5.175 -2.899 8.064) 10.010 6.331 ( -4.902 -0.079 17.509) 18.183 6.825 ( 0.631 16.430 -2.678) 16.658 7.071 ( 0.386 -3.912 2.163) 4.487 7.114 ( 3.543 -7.501 -1.405) 8.414 7.248 ( -11.370 4.946 6.769) 14.127 7.881 ( -5.260 1.155 6.737) 8.625 8.562 ( 16.939 -23.257 3.296) 28.959 9.158 ( -4.699 -4.215 -4.671) 7.853 9.387 ( -11.209 -11.086 -33.267) 36.814 11.027 ( -5.014 3.042 12.489) 13.797 11.179 ( -0.152 -1.108 9.852) 9.916 11.354 ( 5.334 -5.051 2.164) 7.658 12.424 ( 4.150 8.830 -21.769) 23.856 13.753 ( -13.771 6.005 6.449) 16.349 14.319 ( 9.700 10.120 15.271) 20.730 15.109 ( -6.061 -0.753 -10.596) 12.231 15.404 ( -2.401 7.587 -8.847) 11.900 16.227 ( 1.236 -8.331 10.779) 13.679 16.476 ( 7.019 -12.069 -19.502) 23.984 18.007 ( 11.292 -15.314 4.831) 19.631 19.743 ( -14.228 -12.699 8.594) 20.918 20.243 ( 5.248 4.728 6.395) 9.528 21.065 ( 8.692 2.449 0.305) 9.036 21.766 ( 12.278 -8.510 -14.189) 20.604 22.685 ( -6.689 -0.401 6.822) 9.562 22.996 ( -4.516 -0.571 1.426) 4.770 23.270 ( 1.731 2.890 -3.061) 4.552 23.927 ( 1.276 9.328 8.690) 12.812 ======================= Grid point 19 (17/156) ======================= q-point: ( 0.00 -0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( 11.322 18.482 -7.857) 23.055 2.232 ( 10.434 25.408 -17.420) 32.525 3.841 ( -1.996 3.910 8.559) 9.619 4.243 ( -5.708 34.139 -7.172) 35.348 4.372 ( 2.294 -3.904 1.919) 4.918 4.429 ( -1.035 3.047 -2.049) 3.815 5.478 ( 5.973 15.782 2.767) 17.100 6.224 ( 1.964 7.497 5.468) 9.485 6.526 ( -5.176 -2.876 -6.917) 9.106 6.659 ( 1.617 -10.272 11.342) 15.387 7.069 ( -4.953 -6.086 6.629) 10.272 7.188 ( -3.216 -1.964 5.836) 6.947 7.593 ( -0.279 -2.316 -0.230) 2.344 7.687 ( 8.783 -8.737 1.349) 12.462 8.504 ( 2.466 -6.741 -17.915) 19.299 9.096 ( -0.077 -1.377 4.093) 4.319 9.412 ( 18.003 -3.329 -11.345) 21.538 11.024 ( -3.373 -3.353 10.480) 11.509 11.344 ( -3.614 -8.196 -8.268) 12.190 11.424 ( 2.893 -0.572 5.808) 6.514 12.314 ( -4.278 19.346 -5.165) 20.475 13.350 ( 0.015 5.846 8.929) 10.673 14.719 ( -3.214 -4.802 -7.142) 9.187 15.033 ( 7.012 7.439 12.268) 15.969 15.229 ( 2.104 6.394 -5.631) 8.776 16.107 ( -0.219 -4.167 -19.594) 20.033 16.501 ( -1.354 -4.082 5.890) 7.293 18.044 ( -12.135 -16.986 3.544) 21.174 19.384 ( 1.785 -11.515 -0.586) 11.667 20.473 ( 2.518 1.581 4.449) 5.351 21.423 ( -4.882 -6.675 3.938) 9.160 21.781 ( -7.388 6.566 -6.538) 11.851 22.575 ( 1.606 -6.448 6.337) 9.183 22.906 ( 0.659 -3.798 -5.154) 6.436 23.237 ( -0.152 3.674 -2.080) 4.225 24.155 ( -0.949 5.778 9.864) 11.471 ======================= Grid point 20 (18/156) ======================= q-point: ( 0.00 0.00 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.063 ( 8.948 3.617 -0.000) 9.651 3.236 ( 5.608 2.140 -0.000) 6.002 3.780 ( -5.029 -13.851 -0.000) 14.736 3.886 ( 5.556 6.793 0.000) 8.776 3.903 ( -15.404 -5.955 0.000) 16.515 4.569 ( -2.098 -2.554 -0.000) 3.305 5.466 ( 0.054 2.623 0.000) 2.623 5.691 ( -6.728 -11.250 -0.000) 13.108 6.605 ( 10.668 -8.329 -0.000) 13.534 6.958 ( -7.651 5.936 0.000) 9.683 7.385 ( 16.359 14.620 -0.000) 21.940 7.680 ( 2.131 6.859 0.000) 7.183 7.852 ( 22.128 7.531 -0.000) 23.375 8.143 ( -2.148 -2.356 -0.000) 3.188 8.199 ( -6.239 -12.195 -0.000) 13.698 8.599 ( -20.241 9.513 0.000) 22.365 10.449 ( 8.301 17.758 0.000) 19.602 10.969 ( -5.181 -5.826 -0.000) 7.796 11.097 ( 8.045 -3.636 -0.000) 8.828 11.507 ( 3.347 -8.471 -0.000) 9.108 12.655 ( 6.650 22.411 0.000) 23.377 13.979 ( -11.662 -17.922 -0.000) 21.382 14.513 ( 25.717 -4.171 -0.000) 26.053 15.119 ( -13.989 11.330 0.000) 18.001 15.633 ( 5.533 2.057 -0.000) 5.903 15.799 ( -5.398 1.857 0.000) 5.709 16.340 ( -5.179 4.826 0.000) 7.079 16.723 ( -8.606 -17.556 -0.000) 19.552 19.834 ( 15.618 -12.608 -0.000) 20.072 20.370 ( -19.009 -1.957 0.000) 19.109 20.842 ( 8.093 -5.684 -0.000) 9.889 20.901 ( -16.181 14.164 0.000) 21.505 22.927 ( 5.053 1.955 -0.000) 5.418 23.102 ( 10.467 -2.181 -0.000) 10.691 23.185 ( -1.296 -1.467 -0.000) 1.957 23.754 ( -13.510 -4.200 0.000) 14.148 ======================= Grid point 21 (19/156) ======================= q-point: ( 0.00 -0.80 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.263 ( -5.187 3.977 -1.638) 6.739 3.336 ( -3.481 -5.479 1.539) 6.671 3.487 ( 3.400 -6.033 1.705) 7.131 3.721 ( 7.809 -3.331 -2.117) 8.750 4.378 ( 8.893 1.476 -2.466) 9.346 4.499 ( 3.961 -9.375 3.515) 10.767 5.458 ( -0.487 1.880 2.690) 3.318 5.567 ( -4.312 -0.923 5.681) 7.192 6.368 ( -18.556 7.295 6.030) 20.830 7.028 ( 5.998 6.362 2.075) 8.986 7.449 ( -6.707 7.969 -4.648) 11.406 7.749 ( -8.236 3.179 -3.984) 9.685 7.801 ( -9.692 2.602 -1.715) 10.181 7.975 ( -8.168 -0.509 7.349) 11.000 8.045 ( 1.429 7.204 0.118) 7.345 8.864 ( 23.182 -5.317 -5.770) 24.474 10.686 ( -5.619 -2.332 2.736) 6.670 10.772 ( 2.839 5.918 3.801) 7.585 11.125 ( -3.908 3.389 -5.415) 7.489 11.443 ( -8.205 -9.439 -1.652) 12.615 13.095 ( 9.861 15.640 -4.709) 19.079 13.493 ( -3.806 -8.524 0.053) 9.335 14.410 ( -14.366 -1.438 -1.840) 14.554 15.518 ( 13.316 -7.638 -10.234) 18.450 15.640 ( -2.459 4.750 8.942) 10.420 15.927 ( 7.016 -5.222 6.349) 10.807 16.125 ( 0.808 10.225 -0.258) 10.260 16.651 ( 3.765 -10.902 -0.940) 11.572 19.663 ( -12.780 -1.564 1.791) 13.000 20.307 ( 1.161 2.946 0.812) 3.269 20.641 ( 6.903 1.260 1.261) 7.130 21.284 ( 13.365 -6.740 -3.315) 15.331 23.036 ( -8.298 -1.550 -2.506) 8.805 23.114 ( 3.135 0.538 0.469) 3.215 23.191 ( -7.932 -5.539 2.597) 10.017 23.590 ( 10.858 3.071 -0.292) 11.288 ======================= Grid point 22 (20/156) ======================= q-point: ( 0.00 -0.60 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.992 ( -13.980 0.944 1.899) 14.140 3.214 ( -0.375 15.831 1.510) 15.907 3.472 ( 0.562 0.711 -3.955) 4.058 4.085 ( 2.363 -0.723 5.151) 5.714 4.663 ( 8.311 5.724 -12.799) 16.299 4.751 ( 6.082 -5.674 6.805) 10.747 5.493 ( 4.131 8.344 -1.340) 9.406 5.839 ( 6.680 -5.410 9.973) 13.166 6.072 ( -5.512 9.154 18.023) 20.952 7.056 ( -4.148 -4.470 -7.251) 9.474 7.118 ( -6.670 -4.206 -6.903) 10.481 7.327 ( -7.293 14.716 5.249) 17.242 7.506 ( -0.455 15.622 0.206) 15.630 7.754 ( -4.536 -7.365 8.088) 11.842 8.008 ( -3.982 -7.095 0.010) 8.136 9.229 ( 0.450 -7.955 -8.764) 11.845 10.108 ( -18.720 0.568 -16.790) 25.153 10.900 ( -7.820 -3.446 14.497) 16.828 11.070 ( 0.774 6.081 1.298) 6.266 11.097 ( 2.897 -2.672 7.067) 8.092 12.884 ( 4.245 -0.174 -23.140) 23.526 13.880 ( -12.200 -12.036 5.465) 17.988 14.081 ( 14.243 16.620 7.018) 22.986 15.391 ( -4.637 -1.587 -6.858) 8.429 15.742 ( -5.955 1.226 -0.524) 6.102 15.843 ( 0.025 0.916 9.822) 9.865 16.469 ( 7.108 -5.568 -13.846) 16.530 17.296 ( 20.249 -9.261 6.291) 23.138 19.443 ( -6.076 -8.203 12.277) 15.966 20.296 ( -0.210 8.204 -0.053) 8.206 21.017 ( 5.079 1.553 1.185) 5.441 21.624 ( 13.786 -6.701 -16.865) 22.790 22.727 ( -4.899 2.597 4.287) 7.009 22.963 ( -7.209 -5.711 7.230) 11.699 23.291 ( 3.417 0.789 -1.007) 3.649 23.935 ( 6.249 5.400 -1.446) 8.385 ======================= Grid point 24 (21/156) ======================= q-point: ( 0.00 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.551 ( 16.580 12.357 -5.256) 21.336 2.944 ( 11.323 18.413 -11.174) 24.333 3.744 ( -1.957 -2.142 4.929) 5.719 4.174 ( -9.071 -4.199 0.926) 10.038 4.466 ( 3.125 -8.113 -4.718) 9.892 4.640 ( -15.995 23.161 0.545) 28.153 5.601 ( -8.089 -0.785 1.547) 8.273 6.126 ( -7.468 -18.184 5.387) 20.383 6.373 ( 2.262 -15.202 -10.504) 18.616 6.674 ( 6.522 14.254 8.662) 17.910 7.000 ( 5.071 9.436 -0.499) 10.724 7.302 ( 5.839 6.458 -0.381) 8.715 7.524 ( 1.832 0.495 -3.181) 3.704 7.816 ( 16.189 -7.167 1.476) 17.766 8.398 ( 0.239 -12.128 -2.787) 12.447 9.075 ( -4.550 5.236 8.543) 11.004 9.996 ( 23.490 13.750 -10.847) 29.300 10.827 ( 1.142 -10.827 2.935) 11.276 11.101 ( -5.823 -5.704 -3.328) 8.804 11.391 ( 0.707 -5.820 3.900) 7.041 12.645 ( -4.403 21.305 -2.549) 21.904 13.564 ( 9.722 3.906 13.542) 17.122 14.474 ( -6.619 -9.855 -8.389) 14.536 15.265 ( 4.711 4.357 1.419) 6.572 15.450 ( 4.429 8.044 -2.938) 9.641 16.013 ( -1.822 -3.976 -4.918) 6.581 16.461 ( -1.980 3.309 3.311) 5.083 17.377 ( -19.585 -14.551 2.153) 24.494 19.292 ( 8.907 -8.371 -2.493) 12.475 20.562 ( 4.392 -0.931 3.119) 5.467 21.078 ( -12.917 -5.611 0.209) 14.085 21.664 ( -17.828 7.557 4.002) 19.773 22.638 ( 9.356 0.289 -1.197) 9.436 22.832 ( 3.081 -5.911 -5.663) 8.747 23.271 ( -1.662 1.394 -1.199) 2.478 24.134 ( -6.673 -0.006 6.036) 8.998 ======================= Grid point 25 (22/156) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.237 ( -1.923 -2.876 -0.000) 3.459 3.237 ( 1.923 2.876 0.000) 3.459 3.549 ( -6.950 1.775 0.000) 7.173 3.549 ( 6.950 -1.775 -0.000) 7.173 4.315 ( -10.171 -9.370 0.000) 13.829 4.315 ( 10.171 9.370 -0.000) 13.829 5.511 ( 0.607 -3.024 -0.000) 3.084 5.511 ( -0.607 3.024 0.000) 3.084 6.804 ( -15.240 2.931 0.000) 15.519 6.804 ( 15.240 -2.931 -0.000) 15.519 7.834 ( -2.137 -12.520 -0.000) 12.701 7.834 ( 2.137 12.520 0.000) 12.701 7.951 ( -9.226 -5.850 0.000) 10.925 7.951 ( 9.226 5.850 -0.000) 10.925 8.338 ( -19.780 3.469 0.000) 20.082 8.338 ( 19.780 -3.469 -0.000) 20.082 10.751 ( -6.324 -3.173 0.000) 7.076 10.751 ( 6.324 3.173 -0.000) 7.076 11.330 ( -1.811 -10.653 -0.000) 10.806 11.330 ( 1.811 10.653 0.000) 10.806 13.313 ( -11.682 -21.859 -0.000) 24.784 13.313 ( 11.682 21.859 0.000) 24.784 14.926 ( -24.589 8.213 0.000) 25.924 14.926 ( 24.589 -8.213 -0.000) 25.924 15.726 ( -4.582 1.567 0.000) 4.843 15.726 ( 4.582 -1.567 -0.000) 4.843 16.392 ( 2.938 -9.769 -0.000) 10.201 16.392 ( -2.938 9.769 0.000) 10.201 19.999 ( -17.067 3.667 0.000) 17.456 19.999 ( 17.067 -3.667 -0.000) 17.456 20.879 ( 10.559 -9.682 -0.000) 14.326 20.879 ( -10.559 9.682 0.000) 14.326 23.073 ( -3.527 -2.942 0.000) 4.593 23.073 ( 3.527 2.942 -0.000) 4.593 23.381 ( -14.498 -2.322 0.000) 14.683 23.381 ( 14.498 2.322 -0.000) 14.683 ======================= Grid point 27 (23/156) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.055 ( -10.599 -8.480 3.259) 13.960 3.326 ( -1.194 -4.086 5.266) 6.772 3.558 ( 3.031 11.426 -1.223) 11.884 3.959 ( 10.626 -0.486 -5.777) 12.105 4.253 ( 7.301 -5.511 9.180) 12.960 4.687 ( 9.749 -4.763 -5.781) 12.294 5.487 ( 0.587 -1.150 2.659) 2.956 5.620 ( 6.483 10.495 0.329) 12.340 6.207 ( -13.896 13.197 13.148) 23.241 7.073 ( -0.967 -9.909 -8.819) 13.300 7.387 ( -12.336 -4.192 -2.504) 13.267 7.529 ( -8.855 -0.853 4.712) 10.067 7.651 ( -7.209 0.509 3.690) 8.114 7.927 ( -7.055 10.543 -0.781) 12.710 8.145 ( -1.398 5.701 -0.185) 5.873 9.078 ( 13.373 -10.467 -9.361) 19.391 10.567 ( -6.942 0.556 3.752) 7.911 10.888 ( -1.335 6.182 0.948) 6.395 10.909 ( -13.688 -10.362 3.595) 17.540 11.250 ( -0.976 8.254 -2.706) 8.741 12.994 ( -0.678 -15.794 -5.555) 16.756 13.769 ( 3.519 3.474 -6.153) 7.893 14.145 ( -4.960 7.241 5.382) 10.296 15.434 ( -2.835 -4.423 1.302) 5.413 15.668 ( -0.552 -5.315 0.281) 5.351 15.915 ( 0.662 1.116 2.777) 3.065 16.474 ( 5.912 -0.790 -6.913) 9.130 16.714 ( 18.083 6.050 3.876) 19.458 19.399 ( -11.969 2.341 4.028) 12.843 20.512 ( 0.152 10.388 -0.529) 10.402 20.782 ( 11.229 -3.561 0.069) 11.781 21.444 ( 16.517 -6.988 -6.342) 19.023 22.848 ( -8.786 3.222 2.801) 9.769 22.888 ( -8.003 -5.185 3.297) 10.090 23.228 ( 3.388 0.363 0.507) 3.445 23.904 ( 11.093 3.464 -3.529) 12.145 ======================= Grid point 28 (24/156) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( -9.187 -7.158 5.866) 13.040 3.320 ( -2.060 -9.178 5.620) 10.957 3.516 ( -2.986 9.225 0.519) 9.710 4.119 ( -2.368 4.276 -2.652) 5.561 4.605 ( 5.206 -6.017 2.350) 8.297 5.206 ( 15.217 2.032 -5.009) 16.148 5.801 ( 4.000 3.277 1.104) 5.287 5.919 ( 11.589 0.886 2.769) 11.948 6.287 ( -0.682 15.358 11.832) 19.399 6.771 ( -1.036 -14.907 -7.572) 16.752 6.890 ( -5.535 -1.678 -8.641) 10.397 7.266 ( -17.538 6.384 2.935) 18.893 7.449 ( -0.137 -11.271 4.347) 12.081 7.689 ( -1.307 -3.893 3.685) 5.517 8.081 ( 4.467 14.309 -2.866) 15.261 9.057 ( -3.457 0.085 1.120) 3.635 9.680 ( -23.541 -3.151 -6.654) 24.665 10.682 ( -1.467 -0.102 4.540) 4.772 11.139 ( 1.458 2.542 -2.707) 3.990 11.308 ( 4.227 4.509 5.675) 8.391 13.011 ( 8.075 -2.585 -10.356) 13.384 13.387 ( -8.852 -10.713 -0.032) 13.897 14.615 ( 10.530 9.240 6.945) 15.636 15.205 ( -7.373 -5.061 -4.405) 9.969 15.581 ( -3.691 -4.217 6.773) 8.790 15.901 ( -0.861 5.653 -1.001) 5.805 16.488 ( 1.980 -2.607 -5.656) 6.535 17.562 ( 13.406 0.595 0.666) 13.436 19.226 ( -2.619 -1.946 6.522) 7.292 20.376 ( -2.721 2.921 -2.315) 4.615 21.143 ( 2.115 3.153 0.466) 3.825 21.890 ( 17.192 -1.332 -13.431) 21.857 22.515 ( -14.187 -1.271 7.467) 16.082 22.896 ( 2.476 1.053 6.371) 6.916 23.344 ( 1.407 -0.473 0.137) 1.491 24.111 ( 3.238 1.234 -4.376) 5.582 ======================= Grid point 51 (25/156) ======================= q-point: ( 0.05 -0.05 -0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( -31.102 -0.023 0.000) 31.102 0.709 ( -33.244 -16.914 0.000) 37.300 1.458 ( -69.096 8.803 0.000) 69.654 4.253 ( 2.402 0.937 -0.000) 2.578 4.277 ( -2.294 -2.328 -0.000) 3.268 4.342 ( -5.769 -1.395 0.000) 5.936 4.920 ( -3.628 0.207 0.000) 3.634 5.867 ( -9.320 -2.593 0.000) 9.674 6.897 ( 7.702 3.230 -0.000) 8.352 6.960 ( 1.794 -3.295 -0.000) 3.752 7.389 ( 0.832 -1.848 -0.000) 2.026 7.552 ( 5.200 12.214 0.000) 13.275 7.748 ( -2.426 -11.965 -0.000) 12.209 8.029 ( 1.020 -0.189 -0.000) 1.037 8.152 ( 17.223 4.780 -0.000) 17.874 8.874 ( -12.657 2.088 0.000) 12.828 9.972 ( 22.670 0.936 -0.000) 22.689 11.061 ( -3.452 -0.825 0.000) 3.549 11.197 ( -11.720 0.289 0.000) 11.724 11.533 ( 0.367 -0.238 -0.000) 0.438 11.842 ( -0.586 4.916 0.000) 4.951 13.222 ( -6.398 -8.983 -0.000) 11.029 14.856 ( 2.796 -0.823 -0.000) 2.914 14.913 ( -2.622 0.677 0.000) 2.708 15.220 ( -0.449 0.183 0.000) 0.485 15.517 ( -2.941 3.066 0.000) 4.249 16.800 ( 3.463 0.002 -0.000) 3.463 18.838 ( 9.902 -0.089 -0.000) 9.902 19.910 ( 6.958 -8.613 -0.000) 11.072 20.455 ( -0.298 0.071 0.000) 0.306 21.208 ( -5.739 8.823 0.000) 10.525 22.070 ( 10.579 0.269 -0.000) 10.583 22.883 ( -0.661 -1.136 -0.000) 1.314 22.954 ( -6.373 0.795 0.000) 6.422 23.087 ( 7.452 -0.441 -0.000) 7.465 24.037 ( -5.547 -0.315 0.000) 5.556 ======================= Grid point 52 (26/156) ======================= q-point: ( 0.05 0.15 -0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.899 ( 24.292 9.266 19.168) 32.301 1.062 ( 25.771 -0.854 26.322) 36.848 1.783 ( 50.212 -4.592 34.688) 61.201 4.193 ( -2.006 2.091 -5.481) 6.199 4.267 ( 2.704 -5.628 -3.951) 7.389 4.323 ( 5.178 5.382 0.109) 7.469 4.901 ( 3.191 -0.193 -1.943) 3.741 5.846 ( 9.051 3.103 -2.301) 9.841 6.483 ( 33.966 -3.217 -38.389) 51.359 6.832 ( -5.065 -5.221 -7.662) 10.565 6.884 ( 1.270 5.249 -9.294) 10.749 7.455 ( -7.753 -0.124 -5.122) 9.293 7.676 ( -2.341 -2.188 -0.676) 3.275 7.763 ( 3.330 2.273 -3.736) 5.497 8.780 ( 9.073 -0.177 4.888) 10.308 9.747 ( -54.644 1.930 51.927) 75.406 9.950 ( -22.367 -3.827 -0.421) 22.696 11.004 ( 2.383 0.733 -5.283) 5.842 11.136 ( 10.590 -0.149 -5.780) 12.065 11.693 ( -3.317 0.025 13.877) 14.268 11.833 ( 3.003 -3.963 1.842) 5.302 13.200 ( 5.897 9.134 -2.052) 11.064 14.041 ( 41.575 -4.250 -40.191) 57.981 14.928 ( -2.296 0.466 7.048) 7.428 14.985 ( 3.125 -0.264 6.680) 7.380 16.727 ( -3.396 -0.130 -7.775) 8.485 17.110 ( -66.135 -1.039 68.583) 95.282 18.796 ( -9.706 0.198 -4.077) 10.529 19.900 ( -6.945 8.579 -1.088) 11.091 20.365 ( 3.983 -1.541 -8.577) 9.582 21.223 ( 4.657 -8.430 1.542) 9.753 22.119 ( -9.826 -0.015 4.866) 10.965 22.780 ( 9.079 4.732 -22.190) 24.438 22.904 ( 2.132 -3.207 0.237) 3.858 23.064 ( 5.526 0.500 -1.224) 5.682 23.410 ( 36.656 0.144 -28.251) 46.280 ======================= Grid point 53 (27/156) ======================= q-point: ( 0.05 0.35 -0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( 17.638 8.199 11.507) 22.599 2.524 ( 22.738 0.609 18.880) 29.561 3.686 ( 3.688 -4.408 -2.956) 6.463 4.196 ( -0.712 -5.454 -4.183) 6.910 4.462 ( 27.297 -1.268 9.849) 29.047 4.583 ( 9.245 9.887 -2.983) 13.861 5.313 ( 17.705 -2.444 -3.422) 18.198 6.153 ( 7.273 4.846 -7.538) 11.541 6.304 ( -5.381 -4.967 -16.929) 18.445 6.792 ( 2.753 5.022 5.246) 7.767 6.955 ( 5.588 8.163 -9.219) 13.522 7.093 ( 0.183 -0.781 -5.966) 6.020 7.351 ( -9.922 -13.558 1.436) 16.862 7.745 ( 0.773 7.280 -4.638) 8.667 8.833 ( -24.110 1.477 1.097) 24.180 9.033 ( -2.237 -3.052 -2.545) 4.560 9.391 ( -11.210 -10.172 33.124) 36.419 10.890 ( -1.289 6.563 -13.904) 15.429 11.217 ( 1.210 -2.679 -8.441) 8.938 11.462 ( -6.464 -4.450 1.809) 8.053 12.507 ( 11.974 -3.115 18.578) 22.321 13.404 ( 4.180 17.070 -6.968) 18.905 14.543 ( 14.721 -9.568 -14.565) 22.813 15.015 ( -2.315 2.075 12.979) 13.346 15.365 ( 5.990 1.132 8.464) 10.431 16.252 ( -9.058 -0.952 -12.010) 15.073 16.574 ( -12.796 -1.838 19.579) 23.462 18.111 ( -15.389 1.580 -4.558) 16.128 19.477 ( -9.659 9.498 -1.636) 13.645 20.311 ( 2.237 -2.163 -7.158) 7.805 21.288 ( -2.981 -9.946 -2.931) 10.789 21.973 ( -1.806 -5.017 11.536) 12.709 22.485 ( -2.974 8.578 -9.502) 13.142 22.968 ( -0.163 -0.715 1.586) 1.747 23.289 ( 2.969 -0.276 3.048) 4.264 23.939 ( 11.858 0.074 -10.731) 15.993 ======================= Grid point 54 (28/156) ======================= q-point: ( 0.05 -0.45 -0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( -3.631 -3.460 0.455) 5.037 3.314 ( -8.252 -1.059 -5.665) 10.066 3.476 ( 3.878 -0.542 1.134) 4.076 4.074 ( 3.381 1.502 0.917) 3.812 4.658 ( 1.723 0.517 -2.724) 3.264 5.375 ( -1.561 -0.374 5.067) 5.315 5.839 ( -2.900 0.949 -4.797) 5.685 6.084 ( 10.403 0.524 -0.357) 10.423 6.308 ( 2.228 -6.838 -3.561) 8.026 6.739 ( -2.264 2.779 6.348) 7.291 6.855 ( 0.770 9.898 -1.691) 10.070 7.000 ( 0.709 -7.293 3.012) 7.922 7.500 ( -5.849 -2.964 -3.741) 7.549 7.658 ( 3.434 0.665 1.404) 3.769 8.174 ( 1.691 0.041 1.395) 2.192 9.001 ( 6.575 -0.477 -11.963) 13.659 9.336 ( -14.690 6.430 3.918) 16.507 10.699 ( 5.469 -2.621 0.666) 6.101 11.142 ( 2.382 0.923 1.498) 2.962 11.397 ( -0.889 -3.956 1.806) 4.438 13.027 ( -9.039 8.592 -5.898) 13.795 13.356 ( 4.846 -7.418 14.642) 17.114 14.800 ( 5.492 -5.734 -3.791) 8.799 15.055 ( -7.103 5.438 1.931) 9.151 15.544 ( -2.718 -0.296 -6.797) 7.326 15.891 ( 5.551 -0.048 0.976) 5.636 16.484 ( -3.982 2.579 0.729) 4.800 17.711 ( 1.488 -0.519 0.658) 1.708 19.233 ( 0.690 -3.377 -0.713) 3.519 20.336 ( 1.900 1.022 0.972) 2.366 21.160 ( 0.620 -0.101 0.036) 0.630 22.026 ( -2.301 12.983 -5.746) 14.384 22.388 ( 1.131 -10.419 6.359) 12.259 22.951 ( 0.105 -2.364 -2.198) 3.229 23.360 ( -0.895 -0.073 0.147) 0.910 24.127 ( 2.040 1.754 1.306) 2.990 ======================= Grid point 55 (29/156) ======================= q-point: ( 0.05 -0.25 -0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( -22.243 -11.051 -5.955) 25.540 2.142 ( -26.628 -3.217 -18.533) 32.601 3.771 ( -15.464 8.187 5.499) 18.341 4.112 ( -4.713 9.412 -7.854) 13.133 4.478 ( -13.422 -7.805 5.761) 16.561 4.608 ( -12.701 -10.262 -0.294) 16.331 5.371 ( -17.443 3.263 2.310) 17.895 6.270 ( -0.985 -3.115 5.531) 6.424 6.480 ( 5.051 3.041 -1.598) 6.108 6.791 ( -1.252 -9.147 6.459) 11.267 7.101 ( 4.003 -0.231 2.968) 4.989 7.276 ( 0.340 -3.167 13.275) 13.651 7.328 ( 10.209 14.102 3.425) 17.743 7.797 ( 1.589 -9.245 1.064) 9.441 8.524 ( 9.816 -5.072 -33.175) 34.966 8.998 ( 18.206 19.124 -2.975) 26.571 9.074 ( 0.545 2.686 0.423) 2.773 11.127 ( 2.711 -5.546 9.380) 11.229 11.344 ( 1.423 3.165 0.270) 3.481 11.406 ( 2.962 -1.474 1.276) 3.546 12.292 ( -16.304 6.033 -5.244) 18.158 13.555 ( -9.008 -17.164 7.923) 20.941 14.769 ( 3.468 0.849 -9.198) 9.866 14.887 ( -7.580 4.073 17.965) 19.919 15.214 ( -6.295 -0.666 -6.318) 8.943 16.060 ( 6.476 4.457 -24.020) 25.274 16.506 ( 5.761 0.849 5.845) 8.250 18.189 ( 16.062 -1.242 3.175) 16.420 19.497 ( 10.285 -12.626 0.570) 16.295 20.431 ( -0.789 1.478 4.758) 5.044 21.375 ( 2.969 9.771 6.323) 12.011 21.743 ( 1.539 9.110 -11.906) 15.070 22.659 ( 5.242 -8.114 7.763) 12.393 22.924 ( 0.710 -2.253 -2.635) 3.539 23.235 ( -4.072 0.419 -2.381) 4.736 24.149 ( -6.242 1.466 9.682) 11.612 ======================= Grid point 57 (30/156) ======================= q-point: ( 0.05 0.15 0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.680 ( 24.001 14.560 19.158) 33.986 1.873 ( 28.220 14.983 7.109) 32.732 2.929 ( 39.420 13.338 13.205) 43.660 4.008 ( -4.335 -7.979 -3.160) 9.615 4.407 ( 7.076 4.344 -6.360) 10.459 4.611 ( 7.368 4.875 0.458) 8.847 5.103 ( 11.273 7.261 -2.114) 13.574 6.168 ( 15.452 1.556 -3.388) 15.895 6.494 ( -8.303 -6.984 -0.168) 10.851 6.864 ( -0.762 4.139 -21.315) 21.727 7.244 ( 5.526 9.565 -19.473) 22.388 7.277 ( -1.499 -0.802 -3.484) 3.877 7.350 ( -13.245 -7.968 3.271) 15.799 7.948 ( 3.264 5.469 -4.324) 7.698 8.772 ( -13.050 -7.270 41.056) 43.689 9.029 ( -6.089 -2.869 -2.454) 7.164 9.375 ( -21.691 2.822 7.680) 23.183 11.105 ( 5.793 -0.386 -6.935) 9.045 11.358 ( 3.524 4.855 -8.086) 10.068 11.506 ( -8.674 -2.843 1.188) 9.206 11.872 ( 10.187 -4.359 13.462) 17.436 13.608 ( 15.591 4.476 -4.143) 16.742 14.570 ( 6.686 3.244 -28.230) 29.192 14.958 ( -0.895 5.805 6.349) 8.649 15.080 ( 7.740 0.526 5.951) 9.778 16.185 ( -16.024 -7.357 38.076) 41.961 16.606 ( -6.033 -2.624 -6.586) 9.309 18.418 ( -15.401 -10.745 -3.659) 19.132 20.030 ( -3.138 10.369 -1.158) 10.896 20.362 ( 0.730 -2.727 -10.771) 11.135 21.023 ( -1.523 -8.772 1.913) 9.106 21.780 ( -12.897 -8.387 7.503) 17.117 22.827 ( -0.573 -1.809 -7.115) 7.364 22.996 ( -0.351 6.296 1.412) 6.462 23.126 ( 4.589 -1.097 3.287) 5.750 23.971 ( 9.878 3.069 -16.381) 19.374 ======================= Grid point 58 (31/156) ======================= q-point: ( 0.05 0.35 0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( 10.009 16.053 1.644) 18.989 3.065 ( 19.919 5.967 10.771) 23.418 3.555 ( -3.028 -3.719 -5.558) 7.341 4.118 ( -1.501 -0.261 0.929) 1.784 4.658 ( 2.327 -4.861 3.845) 6.620 5.017 ( 14.363 -5.912 -7.037) 17.052 5.568 ( 9.334 -6.398 2.508) 11.591 6.121 ( 0.978 -1.412 -8.520) 8.692 6.317 ( 1.109 -0.615 -10.513) 10.589 6.854 ( -6.739 6.851 1.920) 9.800 6.887 ( -8.794 -1.189 4.467) 9.935 7.272 ( 5.587 5.324 -1.879) 7.943 7.391 ( 12.968 10.009 0.459) 16.387 7.859 ( -4.138 6.352 -4.246) 8.689 8.123 ( -16.890 -16.354 -4.667) 23.969 9.067 ( -3.238 2.360 3.274) 5.174 9.301 ( 2.491 15.504 27.144) 31.359 10.978 ( -7.435 8.711 -9.954) 15.174 11.150 ( -1.977 -2.875 -4.621) 5.790 11.344 ( 4.216 -2.630 -7.390) 8.905 12.624 ( 9.801 -7.751 14.696) 19.290 13.750 ( -6.033 14.934 -11.426) 19.748 14.547 ( 11.690 -13.532 -10.239) 20.606 15.091 ( -0.962 6.818 11.081) 13.046 15.535 ( 4.642 4.319 7.783) 10.039 16.049 ( -8.236 0.449 -5.206) 9.754 16.342 ( -1.627 -6.997 10.075) 12.374 17.730 ( -10.784 -11.396 -3.918) 16.172 19.503 ( -9.898 10.991 -8.054) 16.842 20.320 ( 2.538 -0.995 -3.131) 4.151 21.114 ( 1.812 -4.308 -1.062) 4.793 21.642 ( -3.073 -18.581 15.120) 24.152 22.675 ( -0.422 10.534 -6.684) 12.483 22.985 ( -0.442 2.164 -2.532) 3.360 23.317 ( 1.825 -1.541 1.518) 2.830 24.049 ( 2.692 -4.413 -2.799) 5.878 ======================= Grid point 59 (32/156) ======================= q-point: ( 0.05 -0.45 0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.435 ( -13.098 8.448 -10.321) 18.694 3.017 ( -18.267 5.668 -13.597) 23.466 3.680 ( 5.160 1.139 2.082) 5.679 4.208 ( 3.302 1.359 6.183) 7.140 4.504 ( -2.965 -5.653 0.111) 6.384 5.003 ( -20.902 -12.102 -4.305) 24.534 5.680 ( -9.587 -1.672 2.216) 9.981 6.108 ( 10.397 -2.577 6.174) 12.364 6.441 ( -15.172 -0.739 9.929) 18.148 6.573 ( 10.185 0.303 -9.702) 14.069 6.862 ( -0.045 -1.728 7.500) 7.697 7.209 ( -8.493 4.427 -0.522) 9.591 7.451 ( 9.724 14.944 -1.449) 17.888 7.637 ( -1.363 -4.020 -1.582) 4.530 8.388 ( 13.942 -0.927 2.427) 14.182 9.065 ( 0.901 -1.859 0.425) 2.109 9.664 ( 1.419 28.035 -13.511) 31.154 10.721 ( 3.424 -2.598 8.304) 9.351 11.210 ( 3.969 -0.840 5.567) 6.888 11.399 ( 4.365 -0.451 -6.848) 8.133 12.827 ( -14.414 -3.544 -7.268) 16.527 13.236 ( -3.961 -1.640 9.120) 10.077 14.742 ( 2.037 -6.483 -1.958) 7.072 15.091 ( -4.748 8.695 -1.526) 10.024 15.482 ( -5.212 2.376 -7.461) 9.406 16.059 ( 9.313 0.110 5.263) 10.698 16.461 ( 0.228 -1.567 -2.567) 3.016 17.677 ( 10.144 -13.448 3.057) 17.120 19.254 ( 4.525 1.710 -3.881) 6.201 20.396 ( -0.927 3.067 5.601) 6.452 21.241 ( 6.197 -2.329 0.355) 6.630 21.870 ( -0.783 -15.358 7.805) 17.245 22.493 ( -0.601 11.256 -5.547) 12.563 22.938 ( 2.776 -0.744 -5.356) 6.079 23.328 ( -1.229 -0.809 -1.769) 2.301 24.078 ( -4.434 -3.142 8.511) 10.098 ======================= Grid point 60 (33/156) ======================= q-point: ( 0.05 -0.25 0.05) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( -18.310 19.741 -10.388) 28.860 1.716 ( -23.813 13.680 -22.432) 35.460 3.151 ( -48.945 11.454 -8.714) 51.017 4.023 ( 2.172 -8.196 3.979) 9.366 4.365 ( -3.299 1.596 0.165) 3.668 4.457 ( 2.500 8.157 1.224) 8.619 5.149 ( -14.305 7.363 2.405) 16.268 6.030 ( -9.509 4.007 4.285) 11.173 6.576 ( 3.598 -9.959 1.203) 10.657 6.858 ( 6.314 5.367 12.329) 14.855 7.151 ( -1.682 4.931 18.320) 19.046 7.276 ( 5.966 -2.736 6.967) 9.571 7.558 ( -3.025 -7.469 0.475) 8.072 7.833 ( 4.374 9.049 3.161) 10.536 8.735 ( 14.792 -5.765 -35.783) 39.147 9.099 ( 0.378 -0.761 5.496) 5.561 9.567 ( 10.640 1.307 -10.944) 15.320 11.031 ( -1.057 -0.096 8.217) 8.285 11.379 ( -4.867 4.122 6.925) 9.415 11.538 ( 8.930 -3.390 -7.184) 11.952 11.959 ( -14.275 -6.567 -8.455) 17.844 13.267 ( -1.652 8.124 5.616) 10.014 14.706 ( -10.444 0.394 19.795) 22.384 14.919 ( -0.023 6.938 -2.623) 7.417 15.091 ( -6.633 1.090 -5.674) 8.796 16.257 ( 11.951 -7.424 -36.642) 39.250 16.607 ( 5.464 -2.325 7.352) 9.451 18.399 ( 16.540 -10.817 4.093) 20.182 19.658 ( 14.643 6.299 0.859) 15.963 20.430 ( -2.389 0.859 5.835) 6.364 21.382 ( -9.955 -9.196 1.822) 13.675 21.817 ( 8.974 -8.196 -7.415) 14.237 22.707 ( 5.753 0.883 9.788) 11.388 22.979 ( 3.356 2.991 -4.208) 6.157 23.143 ( -5.420 0.147 -2.632) 6.027 23.983 ( -11.233 3.399 16.884) 20.562 ======================= Grid point 61 (34/156) ======================= q-point: ( 0.05 -0.05 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 22.743 19.257 -0.000) 29.801 1.460 ( 15.899 28.056 0.000) 32.248 3.072 ( 12.573 55.031 0.000) 56.450 4.068 ( -9.031 -3.729 0.000) 9.770 4.351 ( 6.009 1.999 -0.000) 6.333 4.480 ( 4.125 -2.634 -0.000) 4.895 5.173 ( 7.514 14.572 0.000) 16.395 6.072 ( 4.140 10.818 0.000) 11.583 6.579 ( -10.749 -7.280 0.000) 12.982 6.990 ( 9.139 -7.217 -0.000) 11.645 7.256 ( -2.757 -7.034 -0.000) 7.555 7.413 ( -14.475 -8.202 0.000) 16.637 7.842 ( -9.118 -9.384 -0.000) 13.084 7.860 ( 9.585 -3.838 -0.000) 10.325 8.075 ( 12.985 6.398 -0.000) 14.475 9.171 ( 5.911 5.834 -0.000) 8.305 9.457 ( -6.725 -14.731 -0.000) 16.194 11.123 ( -0.463 3.219 0.000) 3.252 11.442 ( -0.546 -9.975 -0.000) 9.990 11.450 ( 4.207 4.771 0.000) 6.361 11.895 ( -10.260 15.363 0.000) 18.474 13.329 ( 9.772 3.036 -0.000) 10.233 14.760 ( 0.352 -6.187 -0.000) 6.197 15.013 ( 0.516 6.529 0.000) 6.550 15.239 ( 0.562 0.372 -0.000) 0.674 15.698 ( 2.080 7.793 0.000) 8.066 16.677 ( -2.470 -5.547 -0.000) 6.072 18.440 ( -10.751 -16.694 -0.000) 19.856 19.666 ( 6.689 -15.235 -0.000) 16.639 20.488 ( 1.608 1.483 -0.000) 2.187 21.407 ( -9.438 14.338 0.000) 17.165 21.735 ( -8.201 -12.272 -0.000) 14.760 22.856 ( -1.849 -9.378 -0.000) 9.558 22.888 ( 2.059 -1.725 -0.000) 2.686 23.115 ( 1.316 5.592 0.000) 5.744 24.171 ( 0.448 4.850 0.000) 4.871 ======================= Grid point 62 (35/156) ======================= q-point: ( 0.05 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( 22.477 17.123 12.257) 30.800 2.622 ( 22.929 5.727 3.027) 23.826 3.618 ( 3.831 2.791 -6.153) 7.767 3.889 ( 6.865 2.733 7.715) 10.682 4.502 ( 1.091 -7.341 -7.348) 10.443 4.830 ( 8.339 -1.604 3.465) 9.171 5.438 ( 0.226 2.487 -1.900) 3.138 6.270 ( 4.535 5.944 -7.646) 10.694 6.521 ( -15.847 -8.720 -3.146) 18.359 6.736 ( 17.678 2.848 2.791) 18.122 7.079 ( -0.165 1.861 -0.113) 1.871 7.276 ( -6.989 9.072 -6.230) 13.037 7.338 ( 2.411 -12.377 0.839) 12.638 8.097 ( 1.302 3.750 -3.966) 5.611 8.490 ( -11.429 3.925 -8.462) 14.752 8.828 ( -4.725 -3.012 13.744) 14.843 9.392 ( -3.937 22.813 17.490) 29.014 11.163 ( 1.995 -3.561 -5.521) 6.866 11.316 ( -3.824 -1.706 -0.634) 4.235 11.488 ( 1.936 2.711 -10.393) 10.914 12.035 ( 9.790 0.236 11.941) 15.443 14.003 ( 20.514 -2.213 -9.665) 22.785 14.567 ( -7.784 -0.099 -13.917) 15.946 15.037 ( -0.884 3.385 9.246) 9.886 15.335 ( 8.748 5.340 3.734) 10.908 15.917 ( -6.225 0.475 20.037) 20.987 16.403 ( -6.866 -3.170 -6.399) 9.906 17.774 ( -16.001 -18.417 -3.421) 24.636 20.152 ( 10.504 -8.544 -1.752) 13.653 20.285 ( -10.995 8.062 -16.649) 21.519 20.896 ( -2.365 1.090 8.617) 9.002 21.287 ( -14.219 -11.218 8.207) 19.884 22.812 ( 2.436 -0.821 -3.162) 4.076 23.086 ( 1.669 1.294 2.939) 3.620 23.195 ( 2.531 0.025 0.720) 2.632 24.045 ( -1.700 -2.646 -6.885) 7.569 ======================= Grid point 63 (36/156) ======================= q-point: ( 0.05 0.35 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.065 ( -3.957 12.958 -8.266) 15.872 3.405 ( 2.773 4.028 2.649) 5.561 3.574 ( 8.521 -2.551 -3.446) 9.539 4.087 ( -2.030 -2.668 1.147) 3.543 4.401 ( -6.387 -7.129 10.532) 14.232 4.885 ( 1.726 -17.151 -8.794) 19.352 5.586 ( 7.311 -6.608 6.651) 11.889 5.799 ( -9.806 -6.824 -4.193) 12.661 6.548 ( -3.294 1.922 -0.856) 3.909 6.784 ( -0.876 8.064 -1.534) 8.255 6.942 ( -3.405 10.821 -0.949) 11.383 7.466 ( 3.706 2.799 -0.198) 4.649 7.699 ( -8.173 13.396 -1.166) 15.736 7.829 ( -9.149 5.137 -2.886) 10.882 7.961 ( 16.903 1.630 4.629) 17.601 8.896 ( -2.340 -8.374 7.936) 11.772 9.998 ( 14.819 24.158 10.763) 30.316 10.957 ( -10.490 5.703 -6.951) 13.816 11.070 ( -0.847 0.320 -0.265) 0.944 11.443 ( 6.818 -1.916 -13.341) 15.104 12.624 ( 5.541 -4.839 10.604) 12.907 13.713 ( -17.511 6.450 -11.446) 21.892 14.547 ( 10.093 -9.151 -8.296) 15.951 15.224 ( 1.971 5.299 6.233) 8.415 15.697 ( -0.192 5.626 5.754) 8.050 15.954 ( -4.670 2.851 -2.483) 6.008 16.213 ( 5.566 -8.911 9.057) 13.871 17.257 ( -3.180 -18.416 -2.945) 18.920 19.530 ( -5.814 8.400 -11.412) 15.317 20.384 ( 0.355 3.628 3.751) 5.231 21.022 ( -1.876 -14.494 2.330) 14.799 21.296 ( 6.770 -8.778 10.673) 15.388 22.869 ( 2.035 6.521 -4.648) 8.263 23.015 ( -1.669 2.479 -6.288) 6.962 23.315 ( 1.895 -2.021 -0.653) 2.846 23.892 ( -3.572 -8.379 4.854) 10.321 ======================= Grid point 64 (37/156) ======================= q-point: ( 0.05 -0.45 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -11.721 17.517 -9.994) 23.326 2.826 ( -18.885 12.721 -15.329) 27.449 3.608 ( -2.580 -6.364 4.857) 8.411 4.199 ( -14.783 -0.400 -3.625) 15.226 4.260 ( 1.668 -3.540 3.713) 5.395 4.714 ( 2.222 6.425 -7.156) 9.871 5.495 ( -8.272 0.734 3.428) 8.984 6.163 ( -7.250 -1.476 12.160) 14.234 6.259 ( 8.411 0.062 10.248) 13.258 6.664 ( -8.703 6.558 3.637) 11.488 7.002 ( 10.749 3.017 -5.944) 12.648 7.181 ( -5.122 5.525 1.551) 7.692 7.478 ( -5.052 -5.126 1.722) 7.400 7.885 ( 2.921 10.340 4.661) 11.712 8.532 ( 5.743 -7.510 7.500) 12.068 9.058 ( 6.523 -4.193 -9.020) 11.895 10.071 ( -8.837 12.288 -19.139) 24.401 10.830 ( 5.104 4.586 10.368) 12.432 11.237 ( 3.592 -5.134 6.322) 8.901 11.442 ( 0.666 -2.550 -2.614) 3.712 12.446 ( -11.794 -1.915 -17.586) 21.261 13.300 ( 2.845 12.649 10.565) 16.725 14.589 ( -6.194 -4.996 7.268) 10.777 15.204 ( 0.067 6.049 -9.112) 10.937 15.422 ( -7.140 4.695 -7.077) 11.095 16.217 ( 7.633 -3.257 9.215) 12.401 16.409 ( 3.318 -7.300 -11.213) 13.785 17.632 ( 17.499 -17.347 5.995) 25.359 19.537 ( 11.517 9.503 -0.425) 14.937 20.372 ( -6.335 0.051 9.933) 11.781 21.150 ( 1.686 -13.849 2.123) 14.112 21.627 ( 4.618 -11.711 -5.216) 13.627 22.655 ( -1.131 6.768 -1.513) 7.026 23.051 ( 4.902 2.898 -4.793) 7.443 23.274 ( -2.665 -0.930 -2.695) 3.902 23.898 ( -5.159 -1.703 12.474) 13.605 ======================= Grid point 66 (38/156) ======================= q-point: ( 0.05 -0.05 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 22.887 11.836 -0.000) 25.766 2.367 ( 18.228 23.636 0.000) 29.848 3.820 ( -7.803 -1.380 0.000) 7.925 4.043 ( -4.169 31.487 0.000) 31.762 4.375 ( -0.119 -10.899 -0.000) 10.900 4.540 ( 8.287 -3.068 -0.000) 8.836 5.574 ( -0.999 6.600 0.000) 6.675 6.402 ( 3.013 4.880 0.000) 5.735 6.433 ( 6.557 -0.635 -0.000) 6.587 6.826 ( -13.905 -1.257 0.000) 13.962 6.840 ( 3.288 -20.138 -0.000) 20.405 7.180 ( -1.237 3.075 0.000) 3.314 7.528 ( -2.106 -1.382 0.000) 2.519 7.971 ( 12.169 -5.787 -0.000) 13.475 8.472 ( 6.431 0.083 -0.000) 6.431 9.152 ( -9.827 0.113 0.000) 9.827 9.509 ( 11.701 15.997 0.000) 19.820 11.137 ( -0.208 -1.885 -0.000) 1.897 11.147 ( -1.047 -14.200 -0.000) 14.238 11.532 ( 1.647 -2.388 -0.000) 2.901 12.139 ( -4.485 22.044 0.000) 22.495 13.662 ( 16.706 1.259 -0.000) 16.754 14.580 ( -2.612 -10.201 -0.000) 10.530 15.197 ( -1.771 10.133 0.000) 10.286 15.287 ( 5.063 1.284 -0.000) 5.224 15.875 ( -1.220 6.975 0.000) 7.081 16.507 ( -3.704 -3.315 0.000) 4.971 17.764 ( -17.495 -19.005 -0.000) 25.831 19.538 ( 12.378 -16.225 -0.000) 20.407 20.582 ( 3.371 2.237 -0.000) 4.046 21.266 ( -13.449 -10.797 0.000) 17.246 21.416 ( -19.658 15.710 0.000) 25.164 22.721 ( 4.531 -5.311 -0.000) 6.981 22.882 ( 4.376 -5.092 -0.000) 6.714 23.214 ( -0.186 2.741 0.000) 2.747 24.192 ( -4.903 0.951 0.000) 4.994 ======================= Grid point 67 (39/156) ======================= q-point: ( 0.05 0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( 14.824 -0.493 1.928) 14.957 3.193 ( 13.588 8.435 6.755) 17.361 3.629 ( 1.435 2.050 -9.427) 9.753 4.058 ( -3.709 0.014 6.645) 7.610 4.143 ( -8.147 -15.815 -0.901) 17.813 4.725 ( -1.216 -10.749 0.964) 10.861 5.401 ( -0.383 1.952 -0.171) 1.996 5.934 ( -11.385 -9.763 -0.218) 14.999 6.725 ( -0.938 5.080 -7.217) 8.875 6.810 ( 4.383 -0.869 3.597) 5.736 7.229 ( 9.079 7.016 7.520) 13.718 7.445 ( -1.301 8.414 -5.511) 10.142 7.601 ( 21.851 13.635 0.565) 25.762 8.126 ( -3.954 1.654 -2.436) 4.930 8.321 ( -16.645 8.848 -8.200) 20.557 8.562 ( -4.897 -12.715 9.199) 16.440 10.061 ( 9.855 27.352 10.756) 30.999 11.042 ( -3.633 -5.498 -3.562) 7.491 11.229 ( 0.816 -4.970 -1.008) 5.136 11.560 ( 4.011 -2.491 -8.682) 9.883 12.326 ( 7.663 11.964 7.214) 15.935 14.187 ( -2.751 -13.493 -10.794) 17.497 14.455 ( 8.498 4.842 -10.343) 14.235 15.062 ( -1.673 1.364 10.377) 10.599 15.611 ( 6.896 4.760 5.056) 9.786 15.841 ( -4.821 1.357 10.269) 11.425 16.239 ( -6.135 1.235 -4.635) 7.788 17.083 ( -10.676 -19.482 -2.841) 22.396 20.040 ( 3.189 -10.226 -11.734) 15.888 20.340 ( -3.188 5.063 -2.455) 6.467 20.762 ( -17.390 -1.060 12.256) 21.301 20.964 ( 6.018 -3.115 1.946) 7.051 22.893 ( 4.600 1.218 -1.157) 4.898 23.151 ( 4.551 -0.271 1.043) 4.677 23.215 ( 0.821 -1.433 -0.034) 1.652 23.831 ( -9.240 -6.132 -2.412) 11.349 ======================= Grid point 68 (40/156) ======================= q-point: ( 0.05 -0.65 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.082 ( -9.967 6.869 -6.771) 13.870 3.456 ( -6.540 2.537 1.792) 7.240 3.516 ( -2.415 -4.586 -4.919) 7.146 3.907 ( 7.209 -10.991 2.884) 13.457 4.351 ( 1.760 -0.225 3.990) 4.367 4.696 ( 7.045 -7.084 -4.888) 11.123 5.526 ( -5.788 -4.161 -0.430) 7.141 5.662 ( 6.589 -1.380 6.303) 9.222 6.390 ( -13.864 6.567 10.646) 18.673 6.949 ( -2.784 10.063 6.220) 12.153 7.144 ( 0.867 7.773 -10.483) 13.079 7.543 ( -5.669 7.228 -3.356) 9.780 7.665 ( -14.231 5.134 -2.503) 15.335 7.927 ( 3.132 7.419 3.400) 8.741 8.192 ( -2.487 -0.831 11.967) 12.251 8.848 ( 17.231 -7.110 -6.942) 19.891 10.663 ( 9.224 13.589 6.702) 17.738 10.801 ( -10.782 1.788 -1.124) 10.987 11.004 ( -3.044 -5.303 -4.731) 7.731 11.477 ( -0.521 -2.520 -6.702) 7.179 12.779 ( 5.138 7.220 -2.029) 9.091 13.472 ( -9.685 4.835 -3.361) 11.335 14.478 ( -3.376 -6.267 -0.332) 7.126 15.391 ( 6.585 0.872 -7.100) 9.723 15.747 ( -3.309 4.676 3.846) 6.900 15.937 ( -3.010 1.931 2.321) 4.263 16.215 ( 9.721 -6.881 4.995) 12.915 16.918 ( 6.611 -16.334 0.265) 17.623 19.624 ( -0.791 5.792 -3.882) 7.017 20.364 ( -10.647 1.507 9.692) 14.476 20.743 ( 9.810 -10.732 0.619) 14.553 21.355 ( 9.357 -6.801 -2.195) 11.774 22.946 ( -7.017 2.856 -5.876) 9.587 23.067 ( 4.776 1.936 -2.355) 5.666 23.308 ( -0.180 -2.633 -1.985) 3.302 23.670 ( 0.037 -4.793 8.332) 9.612 ======================= Grid point 69 (41/156) ======================= q-point: ( 0.05 -0.45 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( -5.508 20.343 -4.875) 21.632 2.764 ( -15.625 17.867 -12.531) 26.840 3.506 ( 1.927 -1.867 4.543) 5.276 4.075 ( -4.315 8.137 -10.604) 14.046 4.360 ( 5.911 3.645 6.358) 9.415 4.877 ( -0.774 5.061 -1.136) 5.245 5.389 ( -3.072 3.007 2.947) 5.212 6.081 ( -1.488 1.573 11.336) 11.541 6.356 ( 3.334 -6.281 14.260) 15.935 6.803 ( -1.873 20.815 -3.371) 21.169 7.093 ( -4.204 0.279 -1.083) 4.350 7.175 ( -5.032 -6.268 2.324) 8.367 7.352 ( 1.561 4.686 0.133) 4.941 7.972 ( -4.516 1.507 8.422) 9.675 8.347 ( 3.430 -16.968 5.636) 18.205 9.132 ( 5.580 -3.514 -14.749) 16.156 9.770 ( -22.083 -5.124 -21.328) 31.126 11.036 ( 2.737 5.992 7.701) 10.134 11.213 ( 2.668 -1.693 11.548) 11.972 11.311 ( -4.943 -5.256 5.067) 8.817 12.367 ( 0.376 5.365 -22.661) 23.290 13.818 ( 7.359 19.454 8.577) 22.498 14.293 ( -7.272 -6.723 13.244) 16.538 15.228 ( -4.449 -0.172 -10.046) 10.988 15.463 ( -3.637 9.496 -8.422) 13.204 16.208 ( 0.855 -6.141 12.380) 13.846 16.317 ( 7.219 -10.179 -18.870) 22.623 17.682 ( 18.888 -15.393 5.933) 25.079 19.931 ( 2.549 -6.204 16.717) 18.012 20.150 ( -3.051 4.374 1.461) 5.529 20.984 ( 0.592 -0.063 -1.681) 1.783 21.519 ( 10.782 -12.935 -14.510) 22.229 22.743 ( -0.820 3.236 3.680) 4.968 23.127 ( -5.713 -2.355 -0.375) 6.190 23.220 ( 2.565 2.747 -2.063) 4.287 23.891 ( 1.979 3.924 8.038) 9.161 ======================= Grid point 71 (42/156) ======================= q-point: ( 0.05 -0.05 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.836 ( 13.748 8.788 -0.000) 16.317 3.073 ( 10.576 12.179 0.000) 16.130 3.761 ( -0.351 4.135 0.000) 4.150 4.001 ( -8.694 -13.777 -0.000) 16.291 4.216 ( -14.955 -0.015 0.000) 14.955 4.568 ( 1.665 3.513 0.000) 3.887 5.491 ( -3.475 0.021 0.000) 3.475 5.910 ( -14.366 -16.608 -0.000) 21.959 6.392 ( 9.676 -16.912 -0.000) 19.485 7.027 ( 1.217 7.560 0.000) 7.657 7.048 ( 15.179 16.829 0.000) 22.663 7.464 ( 13.765 8.806 -0.000) 16.341 7.605 ( 5.079 2.235 -0.000) 5.549 8.088 ( 7.750 -4.048 -0.000) 8.744 8.314 ( -4.193 -11.761 -0.000) 12.486 8.989 ( -15.912 8.558 0.000) 18.067 10.245 ( 12.983 21.876 0.000) 25.439 10.916 ( 7.431 -10.728 -0.000) 13.051 11.029 ( -1.229 -6.623 -0.000) 6.736 11.455 ( 1.431 -7.182 -0.000) 7.323 12.577 ( 0.743 23.291 0.000) 23.303 14.045 ( 19.278 -0.177 -0.000) 19.278 14.195 ( -9.260 -15.403 -0.000) 17.972 15.309 ( -3.581 8.334 0.000) 9.071 15.514 ( 5.193 6.086 0.000) 8.000 15.895 ( -3.781 0.583 0.000) 3.826 16.435 ( -3.884 3.865 0.000) 5.480 16.999 ( -17.559 -18.232 -0.000) 25.312 19.519 ( 14.334 -11.879 -0.000) 18.617 20.691 ( 3.472 0.531 -0.000) 3.512 20.764 ( -15.382 -8.029 0.000) 17.351 21.284 ( -20.289 12.921 0.000) 24.054 22.807 ( 6.859 0.932 -0.000) 6.922 22.898 ( 8.629 -4.979 -0.000) 9.963 23.222 ( -1.905 0.202 0.000) 1.915 24.007 ( -10.865 -2.574 0.000) 11.166 ======================= Grid point 72 (43/156) ======================= q-point: ( 0.05 0.15 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.251 ( 6.863 -1.700 1.959) 7.337 3.351 ( 2.247 -4.357 2.247) 5.393 3.544 ( -9.661 -4.197 -4.498) 11.453 3.650 ( -2.155 -10.142 -2.606) 10.691 4.168 ( 9.916 6.322 4.542) 12.607 4.507 ( -3.188 -8.500 0.513) 9.093 5.475 ( -0.366 3.652 2.325) 4.344 5.655 ( -3.556 -3.914 4.555) 6.980 6.678 ( -9.417 7.012 -0.555) 11.754 6.903 ( 4.817 -0.855 5.667) 7.487 7.571 ( -3.851 10.050 -3.523) 11.325 7.715 ( 9.882 9.596 -4.044) 14.356 8.007 ( -8.438 -0.297 -1.429) 8.563 8.074 ( -7.293 1.581 4.012) 8.473 8.211 ( -11.931 5.384 0.944) 13.124 8.363 ( 23.598 -5.733 -2.782) 24.443 10.658 ( 6.086 11.027 4.232) 13.287 10.826 ( -6.161 -4.136 0.181) 7.423 11.173 ( 0.235 0.752 -2.728) 2.839 11.509 ( 0.814 -8.377 -4.614) 9.598 12.868 ( 10.563 20.953 2.238) 23.571 13.685 ( -11.754 -15.638 -3.572) 19.887 14.690 ( -8.749 7.255 -7.763) 13.764 15.095 ( 18.012 -8.908 0.382) 20.098 15.743 ( -4.509 2.804 6.309) 8.247 15.806 ( 3.925 -0.161 6.799) 7.853 16.205 ( -5.185 6.647 -2.211) 8.715 16.614 ( -0.627 -13.608 -2.066) 13.778 19.924 ( -9.479 1.639 -4.958) 10.822 20.193 ( 5.969 -12.268 4.063) 14.235 20.657 ( -7.578 11.725 1.513) 14.042 21.040 ( 9.924 -6.479 -0.096) 11.852 23.028 ( 4.331 2.372 0.361) 4.951 23.140 ( -3.008 -2.203 0.108) 3.730 23.318 ( 7.194 1.472 -2.820) 7.866 23.472 ( -9.235 -6.334 1.625) 11.316 ======================= Grid point 73 (44/156) ======================= q-point: ( 0.05 -0.65 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.158 ( -1.358 11.711 -2.277) 12.008 3.285 ( -7.310 -0.901 6.420) 9.770 3.488 ( -1.810 2.962 -5.302) 6.337 3.940 ( 10.972 -5.207 3.898) 12.755 4.461 ( 9.217 1.704 -8.191) 12.448 4.668 ( 4.094 -9.870 3.614) 11.281 5.450 ( -0.561 4.733 -1.702) 5.061 5.704 ( 4.799 -6.121 8.950) 11.858 6.283 ( -13.179 10.592 17.862) 24.595 7.073 ( 1.528 -3.394 -6.837) 7.785 7.249 ( -6.124 4.912 -2.515) 8.243 7.527 ( -8.729 15.181 2.467) 17.685 7.557 ( -8.301 6.162 -3.562) 10.934 7.926 ( -9.350 -3.389 7.781) 12.628 8.073 ( -1.551 -1.675 1.182) 2.571 9.069 ( 13.905 -8.445 -12.709) 20.644 10.503 ( -17.838 1.184 -7.117) 19.242 10.902 ( 3.248 -1.237 6.301) 7.196 11.015 ( 2.934 8.001 2.277) 8.821 11.259 ( -10.957 -6.518 5.005) 13.697 12.858 ( -2.336 0.390 -19.018) 19.165 13.760 ( 13.572 10.358 8.827) 19.220 14.154 ( -11.970 -5.793 3.673) 13.796 15.446 ( 0.304 -2.463 -8.725) 9.071 15.830 ( 0.979 3.245 7.241) 7.995 15.868 ( -5.702 0.450 0.297) 5.727 16.302 ( 8.717 -3.192 -8.778) 12.776 16.894 ( 16.909 -9.398 6.230) 20.324 19.574 ( -6.492 -4.459 9.951) 12.691 20.306 ( -1.111 8.217 0.424) 8.303 20.859 ( 9.836 -2.130 1.257) 10.142 21.384 ( 9.835 -7.507 -12.628) 17.679 22.834 ( -6.566 2.610 1.309) 7.186 23.112 ( -6.001 -6.223 4.386) 9.694 23.214 ( 3.764 1.218 -0.322) 3.969 23.778 ( 8.588 2.614 -0.883) 9.021 ======================= Grid point 75 (45/156) ======================= q-point: ( 0.05 -0.25 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( 6.939 15.781 -5.712) 18.161 2.740 ( 7.343 23.200 -13.172) 27.671 3.749 ( 1.015 -8.831 4.197) 9.830 4.293 ( 2.537 -4.386 2.499) 5.649 4.451 ( -7.061 2.714 -3.747) 8.441 4.984 ( -14.455 29.116 0.748) 32.515 5.719 ( -1.538 5.815 1.806) 6.280 6.153 ( 1.115 -14.940 -0.879) 15.008 6.402 ( -1.676 -8.602 -5.980) 10.610 6.641 ( -4.520 8.858 9.263) 13.591 7.019 ( -5.560 2.431 6.686) 9.029 7.213 ( 2.689 3.941 2.468) 5.372 7.437 ( 19.332 -10.910 -0.309) 22.200 7.552 ( -5.359 -3.101 -7.319) 9.587 8.368 ( 2.032 -8.659 -3.947) 9.731 9.047 ( 6.730 -2.852 -1.036) 7.382 9.471 ( 25.344 9.175 -5.918) 27.596 10.853 ( -3.255 -11.607 3.886) 12.666 11.248 ( -7.845 -2.118 -1.353) 8.238 11.364 ( 1.943 -4.897 3.336) 6.236 12.724 ( -0.784 19.563 -3.180) 19.836 13.484 ( -3.648 6.619 14.179) 16.068 14.602 ( -5.591 -6.069 -10.509) 13.362 15.143 ( 6.583 2.819 3.746) 8.081 15.367 ( 3.478 7.313 -2.639) 8.518 16.022 ( 1.025 -5.040 -6.675) 8.426 16.475 ( 0.719 2.075 2.654) 3.445 17.732 ( -13.551 -12.433 2.313) 18.536 19.194 ( -0.099 -6.650 -2.245) 7.020 20.482 ( 3.320 -1.099 3.165) 4.717 21.254 ( -3.846 -7.639 0.825) 8.592 21.958 ( -6.552 8.859 1.286) 11.094 22.460 ( 4.411 -4.277 2.146) 6.508 22.824 ( -2.195 -3.971 -6.063) 7.573 23.299 ( -0.925 2.451 -1.139) 2.856 24.225 ( -2.029 0.973 6.105) 6.506 ======================= Grid point 76 (46/156) ======================= q-point: ( 0.05 -0.05 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.181 ( 4.322 7.084 0.000) 8.299 3.274 ( -1.357 2.222 0.000) 2.604 3.499 ( -1.744 -9.692 -0.000) 9.848 3.774 ( -14.071 -4.718 0.000) 14.841 4.138 ( 6.047 14.324 0.000) 15.548 4.532 ( -10.303 -2.898 0.000) 10.703 5.496 ( -0.564 -6.685 -0.000) 6.709 5.498 ( 1.627 0.446 -0.000) 1.687 6.449 ( 18.507 -6.969 -0.000) 19.776 7.061 ( -9.369 3.034 0.000) 9.848 7.663 ( 13.001 11.564 -0.000) 17.400 7.737 ( 11.848 -14.697 -0.000) 18.877 7.785 ( 6.776 3.388 -0.000) 7.576 8.025 ( 3.566 -5.974 -0.000) 6.957 8.132 ( -1.646 -0.936 0.000) 1.894 8.789 ( -22.016 8.269 0.000) 23.518 10.620 ( 5.823 1.545 -0.000) 6.024 10.855 ( -3.212 -5.007 -0.000) 5.949 11.203 ( 11.193 12.133 0.000) 16.508 11.318 ( 1.962 -9.229 -0.000) 9.435 13.115 ( 6.871 21.160 0.000) 22.247 13.577 ( -13.539 -20.778 -0.000) 24.800 14.445 ( 21.085 -2.064 -0.000) 21.186 15.376 ( -14.430 13.145 0.000) 19.520 15.642 ( 1.313 -1.007 -0.000) 1.655 15.809 ( -3.379 -0.631 0.000) 3.438 16.393 ( -4.841 -14.356 -0.000) 15.151 16.472 ( -4.228 7.706 0.000) 8.790 19.657 ( 15.759 -4.455 -0.000) 16.377 20.343 ( -15.238 -0.806 0.000) 15.260 20.719 ( 4.464 -6.072 -0.000) 7.536 21.149 ( -15.516 9.970 0.000) 18.443 22.988 ( 4.917 3.825 -0.000) 6.230 23.071 ( 12.011 -0.344 -0.000) 12.016 23.158 ( -1.562 -0.935 0.000) 1.821 23.676 ( -13.770 -3.570 0.000) 14.226 ======================= Grid point 77 (47/156) ======================= q-point: ( 0.05 0.15 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.204 ( -4.233 -6.869 2.340) 8.401 3.311 ( 1.923 -1.437 3.432) 4.188 3.484 ( 2.556 8.698 -1.372) 9.169 3.718 ( 12.197 2.459 -4.989) 13.405 4.196 ( -3.037 -10.919 4.767) 12.296 4.513 ( 8.598 3.330 -1.480) 9.338 5.519 ( -2.713 -0.697 4.046) 4.921 5.563 ( -0.194 4.980 3.543) 6.115 6.526 ( -15.818 7.436 8.128) 19.276 7.020 ( 6.229 -4.636 -3.932) 8.703 7.642 ( -11.049 -0.498 -4.137) 11.809 7.723 ( -7.647 -4.691 -0.193) 8.973 7.802 ( -8.568 6.260 2.018) 10.801 8.033 ( -4.477 4.294 0.904) 6.269 8.147 ( 1.221 2.895 1.638) 3.543 8.716 ( 20.121 -9.045 -7.249) 23.221 10.665 ( -4.263 -0.214 4.307) 6.064 10.852 ( 2.894 3.243 -0.249) 4.353 11.194 ( -9.460 -8.654 -1.808) 12.948 11.293 ( -2.566 6.334 -1.334) 6.963 13.088 ( -8.206 -16.013 -2.741) 18.200 13.569 ( 12.540 15.190 -0.591) 19.707 14.429 ( -19.399 2.845 -0.938) 19.629 15.313 ( 15.781 -10.558 -5.787) 19.850 15.701 ( -3.676 1.065 6.284) 7.358 15.873 ( 3.423 -0.966 4.681) 5.879 16.353 ( 2.850 9.346 -3.873) 10.510 16.479 ( 6.618 -3.475 0.736) 7.511 19.678 ( -14.796 3.531 2.145) 15.362 20.337 ( 15.190 1.130 -0.647) 15.246 20.720 ( -4.505 4.658 0.072) 6.480 21.126 ( 13.986 -8.194 -2.212) 16.360 23.002 ( -4.931 -2.798 1.277) 5.811 23.089 ( -11.971 -0.734 1.697) 12.113 23.159 ( 2.839 1.331 0.268) 3.147 23.651 ( 13.207 3.010 -2.535) 13.781 ======================= Grid point 78 (48/156) ======================= q-point: ( 0.05 0.35 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.905 ( -13.549 -8.069 7.749) 17.571 3.391 ( -4.108 -4.612 5.010) 7.953 3.547 ( 0.563 9.642 -0.986) 9.709 4.104 ( 6.349 1.703 -1.406) 6.722 4.515 ( 1.039 -6.406 3.173) 7.224 4.816 ( 20.371 0.100 -5.662) 21.143 5.676 ( 7.421 -5.783 3.765) 10.134 5.710 ( 7.979 10.712 -1.890) 13.490 6.339 ( -5.658 14.077 17.128) 22.881 6.834 ( -3.860 -14.527 -7.648) 16.865 7.054 ( -9.814 -3.471 -7.811) 13.014 7.448 ( -5.072 -1.913 2.188) 5.846 7.649 ( -12.054 1.242 6.222) 13.622 7.737 ( -5.288 -4.037 3.169) 7.369 8.059 ( -1.820 16.717 -4.521) 17.413 9.058 ( 4.573 -7.605 -8.531) 12.309 10.185 ( -23.230 5.329 -7.394) 24.954 10.785 ( -8.565 -6.397 9.299) 14.169 11.069 ( 5.224 2.038 1.744) 5.873 11.242 ( 1.819 7.688 5.311) 9.520 12.857 ( 5.175 -3.198 -12.621) 14.011 13.584 ( -9.018 -15.090 1.403) 17.635 14.394 ( 10.067 13.043 7.508) 18.106 15.334 ( -4.757 -3.864 -4.564) 7.641 15.680 ( -5.415 -5.024 6.957) 10.147 15.920 ( -0.763 4.957 -0.630) 5.054 16.414 ( 4.853 -0.857 -9.773) 10.946 17.201 ( 20.151 0.638 2.735) 20.346 19.332 ( -7.280 -2.127 8.934) 11.719 20.440 ( -3.330 5.021 -2.265) 6.436 21.030 ( 9.790 0.187 0.616) 9.811 21.548 ( 14.428 -0.757 -14.153) 20.225 22.770 ( -9.585 -0.348 5.319) 10.968 22.876 ( -1.559 -0.619 7.863) 8.040 23.303 ( 2.544 0.349 0.580) 2.632 23.999 ( 7.429 0.938 -5.825) 9.487 ======================= Grid point 80 (49/156) ======================= q-point: ( 0.05 -0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 14.004 10.036 -4.395) 17.780 3.257 ( 4.823 10.685 -7.273) 13.796 3.576 ( 1.363 -11.726 1.386) 11.886 4.150 ( -5.687 -4.903 3.245) 8.180 4.382 ( -6.072 5.947 -7.336) 11.227 4.989 ( -18.637 8.041 8.487) 22.001 5.582 ( -8.829 0.448 -3.251) 9.419 5.761 ( -2.993 -15.170 1.718) 15.557 6.032 ( -0.138 -15.889 -13.349) 20.752 7.002 ( 5.091 15.176 8.965) 18.347 7.176 ( 7.370 5.101 4.048) 9.835 7.378 ( 5.769 0.948 -4.866) 7.607 7.497 ( 7.966 -2.983 -6.988) 11.009 7.715 ( 12.137 -4.227 -0.459) 12.860 8.123 ( 0.421 -11.527 2.161) 11.735 9.203 ( 2.185 6.903 6.076) 9.453 10.253 ( 23.592 9.741 0.181) 25.524 10.650 ( 4.969 -4.203 -4.498) 7.911 10.998 ( -8.231 -4.169 -3.437) 9.846 11.242 ( 0.321 -8.215 2.435) 8.574 13.045 ( -4.529 16.659 5.814) 18.216 13.680 ( 7.303 6.960 10.881) 14.838 14.249 ( -10.274 -11.917 -8.136) 17.713 15.317 ( 6.985 1.292 -6.633) 9.719 15.617 ( 4.287 6.857 2.660) 8.514 15.916 ( 0.386 -4.708 -1.541) 4.969 16.558 ( -2.450 5.519 5.051) 7.873 17.160 ( -22.408 -5.568 -1.441) 23.134 19.197 ( 7.193 -0.743 -4.904) 8.738 20.473 ( 2.604 -7.224 1.145) 7.764 21.015 ( -9.171 -1.107 -0.729) 9.267 21.797 ( -17.294 5.589 10.766) 21.124 22.681 ( 11.866 2.239 -3.557) 12.589 22.729 ( 2.615 -2.214 -6.846) 7.656 23.294 ( -2.875 0.864 -0.322) 3.019 24.097 ( -7.264 -3.760 3.954) 9.085 ======================= Grid point 81 (50/156) ======================= q-point: ( 0.05 -0.05 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.231 ( -7.184 2.227 0.000) 7.521 3.328 ( -3.023 4.907 0.000) 5.763 3.597 ( 13.091 5.606 -0.000) 14.241 3.676 ( 1.688 10.213 0.000) 10.351 4.115 ( -13.495 -9.644 0.000) 16.587 4.500 ( 3.692 8.994 0.000) 9.722 5.457 ( 1.235 -2.429 -0.000) 2.725 5.591 ( 4.208 4.750 0.000) 6.346 6.714 ( 15.902 -5.223 -0.000) 16.737 6.820 ( -9.915 -1.376 0.000) 10.010 7.595 ( 0.487 -9.300 -0.000) 9.313 7.773 ( -10.151 -11.410 -0.000) 15.272 8.010 ( 8.091 0.644 -0.000) 8.117 8.029 ( 8.061 2.263 -0.000) 8.373 8.212 ( 15.977 -8.290 -0.000) 18.000 8.392 ( -25.512 4.612 0.000) 25.925 10.614 ( -7.518 -12.472 -0.000) 14.562 10.824 ( 8.222 4.347 -0.000) 9.301 11.200 ( -1.676 -0.233 0.000) 1.692 11.556 ( -0.155 10.131 0.000) 10.132 12.846 ( -11.782 -22.289 -0.000) 25.211 13.723 ( 12.496 17.529 0.000) 21.527 14.779 ( 17.516 -5.547 -0.000) 18.374 15.092 ( -29.843 6.741 0.000) 30.595 15.675 ( 6.625 -2.783 -0.000) 7.186 15.727 ( -3.491 -1.533 0.000) 3.813 16.228 ( 5.509 -6.096 -0.000) 8.217 16.634 ( 0.728 13.746 0.000) 13.765 19.986 ( 17.805 2.160 -0.000) 17.936 20.140 ( -13.069 9.741 0.000) 16.300 20.641 ( 8.162 -13.175 -0.000) 15.498 21.042 ( -11.426 6.196 0.000) 12.998 23.024 ( -4.488 -1.684 0.000) 4.793 23.138 ( 2.167 3.107 0.000) 3.788 23.348 ( -11.928 -1.241 0.000) 11.993 23.456 ( 15.110 5.136 -0.000) 15.959 ======================= Grid point 82 (51/156) ======================= q-point: ( 0.05 0.15 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( -12.974 -8.911 3.291) 16.080 3.161 ( -8.603 -10.871 8.251) 16.133 3.695 ( 1.229 -3.936 -5.992) 7.273 3.990 ( 9.109 12.284 -1.115) 15.333 4.277 ( 14.067 -1.748 5.349) 15.151 4.579 ( -2.351 0.040 0.971) 2.544 5.474 ( 3.080 -0.498 -0.839) 3.231 5.895 ( 11.364 15.331 -2.424) 19.237 6.499 ( -8.145 14.493 10.488) 19.657 6.834 ( -7.085 -12.899 -10.688) 18.188 7.189 ( -11.310 -10.541 5.026) 16.257 7.476 ( -12.152 -7.612 0.618) 14.353 7.587 ( -3.613 -5.207 -0.863) 6.396 8.067 ( -7.486 4.315 -2.306) 8.943 8.373 ( 2.666 13.510 5.375) 14.782 8.862 ( 15.050 -9.709 -10.935) 20.984 10.373 ( -11.986 -19.080 11.646) 25.364 10.892 ( -4.431 7.766 -2.633) 9.320 11.038 ( -0.135 7.786 0.615) 7.811 11.407 ( -1.312 6.414 -4.007) 7.675 12.606 ( -1.073 -20.587 3.086) 20.845 13.813 ( -12.084 2.686 -15.197) 19.601 14.354 ( 3.253 10.721 8.071) 13.808 15.290 ( 3.268 -8.662 -1.284) 9.347 15.559 ( -6.152 -4.866 4.879) 9.237 15.953 ( 3.812 1.584 4.633) 6.205 16.399 ( 3.844 -4.005 -3.679) 6.660 16.980 ( 17.439 16.983 -1.836) 24.412 19.529 ( -13.357 10.236 1.107) 16.865 20.653 ( -1.754 -3.650 -4.036) 5.718 20.762 ( 14.136 8.456 -0.232) 16.473 21.289 ( 17.744 -8.155 0.659) 19.540 22.810 ( -7.180 -2.297 0.866) 7.588 22.939 ( -6.972 5.111 3.543) 9.343 23.233 ( 1.989 -0.021 1.161) 2.303 23.958 ( 10.131 2.009 -4.932) 11.445 ======================= Grid point 84 (52/156) ======================= q-point: ( 0.05 0.55 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 12.034 -2.364 1.531) 12.359 3.186 ( 2.110 -15.920 1.745) 16.153 3.509 ( -2.946 3.151 0.349) 4.328 4.072 ( 2.030 -0.378 -4.552) 4.998 4.693 ( 3.372 1.648 -4.376) 5.765 4.998 ( -14.395 -16.210 8.731) 23.371 5.604 ( -6.072 -12.457 0.730) 13.877 5.895 ( 0.342 -5.477 -14.722) 15.712 6.095 ( -5.103 -1.883 -9.201) 10.688 6.950 ( 8.610 3.726 4.992) 10.628 6.980 ( 1.164 4.458 4.174) 6.217 7.175 ( 10.867 -2.266 -5.460) 12.371 7.427 ( 3.175 -16.207 0.929) 16.542 7.759 ( 3.079 1.535 -5.541) 6.523 8.063 ( -14.490 15.844 -1.234) 21.506 9.088 ( 11.993 4.047 -0.359) 12.662 9.789 ( 11.385 7.183 21.646) 25.490 10.721 ( 6.897 3.071 -13.307) 15.299 11.091 ( -0.943 -3.031 -1.946) 3.723 11.238 ( -8.356 -1.088 -4.854) 9.725 12.999 ( -6.025 -2.218 23.526) 24.386 13.595 ( 14.661 7.656 -4.415) 17.119 14.380 ( -13.690 -13.202 -6.961) 20.253 15.280 ( 5.579 2.222 7.338) 9.482 15.632 ( 4.475 -0.445 -0.455) 4.520 15.839 ( 0.165 0.188 -10.268) 10.271 16.586 ( -3.898 7.779 12.048) 14.861 17.655 ( -12.911 9.203 -3.668) 16.274 19.333 ( 4.319 8.196 -8.972) 12.897 20.285 ( 0.821 -5.508 -0.671) 5.609 21.096 ( -3.602 -1.910 -0.847) 4.164 21.938 ( -15.601 3.627 15.466) 22.265 22.538 ( 13.748 0.978 -7.060) 15.486 22.898 ( -1.184 1.094 -6.584) 6.778 23.347 ( -1.917 -0.263 1.509) 2.454 24.024 ( -2.151 -7.335 0.212) 7.647 ======================= Grid point 85 (53/156) ======================= q-point: ( 0.05 0.75 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.188 ( 4.393 -6.189 0.531) 7.608 3.200 ( 6.835 -0.454 -2.297) 7.225 3.536 ( -0.613 3.973 -0.033) 4.021 3.898 ( -7.716 -2.196 -0.452) 8.035 4.524 ( -6.184 15.073 -2.190) 16.438 4.674 ( -11.258 -4.749 5.210) 13.283 5.457 ( 0.268 -5.528 -1.704) 5.790 5.552 ( -4.811 4.584 -5.858) 8.858 5.976 ( 17.549 -8.404 -12.063) 22.893 7.123 ( -2.633 -13.629 -1.209) 13.934 7.338 ( 3.458 2.874 6.036) 7.527 7.500 ( 13.260 -3.695 0.609) 13.779 7.618 ( 8.663 -10.123 1.977) 13.469 7.783 ( 9.369 3.491 -6.752) 12.064 8.076 ( 0.648 -2.955 0.824) 3.135 9.261 ( -13.535 6.490 6.991) 16.559 10.559 ( 7.075 1.673 -0.439) 7.283 10.790 ( 0.385 -3.598 -3.454) 5.002 11.054 ( 4.268 -3.717 3.781) 6.807 11.175 ( 14.446 7.486 -3.670) 16.679 13.216 ( -3.710 3.931 16.803) 17.651 13.615 ( -13.180 -8.584 -6.780) 17.128 14.132 ( 12.397 4.759 1.111) 13.325 15.476 ( 6.523 0.112 -8.653) 10.836 15.717 ( -1.620 -1.053 4.008) 4.450 15.917 ( 4.711 -0.777 0.863) 4.852 16.434 ( -20.469 0.713 4.854) 21.048 16.782 ( -10.782 9.377 -4.933) 15.117 19.425 ( 10.031 4.395 -5.422) 12.221 20.299 ( 0.469 -10.194 -0.265) 10.208 20.837 ( -9.727 2.149 -0.895) 10.002 21.584 ( -15.446 6.440 7.685) 18.415 22.822 ( 10.406 0.822 0.078) 10.438 23.015 ( 8.044 6.851 -4.958) 11.671 23.220 ( -4.423 -0.418 0.314) 4.453 23.805 ( -9.582 -6.331 1.467) 11.578 ======================= Grid point 86 (54/156) ======================= q-point: ( 0.05 -0.05 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.040 ( -15.214 0.730 0.000) 15.231 3.122 ( -15.748 -9.726 0.000) 18.510 3.753 ( -5.830 -0.877 0.000) 5.896 3.945 ( 7.159 -2.254 -0.000) 7.506 4.173 ( 10.844 17.954 0.000) 20.975 4.711 ( -0.939 11.536 0.000) 11.574 5.407 ( 1.427 -2.403 -0.000) 2.794 5.922 ( 12.886 10.360 -0.000) 16.535 6.769 ( -2.952 4.091 0.000) 5.045 6.840 ( 7.287 -5.058 -0.000) 8.870 7.113 ( -16.600 -8.005 0.000) 18.429 7.510 ( 0.807 -8.973 -0.000) 9.010 7.592 ( -21.131 -14.566 0.000) 25.665 8.148 ( 4.058 -1.564 -0.000) 4.349 8.411 ( 20.740 -8.593 -0.000) 22.450 8.473 ( 2.940 12.071 0.000) 12.423 9.947 ( -13.131 -28.829 -0.000) 31.678 11.083 ( 5.920 5.068 -0.000) 7.793 11.231 ( -2.372 5.381 0.000) 5.881 11.651 ( -4.814 5.084 0.000) 7.002 12.257 ( -8.427 -13.670 -0.000) 16.059 14.306 ( 11.907 13.377 0.000) 17.909 14.592 ( -26.362 2.504 0.000) 26.480 14.925 ( 9.701 -6.884 -0.000) 11.895 15.560 ( -6.169 -4.852 0.000) 7.848 15.728 ( 4.602 -4.609 -0.000) 6.513 16.284 ( 6.442 -0.461 -0.000) 6.458 17.111 ( 10.929 19.616 0.000) 22.455 20.168 ( -15.341 18.842 0.000) 24.298 20.418 ( 15.914 2.430 -0.000) 16.099 20.566 ( 17.408 -17.630 -0.000) 24.776 20.955 ( -5.737 5.441 0.000) 7.907 22.905 ( -4.361 -0.510 0.000) 4.390 23.138 ( -6.149 0.643 0.000) 6.183 23.215 ( -1.305 1.565 0.000) 2.038 23.858 ( 11.164 5.952 -0.000) 12.652 ======================= Grid point 87 (55/156) ======================= q-point: ( 0.05 0.15 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( -21.288 -12.134 5.498) 25.113 2.522 ( -16.497 -21.625 14.300) 30.729 3.733 ( 6.591 -1.989 -7.088) 9.881 4.105 ( 4.125 -25.807 4.991) 26.607 4.333 ( 1.351 7.801 -3.405) 8.618 4.599 ( -8.353 4.109 4.973) 10.554 5.551 ( 0.615 -6.761 -2.267) 7.157 6.335 ( -6.289 -7.806 -5.882) 11.623 6.428 ( 2.962 5.384 -4.580) 7.664 6.692 ( -0.839 4.563 -3.383) 5.741 6.941 ( 2.287 10.411 2.714) 10.999 7.185 ( -1.622 -2.703 0.571) 3.204 7.509 ( 3.282 -1.889 -1.576) 4.102 7.952 ( -11.779 5.133 -2.183) 13.033 8.565 ( -2.398 3.871 5.902) 7.454 9.004 ( 9.392 -1.356 -6.833) 11.693 9.727 ( -11.925 -11.772 16.562) 23.560 11.012 ( -1.947 5.818 -8.125) 10.182 11.247 ( 4.604 8.523 4.707) 10.770 11.472 ( -1.681 1.915 -5.045) 5.652 12.207 ( 3.473 -19.757 7.526) 21.425 13.529 ( -15.048 0.638 -11.614) 19.019 14.645 ( 4.270 5.987 2.958) 7.927 15.135 ( -2.218 -7.135 -3.258) 8.151 15.307 ( -5.747 -6.421 4.127) 9.554 16.057 ( 4.230 0.444 14.886) 15.482 16.450 ( 3.501 2.380 -5.790) 7.172 17.728 ( 17.408 18.648 -3.652) 25.771 19.536 ( -11.613 14.986 -0.114) 18.959 20.526 ( -2.140 -3.742 -5.706) 7.151 21.207 ( 14.364 3.475 -3.833) 15.267 21.506 ( 16.792 -5.078 6.799) 18.815 22.674 ( -6.108 3.381 -2.894) 7.557 22.951 ( -3.484 5.296 5.365) 8.304 23.231 ( 0.432 -2.723 1.650) 3.213 24.107 ( 3.819 -2.422 -8.443) 9.578 ======================= Grid point 89 (56/156) ======================= q-point: ( 0.05 0.55 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( 5.382 -16.352 4.873) 17.891 2.942 ( 13.348 -10.542 5.805) 17.972 3.475 ( -1.988 1.541 1.628) 2.997 4.112 ( 0.928 0.975 -7.687) 7.804 4.422 ( -5.144 -13.200 12.905) 19.164 4.864 ( 4.838 1.004 -2.790) 5.675 5.337 ( 2.730 -7.925 -2.274) 8.685 5.860 ( 0.103 0.781 -11.383) 11.411 6.037 ( -0.477 2.316 -16.393) 16.562 6.824 ( -2.777 -24.454 -1.888) 24.683 7.083 ( 9.012 -5.332 -2.988) 10.889 7.187 ( 6.327 3.503 1.968) 7.494 7.353 ( 2.655 -3.872 2.140) 5.160 7.817 ( 4.335 -1.498 -6.958) 8.333 8.260 ( -6.514 16.939 -3.919) 18.566 9.346 ( -0.687 2.668 7.805) 8.277 10.179 ( 14.026 6.845 20.307) 25.611 10.866 ( -0.450 -6.595 -9.262) 11.379 11.014 ( 1.738 2.784 -8.084) 8.725 11.218 ( 2.503 6.930 -5.132) 8.979 12.882 ( -3.181 -0.243 29.749) 29.919 13.697 ( -12.316 -18.779 -3.615) 22.746 14.081 ( 12.285 5.940 -8.703) 16.185 15.405 ( 4.682 -0.058 7.497) 8.839 15.618 ( 3.121 -8.317 7.062) 11.348 15.890 ( -0.177 3.405 -19.223) 19.523 16.664 ( -10.149 13.200 16.278) 23.286 17.553 ( -20.253 14.886 -7.368) 26.193 19.636 ( 2.214 9.033 -13.592) 16.470 20.124 ( -0.573 -7.771 -1.212) 7.885 20.996 ( -1.753 0.868 0.036) 1.957 21.797 ( -11.982 9.053 13.749) 20.361 22.682 ( 4.190 -1.986 -2.402) 5.222 23.082 ( 9.357 5.623 -4.914) 11.972 23.265 ( -3.800 -1.876 2.322) 4.832 23.774 ( -2.666 -10.077 -3.761) 11.081 ======================= Grid point 90 (57/156) ======================= q-point: ( 0.05 0.75 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.200 ( 10.698 -2.852 5.042) 12.165 3.421 ( 5.206 1.763 -0.925) 5.574 3.606 ( -0.325 5.431 3.352) 6.391 3.858 ( -2.104 9.340 -1.921) 9.765 4.254 ( -9.952 -8.105 -5.019) 13.781 4.767 ( -4.917 14.101 2.351) 15.118 5.482 ( -0.002 4.132 -2.875) 5.034 5.570 ( 4.056 -0.479 -4.818) 6.316 6.249 ( 17.780 -3.728 -3.251) 18.455 6.781 ( 4.491 -14.031 -7.752) 16.647 7.374 ( -1.156 -2.964 10.188) 10.673 7.594 ( 9.247 -10.704 1.739) 14.252 7.705 ( 13.363 -4.802 1.754) 14.307 7.881 ( -4.585 -7.799 -1.447) 9.162 7.987 ( 2.479 -0.527 -8.820) 9.177 8.950 ( -21.090 3.300 3.502) 21.632 10.544 ( -9.338 -14.034 -4.752) 17.514 10.773 ( 6.965 4.356 -1.963) 8.447 11.134 ( 5.110 1.317 6.004) 7.993 11.588 ( 7.515 4.704 4.341) 9.871 12.766 ( -14.062 -13.067 -2.100) 19.311 13.653 ( 9.445 5.994 12.268) 16.602 14.483 ( 9.350 5.165 0.452) 10.691 15.488 ( -6.935 -8.619 -6.490) 12.826 15.605 ( 0.898 -0.107 2.745) 2.890 15.945 ( 3.102 -7.118 -0.685) 7.795 16.112 ( -15.816 11.832 -4.647) 20.292 16.924 ( -2.351 15.515 0.590) 15.703 19.707 ( 8.298 1.273 4.475) 9.513 20.186 ( 8.213 -7.431 -8.137) 13.743 20.733 ( -10.330 10.177 -0.395) 14.507 21.391 ( -13.514 3.275 1.332) 13.969 23.065 ( 4.510 -0.540 5.864) 7.417 23.103 ( -2.736 0.729 1.749) 3.328 23.324 ( 5.873 6.153 -0.863) 8.549 23.532 ( -3.112 -1.362 -5.314) 6.307 ======================= Grid point 91 (58/156) ======================= q-point: ( 0.05 -0.05 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -24.474 -18.278 0.000) 30.546 2.592 ( -23.999 -5.619 0.000) 24.648 3.698 ( -14.294 -12.694 0.000) 19.117 3.799 ( 2.577 6.097 0.000) 6.620 4.594 ( 0.877 8.634 0.000) 8.679 4.778 ( -10.866 1.994 0.000) 11.047 5.457 ( 0.483 -2.270 -0.000) 2.321 6.347 ( -7.496 -8.783 -0.000) 11.547 6.537 ( 22.210 10.048 -0.000) 24.377 6.710 ( -17.549 -3.031 0.000) 17.808 7.086 ( 1.842 -1.934 -0.000) 2.671 7.303 ( -5.112 2.035 0.000) 5.502 7.372 ( 11.813 9.604 -0.000) 15.225 8.131 ( -0.787 -3.318 -0.000) 3.410 8.554 ( -10.022 -9.049 0.000) 13.503 8.741 ( 23.611 -2.847 -0.000) 23.782 9.180 ( 1.117 -19.599 -0.000) 19.631 11.227 ( -1.226 3.285 0.000) 3.507 11.311 ( 4.963 0.640 -0.000) 5.004 11.601 ( -3.881 -0.659 0.000) 3.936 11.915 ( -11.618 -0.405 0.000) 11.625 14.116 ( -21.969 -0.483 0.000) 21.974 14.725 ( 6.639 7.605 0.000) 10.095 14.932 ( 3.325 -4.558 -0.000) 5.642 15.326 ( -4.940 -4.706 0.000) 6.823 15.666 ( 1.394 -6.537 -0.000) 6.683 16.464 ( 7.135 3.317 -0.000) 7.868 17.807 ( 16.284 18.327 0.000) 24.516 20.164 ( -8.056 3.870 0.000) 8.937 20.549 ( 0.427 -3.397 -0.000) 3.424 20.708 ( 13.358 -0.478 -0.000) 13.367 21.215 ( 12.127 10.608 -0.000) 16.112 22.847 ( -1.204 1.127 0.000) 1.649 23.050 ( -3.718 0.038 0.000) 3.718 23.188 ( -2.533 -0.603 0.000) 2.604 24.117 ( 4.014 3.340 -0.000) 5.222 ======================= Grid point 93 (59/156) ======================= q-point: ( 0.05 0.35 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( 18.616 -18.622 13.748) 29.704 2.092 ( 5.660 -25.566 16.656) 31.034 3.292 ( 7.298 -22.771 22.205) 32.631 3.954 ( -7.151 -1.279 -0.636) 7.293 4.250 ( 4.772 -5.542 -9.787) 12.217 4.617 ( 6.841 -8.077 0.204) 10.586 5.049 ( 6.493 -10.760 -3.256) 12.982 6.064 ( -0.604 -11.309 -7.410) 13.534 6.359 ( 7.080 1.352 -22.880) 23.988 6.533 ( -5.669 -6.289 -1.121) 8.541 7.010 ( 10.633 -10.208 -6.694) 16.189 7.167 ( -1.203 3.841 -9.399) 10.225 7.386 ( -4.298 10.180 -0.632) 11.068 7.827 ( 4.424 -3.803 -8.129) 10.006 8.971 ( -7.072 8.938 -3.081) 11.806 9.252 ( -8.703 12.007 8.724) 17.205 9.750 ( 5.337 22.176 30.385) 37.994 10.940 ( 0.146 -3.935 -9.198) 10.006 11.171 ( 3.876 -2.287 -10.733) 11.638 11.493 ( -5.108 7.760 -2.433) 9.603 12.281 ( -1.160 -4.710 28.732) 29.139 13.531 ( 1.925 -14.423 -3.289) 14.918 14.100 ( 7.330 -11.982 -19.804) 24.280 15.123 ( 4.863 0.629 9.877) 11.027 15.248 ( 0.321 -6.945 9.749) 11.974 16.373 ( -2.202 5.728 -15.251) 16.439 16.865 ( -12.993 25.889 29.264) 41.176 18.328 ( -11.344 14.907 -5.243) 19.452 19.981 ( 13.873 7.970 -5.320) 16.860 20.132 ( -10.705 -4.907 -10.746) 15.943 21.056 ( -5.166 2.785 1.415) 6.037 21.967 ( -8.373 10.273 11.391) 17.476 22.667 ( 2.380 -3.187 -9.124) 9.954 23.009 ( 7.796 0.767 -0.190) 7.836 23.194 ( -1.610 -4.428 3.560) 5.905 23.655 ( 4.816 -16.853 -14.224) 22.573 ======================= Grid point 94 (60/156) ======================= q-point: ( 0.05 0.55 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.657 ( 11.483 -12.264 11.464) 20.339 3.062 ( 16.067 -8.982 8.999) 20.489 3.570 ( 3.366 6.089 0.950) 7.022 4.137 ( -1.613 0.602 -6.966) 7.176 4.266 ( 4.792 -2.123 0.803) 5.302 4.879 ( 1.425 -0.346 9.854) 9.963 5.417 ( 11.616 -2.374 -4.881) 12.822 5.908 ( -1.133 4.369 -13.314) 14.058 6.075 ( 2.836 -1.218 -8.205) 8.766 6.526 ( 8.975 -8.536 -9.462) 15.587 7.093 ( 5.229 -11.710 -3.428) 13.275 7.192 ( -1.070 -2.850 8.518) 9.046 7.439 ( 7.282 2.743 -2.219) 8.092 7.791 ( 0.710 -8.510 -4.609) 9.704 8.385 ( -10.309 11.381 -7.057) 16.900 9.204 ( -9.847 -1.570 5.266) 11.277 10.436 ( 3.592 -8.515 17.208) 19.532 10.645 ( -3.800 -4.668 -7.653) 9.737 11.109 ( -0.860 2.746 -5.349) 6.073 11.477 ( 5.430 5.105 -0.103) 7.453 12.806 ( -3.752 -0.337 13.206) 13.733 13.224 ( 0.758 -7.174 8.695) 11.298 14.446 ( 12.127 3.280 -6.707) 14.241 15.400 ( -2.460 -5.472 10.067) 11.719 15.541 ( 5.663 -4.312 3.671) 8.009 15.917 ( -1.760 0.673 -18.480) 18.576 16.652 ( -15.328 10.711 11.560) 21.984 17.510 ( -15.015 17.724 -6.398) 24.094 19.560 ( -6.479 -6.397 2.084) 9.340 20.161 ( 7.197 0.430 -11.673) 13.720 21.123 ( -1.909 13.714 -0.761) 13.867 21.695 ( -12.005 4.165 1.908) 12.849 22.739 ( 5.773 -4.612 7.018) 10.190 23.129 ( -4.236 -2.487 3.238) 5.883 23.324 ( 3.141 1.888 2.196) 4.273 23.656 ( 6.572 -0.408 -12.243) 13.901 ======================= Grid point 95 (61/156) ======================= q-point: ( 0.05 -0.25 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.196 ( -3.211 -11.295 4.975) 12.753 3.338 ( -10.109 -4.650 -3.672) 11.717 3.666 ( -3.920 1.116 6.283) 7.489 4.002 ( 1.923 -2.454 -8.343) 8.907 4.267 ( 10.987 14.295 -2.328) 18.179 5.042 ( -2.293 18.875 6.617) 20.132 5.467 ( -4.620 4.787 -5.258) 8.480 5.820 ( 12.321 4.083 -1.752) 13.098 6.531 ( 12.317 0.347 0.299) 12.326 6.723 ( 5.252 -7.286 -4.320) 9.966 7.099 ( -5.374 -13.943 8.247) 17.068 7.483 ( -8.572 -0.362 2.225) 8.863 7.706 ( 2.031 -10.642 -2.541) 11.128 7.796 ( 7.551 -5.795 -1.770) 9.682 7.932 ( 4.564 -3.548 -0.275) 5.788 8.771 ( -5.238 6.941 -4.660) 9.865 9.819 ( -20.337 -24.453 -7.113) 32.590 11.019 ( 8.004 3.691 0.742) 8.846 11.110 ( 3.496 -9.833 2.722) 10.785 11.680 ( -2.640 0.270 9.829) 10.181 12.468 ( -9.114 5.869 -5.576) 12.190 13.994 ( 14.739 -0.775 16.354) 22.029 14.695 ( -1.888 7.118 6.480) 9.809 15.079 ( -9.249 -8.942 -9.735) 16.133 15.573 ( -0.591 -5.456 -4.266) 6.951 15.857 ( -2.229 0.496 -10.106) 10.361 16.174 ( -0.577 7.256 2.482) 7.690 17.305 ( 5.136 17.603 1.847) 18.430 19.752 ( 8.657 -12.370 11.113) 18.747 20.291 ( 7.510 -0.847 -5.851) 9.558 20.926 ( -3.253 21.656 -6.123) 22.739 21.181 ( -9.586 1.199 -2.085) 9.883 22.939 ( -3.705 -3.936 2.544) 5.975 23.108 ( 0.291 -4.369 3.218) 5.434 23.326 ( -3.155 1.531 0.439) 3.534 23.824 ( 8.766 10.009 -2.241) 13.493 ======================= Grid point 96 (62/156) ======================= q-point: ( 0.05 -0.05 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -28.125 -15.904 0.000) 32.311 1.803 ( -29.586 -17.151 0.000) 34.198 2.805 ( -44.557 -15.002 0.000) 47.015 4.042 ( 5.335 7.829 0.000) 9.474 4.475 ( -9.371 -5.039 0.000) 10.640 4.602 ( -5.507 -3.327 0.000) 6.434 5.124 ( -11.457 -7.498 0.000) 13.692 6.198 ( -17.703 -2.565 0.000) 17.888 6.497 ( 12.316 8.674 -0.000) 15.065 7.102 ( -0.964 -8.518 -0.000) 8.573 7.222 ( 13.091 6.563 -0.000) 14.644 7.323 ( 11.428 9.531 -0.000) 14.881 7.878 ( 6.667 9.978 0.000) 12.001 7.937 ( -2.779 -17.606 -0.000) 17.824 7.998 ( -3.209 -6.890 -0.000) 7.601 9.059 ( -0.406 -4.584 -0.000) 4.602 9.308 ( 25.947 7.727 -0.000) 27.073 11.176 ( -6.187 0.563 0.000) 6.213 11.456 ( -5.611 -4.624 0.000) 7.270 11.468 ( 9.824 -2.051 -0.000) 10.035 11.752 ( -11.713 9.262 0.000) 14.932 13.655 ( -16.539 -5.746 0.000) 17.508 14.846 ( 3.661 -4.132 -0.000) 5.521 14.931 ( -3.307 3.996 0.000) 5.186 15.222 ( 0.191 -1.026 -0.000) 1.044 15.559 ( -1.393 -2.924 -0.000) 3.239 16.671 ( 6.107 2.621 -0.000) 6.645 18.455 ( 15.671 10.651 -0.000) 18.948 20.040 ( 2.631 -9.726 -0.000) 10.076 20.478 ( -0.844 -1.574 -0.000) 1.786 20.998 ( 1.147 12.383 0.000) 12.436 21.704 ( 14.210 8.213 -0.000) 16.413 22.918 ( 4.903 1.964 -0.000) 5.282 22.963 ( -2.079 -2.621 -0.000) 3.346 23.089 ( -5.238 -1.036 0.000) 5.340 24.156 ( -3.103 -0.069 0.000) 3.104 ======================= Grid point 98 (63/156) ======================= q-point: ( 0.05 0.35 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 15.165 -15.678 16.776) 27.517 2.160 ( 21.657 -9.967 21.166) 31.881 3.409 ( 28.449 -6.314 16.678) 33.576 3.952 ( 4.343 5.735 -2.022) 7.472 4.278 ( 3.584 -0.398 -7.873) 8.660 4.495 ( 1.669 -9.872 4.631) 11.031 5.088 ( 13.530 -6.880 -3.785) 15.643 5.912 ( 7.518 -3.974 -7.933) 11.629 6.431 ( -1.101 0.289 -16.811) 16.849 6.593 ( 5.011 5.742 -10.836) 13.247 6.923 ( 4.708 -11.667 -2.833) 12.896 7.153 ( -3.834 0.769 -8.728) 9.564 7.548 ( 1.235 7.783 -2.920) 8.404 7.739 ( -2.225 -8.315 -6.473) 10.769 9.004 ( -4.509 5.270 -3.859) 7.937 9.191 ( -16.024 7.241 11.070) 20.778 9.919 ( -12.084 -3.392 25.296) 28.238 10.852 ( -2.100 -0.184 -9.497) 9.728 11.214 ( 5.120 -3.617 -9.535) 11.411 11.612 ( -4.076 6.147 -0.022) 7.376 12.298 ( 6.559 1.735 26.823) 27.668 13.153 ( -0.744 -5.118 -5.429) 7.498 14.314 ( 20.592 -5.661 -16.817) 27.183 15.104 ( -2.039 -4.690 11.633) 12.708 15.237 ( 5.900 -0.296 8.560) 10.400 16.386 ( -4.650 2.036 -15.853) 16.646 16.898 ( -24.742 13.316 28.982) 40.367 18.296 ( -16.335 11.262 -6.245) 20.801 19.637 ( -12.962 -5.305 -1.100) 14.049 20.276 ( 4.000 0.644 -9.815) 10.618 21.361 ( 5.556 9.544 -0.044) 11.043 21.964 ( -8.182 7.306 6.126) 12.564 22.527 ( -1.182 -6.295 -7.283) 9.699 23.047 ( -1.706 -4.981 3.078) 6.099 23.202 ( 5.497 0.748 3.114) 6.362 23.644 ( 16.834 -4.971 -16.390) 24.016 ======================= Grid point 99 (64/156) ======================= q-point: ( 0.05 0.55 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.658 ( 9.476 -10.042 12.428) 18.577 3.211 ( 11.879 -4.733 6.511) 14.349 3.685 ( -3.228 -1.897 2.148) 4.316 4.062 ( -1.132 -2.769 -8.748) 9.245 4.426 ( 5.457 7.612 -6.889) 11.627 5.166 ( 10.917 10.931 11.552) 19.290 5.628 ( 13.165 0.794 -3.363) 13.611 5.923 ( -4.973 3.901 -11.882) 13.458 6.297 ( 17.585 -1.662 -4.749) 18.291 6.621 ( 1.955 1.956 -5.974) 6.583 6.843 ( -6.336 -4.732 5.305) 9.523 7.225 ( 8.311 -6.119 1.608) 10.445 7.498 ( -5.952 -8.195 3.083) 10.587 7.623 ( 5.112 0.518 -2.368) 5.658 8.302 ( -14.387 6.065 -5.520) 16.560 9.011 ( -3.197 -2.522 -4.711) 6.227 9.886 ( -17.935 -18.923 6.797) 26.943 10.635 ( 5.223 -2.974 1.510) 6.197 11.100 ( -0.574 0.584 -5.331) 5.393 11.525 ( -1.424 -3.243 4.956) 6.092 12.892 ( -1.595 12.026 -2.543) 12.395 13.297 ( 10.278 -3.416 17.785) 20.824 14.702 ( 8.103 1.063 -3.844) 9.032 15.193 ( -5.981 -4.162 6.093) 9.498 15.576 ( 2.643 -2.131 -0.378) 3.416 15.864 ( -0.989 -1.420 -10.893) 11.030 16.540 ( -10.562 6.076 4.222) 12.896 17.628 ( -6.792 13.263 -1.873) 15.018 19.336 ( -2.228 -5.403 4.485) 7.367 20.277 ( 4.385 -0.851 -6.599) 7.968 21.245 ( -5.993 0.920 0.821) 6.119 21.694 ( -3.839 17.612 -9.644) 20.443 22.639 ( 2.018 -12.394 8.766) 15.314 23.015 ( -2.111 -2.044 2.389) 3.787 23.362 ( 0.001 0.743 1.753) 1.904 23.926 ( 8.400 6.002 -6.808) 12.367 ======================= Grid point 100 (65/156) ======================= q-point: ( 0.05 -0.25 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( -18.102 -15.320 -1.653) 23.772 2.838 ( -20.495 -12.166 -10.544) 26.062 3.693 ( 3.974 2.292 7.749) 9.006 4.041 ( -2.433 4.672 -5.887) 7.900 4.640 ( 1.827 3.943 1.207) 4.510 5.143 ( -18.970 4.938 5.039) 20.239 5.523 ( -3.124 7.060 -1.861) 7.941 6.238 ( 4.991 1.083 3.875) 6.410 6.379 ( 1.416 -2.490 -2.443) 3.764 6.816 ( 9.925 4.103 -1.679) 10.870 6.948 ( 4.007 -7.161 8.016) 11.471 7.240 ( -13.958 -2.524 -2.825) 14.463 7.450 ( 1.616 -7.338 5.106) 9.085 7.912 ( 6.036 -8.248 1.371) 10.313 8.218 ( 17.745 14.000 4.542) 23.055 8.758 ( -6.363 -12.567 -22.844) 26.838 9.036 ( -4.995 -4.832 -3.702) 7.875 11.055 ( 9.702 -6.773 0.335) 11.837 11.234 ( 4.706 3.635 3.021) 6.670 11.536 ( -5.932 -4.090 10.257) 12.534 12.432 ( -13.770 10.394 -5.918) 18.239 14.028 ( 0.356 -14.427 17.142) 22.408 14.699 ( -6.813 7.385 -1.569) 10.170 14.916 ( 2.347 -2.700 -1.224) 3.782 15.391 ( -5.200 -4.617 -6.147) 9.281 15.890 ( 0.917 4.007 -14.829) 15.389 16.342 ( 4.168 4.591 4.380) 7.592 17.794 ( 11.861 10.888 2.503) 16.294 19.621 ( 10.245 -17.880 4.112) 21.014 20.402 ( 1.561 1.474 4.819) 5.275 21.139 ( -1.213 7.290 1.781) 7.602 21.376 ( 1.515 20.747 -12.058) 24.044 22.780 ( -0.210 -7.257 4.034) 8.306 23.004 ( 0.082 -5.204 -0.081) 5.205 23.294 ( -3.324 1.260 -0.868) 3.659 24.115 ( 1.957 6.334 3.443) 7.470 ======================= Grid point 101 (66/156) ======================= q-point: ( 0.10 -0.10 -0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( -31.035 -0.050 0.000) 31.035 1.355 ( -28.999 -16.783 0.000) 33.506 2.815 ( -60.961 10.990 0.000) 61.943 4.170 ( 5.773 2.134 -0.000) 6.155 4.354 ( -5.503 -5.310 0.000) 7.647 4.471 ( -5.668 -5.584 0.000) 7.957 5.074 ( -11.926 1.814 0.000) 12.063 6.119 ( -14.037 -5.945 0.000) 15.244 6.678 ( 13.126 5.945 -0.000) 14.409 6.914 ( 2.329 -6.592 -0.000) 6.991 7.278 ( 8.581 -0.023 -0.000) 8.581 7.488 ( 4.211 6.432 0.000) 7.688 7.809 ( -4.879 0.675 0.000) 4.925 7.847 ( 10.708 -0.528 -0.000) 10.721 7.963 ( 6.183 -1.659 -0.000) 6.402 9.053 ( -4.411 3.709 0.000) 5.764 9.461 ( 25.029 5.305 -0.000) 25.585 11.165 ( -6.391 -2.151 0.000) 6.743 11.395 ( -6.509 0.030 0.000) 6.509 11.445 ( 8.363 -0.162 -0.000) 8.365 11.955 ( -10.779 6.654 0.000) 12.667 13.402 ( -10.636 -14.769 -0.000) 18.200 14.775 ( 4.906 -2.054 -0.000) 5.319 14.993 ( -5.120 1.610 0.000) 5.368 15.222 ( 0.504 0.828 0.000) 0.969 15.604 ( -5.313 5.793 0.000) 7.860 16.700 ( 6.030 0.143 -0.000) 6.032 18.563 ( 15.845 -0.513 -0.000) 15.854 19.724 ( 10.449 -12.783 -0.000) 16.510 20.466 ( -0.667 0.365 0.000) 0.760 21.360 ( -8.466 14.204 0.000) 16.536 21.809 ( 13.919 1.187 -0.000) 13.969 22.895 ( -0.277 -2.598 -0.000) 2.613 22.909 ( 8.867 -2.477 -0.000) 9.207 23.092 ( -6.437 0.851 0.000) 6.493 24.161 ( -5.674 0.441 0.000) 5.691 ======================= Grid point 102 (67/156) ======================= q-point: ( 0.10 0.10 -0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 131 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.584 ( -0.000 -0.000 30.138) 30.138 0.584 ( -0.000 -0.000 30.138) 30.138 1.229 ( -0.000 -0.000 63.363) 63.363 4.222 ( 0.000 0.000 -5.655) 5.655 4.222 ( 0.000 0.000 -5.655) 5.655 4.268 ( -0.000 -0.000 1.494) 1.494 4.894 ( 0.000 0.000 -2.417) 2.417 5.747 ( 0.000 0.000 -2.031) 2.031 5.747 ( 0.000 0.000 -2.031) 2.031 6.886 ( 0.000 0.000 -8.745) 8.745 6.886 ( 0.000 0.000 -8.745) 8.745 7.568 ( 0.000 0.000 -8.951) 8.951 7.693 ( 0.000 0.000 -0.509) 0.509 7.693 ( 0.000 0.000 -0.509) 0.509 8.661 ( -0.000 -0.000 4.894) 4.894 10.214 ( 0.000 0.000 -4.779) 4.779 10.915 ( -0.000 -0.000 3.839) 3.839 10.978 ( 0.000 0.000 -4.376) 4.376 10.978 ( 0.000 0.000 -4.376) 4.376 11.705 ( -0.000 -0.000 18.569) 18.569 11.839 ( 0.000 0.000 -1.280) 1.280 13.136 ( 0.000 0.000 -1.608) 1.608 13.136 ( 0.000 0.000 -1.608) 1.608 14.953 ( -0.000 -0.000 6.522) 6.522 14.953 ( -0.000 -0.000 6.522) 6.522 16.762 ( 0.000 0.000 -7.906) 7.906 18.900 ( 0.000 0.000 -4.294) 4.294 19.069 ( 0.000 0.000 -2.657) 2.657 19.976 ( 0.000 0.000 -1.067) 1.067 19.976 ( 0.000 0.000 -1.067) 1.067 21.168 ( -0.000 -0.000 2.273) 2.273 21.780 ( 0.000 0.000 -1.565) 1.565 22.236 ( -0.000 -0.000 4.331) 4.331 22.884 ( -0.000 -0.000 0.903) 0.903 22.884 ( -0.000 -0.000 0.903) 0.903 23.163 ( 0.000 0.000 -1.114) 1.114 ======================= Grid point 103 (68/156) ======================= q-point: ( 0.10 0.30 -0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( 19.807 7.904 17.243) 27.424 2.042 ( 24.176 -1.278 21.006) 32.053 3.281 ( 33.448 -4.878 23.471) 41.152 4.076 ( 5.514 2.866 -2.594) 6.734 4.191 ( 1.927 -5.706 -8.728) 10.604 4.459 ( 5.768 6.524 0.942) 8.759 5.001 ( 11.554 -1.311 -3.105) 12.035 5.964 ( 9.908 7.755 -8.745) 15.323 6.355 ( 5.492 -5.550 -21.572) 22.941 6.685 ( 3.629 -8.029 2.064) 9.050 6.781 ( 8.242 9.197 -10.366) 16.124 7.165 ( -5.268 0.588 -10.250) 11.539 7.540 ( -6.904 -8.904 -3.047) 11.672 7.712 ( 2.163 6.341 -6.635) 9.429 9.015 ( 4.909 -0.498 0.400) 4.950 9.363 ( -26.053 3.882 -0.446) 26.345 9.771 ( -26.707 -8.305 34.738) 44.597 10.894 ( 0.293 3.420 -9.749) 10.336 11.149 ( 5.384 -1.740 -9.303) 10.889 11.613 ( -7.231 -4.977 -1.707) 8.943 12.311 ( 6.710 -1.014 26.936) 27.777 13.284 ( 6.655 15.413 -3.727) 17.197 14.155 ( 23.475 -8.425 -18.020) 30.770 15.062 ( -2.061 0.691 11.313) 11.520 15.239 ( 5.760 0.386 8.977) 10.673 16.402 ( -5.683 -0.446 -16.016) 17.000 17.037 ( -33.059 -1.448 30.748) 45.171 18.437 ( -15.248 1.247 -4.997) 16.094 19.686 ( -10.097 10.627 -2.070) 14.804 20.259 ( 2.842 -2.491 -9.022) 9.781 21.309 ( 0.973 -13.605 -0.478) 13.649 22.069 ( -7.230 0.271 9.837) 12.211 22.519 ( 1.035 7.542 -13.868) 15.820 22.960 ( 1.046 -2.497 1.479) 3.085 23.210 ( 4.695 -0.018 3.205) 5.685 23.597 ( 21.443 0.473 -14.340) 25.800 ======================= Grid point 104 (69/156) ======================= q-point: ( 0.10 0.50 -0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( 6.255 1.245 8.031) 10.255 3.159 ( 14.273 -0.247 5.228) 15.202 3.596 ( -6.110 -5.213 -0.386) 8.041 4.041 ( 0.131 0.569 -6.516) 6.542 4.579 ( 4.716 6.874 -6.468) 10.551 5.231 ( 15.381 -5.708 11.194) 19.862 5.666 ( 20.558 1.618 -0.235) 20.622 5.919 ( -1.235 -3.224 -13.982) 14.402 6.197 ( 9.592 -5.279 -7.050) 13.022 6.772 ( -2.812 8.628 -0.575) 9.093 6.894 ( 0.154 10.300 -2.765) 10.666 7.076 ( -5.170 -7.104 2.863) 9.240 7.414 ( 8.228 -0.870 4.715) 9.523 7.661 ( 0.005 3.733 -4.450) 5.809 8.366 ( -18.032 -5.968 -0.636) 19.005 8.913 ( 0.632 -0.584 -8.454) 8.498 9.667 ( -16.054 -1.006 17.356) 23.664 10.628 ( 0.949 2.173 -6.758) 7.162 11.104 ( 1.440 -0.239 -4.055) 4.310 11.408 ( -0.232 -7.545 0.253) 7.553 13.083 ( 3.363 0.898 14.869) 15.271 13.313 ( -0.998 9.514 3.581) 10.215 14.620 ( 11.545 -8.742 -6.789) 15.994 15.183 ( -4.647 3.023 8.053) 9.777 15.568 ( 0.956 1.463 -0.516) 1.822 15.843 ( -1.102 -0.615 -11.040) 11.112 16.617 ( -9.668 1.107 8.412) 12.863 17.783 ( -8.270 0.900 -2.175) 8.599 19.281 ( -5.138 0.222 -2.068) 5.543 20.271 ( 4.105 0.305 -2.975) 5.079 21.184 ( -2.745 -4.661 -0.849) 5.476 22.071 ( -2.121 13.257 -2.039) 13.579 22.376 ( 0.101 -9.029 4.686) 10.173 22.956 ( -0.583 -3.431 -2.300) 4.171 23.369 ( 0.114 -0.246 1.801) 1.821 24.019 ( 8.481 2.603 -2.784) 9.298 ======================= Grid point 105 (70/156) ======================= q-point: ( 0.10 -0.30 -0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -16.549 -11.624 -2.185) 20.341 2.679 ( -24.936 -2.135 -14.619) 28.984 3.724 ( 9.345 1.194 5.479) 10.898 4.173 ( 1.175 7.031 -1.593) 7.305 4.616 ( -2.405 -5.869 -0.395) 6.355 5.168 ( -28.576 -3.156 3.130) 28.919 5.665 ( -7.148 5.725 -0.312) 9.164 6.168 ( 2.434 -3.082 0.032) 3.927 6.415 ( 8.262 0.820 -2.201) 8.589 6.790 ( -1.450 -7.346 7.884) 10.873 7.032 ( 10.971 14.003 0.445) 17.795 7.187 ( -7.502 -5.307 -1.171) 9.264 7.236 ( 5.705 -5.925 9.397) 12.489 7.725 ( 4.440 -9.707 -3.180) 11.138 8.376 ( 7.758 -3.478 -6.066) 10.444 8.765 ( 4.387 18.852 -15.927) 25.067 9.099 ( -6.144 8.598 1.583) 10.686 10.938 ( 12.120 -4.716 1.614) 13.105 11.306 ( 4.875 3.166 4.010) 7.061 11.413 ( -3.314 -7.343 4.252) 9.110 12.636 ( -16.273 8.323 -3.975) 18.705 13.705 ( -4.957 -15.442 15.888) 22.704 14.703 ( 2.278 -4.104 -14.652) 15.385 14.996 ( -2.963 7.488 10.198) 12.994 15.332 ( -5.375 -0.620 -5.226) 7.523 15.973 ( 3.547 3.525 -10.429) 11.566 16.430 ( 0.513 3.541 2.836) 4.566 17.895 ( 11.724 -1.582 2.366) 12.064 19.311 ( 7.280 -11.070 -0.156) 13.250 20.429 ( 1.323 1.743 3.627) 4.236 21.252 ( 6.560 3.360 2.481) 7.777 21.799 ( -4.870 17.894 -8.268) 20.305 22.575 ( 2.758 -11.275 7.089) 13.601 22.901 ( 1.356 -4.704 -3.637) 6.099 23.308 ( -3.052 0.104 -1.047) 3.228 24.215 ( -0.343 2.924 5.047) 5.843 ======================= Grid point 112 (71/156) ======================= q-point: ( 0.10 0.10 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( 23.881 16.501 11.799) 31.333 2.116 ( 24.421 13.563 11.051) 30.041 3.410 ( 13.548 27.774 4.819) 31.275 3.876 ( -4.860 -3.448 -1.231) 6.085 4.442 ( 4.241 -1.731 -6.366) 7.842 4.643 ( 9.455 -0.655 3.795) 10.209 5.331 ( 8.899 12.899 -2.642) 15.892 6.217 ( 8.346 3.596 -6.832) 11.369 6.423 ( 1.267 0.740 2.947) 3.292 6.824 ( -9.966 -7.115 -14.668) 19.108 7.167 ( -5.865 -5.384 -1.689) 8.138 7.244 ( 4.513 -7.427 -0.013) 8.691 7.427 ( -5.837 5.994 -9.107) 12.367 8.007 ( 6.924 0.068 -3.951) 7.972 8.622 ( -4.612 -4.330 18.861) 19.894 9.002 ( -8.688 -0.497 -4.195) 9.661 9.514 ( -5.617 9.008 17.435) 20.413 11.081 ( 4.346 -1.780 -7.435) 8.794 11.409 ( -4.561 -5.471 -2.043) 7.410 11.464 ( 0.687 2.288 -4.804) 5.365 11.898 ( 2.317 8.446 13.873) 16.406 13.583 ( 19.401 -3.818 -8.044) 21.347 14.676 ( -3.064 3.577 -14.090) 14.856 15.032 ( 2.111 2.287 6.060) 6.812 15.164 ( 6.938 7.135 1.770) 10.108 16.076 ( -8.897 -2.635 27.193) 28.732 16.530 ( -5.123 -4.396 -6.937) 9.680 18.113 ( -16.028 -17.747 -3.925) 24.233 19.885 ( 13.569 -17.324 -2.165) 22.111 20.426 ( -2.218 5.772 -9.200) 11.085 21.089 ( -15.068 10.521 0.709) 18.391 21.584 ( -13.642 -9.410 8.254) 18.514 22.758 ( 2.917 -4.220 -5.683) 7.656 23.039 ( 2.693 -2.753 5.512) 6.724 23.156 ( 1.202 4.197 1.026) 4.485 24.043 ( 1.825 3.518 -11.876) 12.520 ======================= Grid point 113 (72/156) ======================= q-point: ( 0.10 0.30 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.003 ( 9.741 13.362 0.858) 16.558 3.173 ( 18.634 4.965 6.957) 20.501 3.473 ( -0.267 -3.675 -5.812) 6.882 4.138 ( -1.401 0.862 1.799) 2.438 4.458 ( 3.127 -12.062 5.484) 13.614 4.890 ( -2.459 -7.279 -6.210) 9.879 5.449 ( 4.882 -4.368 2.653) 7.068 6.023 ( -9.699 -7.107 -8.357) 14.643 6.389 ( 10.529 7.171 -12.638) 17.945 6.913 ( -5.984 2.426 7.143) 9.629 7.038 ( -5.585 9.859 -0.315) 11.336 7.365 ( 10.644 5.810 0.847) 12.156 7.484 ( 16.666 -1.760 2.484) 16.942 7.936 ( -5.608 4.917 -9.887) 12.385 8.035 ( -12.669 4.970 -2.930) 13.921 9.015 ( -7.186 -6.783 13.060) 16.377 9.768 ( 6.031 26.172 17.800) 32.221 11.078 ( -1.476 -4.098 -3.072) 5.330 11.174 ( -8.049 8.333 -5.873) 12.989 11.284 ( 7.591 -2.033 -15.373) 17.265 12.496 ( 6.626 -3.492 16.571) 18.185 14.032 ( -10.490 12.138 -10.474) 19.160 14.257 ( 14.537 -14.054 -11.095) 23.064 15.218 ( -0.570 4.761 10.093) 11.174 15.635 ( 6.286 5.042 7.427) 10.959 16.074 ( -6.542 1.803 -7.226) 9.913 16.181 ( -2.728 -7.852 12.967) 15.402 17.406 ( -10.775 -18.782 -5.009) 22.225 19.711 ( -11.159 7.935 -15.100) 20.384 20.299 ( 6.937 -0.692 -0.583) 6.995 21.039 ( 3.047 -4.020 -0.861) 5.117 21.284 ( -7.761 -14.402 18.166) 24.447 22.808 ( 3.172 3.137 -3.855) 5.896 23.070 ( -2.969 5.479 -3.679) 7.237 23.271 ( 2.290 -2.818 0.988) 3.763 23.931 ( -0.049 -6.669 -1.224) 6.781 ======================= Grid point 114 (73/156) ======================= q-point: ( 0.10 -0.50 0.10) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.694 ( -11.729 14.314 -9.408) 20.760 3.179 ( -14.499 9.066 -11.536) 20.627 3.654 ( -0.314 -3.671 3.435) 5.037 4.144 ( 3.849 -7.239 2.214) 8.492 4.480 ( -3.041 2.084 5.066) 6.265 4.705 ( -6.097 -13.911 -8.511) 17.410 5.588 ( -2.374 -6.349 -0.426) 6.792 5.982 ( 13.633 -9.038 9.610) 18.971 6.444 ( -12.466 4.675 7.166) 15.120 6.679 ( 8.000 5.895 -12.374) 15.870 6.937 ( -6.753 8.716 6.154) 12.627 7.330 ( -7.885 7.420 -2.110) 11.031 7.581 ( -5.976 -0.857 -2.355) 6.480 7.774 ( 6.833 14.416 2.626) 16.168 8.386 ( 11.307 0.521 5.549) 12.606 8.966 ( 0.143 -8.219 1.531) 8.362 10.222 ( -3.803 24.350 -10.928) 26.960 10.730 ( 2.527 3.270 5.384) 6.787 11.145 ( 4.653 -5.619 1.757) 7.503 11.378 ( 5.189 -0.993 -5.392) 7.548 12.712 ( -11.356 -4.440 -3.600) 12.714 13.336 ( -7.113 8.942 7.571) 13.707 14.595 ( 5.524 -7.372 -3.466) 9.843 15.246 ( -3.948 5.554 -0.879) 6.871 15.562 ( -6.290 5.041 -7.049) 10.708 16.048 ( 7.579 -1.264 3.325) 8.372 16.398 ( -0.792 -4.078 2.076) 4.644 17.327 ( 11.180 -19.162 2.673) 22.346 19.363 ( 5.130 8.193 -4.913) 10.844 20.470 ( -2.310 3.971 6.602) 8.043 21.070 ( 4.040 -13.993 0.743) 14.583 21.566 ( 1.926 -12.906 5.579) 14.192 22.707 ( -3.642 8.640 -5.817) 11.034 22.945 ( 5.101 1.734 -5.695) 7.840 23.303 ( -0.466 -1.534 -2.008) 2.570 23.980 ( -2.608 -6.169 9.470) 11.599 ======================= Grid point 116 (74/156) ======================= q-point: ( 0.10 -0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( 11.593 19.601 0.000) 22.772 2.044 ( 11.907 28.030 0.000) 30.454 3.978 ( -5.626 -5.896 -0.000) 8.149 4.113 ( 4.297 40.949 0.000) 41.174 4.405 ( -1.344 6.157 0.000) 6.302 4.408 ( -4.524 -2.707 0.000) 5.272 5.506 ( 6.041 15.825 0.000) 16.939 6.298 ( 1.759 9.360 0.000) 9.524 6.425 ( -1.849 -9.224 -0.000) 9.407 6.785 ( 0.515 -9.860 -0.000) 9.873 7.109 ( -4.752 -6.778 -0.000) 8.278 7.289 ( -12.732 -2.216 0.000) 12.923 7.620 ( -6.620 -11.426 -0.000) 13.205 7.687 ( 13.570 -11.123 -0.000) 17.546 8.256 ( 14.010 7.847 -0.000) 16.058 9.202 ( 5.078 -9.918 -0.000) 11.143 9.255 ( 11.396 4.114 -0.000) 12.116 11.187 ( -2.034 -14.230 -0.000) 14.375 11.194 ( -5.329 3.266 0.000) 6.250 11.488 ( 2.507 -1.197 -0.000) 2.778 12.271 ( -5.400 20.153 0.000) 20.863 13.451 ( 1.293 8.435 0.000) 8.534 14.618 ( -1.447 -7.325 -0.000) 7.467 15.169 ( 2.502 7.837 0.000) 8.227 15.232 ( 1.831 -0.553 -0.000) 1.913 15.852 ( 3.776 6.452 0.000) 7.476 16.560 ( -1.388 -5.090 -0.000) 5.276 18.079 ( -11.986 -17.394 -0.000) 21.124 19.379 ( 1.693 -12.266 -0.000) 12.382 20.516 ( 2.716 0.987 -0.000) 2.890 21.480 ( -6.482 -11.894 -0.000) 13.546 21.694 ( -4.367 13.384 0.000) 14.079 22.663 ( -0.395 -8.809 -0.000) 8.818 22.835 ( -0.163 -3.494 -0.000) 3.498 23.216 ( 0.095 4.091 0.000) 4.092 24.258 ( -1.428 3.129 0.000) 3.440 ======================= Grid point 117 (75/156) ======================= q-point: ( 0.10 0.10 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.714 ( 18.660 5.694 3.044) 19.746 2.873 ( 16.774 16.535 10.583) 25.822 3.630 ( -2.522 0.571 -7.038) 7.498 4.082 ( 0.534 12.661 6.462) 14.225 4.284 ( -4.366 -13.312 -4.699) 14.776 4.717 ( 2.811 -8.536 4.214) 9.926 5.464 ( -5.446 0.510 -1.633) 5.708 6.213 ( -14.734 -14.327 -4.669) 21.075 6.525 ( 12.323 12.390 -6.914) 18.793 6.798 ( 2.928 -6.373 2.047) 7.306 7.039 ( 11.426 -0.094 5.188) 12.548 7.255 ( 7.389 9.534 3.185) 12.475 7.469 ( -1.034 7.346 -4.265) 8.557 8.125 ( 4.339 -0.964 -2.707) 5.204 8.571 ( -3.378 -1.179 -3.595) 5.072 8.736 ( -14.282 -1.231 0.620) 14.348 9.904 ( 6.421 24.967 15.932) 30.305 11.061 ( 1.531 -6.753 -5.587) 8.897 11.204 ( 0.590 -7.896 -0.173) 7.920 11.501 ( 1.626 -2.306 -5.951) 6.586 12.208 ( 3.316 15.926 8.354) 18.287 13.902 ( 19.757 -5.608 -14.235) 24.989 14.529 ( -7.008 -5.254 -0.456) 8.771 15.125 ( -2.671 6.299 4.258) 8.059 15.454 ( 7.843 5.590 3.922) 10.399 15.952 ( -5.530 1.732 11.563) 12.934 16.359 ( -5.256 -0.461 -5.297) 7.477 17.368 ( -16.407 -19.957 -3.328) 26.049 19.813 ( 14.065 -16.696 -2.773) 22.006 20.510 ( -5.867 8.954 -9.249) 14.147 20.947 ( -6.896 -4.431 -0.804) 8.237 21.138 ( -18.338 2.504 11.063) 21.562 22.793 ( 5.242 -0.459 -1.664) 5.519 23.041 ( 5.102 -4.317 3.674) 7.627 23.220 ( -0.531 1.316 1.030) 1.754 23.997 ( -6.718 -2.000 -5.901) 9.163 ======================= Grid point 118 (76/156) ======================= q-point: ( 0.10 0.30 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.251 ( -3.472 4.780 -4.548) 7.456 3.453 ( 5.546 -3.800 1.799) 6.960 3.512 ( 3.507 1.079 -2.300) 4.331 3.872 ( -4.785 -14.854 -1.872) 15.717 4.307 ( 1.838 -5.051 10.725) 11.996 4.630 ( -1.364 -6.708 -5.922) 9.052 5.498 ( 5.177 -1.416 4.707) 7.139 5.704 ( -7.225 -1.854 -4.854) 8.900 6.621 ( -6.541 4.679 5.057) 9.500 6.919 ( 3.365 4.761 -4.126) 7.143 7.197 ( -3.990 13.287 -2.887) 14.170 7.557 ( 4.248 5.904 2.330) 7.638 7.900 ( -4.443 4.724 -3.245) 7.252 7.937 ( -6.201 7.235 -2.244) 9.789 8.099 ( 12.048 9.496 2.815) 15.596 8.660 ( -2.252 -14.067 7.740) 16.213 10.457 ( 9.723 19.455 8.526) 23.360 10.929 ( -3.033 -4.560 0.512) 5.501 11.120 ( -5.930 -0.508 -6.307) 8.672 11.424 ( 4.228 0.610 -11.845) 12.592 12.651 ( 6.361 8.067 8.974) 13.641 13.773 ( -16.411 -2.062 -6.727) 17.855 14.426 ( 8.721 -0.802 -9.448) 12.883 15.270 ( 3.236 -1.897 4.647) 5.973 15.804 ( -1.177 4.295 5.860) 7.360 15.989 ( -0.198 -2.800 -5.294) 5.992 16.079 ( 0.966 0.197 11.315) 11.358 16.876 ( -2.287 -17.474 -3.865) 18.042 19.685 ( -5.100 6.750 -10.345) 13.364 20.476 ( 7.209 2.812 1.405) 7.864 20.667 ( -9.889 -14.483 8.091) 19.313 21.180 ( 7.212 -5.285 3.861) 9.739 22.957 ( 4.521 3.356 -2.238) 6.059 23.087 ( -5.117 3.589 -5.146) 8.096 23.270 ( 3.173 -2.100 -1.671) 4.156 23.709 ( -3.312 -9.213 5.176) 11.075 ======================= Grid point 119 (77/156) ======================= q-point: ( 0.10 -0.50 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.796 ( -5.903 16.056 -5.240) 17.891 3.099 ( -15.029 13.212 -11.291) 22.976 3.495 ( -1.315 -4.050 5.789) 7.187 4.175 ( 5.934 -5.232 4.374) 9.040 4.236 ( -3.990 2.771 -6.711) 8.285 4.796 ( 8.007 0.475 -3.639) 8.807 5.433 ( -1.746 -4.141 1.375) 4.700 6.046 ( 9.334 -8.310 11.698) 17.118 6.359 ( -8.759 8.860 10.452) 16.262 6.898 ( -2.062 9.148 -4.514) 10.407 7.085 ( 1.946 9.375 -1.548) 9.699 7.318 ( -10.230 6.971 -2.353) 12.601 7.401 ( -6.832 -1.632 1.098) 7.109 8.041 ( -0.893 4.369 5.780) 7.300 8.360 ( -3.543 -9.343 11.753) 15.426 8.946 ( 11.908 -6.278 -14.247) 19.601 10.230 ( -21.613 3.850 -16.722) 27.596 10.947 ( 5.967 5.054 6.397) 10.103 11.122 ( 4.893 -3.112 7.800) 9.719 11.410 ( -1.952 -1.384 2.645) 3.567 12.454 ( -9.217 2.386 -17.230) 19.686 13.632 ( 7.977 18.194 12.627) 23.539 14.447 ( -5.205 -8.752 6.478) 12.069 15.273 ( -0.486 0.741 -9.852) 9.891 15.563 ( -5.718 8.338 -6.886) 12.233 16.125 ( 6.453 -5.310 2.846) 8.828 16.265 ( -1.538 -6.371 -3.684) 7.519 17.279 ( 18.999 -15.937 5.755) 25.458 19.738 ( 10.664 8.246 4.864) 14.331 20.330 ( -10.324 -3.872 8.899) 14.170 20.933 ( 6.115 -5.335 0.772) 8.152 21.361 ( 4.030 -13.713 -11.566) 18.387 22.772 ( -2.506 4.812 0.181) 5.428 23.114 ( 4.537 3.070 -3.516) 6.509 23.245 ( -2.541 -1.877 -1.285) 3.411 23.853 ( 1.524 -2.710 8.386) 8.944 ======================= Grid point 121 (78/156) ======================= q-point: ( 0.10 -0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.500 ( 17.464 12.543 -0.000) 21.501 2.824 ( 12.509 20.068 0.000) 23.647 3.800 ( -1.476 -3.695 -0.000) 3.978 4.182 ( -9.713 -4.168 0.000) 10.569 4.409 ( 1.227 -8.075 -0.000) 8.168 4.648 ( -14.717 25.411 0.000) 29.365 5.622 ( -8.211 -1.116 0.000) 8.286 6.217 ( -12.374 -16.161 -0.000) 20.354 6.220 ( 6.684 -21.579 -0.000) 22.590 6.794 ( 8.400 14.649 0.000) 16.887 6.961 ( 1.176 10.081 0.000) 10.149 7.305 ( 2.903 6.774 0.000) 7.370 7.486 ( 5.829 -2.801 -0.000) 6.468 7.830 ( 16.692 -6.952 -0.000) 18.082 8.360 ( -0.060 -9.696 -0.000) 9.696 9.184 ( -1.585 2.855 0.000) 3.265 9.873 ( 22.111 18.522 -0.000) 28.843 10.845 ( -0.122 -14.203 -0.000) 14.203 11.075 ( -4.639 -4.219 0.000) 6.271 11.437 ( 0.819 -6.615 -0.000) 6.666 12.621 ( -4.445 23.740 0.000) 24.153 13.731 ( 10.543 5.251 -0.000) 11.779 14.360 ( -6.599 -11.099 -0.000) 12.913 15.270 ( 5.285 -1.113 -0.000) 5.401 15.444 ( 2.561 11.621 0.000) 11.900 15.948 ( -1.091 -0.289 0.000) 1.128 16.495 ( -1.797 2.718 0.000) 3.258 17.399 ( -19.709 -15.634 0.000) 25.157 19.268 ( 9.219 -9.580 -0.000) 13.296 20.592 ( 4.398 -2.037 -0.000) 4.847 21.080 ( -12.779 -6.437 0.000) 14.309 21.704 ( -19.066 12.044 0.000) 22.552 22.640 ( 9.019 -2.050 -0.000) 9.249 22.763 ( 3.988 -6.040 -0.000) 7.238 23.260 ( -1.664 1.750 0.000) 2.415 24.194 ( -7.016 -1.060 0.000) 7.096 ======================= Grid point 122 (79/156) ======================= q-point: ( 0.10 0.10 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.086 ( 8.779 3.727 2.244) 9.797 3.282 ( 3.903 1.452 4.394) 6.054 3.691 ( -2.204 -1.561 -7.652) 8.115 3.798 ( -9.347 -11.318 -2.963) 14.975 4.064 ( -3.359 0.590 8.925) 9.554 4.578 ( -2.502 -3.837 0.721) 4.637 5.463 ( 0.997 3.432 0.549) 3.616 5.729 ( -4.755 -9.577 2.094) 10.895 6.666 ( 7.180 -6.161 6.576) 11.522 6.900 ( -0.990 6.292 -5.111) 8.167 7.441 ( 13.035 11.968 4.428) 18.241 7.621 ( 0.850 7.266 -5.510) 9.158 7.846 ( 21.023 7.349 -0.820) 22.286 8.119 ( -2.000 -2.544 -2.251) 3.942 8.281 ( -6.473 -12.556 8.144) 16.306 8.513 ( -17.082 9.846 -8.086) 21.310 10.534 ( 5.785 16.195 8.187) 19.046 10.925 ( -2.482 -4.847 -3.768) 6.622 11.108 ( 5.263 -3.650 0.098) 6.406 11.456 ( 3.239 -7.138 -4.508) 9.042 12.688 ( 6.579 20.554 3.501) 21.863 13.891 ( -5.942 -15.090 -8.236) 18.189 14.489 ( 16.589 -1.645 -2.503) 16.857 15.130 ( -11.020 6.274 1.675) 12.791 15.687 ( 5.750 2.356 5.242) 8.129 15.862 ( -4.854 0.545 5.342) 7.238 16.309 ( -4.784 5.053 -3.185) 7.653 16.704 ( -8.726 -16.753 -1.872) 18.982 19.815 ( 13.388 -9.525 -1.892) 16.539 20.367 ( -16.766 -1.314 -0.363) 16.822 20.787 ( 2.494 -0.689 -3.522) 4.370 20.972 ( -9.861 5.210 5.200) 12.305 22.934 ( 5.022 2.901 0.715) 5.844 23.114 ( 9.748 -2.258 0.949) 10.051 23.191 ( -2.058 -1.390 0.781) 2.604 23.724 ( -12.338 -4.273 -2.939) 13.384 ======================= Grid point 123 (80/156) ======================= q-point: ( 0.10 -0.70 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.213 ( -4.998 6.611 -3.407) 8.961 3.384 ( -2.105 -4.310 2.977) 5.645 3.509 ( 0.846 -1.667 -0.017) 1.869 3.694 ( 10.989 -8.205 0.412) 13.721 4.319 ( 4.173 -1.449 -3.914) 5.902 4.560 ( 5.543 -6.515 2.463) 8.902 5.507 ( -3.598 2.685 1.312) 4.677 5.660 ( -0.295 -0.465 3.908) 3.946 6.553 ( -11.780 8.914 12.076) 19.080 7.029 ( 2.465 -1.768 -4.274) 5.241 7.376 ( -5.941 12.356 -0.530) 13.720 7.656 ( -5.077 4.676 -4.997) 8.521 7.790 ( -10.637 5.326 0.475) 11.906 8.051 ( 0.005 5.331 0.658) 5.372 8.138 ( -8.477 -4.391 9.402) 13.399 8.705 ( 20.168 -6.970 -10.519) 23.790 10.751 ( -3.804 -0.929 3.622) 5.334 10.863 ( 1.295 -2.157 2.974) 3.896 11.000 ( -4.350 9.240 -4.821) 11.294 11.404 ( -2.638 -5.095 -2.024) 6.084 12.954 ( -4.230 7.875 -9.050) 12.720 13.551 ( 4.547 1.859 6.073) 7.811 14.395 ( -10.860 -0.766 0.589) 10.902 15.330 ( 10.892 -6.213 -8.673) 15.247 15.823 ( -0.974 2.444 7.196) 7.662 15.954 ( -1.376 -1.017 -2.251) 2.828 16.160 ( 3.135 2.558 3.320) 5.234 16.638 ( 7.816 -10.476 0.084) 13.071 19.709 ( -6.524 2.463 2.898) 7.551 20.329 ( 0.350 -3.122 1.307) 3.403 20.675 ( 5.475 2.189 2.239) 6.307 21.196 ( 8.534 -7.825 -5.566) 12.847 22.991 ( -7.781 2.014 -2.128) 8.314 23.120 ( 3.600 3.032 0.282) 4.715 23.228 ( -3.865 -5.002 0.772) 6.369 23.599 ( 8.050 -2.094 1.640) 8.478 ======================= Grid point 126 (81/156) ======================= q-point: ( 0.10 -0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.024 ( 11.274 8.687 -0.000) 14.233 3.268 ( 2.487 6.435 0.000) 6.899 3.570 ( -3.406 -13.798 -0.000) 14.212 4.068 ( -12.001 -9.642 0.000) 15.395 4.112 ( -4.280 16.488 0.000) 17.035 4.746 ( -11.894 7.842 0.000) 14.247 5.474 ( -0.371 -1.848 -0.000) 1.885 5.599 ( -10.106 -11.753 -0.000) 15.500 6.075 ( 16.779 -13.279 -0.000) 21.398 7.185 ( -2.576 7.266 0.000) 7.709 7.381 ( 13.520 13.691 0.000) 19.242 7.474 ( 11.181 -8.015 -0.000) 13.757 7.625 ( 8.763 0.578 -0.000) 8.782 7.936 ( 6.871 -12.342 -0.000) 14.126 8.147 ( 0.406 -2.875 -0.000) 2.903 9.176 ( -13.467 8.936 0.000) 16.162 10.518 ( 4.810 2.618 -0.000) 5.476 10.869 ( 19.758 8.962 -0.000) 21.696 10.886 ( -0.903 -6.758 -0.000) 6.818 11.284 ( 0.928 -8.860 -0.000) 8.908 13.046 ( -0.157 21.446 0.000) 21.447 13.859 ( -13.475 -17.183 -0.000) 21.837 14.076 ( 14.450 3.006 -0.000) 14.759 15.391 ( 6.737 0.267 -0.000) 6.742 15.711 ( -1.767 11.771 0.000) 11.903 15.864 ( -1.929 -2.859 -0.000) 3.449 16.553 ( -3.456 7.137 0.000) 7.929 16.664 ( -20.778 -13.751 0.000) 24.917 19.360 ( 12.687 -3.433 -0.000) 13.143 20.517 ( -0.331 -10.604 -0.000) 10.609 20.780 ( -10.888 2.669 0.000) 11.210 21.509 ( -18.968 8.994 0.000) 20.992 22.817 ( 10.854 -2.246 -0.000) 11.083 22.858 ( 8.038 3.890 -0.000) 8.930 23.223 ( -3.430 0.022 0.000) 3.431 23.940 ( -11.464 -4.255 0.000) 12.228 ======================= Grid point 127 (82/156) ======================= q-point: ( 0.10 0.10 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.265 ( -2.227 -3.004 2.787) 4.664 3.265 ( 2.227 3.004 2.787) 4.664 3.516 ( -3.490 0.060 -3.214) 4.745 3.516 ( 3.490 -0.060 -3.214) 4.745 4.330 ( -8.264 -8.581 1.293) 11.983 4.330 ( 8.264 8.581 1.293) 11.983 5.565 ( -0.370 -4.644 4.723) 6.634 5.565 ( 0.370 4.644 4.723) 6.634 6.824 ( -5.494 -2.816 2.219) 6.560 6.824 ( 5.494 2.816 2.219) 6.560 7.782 ( 1.712 -6.671 -4.702) 8.339 7.782 ( -1.712 6.671 -4.702) 8.339 7.988 ( -7.457 -0.219 3.147) 8.097 7.988 ( 7.457 0.219 3.147) 8.097 8.313 ( -16.563 2.597 -2.365) 16.931 8.313 ( 16.563 -2.597 -2.365) 16.931 10.764 ( -4.945 -2.059 1.254) 5.501 10.764 ( 4.945 2.059 1.254) 5.501 11.307 ( -0.955 -10.102 -2.112) 10.364 11.307 ( 0.955 10.102 -2.112) 10.364 13.307 ( -11.022 -20.289 -0.523) 23.095 13.307 ( 11.022 20.289 -0.523) 23.095 14.882 ( -11.902 -3.634 -3.800) 13.012 14.882 ( 11.902 3.634 -3.800) 13.012 15.790 ( -3.121 0.261 5.674) 6.481 15.790 ( 3.121 -0.261 5.674) 6.481 16.374 ( 2.323 -9.666 -1.773) 10.098 16.374 ( -2.323 9.666 -1.773) 10.098 20.002 ( -11.129 -1.922 0.232) 11.296 20.002 ( 11.129 1.922 0.232) 11.296 20.876 ( 5.738 -8.404 -0.233) 10.179 20.876 ( -5.738 8.404 -0.233) 10.179 23.085 ( -3.496 -2.936 1.141) 4.706 23.085 ( 3.496 2.936 1.141) 4.706 23.369 ( -13.115 -2.932 -1.156) 13.488 23.369 ( 13.115 2.932 -1.156) 13.488 ======================= Grid point 129 (83/156) ======================= q-point: ( 0.10 0.30 -0.60) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.144 ( -8.663 -7.748 5.691) 12.940 3.426 ( 2.249 3.897 4.090) 6.081 3.526 ( 0.385 4.340 -1.993) 4.791 3.875 ( 13.370 -1.187 -2.515) 13.657 4.416 ( 13.333 -3.060 4.768) 14.487 4.561 ( 0.553 -1.215 -4.483) 4.677 5.575 ( 2.532 -0.665 1.986) 3.286 5.593 ( 1.403 3.681 0.959) 4.055 6.518 ( -10.681 11.254 16.560) 22.692 6.903 ( -2.475 -10.789 -7.546) 13.396 7.284 ( -12.024 -1.392 -7.163) 14.065 7.580 ( -7.080 -3.530 0.423) 7.922 7.779 ( -4.220 -0.184 8.180) 9.206 7.916 ( -7.992 4.103 -0.060) 8.984 8.136 ( -4.784 11.952 -0.981) 12.911 8.860 ( 13.840 -10.647 -12.145) 21.270 10.584 ( -14.552 6.247 -3.347) 16.187 10.926 ( 2.956 3.093 1.804) 4.643 10.996 ( -4.684 -10.743 5.607) 12.992 11.249 ( -2.916 6.415 4.598) 8.414 12.839 ( -3.991 -3.044 -9.862) 11.066 13.703 ( -0.258 -10.543 0.098) 10.547 14.264 ( -0.158 11.723 7.261) 13.790 15.372 ( 2.188 -4.249 -5.624) 7.381 15.782 ( -3.972 -4.242 8.242) 10.084 15.931 ( -0.389 2.937 -0.850) 3.083 16.305 ( 4.991 1.794 -10.658) 11.904 16.795 ( 17.645 0.668 4.430) 18.205 19.512 ( -9.922 -0.701 7.607) 12.522 20.498 ( -0.511 9.627 -0.945) 9.687 20.766 ( 12.535 -6.922 -2.375) 14.515 21.297 ( 10.774 -0.803 -7.892) 13.379 22.906 ( -5.711 4.017 2.979) 7.591 22.979 ( -6.444 -6.105 5.677) 10.537 23.243 ( 3.087 1.479 1.098) 3.595 23.815 ( 10.187 1.053 -5.487) 11.618 ======================= Grid point 131 (84/156) ======================= q-point: ( 0.10 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.562 ( 5.596 11.345 -3.183) 13.045 3.164 ( 3.319 16.692 -8.675) 19.102 3.524 ( 2.599 -11.692 0.899) 12.011 4.162 ( 2.525 -7.945 1.656) 8.500 4.534 ( -6.503 4.204 -3.444) 8.475 5.354 ( -14.253 4.659 7.859) 16.930 5.711 ( 0.689 -6.091 -6.093) 8.643 5.864 ( -13.763 -8.868 -2.981) 16.642 6.141 ( -5.119 -13.783 -3.439) 15.100 6.913 ( 2.146 14.123 6.545) 15.713 7.053 ( 6.246 -2.362 6.904) 9.605 7.206 ( 15.227 -9.727 -1.988) 18.178 7.362 ( 0.073 10.427 -4.665) 11.423 7.578 ( -0.814 3.840 -6.825) 7.873 8.141 ( -3.023 -11.447 2.814) 12.169 9.007 ( 15.243 -0.215 -2.979) 15.533 9.745 ( 22.759 15.796 0.957) 27.721 10.633 ( -1.978 -8.129 -1.165) 8.447 11.200 ( -6.389 -3.562 2.593) 7.761 11.238 ( -3.905 -6.558 -1.518) 7.782 13.094 ( 2.341 15.731 -0.015) 15.905 13.608 ( -2.400 5.172 19.319) 20.143 14.465 ( -10.034 -7.563 -9.335) 15.653 15.172 ( 6.866 0.831 -7.942) 10.532 15.515 ( 4.933 6.279 2.381) 8.333 15.901 ( 1.071 -6.187 -1.419) 6.437 16.574 ( 1.080 7.049 3.101) 7.776 17.559 ( -14.820 -3.681 0.195) 15.272 19.121 ( -0.191 -0.228 -4.059) 4.069 20.417 ( 2.738 -5.181 1.670) 6.094 21.136 ( -2.854 -3.763 -0.256) 4.730 22.119 ( -9.903 6.411 9.257) 14.995 22.408 ( 10.631 -0.679 -2.575) 10.960 22.754 ( -4.373 -2.354 -7.829) 9.271 23.342 ( -1.733 1.803 -0.066) 2.502 24.192 ( -1.724 -4.287 3.507) 5.801 ======================= Grid point 132 (85/156) ======================= q-point: ( 0.10 -0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.277 ( 4.376 -1.931 -0.000) 4.783 3.323 ( 3.886 6.049 0.000) 7.190 3.469 ( -2.304 6.236 0.000) 6.648 3.745 ( -7.235 1.914 0.000) 7.483 4.412 ( -15.181 -8.566 0.000) 17.431 4.451 ( 0.357 15.814 0.000) 15.818 5.433 ( 0.026 0.164 0.000) 0.166 5.494 ( 4.977 -0.436 -0.000) 4.996 6.317 ( 21.863 -5.651 -0.000) 22.582 7.004 ( -7.422 -10.576 -0.000) 12.921 7.499 ( 6.132 -4.954 -0.000) 7.884 7.786 ( 12.689 -0.451 -0.000) 12.697 7.856 ( 7.824 -10.382 -0.000) 13.000 7.868 ( 7.667 4.683 -0.000) 8.984 8.044 ( -2.706 -7.561 -0.000) 8.031 8.920 ( -24.248 4.402 0.000) 24.645 10.658 ( 7.227 3.315 -0.000) 7.951 10.736 ( -3.676 -8.052 -0.000) 8.851 11.179 ( 2.925 -2.639 -0.000) 3.940 11.460 ( 10.598 11.041 0.000) 15.304 13.135 ( -15.900 -21.412 -0.000) 26.670 13.506 ( 7.305 16.470 0.000) 18.017 14.436 ( 15.245 1.234 -0.000) 15.294 15.525 ( 7.739 -3.981 -0.000) 8.703 15.712 ( -27.758 12.459 0.000) 30.426 15.779 ( -1.579 -2.283 -0.000) 2.776 16.134 ( 1.506 -10.402 -0.000) 10.511 16.661 ( -2.727 10.917 0.000) 11.252 19.645 ( 15.021 2.976 -0.000) 15.313 20.299 ( -1.553 -5.211 -0.000) 5.438 20.628 ( -7.337 -0.802 0.000) 7.381 21.317 ( -15.116 6.239 0.000) 16.353 23.077 ( 4.020 4.521 0.000) 6.049 23.096 ( 3.708 2.121 -0.000) 4.272 23.160 ( 7.078 2.033 -0.000) 7.365 23.595 ( -11.710 -4.572 0.000) 12.571 ======================= Grid point 137 (86/156) ======================= q-point: ( 0.10 0.70 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.949 ( 12.709 5.239 -1.974) 13.888 3.187 ( 0.030 -14.307 -0.972) 14.340 3.525 ( 1.218 4.305 0.702) 4.529 4.000 ( -1.932 -6.268 -2.897) 7.170 4.608 ( -1.290 11.342 -5.418) 12.635 4.940 ( -14.120 -10.316 13.054) 21.822 5.483 ( -2.513 -8.546 -2.384) 9.221 5.648 ( 1.062 -1.599 -9.738) 9.925 5.800 ( -6.249 -3.006 -8.567) 11.022 7.110 ( 5.431 -12.257 -5.634) 14.542 7.210 ( 10.749 -1.232 4.553) 11.739 7.307 ( 3.838 -0.125 6.122) 7.227 7.485 ( 4.663 -12.096 -1.467) 13.046 7.624 ( 2.818 9.648 -6.126) 11.770 8.025 ( 3.087 0.762 1.298) 3.434 9.349 ( 5.898 6.783 3.977) 9.829 10.383 ( 11.021 4.671 11.163) 16.368 10.679 ( 12.285 4.621 -7.693) 15.214 10.936 ( -4.715 -2.395 -8.036) 9.621 11.088 ( 0.055 -4.713 1.255) 4.877 13.316 ( -5.582 9.377 19.020) 21.928 13.823 ( 4.335 5.145 -0.364) 6.737 13.991 ( -8.905 -11.597 -2.176) 14.783 15.335 ( 6.877 0.630 -13.068) 14.780 15.691 ( 3.630 0.136 3.996) 5.400 15.829 ( 3.221 -4.186 0.187) 5.285 16.694 ( -6.087 8.421 9.303) 13.947 17.174 ( -23.589 6.797 -6.037) 25.280 19.256 ( 6.063 6.151 -6.866) 11.034 20.297 ( 0.039 -9.179 0.096) 9.179 20.998 ( -5.563 -0.956 -0.761) 5.696 21.910 ( -15.847 5.593 12.182) 20.756 22.654 ( 6.107 -1.008 -3.049) 6.900 22.816 ( 10.421 6.509 -7.245) 14.264 23.307 ( -3.787 0.329 0.597) 3.848 23.971 ( -6.096 -8.634 1.805) 10.723 ======================= Grid point 138 (87/156) ======================= q-point: ( 0.10 -0.10 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.298 ( -8.107 2.671 0.000) 8.536 3.382 ( -8.348 -0.934 0.000) 8.400 3.729 ( 11.342 6.136 -0.000) 12.895 3.934 ( -10.934 -6.633 0.000) 12.788 3.947 ( 9.152 14.198 0.000) 16.892 4.729 ( -1.445 14.407 0.000) 14.479 5.410 ( -1.440 -1.756 -0.000) 2.271 5.698 ( 9.737 5.182 -0.000) 11.030 6.609 ( 15.003 -4.502 -0.000) 15.664 6.763 ( 2.283 -3.645 -0.000) 4.301 7.483 ( -2.890 -1.521 0.000) 3.265 7.492 ( -13.282 -14.882 -0.000) 19.947 7.880 ( -2.424 -11.511 -0.000) 11.763 8.009 ( 8.060 -2.836 -0.000) 8.545 8.014 ( 17.061 -10.593 -0.000) 20.082 8.561 ( -14.856 9.640 0.000) 17.709 10.241 ( -14.362 -22.210 -0.000) 26.449 10.924 ( 8.746 5.018 -0.000) 10.084 11.248 ( 0.927 0.987 0.000) 1.354 11.724 ( -0.884 5.707 0.000) 5.775 12.463 ( -11.523 -12.282 -0.000) 16.841 14.025 ( 14.034 11.481 -0.000) 18.132 14.716 ( 10.423 -0.244 -0.000) 10.426 15.136 ( -24.161 -4.080 0.000) 24.503 15.655 ( 0.484 1.801 0.000) 1.865 15.664 ( -3.777 -4.392 -0.000) 5.792 16.151 ( 6.262 -0.914 -0.000) 6.328 16.957 ( 4.045 17.240 0.000) 17.708 20.074 ( 16.371 5.921 -0.000) 17.409 20.254 ( 10.652 -11.763 -0.000) 15.870 20.481 ( -12.938 10.846 0.000) 16.883 21.136 ( -11.079 2.885 0.000) 11.449 23.000 ( -4.885 -1.025 0.000) 4.991 23.186 ( 0.210 0.782 0.000) 0.809 23.324 ( -7.599 -0.884 0.000) 7.650 23.598 ( 13.870 8.603 -0.000) 16.321 ======================= Grid point 141 (88/156) ======================= q-point: ( 0.10 0.50 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.559 ( 14.061 -11.056 8.742) 19.909 2.814 ( 1.741 -19.544 7.621) 21.049 3.550 ( -5.048 1.192 -0.328) 5.198 4.060 ( 2.873 -1.622 -8.010) 8.663 4.587 ( -10.235 -20.422 16.876) 28.401 4.693 ( 10.045 -2.820 -6.428) 12.255 5.283 ( 2.442 -16.390 -0.437) 16.577 5.887 ( -1.553 3.141 -16.853) 17.214 6.039 ( -0.190 -4.346 -9.757) 10.683 6.899 ( -1.944 -16.782 -3.419) 17.237 6.940 ( 6.020 -5.923 -5.348) 9.997 7.118 ( 3.372 -3.173 0.514) 4.659 7.200 ( 4.328 3.281 0.307) 5.440 7.741 ( 4.430 -3.036 -7.093) 8.896 8.497 ( -16.112 22.925 -3.395) 28.226 9.216 ( 11.731 6.881 2.166) 13.772 9.981 ( 4.762 12.039 27.083) 30.018 10.779 ( 6.882 1.884 -11.569) 13.593 11.014 ( -2.198 -3.417 -7.355) 8.403 11.281 ( -6.388 4.819 -5.291) 9.593 12.954 ( -3.351 -1.759 32.193) 32.414 13.663 ( 15.678 -1.704 -2.796) 16.016 14.083 ( -12.110 -14.973 -9.142) 21.317 15.304 ( 4.389 0.405 8.617) 9.679 15.554 ( 2.961 -6.055 6.084) 9.080 15.898 ( -0.582 4.360 -20.704) 21.166 16.844 ( -6.846 17.793 16.633) 25.301 17.914 ( -12.842 15.050 -4.508) 20.292 19.546 ( 5.935 11.793 -10.969) 17.164 20.162 ( -1.758 -6.315 -2.452) 6.999 21.059 ( -6.195 -1.272 -0.308) 6.332 22.045 ( -11.465 6.547 14.536) 19.637 22.550 ( 11.076 -0.155 -6.758) 12.976 22.932 ( 2.576 1.996 -5.479) 6.374 23.326 ( -1.938 -2.035 2.626) 3.846 23.804 ( -0.055 -13.963 -3.851) 14.484 ======================= Grid point 142 (89/156) ======================= q-point: ( 0.10 0.70 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.994 ( 8.018 -7.545 3.691) 11.612 3.244 ( 10.775 -0.316 -0.192) 10.782 3.585 ( 1.877 1.431 6.451) 6.869 3.922 ( -2.327 3.509 -7.082) 8.239 4.463 ( -9.987 -10.701 3.242) 14.992 4.863 ( -2.101 12.683 -0.143) 12.856 5.364 ( 5.909 -3.467 -3.213) 7.567 5.645 ( -6.020 3.544 -6.408) 9.480 5.891 ( 14.696 0.591 -8.201) 16.840 6.711 ( 1.401 -21.352 -5.744) 22.155 7.311 ( 15.756 -14.360 -1.760) 21.391 7.410 ( 4.791 -1.920 6.571) 8.356 7.461 ( 3.420 -0.837 4.486) 5.703 7.829 ( 6.454 -2.223 -4.681) 8.277 8.070 ( -5.776 4.895 -3.779) 8.462 9.328 ( -13.678 -0.053 4.535) 14.410 10.627 ( 5.492 2.973 1.670) 6.465 10.683 ( -2.620 -6.188 -4.481) 8.077 11.034 ( 4.168 3.020 5.291) 7.381 11.331 ( 15.600 6.197 -2.898) 17.034 13.085 ( -16.155 -13.181 3.685) 21.173 13.579 ( -2.260 3.750 15.406) 16.016 14.256 ( 12.495 5.902 -1.966) 13.958 15.449 ( 4.865 -2.667 -16.051) 16.983 15.657 ( -1.675 -4.162 5.021) 6.733 15.832 ( 5.947 -5.975 2.682) 8.847 16.576 ( -23.863 11.250 5.015) 26.854 17.041 ( -10.082 15.434 -5.017) 19.106 19.551 ( 6.891 6.685 -3.400) 10.185 20.089 ( 1.391 -9.942 -3.260) 10.555 20.909 ( -6.402 5.982 -0.353) 8.769 21.693 ( -15.556 3.583 4.610) 16.616 22.874 ( 10.984 3.536 5.556) 12.807 23.165 ( 8.196 7.650 -5.853) 12.647 23.206 ( -4.615 -1.072 0.823) 4.809 23.642 ( -5.688 -9.216 -1.447) 10.926 ======================= Grid point 143 (90/156) ======================= q-point: ( 0.10 -0.10 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( -22.812 -13.476 0.000) 26.495 3.017 ( -16.831 -5.930 0.000) 17.845 3.777 ( -0.002 1.750 0.000) 1.750 3.879 ( -2.751 -1.285 0.000) 3.037 4.497 ( 8.847 12.405 0.000) 15.236 4.989 ( -8.871 13.427 0.000) 16.093 5.400 ( 2.351 2.362 0.000) 3.332 6.107 ( 18.383 7.919 -0.000) 20.017 6.614 ( -13.919 -13.975 -0.000) 19.724 6.769 ( 7.909 -1.379 -0.000) 8.028 7.153 ( 7.771 1.080 -0.000) 7.846 7.331 ( -19.468 -9.458 0.000) 21.644 7.395 ( -4.285 3.141 0.000) 5.313 8.076 ( 5.690 -5.408 -0.000) 7.850 8.250 ( 23.183 -6.100 -0.000) 23.972 8.659 ( -0.689 4.675 0.000) 4.725 9.324 ( -16.003 -28.987 -0.000) 33.111 11.178 ( 5.665 4.239 -0.000) 7.076 11.212 ( 4.384 -6.725 -0.000) 8.027 11.706 ( -5.542 0.018 0.000) 5.542 12.177 ( -12.665 5.455 0.000) 13.789 14.497 ( 14.132 4.260 -0.000) 14.760 14.563 ( -20.697 -6.624 0.000) 21.731 14.872 ( 3.369 2.650 -0.000) 4.286 15.444 ( -6.022 -6.048 -0.000) 8.535 15.656 ( -0.826 -0.994 -0.000) 1.293 16.313 ( 7.033 2.890 -0.000) 7.603 17.509 ( 12.072 18.138 0.000) 21.788 20.108 ( 10.857 -21.416 -0.000) 24.011 20.455 ( 9.277 0.924 -0.000) 9.323 20.672 ( -7.601 24.657 0.000) 25.802 21.073 ( 0.563 5.979 0.000) 6.006 22.889 ( -2.858 -1.519 0.000) 3.237 23.108 ( -2.002 -3.524 -0.000) 4.053 23.253 ( -3.659 1.893 0.000) 4.119 23.998 ( 7.569 7.477 -0.000) 10.639 ======================= Grid point 146 (91/156) ======================= q-point: ( 0.10 0.50 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 8.387 -16.522 11.324) 21.715 2.711 ( 17.471 -11.424 12.452) 24.306 3.534 ( -0.012 3.902 -0.443) 3.927 4.116 ( 4.858 -0.122 -7.079) 8.586 4.169 ( 2.071 -10.547 11.588) 15.805 4.800 ( 6.995 -6.140 5.471) 10.796 5.164 ( 11.054 -8.207 -4.889) 14.610 5.862 ( 1.179 -3.807 -9.909) 10.680 6.086 ( 2.894 1.615 -18.173) 18.473 6.427 ( -1.226 -10.106 -3.392) 10.731 6.956 ( 5.261 -5.622 -11.982) 14.242 7.186 ( 5.201 -6.567 4.407) 9.466 7.332 ( 3.122 4.009 -3.187) 5.998 7.734 ( 3.635 -5.752 -8.000) 10.502 8.642 ( -13.980 18.436 -3.864) 23.458 9.336 ( -2.690 -2.938 5.758) 7.002 10.337 ( 3.810 6.828 21.945) 23.297 10.742 ( -4.037 -4.506 -7.157) 9.371 11.067 ( 5.076 0.951 -8.892) 10.283 11.390 ( 1.304 9.797 -3.415) 10.457 12.877 ( -3.090 -0.273 30.818) 30.973 13.328 ( -9.388 -15.614 0.644) 18.230 14.137 ( 17.276 -0.406 -9.248) 19.599 15.394 ( 3.800 -0.932 7.662) 8.603 15.447 ( 2.055 -7.491 7.979) 11.136 15.955 ( -1.772 2.701 -22.665) 22.894 16.998 ( -17.344 18.352 18.766) 31.461 17.876 ( -19.219 15.595 -7.489) 25.859 19.725 ( -8.463 -2.281 -5.886) 10.558 20.031 ( 4.900 0.194 -8.084) 9.455 21.106 ( 3.127 10.467 0.367) 10.930 21.956 ( -12.732 5.206 7.359) 15.600 22.626 ( 4.867 -4.042 1.225) 6.444 23.181 ( 7.890 2.069 -1.741) 8.341 23.213 ( -0.973 -1.644 2.717) 3.321 23.541 ( 4.390 -11.321 -9.114) 15.183 ======================= Grid point 147 (92/156) ======================= q-point: ( 0.10 0.70 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.098 ( 10.154 -7.889 8.857) 15.614 3.389 ( 5.547 -4.061 1.549) 7.047 3.724 ( 1.314 4.954 4.981) 7.147 4.008 ( -1.165 -3.696 -4.747) 6.128 4.119 ( -0.615 3.867 -9.270) 10.063 5.071 ( -0.517 15.398 6.926) 16.892 5.560 ( 3.288 -0.290 -3.932) 5.133 5.602 ( 2.347 6.286 -6.976) 9.679 6.230 ( 14.984 1.990 -0.319) 15.119 6.540 ( 10.610 -8.300 -8.327) 15.837 7.186 ( 0.009 -14.604 5.240) 15.516 7.421 ( 10.949 -6.346 4.616) 13.470 7.602 ( 7.513 -5.103 -0.589) 9.102 7.735 ( -2.597 -6.494 1.775) 7.216 8.009 ( -9.175 4.650 -10.112) 14.424 8.993 ( -14.109 0.201 0.178) 14.111 10.224 ( -17.383 -16.210 -4.216) 24.139 10.846 ( 7.808 1.423 2.899) 8.450 11.075 ( 0.080 -6.504 2.795) 7.080 11.642 ( 6.797 0.151 3.454) 7.626 12.646 ( -8.738 2.419 -3.673) 9.783 13.746 ( 8.102 3.225 22.070) 23.731 14.595 ( 9.304 4.825 -1.019) 10.530 15.287 ( -7.676 -10.016 -12.913) 18.055 15.568 ( 0.269 -2.774 1.991) 3.425 15.829 ( 4.357 -4.186 -1.609) 6.252 16.371 ( -17.621 12.401 -0.851) 21.564 17.275 ( -2.237 17.654 -0.124) 17.795 19.637 ( 2.644 -8.702 9.027) 12.814 20.102 ( 9.415 0.460 -11.257) 14.683 21.030 ( -5.488 17.496 -0.856) 18.357 21.414 ( -12.885 -0.622 -1.832) 13.030 22.992 ( 0.079 -6.256 6.433) 8.973 23.109 ( -1.386 -1.865 2.737) 3.590 23.378 ( -1.559 0.172 1.461) 2.143 23.620 ( 10.437 9.237 -7.498) 15.826 ======================= Grid point 148 (93/156) ======================= q-point: ( 0.10 -0.10 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( -28.372 -12.143 0.000) 30.861 2.337 ( -22.454 -20.148 0.000) 30.168 3.605 ( -29.155 5.228 0.000) 29.620 3.928 ( 5.840 5.756 -0.000) 8.200 4.678 ( -1.756 -0.920 0.000) 1.982 4.742 ( -17.821 -5.153 0.000) 18.551 5.391 ( -11.898 -2.906 0.000) 12.248 6.281 ( 6.294 2.107 -0.000) 6.637 6.517 ( -5.773 -4.739 0.000) 7.469 6.927 ( 8.876 15.766 0.000) 18.093 7.094 ( 1.587 -11.473 -0.000) 11.583 7.106 ( 7.833 3.112 -0.000) 8.429 7.715 ( 8.992 10.622 0.000) 13.917 8.005 ( 2.044 -9.496 -0.000) 9.713 8.145 ( -15.579 -21.789 -0.000) 26.786 8.760 ( 26.195 6.098 -0.000) 26.895 9.016 ( 3.589 -0.004 -0.000) 3.589 11.260 ( 10.278 -3.033 -0.000) 10.716 11.289 ( -3.198 2.737 0.000) 4.209 11.544 ( -3.912 -4.623 -0.000) 6.056 12.049 ( -16.094 10.259 0.000) 19.085 13.992 ( -15.931 -12.505 0.000) 20.253 14.723 ( 8.193 -3.999 -0.000) 9.117 14.999 ( -2.294 7.158 0.000) 7.516 15.236 ( -2.223 -3.715 -0.000) 4.330 15.612 ( -3.740 2.088 0.000) 4.284 16.528 ( 7.384 2.633 -0.000) 7.840 18.118 ( 16.121 10.766 -0.000) 19.385 19.884 ( 10.668 -21.085 -0.000) 23.630 20.492 ( -0.148 -1.901 -0.000) 1.906 21.067 ( -6.257 25.333 0.000) 26.094 21.411 ( 13.301 7.928 -0.000) 15.484 22.839 ( 2.486 -2.381 -0.000) 3.442 22.993 ( -0.876 -4.781 -0.000) 4.861 23.195 ( -4.813 0.840 0.000) 4.886 24.191 ( -0.103 3.606 0.000) 3.607 ======================= Grid point 150 (94/156) ======================= q-point: ( 0.10 0.30 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 8.758 -22.825 19.767) 31.439 1.701 ( 22.439 -13.939 20.597) 33.497 2.841 ( 20.826 -17.316 41.458) 49.521 3.982 ( -4.737 2.751 -7.441) 9.240 4.173 ( 5.679 -2.015 -9.655) 11.381 4.441 ( 4.170 -8.363 1.328) 9.439 4.894 ( 4.974 -4.291 -2.746) 7.120 5.808 ( 2.060 -9.261 -5.589) 11.012 6.239 ( 18.353 -11.515 -22.229) 31.041 6.574 ( -3.954 5.640 -7.249) 10.000 6.811 ( 5.410 -7.955 -6.688) 11.716 7.236 ( -3.277 2.586 -13.132) 13.780 7.554 ( -1.900 6.169 -3.960) 7.572 7.733 ( 2.406 -5.045 -7.980) 9.743 8.936 ( 5.389 -5.336 3.410) 8.315 9.640 ( -19.636 17.990 -1.325) 26.664 10.226 ( -16.841 21.445 28.067) 39.132 10.888 ( -1.174 -0.907 -6.523) 6.689 11.084 ( 6.356 -5.634 -8.735) 12.184 11.668 ( -2.329 8.466 -2.154) 9.041 12.229 ( 0.990 -0.694 32.178) 32.201 13.214 ( -4.429 -13.629 -3.274) 14.700 13.820 ( 25.379 -14.400 -17.441) 33.994 15.130 ( 1.110 -1.927 9.657) 9.910 15.140 ( 1.602 -1.311 9.430) 9.654 16.463 ( -2.711 2.939 -16.522) 16.999 17.524 ( -33.281 35.286 32.543) 58.410 18.587 ( -10.780 9.451 -5.740) 15.443 19.913 ( -11.695 -8.418 -2.474) 14.620 20.170 ( 6.588 3.346 -11.431) 13.611 21.204 ( 6.041 10.264 2.728) 12.218 22.154 ( -8.719 6.518 7.741) 13.358 22.496 ( 6.558 -14.022 -15.988) 22.254 23.024 ( 8.558 -0.358 0.763) 8.600 23.082 ( 1.747 -6.359 1.371) 6.736 23.299 ( 12.495 -13.313 -10.739) 21.183 ======================= Grid point 151 (95/156) ======================= q-point: ( 0.10 0.50 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( 13.040 -9.239 15.800) 22.473 2.898 ( 17.777 -6.445 11.545) 22.155 3.677 ( 2.693 3.068 0.364) 4.099 4.070 ( 1.124 -4.465 -9.415) 10.481 4.329 ( 6.050 6.358 -4.565) 9.892 4.877 ( 14.103 -0.412 18.610) 23.353 5.319 ( 16.214 -5.554 -4.762) 17.788 5.929 ( 11.307 -2.917 -13.160) 17.593 6.058 ( -1.807 1.087 -9.778) 10.003 6.534 ( 5.683 7.026 -9.676) 13.240 6.907 ( 0.558 -5.274 -4.703) 7.089 7.116 ( 3.226 -4.212 5.304) 7.502 7.513 ( 4.664 4.190 -5.836) 8.565 7.589 ( -1.816 -10.547 -2.862) 11.078 8.634 ( -17.565 12.450 -3.608) 21.830 9.118 ( -6.234 -7.141 -0.794) 9.512 10.194 ( -11.639 -12.888 20.934) 27.199 10.606 ( -2.464 0.374 -5.336) 5.889 11.111 ( 0.637 -1.669 -6.950) 7.176 11.528 ( 0.035 -1.415 -2.638) 2.994 12.886 ( 0.988 8.190 11.276) 13.971 13.153 ( 3.886 0.183 15.444) 15.926 14.454 ( 15.484 -2.788 -8.005) 17.652 15.284 ( -2.681 -4.395 10.326) 11.538 15.494 ( 4.848 -0.717 4.499) 6.652 15.922 ( -3.694 -0.199 -20.720) 21.048 16.847 ( -19.757 7.256 13.604) 25.061 17.850 ( -14.054 13.999 -5.041) 20.467 19.437 ( -7.263 -4.019 2.349) 8.626 20.174 ( 5.157 0.553 -9.803) 11.091 21.367 ( -4.545 4.303 1.406) 6.415 21.798 ( -6.734 10.217 -6.695) 13.949 22.583 ( 3.264 -10.063 8.025) 13.279 23.063 ( -2.191 -4.073 2.071) 5.068 23.339 ( 2.427 0.347 2.447) 3.464 23.698 ( 13.574 3.723 -10.392) 17.496 ======================= Grid point 152 (96/156) ======================= q-point: ( 0.10 -0.30 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.891 ( -5.715 -16.267 5.630) 18.138 3.231 ( -15.081 -5.411 -7.687) 17.771 3.600 ( 2.581 -5.883 3.027) 7.101 4.015 ( 3.961 3.338 -2.623) 5.806 4.506 ( 10.242 8.176 -2.422) 13.327 5.384 ( -4.478 11.453 7.900) 14.616 5.629 ( -6.170 9.111 -5.861) 12.467 5.912 ( 17.797 6.451 -3.693) 19.287 6.527 ( -0.963 -12.624 -2.265) 12.862 6.590 ( 10.290 5.889 -0.816) 11.884 6.894 ( -0.157 -4.305 7.356) 8.524 7.339 ( 0.984 -13.092 2.417) 13.350 7.510 ( -2.103 -6.209 -3.243) 7.314 7.747 ( 7.790 -3.771 3.153) 9.211 8.017 ( -0.564 13.538 -1.455) 13.627 8.812 ( -2.007 -5.128 -10.572) 11.920 9.392 ( -24.858 -12.466 -3.491) 28.027 10.870 ( 7.677 -10.139 2.203) 12.907 11.110 ( 6.325 3.619 0.377) 7.297 11.625 ( -1.588 -5.700 7.281) 9.382 12.678 ( -9.739 12.679 -3.951) 16.469 13.921 ( 7.744 -6.051 23.527) 25.497 14.828 ( 6.445 -1.741 -1.461) 6.834 14.904 ( -11.415 -0.253 -11.051) 15.889 15.471 ( -2.962 -3.728 -2.914) 5.583 15.861 ( 3.051 0.352 -5.363) 6.180 16.353 ( -6.327 8.824 0.544) 10.871 17.617 ( 4.819 11.402 1.402) 12.458 19.458 ( 5.171 -14.307 3.963) 15.721 20.318 ( 6.399 2.198 -0.364) 6.776 21.161 ( -2.801 0.400 0.347) 2.851 21.428 ( -4.556 23.185 -8.168) 25.001 22.798 ( -1.099 -9.977 5.674) 11.531 23.002 ( -0.128 -5.615 -0.709) 5.661 23.355 ( -2.517 1.036 0.312) 2.740 24.023 ( 6.943 8.792 -0.136) 11.204 ======================= Grid point 153 (97/156) ======================= q-point: ( 0.15 -0.15 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -23.549 -16.412 0.000) 28.703 1.916 ( -29.968 -0.105 0.000) 29.968 3.850 ( -33.175 15.667 0.000) 36.688 4.012 ( 9.421 1.851 -0.000) 9.601 4.564 ( -3.536 -8.725 -0.000) 9.415 4.580 ( -21.075 -10.119 0.000) 23.378 5.394 ( -17.430 3.492 0.000) 17.777 6.379 ( 14.826 5.473 -0.000) 15.804 6.383 ( -9.194 -7.858 0.000) 12.095 6.877 ( 1.054 -8.720 -0.000) 8.783 7.115 ( 5.314 2.016 -0.000) 5.683 7.295 ( 12.692 13.590 0.000) 18.595 7.703 ( 4.388 -14.584 -0.000) 15.230 7.757 ( 13.646 -4.721 -0.000) 14.439 8.002 ( -12.578 5.994 0.000) 13.933 8.988 ( 20.081 13.525 -0.000) 24.211 9.079 ( 0.633 5.657 0.000) 5.693 11.218 ( 12.859 -1.271 -0.000) 12.922 11.307 ( -6.526 -2.978 0.000) 7.174 11.457 ( 0.015 -1.333 -0.000) 1.333 12.250 ( -16.636 7.273 0.000) 18.156 13.647 ( -12.749 -17.461 -0.000) 21.620 14.655 ( 6.691 -2.400 -0.000) 7.108 15.121 ( -6.825 3.669 0.000) 7.749 15.194 ( 2.029 0.367 -0.000) 2.062 15.727 ( -6.191 7.368 0.000) 9.624 16.565 ( 6.484 0.820 -0.000) 6.536 18.221 ( 16.367 -1.124 -0.000) 16.405 19.502 ( 10.570 -13.524 -0.000) 17.165 20.479 ( -0.380 0.703 0.000) 0.799 21.522 ( 13.310 2.200 -0.000) 13.490 21.541 ( -8.726 17.738 0.000) 19.769 22.746 ( 6.429 -5.931 -0.000) 8.746 22.888 ( 0.982 -4.573 -0.000) 4.677 23.210 ( -4.882 0.514 0.000) 4.908 24.252 ( -2.826 1.889 0.000) 3.399 ======================= Grid point 155 (98/156) ======================= q-point: ( 0.15 0.25 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.328 ( 15.594 5.711 24.196) 29.347 1.509 ( 26.707 -3.647 21.722) 34.618 2.643 ( 22.841 -1.089 49.811) 54.809 4.049 ( -0.683 2.910 -9.376) 9.841 4.120 ( 4.346 -4.005 -10.368) 11.934 4.353 ( 3.986 1.888 2.343) 4.994 4.854 ( 2.899 -0.143 -2.593) 3.892 5.771 ( 7.786 4.412 -5.754) 10.640 6.012 ( 23.491 -4.501 -16.183) 28.879 6.677 ( -1.125 -5.093 -7.887) 9.455 6.696 ( 1.026 5.365 -9.483) 10.944 7.267 ( -4.102 0.233 -14.802) 15.361 7.623 ( -1.608 -3.869 -5.467) 6.888 7.663 ( 2.328 3.403 -7.041) 8.159 8.870 ( 7.302 0.012 5.143) 8.931 9.849 ( -19.480 0.516 -5.853) 20.347 10.473 ( -38.346 -1.349 25.291) 45.955 10.891 ( -0.043 0.312 -5.674) 5.683 11.004 ( 7.883 0.233 -7.185) 10.668 11.740 ( -4.819 -2.843 -3.007) 6.352 12.227 ( 1.763 -0.215 32.599) 32.647 13.158 ( 4.923 9.652 -2.026) 11.023 13.568 ( 32.010 -6.551 -14.151) 35.606 15.096 ( -1.164 0.082 9.606) 9.677 15.143 ( 3.326 0.050 9.006) 9.600 16.493 ( -3.036 -0.056 -16.861) 17.132 17.987 ( -58.891 -1.297 27.853) 65.158 18.701 ( -9.409 0.649 -5.200) 10.770 19.870 ( -7.058 8.028 -1.968) 10.869 20.173 ( 6.939 -3.417 -10.267) 12.854 21.267 ( 2.517 -8.190 2.924) 9.053 22.215 ( 3.112 5.815 -3.754) 7.589 22.313 ( 15.963 -0.377 -9.631) 18.647 22.927 ( 1.767 -2.426 1.526) 3.367 23.058 ( 12.948 1.047 0.119) 12.991 23.187 ( 8.792 0.200 -4.257) 9.770 ======================= Grid point 156 (99/156) ======================= q-point: ( 0.15 0.45 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( 12.644 3.989 14.080) 19.340 2.811 ( 19.075 -1.812 10.764) 21.978 3.659 ( -0.402 -4.407 -0.180) 4.429 4.022 ( 2.453 0.242 -11.130) 11.400 4.491 ( 4.953 9.034 -6.466) 12.163 4.796 ( 23.252 -8.238 21.841) 32.948 5.253 ( 18.071 -0.255 -2.316) 18.221 5.890 ( 6.423 0.005 -17.994) 19.106 6.065 ( 1.221 -1.160 -7.766) 7.947 6.740 ( 5.575 11.716 -12.515) 18.027 6.890 ( 0.999 3.233 0.530) 3.425 7.031 ( 9.909 -2.998 1.881) 10.522 7.354 ( -3.539 -11.137 -1.474) 11.778 7.626 ( 3.003 6.003 -6.917) 9.638 8.814 ( -23.301 -6.792 -1.663) 24.327 8.973 ( -5.464 4.986 -3.164) 8.045 9.987 ( -15.626 -5.598 26.336) 31.130 10.657 ( -3.251 4.441 -8.691) 10.287 11.065 ( 2.818 -2.476 -7.003) 7.945 11.430 ( -2.646 -7.016 -4.860) 8.935 12.997 ( 3.485 0.142 29.744) 29.948 13.312 ( 2.041 15.585 -0.862) 15.741 14.324 ( 17.249 -9.643 -8.365) 21.459 15.246 ( -1.743 0.780 10.084) 10.263 15.505 ( 4.688 1.617 5.118) 7.127 15.912 ( -4.577 -0.675 -21.279) 21.776 16.923 ( -20.809 -0.242 15.141) 25.736 18.030 ( -14.789 2.096 -3.535) 15.349 19.432 ( -9.062 3.612 -2.952) 10.192 20.179 ( 4.535 -0.128 -6.149) 7.641 21.256 ( -3.673 -10.865 -0.648) 11.487 22.118 ( -2.498 13.630 0.060) 13.858 22.379 ( -0.174 -5.895 2.304) 6.332 22.969 ( -0.513 -4.350 -1.793) 4.733 23.345 ( 2.449 -0.062 2.677) 3.629 23.773 ( 15.318 2.921 -6.199) 16.781 ======================= Grid point 157 (100/156) ======================= q-point: ( 0.15 -0.35 -0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( -9.349 -9.466 1.438) 13.382 3.146 ( -19.002 -1.927 -9.713) 21.427 3.510 ( 9.854 -1.858 1.993) 10.224 4.094 ( 5.873 3.803 0.727) 7.035 4.597 ( 4.694 0.678 -2.625) 5.420 5.504 ( -2.373 0.125 6.383) 6.811 5.709 ( -2.096 -0.235 -6.986) 7.298 6.083 ( 15.997 3.759 0.685) 16.446 6.229 ( 3.052 -12.796 -3.752) 13.680 6.805 ( 9.181 14.708 -2.240) 17.482 6.893 ( -5.290 1.957 6.570) 8.659 7.093 ( 2.978 -7.191 6.055) 9.861 7.410 ( -8.090 -3.850 -4.659) 10.098 7.659 ( 1.735 -4.480 -1.784) 5.124 8.240 ( 1.849 -0.692 5.756) 6.085 8.705 ( 1.938 6.592 -16.051) 17.460 9.393 ( -20.419 10.181 1.638) 22.876 10.709 ( 8.876 -5.498 0.231) 10.443 11.176 ( 6.986 2.711 1.504) 7.643 11.454 ( 0.275 -10.436 3.326) 10.957 12.937 ( -12.339 11.329 -3.015) 17.021 13.754 ( -0.230 -9.335 24.997) 26.684 14.659 ( 3.323 -8.981 -12.146) 15.466 15.033 ( -1.796 6.837 -5.353) 8.867 15.443 ( -5.175 1.317 -0.125) 5.342 15.877 ( 5.641 1.090 -2.626) 6.317 16.506 ( -7.692 5.550 1.321) 9.577 17.730 ( 3.701 -1.258 1.024) 4.041 19.213 ( 1.889 -8.631 -1.130) 8.908 20.364 ( 5.030 2.310 1.592) 5.759 21.161 ( 1.799 -0.228 0.080) 1.815 21.899 ( -4.499 21.240 -5.734) 22.455 22.544 ( 0.533 -13.788 8.446) 16.178 22.875 ( 0.931 -6.517 -5.224) 8.404 23.363 ( -2.315 -0.271 0.180) 2.338 24.164 ( 5.320 4.370 2.049) 7.183 ======================= Grid point 170 (101/156) ======================= q-point: ( 0.15 0.25 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.107 ( 13.628 0.219 2.810) 13.916 3.346 ( 9.726 6.764 8.186) 14.400 3.444 ( -0.968 2.962 -9.172) 9.687 4.028 ( -8.466 -12.626 -4.781) 15.936 4.281 ( 1.275 -4.312 10.049) 11.009 4.724 ( -6.045 -7.851 -1.500) 10.021 5.414 ( 2.330 1.351 1.574) 3.120 5.865 ( -8.417 -7.584 -6.922) 13.277 6.572 ( 9.532 9.544 -10.682) 17.206 6.921 ( -2.486 -1.594 7.621) 8.174 7.255 ( -0.315 10.584 -3.240) 11.074 7.444 ( 5.739 3.724 5.741) 8.931 7.594 ( 21.377 11.406 -1.826) 24.299 8.056 ( -2.960 3.730 -4.992) 6.899 8.154 ( -9.944 7.066 -7.704) 14.427 8.799 ( -7.995 -13.646 14.431) 21.410 10.301 ( 4.872 24.282 12.843) 27.898 10.973 ( -1.371 -5.996 -3.193) 6.930 11.154 ( 3.057 -5.181 -7.544) 9.649 11.378 ( -0.815 4.829 -8.271) 9.612 12.533 ( 4.966 7.903 14.243) 17.029 13.959 ( 7.148 -13.381 -11.762) 19.196 14.270 ( -3.214 9.779 -8.215) 13.170 15.260 ( -1.125 -1.039 10.110) 10.225 15.733 ( 7.272 4.296 7.007) 10.974 16.019 ( -4.204 -5.604 1.058) 7.085 16.147 ( -5.084 3.586 1.080) 6.314 17.005 ( -10.051 -18.897 -5.138) 22.012 19.795 ( -3.348 0.355 -12.737) 13.174 20.316 ( 4.785 2.407 -0.666) 5.397 20.874 ( -5.103 -10.314 0.289) 11.510 21.124 ( -5.368 -2.679 13.483) 14.757 22.865 ( 4.358 3.316 -1.663) 5.723 23.161 ( -0.535 1.842 -0.579) 2.004 23.212 ( 0.655 -1.869 -0.212) 1.992 23.786 ( -3.736 -7.089 -1.747) 8.201 ======================= Grid point 171 (102/156) ======================= q-point: ( 0.15 -0.55 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.958 ( -9.255 10.592 -5.842) 15.231 3.342 ( -8.045 5.165 -9.459) 13.448 3.570 ( -4.296 -2.708 6.285) 8.080 3.958 ( 10.231 -10.296 2.243) 14.687 4.369 ( -4.561 -10.582 -2.676) 11.830 4.610 ( 7.478 1.425 -2.999) 8.182 5.486 ( -3.596 -2.346 -2.151) 4.803 5.802 ( 12.056 -6.839 6.960) 15.510 6.601 ( -10.516 9.067 9.668) 16.919 6.784 ( 6.923 4.284 -13.841) 16.058 7.189 ( -7.189 14.381 5.516) 16.998 7.486 ( -5.208 6.391 -1.760) 8.430 7.610 ( -12.221 4.641 -2.796) 13.368 8.003 ( 3.835 7.075 4.081) 9.023 8.402 ( 5.322 0.477 6.780) 8.633 8.730 ( 3.080 -13.724 -1.855) 14.187 10.619 ( -12.711 12.701 -12.172) 21.704 10.815 ( 3.365 3.669 5.160) 7.170 11.019 ( 4.970 -4.152 3.072) 7.168 11.375 ( 4.710 0.611 -2.350) 5.299 12.693 ( -11.210 2.431 -5.537) 12.738 13.554 ( -1.660 11.078 10.494) 15.349 14.455 ( 5.003 -5.415 -2.706) 7.854 15.295 ( -2.520 -1.250 -2.506) 3.767 15.681 ( -5.424 6.255 -6.786) 10.705 16.006 ( 4.711 -2.712 0.700) 5.481 16.308 ( -1.666 -4.343 5.190) 6.969 16.940 ( 12.796 -17.071 1.935) 21.422 19.563 ( 5.701 10.507 -2.430) 12.198 20.537 ( -8.799 -0.165 7.877) 11.811 20.754 ( 9.130 -12.074 0.529) 15.146 21.314 ( 1.557 -12.132 -1.886) 12.376 22.852 ( -5.104 5.823 -3.650) 8.560 23.010 ( 5.126 4.446 -3.538) 7.652 23.266 ( 0.372 -2.081 -2.155) 3.019 23.831 ( 0.747 -8.119 7.956) 11.392 ======================= Grid point 173 (103/156) ======================= q-point: ( 0.15 -0.15 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( 6.099 16.849 0.000) 17.919 2.598 ( 8.384 25.202 0.000) 26.560 3.799 ( 0.891 -11.308 -0.000) 11.343 4.309 ( 6.781 -3.630 -0.000) 7.691 4.413 ( -11.761 3.174 0.000) 12.182 4.994 ( -15.161 31.301 0.000) 34.779 5.738 ( -0.956 4.493 0.000) 4.594 6.130 ( 1.657 -17.908 -0.000) 17.984 6.351 ( -2.569 -6.238 -0.000) 6.746 6.743 ( -3.636 6.852 0.000) 7.757 7.064 ( -7.186 4.827 0.000) 8.657 7.333 ( -7.680 4.108 0.000) 8.710 7.396 ( 2.039 -9.758 -0.000) 9.969 7.434 ( 20.378 -11.550 -0.000) 23.424 8.312 ( 4.283 -3.061 -0.000) 5.264 9.041 ( 14.585 -5.745 -0.000) 15.676 9.418 ( 19.702 12.553 -0.000) 23.361 10.879 ( -2.522 -14.754 -0.000) 14.969 11.239 ( -10.489 0.616 0.000) 10.507 11.407 ( 2.103 -6.298 -0.000) 6.639 12.696 ( -0.507 20.327 0.000) 20.333 13.657 ( -4.758 11.031 0.000) 12.013 14.464 ( -3.460 -7.481 -0.000) 8.242 15.167 ( 3.913 -3.873 -0.000) 5.506 15.374 ( 4.171 9.766 0.000) 10.619 15.931 ( 2.842 0.467 -0.000) 2.881 16.506 ( 0.784 0.886 0.000) 1.183 17.756 ( -13.580 -13.200 0.000) 18.938 19.172 ( -0.611 -7.501 -0.000) 7.526 20.513 ( 3.166 -1.715 -0.000) 3.600 21.263 ( -4.709 -8.623 -0.000) 9.825 21.960 ( -0.809 12.343 0.000) 12.370 22.507 ( -0.223 -6.073 -0.000) 6.077 22.748 ( -2.579 -4.731 -0.000) 5.388 23.287 ( -0.955 2.971 0.000) 3.121 24.288 ( -1.841 -0.507 0.000) 1.910 ======================= Grid point 175 (104/156) ======================= q-point: ( 0.15 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.291 ( 3.519 0.511 1.452) 3.841 3.382 ( -0.575 -1.273 -0.689) 1.558 3.483 ( -1.237 -5.002 -0.006) 5.153 3.589 ( -2.431 -10.964 -2.864) 11.589 4.249 ( 3.676 1.423 3.225) 5.093 4.508 ( -1.644 -6.886 -0.586) 7.104 5.539 ( 0.931 4.753 3.677) 6.081 5.695 ( -2.123 -0.504 -1.129) 2.457 6.737 ( -5.587 6.621 5.905) 10.484 6.962 ( 4.376 -1.009 -1.791) 4.835 7.473 ( -2.891 13.043 -3.020) 13.697 7.680 ( 3.622 4.884 0.111) 6.081 7.958 ( -4.565 2.053 -3.656) 6.198 8.100 ( -6.435 7.228 -1.152) 9.746 8.257 ( 12.387 4.235 -1.453) 13.172 8.348 ( -2.228 -14.409 6.452) 15.944 10.748 ( 2.012 6.818 3.766) 8.045 10.834 ( 0.000 -3.873 0.836) 3.962 11.112 ( -2.454 3.556 -2.690) 5.090 11.403 ( 1.241 -3.832 -5.696) 6.977 12.930 ( 5.796 17.232 4.095) 18.637 13.612 ( -7.699 -12.504 -3.407) 15.075 14.538 ( 0.019 10.730 -7.090) 12.861 15.120 ( 4.251 -12.250 2.567) 13.218 15.865 ( -2.267 1.723 5.047) 5.795 15.916 ( 3.257 -1.972 2.445) 4.525 16.175 ( -2.610 6.687 0.841) 7.227 16.561 ( -0.385 -12.879 -3.169) 13.269 19.825 ( -3.205 7.317 -5.070) 9.461 20.266 ( 2.728 -14.480 3.283) 15.096 20.691 ( -4.864 8.212 1.807) 9.714 21.045 ( 4.941 -7.684 0.852) 9.175 23.035 ( 3.478 4.045 0.158) 5.337 23.136 ( -4.695 0.534 -0.604) 4.764 23.252 ( 3.426 1.427 -3.845) 5.343 23.518 ( -2.512 -9.058 3.157) 9.916 ======================= Grid point 178 (105/156) ======================= q-point: ( 0.15 -0.15 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.743 ( 14.187 10.705 -0.000) 17.772 3.176 ( 5.691 13.205 0.000) 14.379 3.590 ( 1.634 -13.456 -0.000) 13.554 4.202 ( -1.448 -11.116 -0.000) 11.209 4.291 ( -11.295 11.976 0.000) 16.463 5.076 ( -19.075 13.644 0.000) 23.452 5.557 ( -8.254 -4.762 0.000) 9.529 5.792 ( 9.900 -17.903 -0.000) 20.458 5.874 ( -14.542 -14.696 -0.000) 20.675 7.130 ( 10.173 14.725 0.000) 17.897 7.189 ( 0.473 11.597 0.000) 11.607 7.311 ( 5.302 -7.084 -0.000) 8.848 7.430 ( 9.894 -1.681 -0.000) 10.036 7.710 ( 13.955 -6.926 -0.000) 15.579 8.143 ( -0.247 -8.825 -0.000) 8.829 9.266 ( 5.621 5.048 -0.000) 7.555 10.244 ( 23.531 16.673 -0.000) 28.839 10.607 ( 2.459 -7.414 -0.000) 7.811 10.967 ( -8.143 -6.043 0.000) 10.140 11.271 ( 0.706 -8.906 -0.000) 8.934 13.093 ( -2.973 21.575 0.000) 21.779 13.860 ( 5.703 6.708 0.000) 8.805 14.119 ( -11.335 -12.383 -0.000) 16.788 15.227 ( 8.384 -2.806 -0.000) 8.841 15.671 ( 4.399 9.427 0.000) 10.403 15.887 ( -0.270 -4.598 -0.000) 4.606 16.606 ( -1.460 7.440 0.000) 7.582 17.146 ( -23.522 -8.049 0.000) 24.861 19.149 ( 7.269 -1.818 -0.000) 7.493 20.484 ( 2.287 -7.880 -0.000) 8.205 21.008 ( -9.199 -1.322 0.000) 9.293 21.911 ( -19.276 8.064 0.000) 20.894 22.646 ( 12.567 2.568 -0.000) 12.827 22.653 ( 4.346 -3.988 -0.000) 5.899 23.291 ( -2.980 1.317 0.000) 3.258 24.137 ( -7.308 -4.737 0.000) 8.709 ======================= Grid point 180 (106/156) ======================= q-point: ( 0.15 0.25 -0.65) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.265 ( -3.822 -5.993 3.530) 7.937 3.367 ( 1.732 3.662 1.094) 4.196 3.473 ( 4.766 2.811 1.209) 5.664 3.614 ( 11.266 0.251 -5.051) 12.349 4.268 ( 0.262 -4.272 1.690) 4.602 4.496 ( 6.021 1.793 0.046) 6.283 5.588 ( -3.161 0.860 -0.696) 3.349 5.624 ( -2.582 0.325 5.273) 5.881 6.734 ( -9.327 7.892 10.851) 16.340 6.927 ( 0.285 -7.159 -4.487) 8.453 7.525 ( -10.622 0.984 -6.477) 12.479 7.702 ( -3.393 -2.945 -1.774) 4.831 7.873 ( -5.983 2.777 4.763) 8.136 8.063 ( -6.734 -1.159 2.129) 7.157 8.194 ( 0.186 9.904 3.231) 10.420 8.536 ( 16.011 -9.528 -10.660) 21.466 10.751 ( -2.412 1.717 3.313) 4.444 10.848 ( 2.974 0.683 -0.232) 3.061 11.122 ( -7.406 -2.135 -3.946) 8.659 11.313 ( -1.195 0.536 3.266) 3.519 13.016 ( -12.210 -4.160 -4.518) 13.668 13.569 ( 11.358 2.457 0.965) 11.660 14.441 ( -15.201 3.211 2.767) 15.781 15.198 ( 14.785 -4.503 -5.449) 16.388 15.842 ( -2.351 -0.589 6.881) 7.296 15.929 ( 0.996 -0.496 0.369) 1.172 16.256 ( -1.063 3.530 -5.860) 6.923 16.506 ( 10.503 -0.618 2.256) 10.760 19.737 ( -11.926 0.906 3.952) 12.596 20.315 ( 15.067 1.786 -1.806) 15.280 20.716 ( -5.349 0.390 -0.667) 5.404 21.078 ( 10.531 -2.610 -2.421) 11.116 23.027 ( -5.030 0.506 1.041) 5.161 23.120 ( -7.085 -4.230 1.154) 8.332 23.184 ( 1.486 2.800 2.697) 4.162 23.587 ( 11.587 1.207 -3.774) 12.246 ======================= Grid point 183 (107/156) ======================= q-point: ( 0.15 -0.15 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.173 ( 10.311 5.467 -0.000) 11.671 3.198 ( 2.064 -10.000 -0.000) 10.211 3.527 ( -1.476 6.941 0.000) 7.096 3.899 ( -6.231 -5.967 0.000) 8.627 4.492 ( -3.679 19.065 0.000) 19.417 4.744 ( -16.987 -8.392 0.000) 18.946 5.412 ( 2.093 -4.004 -0.000) 4.518 5.505 ( -7.576 2.300 0.000) 7.918 5.860 ( 20.750 -6.924 -0.000) 21.875 7.100 ( -1.139 -18.957 -0.000) 18.991 7.414 ( 0.955 7.056 0.000) 7.120 7.514 ( 13.074 -0.827 -0.000) 13.101 7.639 ( 11.207 -15.379 -0.000) 19.030 7.701 ( 8.828 6.101 -0.000) 10.731 8.086 ( 0.498 -4.170 -0.000) 4.199 9.329 ( -13.297 5.194 0.000) 14.275 10.545 ( 3.573 2.970 -0.000) 4.646 10.763 ( -0.121 -5.521 -0.000) 5.522 11.111 ( 22.258 11.128 -0.000) 24.885 11.123 ( 1.738 -5.358 -0.000) 5.633 13.450 ( -1.552 17.665 0.000) 17.733 13.486 ( -17.597 -18.787 -0.000) 25.741 14.157 ( 11.606 4.492 -0.000) 12.445 15.353 ( 8.897 -3.622 -0.000) 9.606 15.795 ( -0.096 -3.604 -0.000) 3.606 15.908 ( 4.171 4.517 0.000) 6.148 16.482 ( -30.161 -1.481 0.000) 30.197 16.729 ( -3.514 10.163 0.000) 10.754 19.372 ( 11.223 4.280 -0.000) 12.012 20.297 ( 0.261 -10.882 -0.000) 10.885 20.828 ( -9.722 2.313 0.000) 9.993 21.660 ( -17.902 5.641 0.000) 18.769 22.828 ( 13.013 3.739 -0.000) 13.539 22.957 ( 7.978 5.401 -0.000) 9.635 23.224 ( -4.585 -0.057 0.000) 4.585 23.821 ( -9.906 -7.429 0.000) 12.382 ======================= Grid point 187 (108/156) ======================= q-point: ( 0.15 0.65 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.731 ( 6.872 4.559 1.163) 8.329 3.182 ( 0.038 -13.334 -0.908) 13.364 3.506 ( -0.022 7.774 -1.600) 7.937 3.996 ( 1.596 -7.260 -2.524) 7.850 4.570 ( 4.602 -0.935 -5.845) 7.498 5.234 ( -13.412 -13.120 12.077) 22.313 5.562 ( -6.016 -5.730 -6.226) 10.382 5.672 ( -3.236 -11.574 -4.932) 12.991 5.980 ( -6.941 -2.566 -3.304) 8.104 6.867 ( 13.793 -12.919 -9.623) 21.208 7.082 ( 3.083 1.696 4.770) 5.927 7.183 ( 9.441 4.948 4.411) 11.535 7.399 ( 0.802 -12.149 -3.198) 12.589 7.671 ( -0.595 3.670 -3.381) 5.025 8.071 ( -11.888 9.332 1.454) 15.183 9.069 ( 18.610 6.602 -1.223) 19.784 10.077 ( 15.482 15.753 7.771) 23.414 10.556 ( 0.400 0.717 -3.108) 3.214 11.060 ( -0.714 -8.252 -1.611) 8.438 11.155 ( -10.601 -2.090 -3.147) 11.254 13.361 ( 4.753 9.945 6.830) 12.967 13.692 ( 1.582 2.833 19.766) 20.031 14.270 ( -13.623 -11.630 -5.196) 18.651 15.200 ( 5.981 2.098 -16.900) 18.049 15.598 ( 4.613 1.457 4.100) 6.342 15.780 ( 1.706 -5.492 -0.536) 5.776 16.766 ( -1.225 11.958 6.438) 13.636 17.598 ( -15.382 7.459 -2.090) 17.222 19.185 ( 0.628 6.248 -5.844) 8.578 20.283 ( 1.559 -7.251 0.192) 7.419 21.083 ( -3.569 -1.865 -0.502) 4.058 22.224 ( -13.384 4.099 13.954) 19.765 22.423 ( 16.239 1.581 -4.517) 16.929 22.740 ( -3.675 1.056 -9.526) 10.265 23.371 ( -2.264 0.785 0.859) 2.545 24.043 ( -0.668 -10.261 1.296) 10.364 ======================= Grid point 188 (109/156) ======================= q-point: ( 0.15 -0.15 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.253 ( 10.825 -0.874 -0.000) 10.860 3.415 ( 5.075 2.316 -0.000) 5.579 3.639 ( -1.903 8.675 0.000) 8.881 3.840 ( 1.117 7.056 0.000) 7.144 4.199 ( -13.945 -11.712 0.000) 18.210 4.788 ( -4.277 16.774 0.000) 17.310 5.466 ( -4.174 2.186 0.000) 4.712 5.496 ( 9.828 0.877 -0.000) 9.867 6.232 ( 20.732 -2.110 -0.000) 20.839 6.700 ( 3.303 -15.433 -0.000) 15.782 7.481 ( -1.314 -2.091 -0.000) 2.469 7.614 ( 12.211 -10.614 -0.000) 16.179 7.722 ( 12.708 -5.149 -0.000) 13.711 7.868 ( -8.676 -7.442 0.000) 11.430 7.890 ( 4.995 -2.673 -0.000) 5.665 8.983 ( -22.008 1.953 0.000) 22.094 10.497 ( -9.612 -14.306 -0.000) 17.235 10.753 ( 7.118 5.419 -0.000) 8.946 11.194 ( 3.997 1.365 -0.000) 4.224 11.631 ( 10.764 5.281 -0.000) 11.990 12.741 ( -15.558 -14.839 0.000) 21.500 13.798 ( 6.369 12.171 0.000) 13.736 14.492 ( 11.350 3.945 -0.000) 12.016 15.357 ( 2.265 -11.239 -0.000) 11.465 15.715 ( -1.202 -3.799 -0.000) 3.984 15.889 ( -14.281 -2.908 0.000) 14.574 16.076 ( -7.241 11.023 0.000) 13.188 16.931 ( -1.118 15.194 0.000) 15.236 19.762 ( 13.644 7.781 -0.000) 15.707 20.095 ( 4.558 -13.705 -0.000) 14.443 20.729 ( -10.525 10.051 0.000) 14.553 21.404 ( -14.750 2.052 0.000) 14.892 23.106 ( -5.356 -0.966 0.000) 5.443 23.159 ( 2.584 2.784 0.000) 3.799 23.291 ( 15.644 9.972 -0.000) 18.551 23.484 ( -7.667 -5.888 0.000) 9.667 ======================= Grid point 192 (110/156) ======================= q-point: ( 0.15 0.65 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( 4.373 -12.906 3.073) 13.969 3.006 ( 11.128 -1.753 1.600) 11.378 3.554 ( 0.702 -0.909 5.861) 5.972 3.931 ( 1.356 -1.297 -9.741) 9.920 4.669 ( -10.275 -14.248 10.752) 20.596 4.779 ( 9.616 5.519 -5.090) 12.200 5.308 ( 0.006 -9.039 -0.775) 9.072 5.662 ( 3.579 5.534 -8.121) 10.458 5.803 ( -5.100 -0.674 -7.687) 9.250 6.729 ( -1.230 -21.497 -6.878) 22.604 7.004 ( 11.371 -16.199 -3.459) 20.092 7.218 ( 7.812 -0.678 1.313) 7.951 7.453 ( 5.903 -1.519 6.843) 9.164 7.707 ( 3.873 -2.638 -4.952) 6.818 8.192 ( -7.722 15.896 -2.941) 17.916 9.449 ( 2.758 1.883 3.315) 4.705 10.508 ( 5.028 7.614 13.078) 15.947 10.727 ( 0.531 -1.809 -4.493) 4.872 10.890 ( 8.272 0.816 -5.040) 9.721 11.122 ( 1.798 6.632 -4.574) 8.255 13.386 ( -11.763 -5.375 16.477) 20.946 13.725 ( -11.186 -5.273 9.028) 15.311 13.973 ( 14.580 3.535 -1.178) 15.049 15.346 ( 4.893 0.405 -18.306) 18.953 15.654 ( 1.899 -3.109 0.606) 3.693 15.720 ( 4.375 -6.121 3.283) 8.209 16.937 ( -10.770 15.341 12.126) 22.324 17.405 ( -23.472 14.398 -7.933) 28.656 19.428 ( 4.761 9.693 -7.672) 13.247 20.105 ( -2.066 -9.382 -0.752) 9.636 20.994 ( -2.219 1.621 -0.150) 2.752 22.017 ( -15.326 4.134 8.501) 18.006 22.668 ( 8.397 2.133 1.310) 8.762 22.955 ( 11.569 6.661 -7.591) 15.357 23.301 ( -4.012 -1.145 1.289) 4.367 23.739 ( -3.363 -13.559 -0.431) 13.977 ======================= Grid point 193 (111/156) ======================= q-point: ( 0.15 -0.15 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.255 ( -4.973 -8.323 -0.000) 9.696 3.286 ( -15.966 -7.417 0.000) 17.605 3.789 ( -1.783 -7.236 -0.000) 7.453 3.850 ( 3.621 6.197 0.000) 7.177 4.257 ( 12.937 13.854 0.000) 18.955 5.112 ( -2.994 21.948 0.000) 22.151 5.410 ( -3.144 2.139 0.000) 3.802 5.789 ( 12.931 3.393 -0.000) 13.369 6.547 ( 13.051 -1.070 -0.000) 13.095 6.675 ( 8.335 -5.312 -0.000) 9.884 7.177 ( -7.401 -14.133 -0.000) 15.954 7.534 ( -10.900 2.823 0.000) 11.260 7.632 ( -7.133 -11.020 -0.000) 13.128 7.808 ( 18.996 -5.830 -0.000) 19.870 7.921 ( 8.519 -5.544 -0.000) 10.164 8.726 ( -8.430 5.194 0.000) 9.901 9.748 ( -22.584 -24.167 -0.000) 33.077 11.024 ( 8.377 4.638 -0.000) 9.575 11.138 ( 2.593 -11.015 -0.000) 11.317 11.779 ( -0.246 -0.518 -0.000) 0.574 12.414 ( -10.121 6.692 0.000) 12.133 14.203 ( 12.854 6.275 -0.000) 14.304 14.769 ( 6.876 4.840 -0.000) 8.408 14.927 ( -13.160 -14.877 -0.000) 19.862 15.560 ( -4.839 -5.271 -0.000) 7.155 15.723 ( -5.669 3.505 0.000) 6.665 16.205 ( 1.917 5.945 0.000) 6.246 17.323 ( 5.709 17.393 0.000) 18.306 19.889 ( 8.619 -19.579 -0.000) 21.392 20.207 ( 13.351 6.310 -0.000) 14.767 20.859 ( -8.998 21.941 0.000) 23.715 21.167 ( -8.530 0.383 0.000) 8.538 22.964 ( -4.281 -2.917 0.000) 5.180 23.138 ( -0.883 -5.386 -0.000) 5.458 23.330 ( -3.622 1.348 0.000) 3.865 23.803 ( 11.268 10.879 -0.000) 15.663 ======================= Grid point 196 (112/156) ======================= q-point: ( 0.15 0.45 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( 11.565 -15.877 12.959) 23.532 2.405 ( 7.659 -18.997 15.085) 25.439 3.563 ( -2.529 -0.013 2.541) 3.585 4.005 ( 4.801 -3.123 -9.326) 10.944 4.174 ( -2.550 -17.653 18.718) 25.855 4.616 ( 9.268 -5.307 -0.503) 10.692 4.999 ( 5.013 -10.396 -0.901) 11.577 5.896 ( -3.045 -9.578 -9.562) 13.872 5.931 ( 8.891 -0.780 -19.666) 21.597 6.546 ( -8.481 -11.440 0.743) 14.260 6.844 ( 7.989 -4.651 -15.737) 18.251 7.005 ( 9.155 -6.589 -2.510) 11.556 7.326 ( -3.157 6.093 -5.033) 8.510 7.655 ( 4.276 -4.766 -9.112) 11.137 8.910 ( -10.155 13.860 -3.130) 17.465 9.343 ( 0.787 7.272 3.035) 7.919 10.304 ( -0.840 18.598 25.366) 31.464 10.789 ( 0.396 -0.406 -5.896) 5.924 10.969 ( 2.304 -1.374 -9.787) 10.148 11.422 ( -3.861 8.514 -4.882) 10.547 12.931 ( -2.110 -0.505 37.258) 37.321 13.498 ( -0.114 -14.165 0.561) 14.177 13.804 ( 8.516 -11.280 -11.492) 18.216 15.306 ( 3.567 -0.161 8.340) 9.072 15.419 ( 1.247 -6.324 7.673) 10.022 15.987 ( -1.316 3.952 -24.533) 24.884 17.328 ( -13.470 28.794 18.979) 37.023 18.233 ( -13.292 14.737 -4.321) 20.310 19.785 ( 5.070 10.318 -12.372) 16.888 20.026 ( -4.699 -6.824 -2.288) 8.596 21.079 ( -3.904 4.278 1.023) 5.882 22.192 ( -9.390 6.866 11.222) 16.163 22.503 ( 9.513 -5.507 -6.955) 13.008 22.974 ( 7.010 1.987 -3.863) 8.247 23.255 ( -1.272 -4.942 2.687) 5.767 23.463 ( 3.380 -17.810 -5.905) 19.065 ======================= Grid point 197 (113/156) ======================= q-point: ( 0.15 0.65 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( 12.037 -6.726 8.298) 16.093 3.181 ( 12.658 -5.391 3.783) 14.269 3.636 ( 5.413 3.599 5.591) 8.574 3.982 ( 2.613 0.702 -8.845) 9.250 4.253 ( -7.852 -7.977 -1.599) 11.307 5.059 ( 2.479 7.417 7.733) 10.998 5.307 ( 13.788 -2.571 -5.927) 15.227 5.689 ( -2.905 0.769 -8.617) 9.126 5.975 ( 8.894 5.029 -2.096) 10.430 6.349 ( 6.108 -11.132 -7.928) 14.969 6.994 ( 14.088 -14.520 -4.999) 20.839 7.351 ( 3.917 -3.789 4.508) 7.073 7.422 ( 3.968 -2.634 2.434) 5.348 7.714 ( 4.937 -7.800 -3.394) 9.836 8.271 ( -14.506 13.173 -4.646) 20.138 9.267 ( -10.921 -5.734 1.672) 12.448 10.499 ( -9.341 -8.173 -3.982) 13.035 10.721 ( 3.903 2.816 7.495) 8.907 11.081 ( 1.092 -0.570 3.487) 3.698 11.430 ( 11.334 3.061 -4.499) 12.572 12.856 ( -12.016 -5.913 -1.822) 13.515 13.672 ( -0.402 4.340 29.394) 29.716 14.347 ( 14.369 2.598 -3.450) 15.004 15.364 ( -0.583 -5.411 -21.654) 22.328 15.570 ( -0.095 -3.627 6.644) 7.570 15.724 ( 5.309 -4.074 -0.329) 6.700 16.831 ( -25.143 12.321 6.798) 28.813 17.400 ( -10.181 18.657 -4.671) 21.761 19.624 ( -0.507 -2.162 4.759) 5.251 19.942 ( 5.144 -1.824 -10.715) 12.025 21.116 ( -2.266 14.141 -0.137) 14.322 21.711 ( -15.632 -2.175 0.151) 15.783 22.907 ( 7.549 -2.279 9.967) 12.710 23.170 ( -3.400 -2.848 0.618) 4.478 23.329 ( 8.509 7.541 -3.335) 11.849 23.464 ( 2.218 -5.652 -5.745) 8.359 ======================= Grid point 198 (114/156) ======================= q-point: ( 0.15 -0.15 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( -26.521 -9.502 0.000) 28.171 2.732 ( -15.602 -20.116 -0.000) 25.458 3.795 ( 7.174 -0.021 -0.000) 7.174 3.956 ( -6.826 7.907 0.000) 10.446 4.659 ( 4.320 2.953 -0.000) 5.233 5.193 ( -22.641 5.266 0.000) 23.246 5.505 ( 0.528 7.174 0.000) 7.194 6.276 ( 19.772 8.432 -0.000) 21.495 6.337 ( -10.638 -11.654 -0.000) 15.779 6.804 ( 9.725 5.477 -0.000) 11.161 7.040 ( 3.590 -7.543 -0.000) 8.354 7.209 ( -14.528 -3.304 0.000) 14.899 7.523 ( 8.826 0.800 -0.000) 8.862 7.921 ( 5.756 -9.991 -0.000) 11.531 8.268 ( 20.188 11.100 -0.000) 23.038 8.503 ( -15.572 -18.976 -0.000) 24.548 8.997 ( -5.739 -0.108 0.000) 5.740 11.052 ( 9.503 -7.059 -0.000) 11.837 11.263 ( 5.248 4.014 -0.000) 6.607 11.645 ( -5.079 -5.868 -0.000) 7.761 12.377 ( -14.910 11.697 0.000) 18.951 14.306 ( -14.268 -17.298 -0.000) 22.423 14.519 ( 10.921 -0.422 -0.000) 10.929 14.993 ( 3.066 7.005 0.000) 7.646 15.330 ( -6.451 -4.378 0.000) 7.797 15.707 ( -5.060 5.320 0.000) 7.341 16.388 ( 5.360 3.993 -0.000) 6.684 17.819 ( 12.251 10.805 -0.000) 16.335 19.660 ( 10.051 -20.551 -0.000) 22.877 20.460 ( 3.992 -0.161 -0.000) 3.996 21.196 ( 6.479 5.573 -0.000) 8.546 21.210 ( -7.057 26.227 0.000) 27.159 22.820 ( -0.662 -5.549 -0.000) 5.588 23.000 ( 0.217 -6.660 -0.000) 6.664 23.285 ( -3.960 1.116 0.000) 4.114 24.153 ( 3.939 7.056 0.000) 8.081 ======================= Grid point 201 (115/156) ======================= q-point: ( 0.15 0.45 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.147 ( 12.545 -11.209 18.305) 24.861 2.499 ( 20.484 -8.447 14.629) 26.551 3.615 ( 3.027 3.061 1.518) 4.565 3.994 ( 6.005 -6.143 -1.063) 8.656 4.146 ( 10.160 3.602 1.675) 10.908 4.642 ( 8.905 -8.656 12.151) 17.374 5.015 ( 11.859 -5.685 -3.396) 13.582 5.732 ( 6.153 -4.870 -10.456) 13.073 6.077 ( 3.727 -1.977 -17.038) 17.552 6.419 ( 3.312 5.784 -8.363) 10.694 6.874 ( 2.617 -2.673 -11.652) 12.238 7.000 ( 7.813 -9.675 0.732) 12.457 7.440 ( 2.210 5.621 -7.371) 9.529 7.596 ( 0.853 -7.371 -8.109) 10.991 8.953 ( -9.689 9.807 -1.631) 13.882 9.279 ( -11.501 -0.784 0.809) 11.556 10.416 ( -11.399 0.375 24.196) 26.749 10.697 ( -5.115 0.182 -6.183) 8.027 11.043 ( 5.420 -2.755 -7.630) 9.756 11.559 ( -2.650 4.057 -5.016) 6.975 12.890 ( -1.456 2.893 25.276) 25.483 13.119 ( -0.547 -3.638 10.054) 10.706 14.070 ( 21.488 -5.898 -9.067) 24.057 15.313 ( -0.401 -4.372 9.541) 10.502 15.389 ( 4.964 -0.179 6.640) 8.292 15.996 ( -3.293 1.221 -24.643) 24.892 17.358 ( -29.111 14.221 19.262) 37.692 18.174 ( -16.359 12.754 -6.296) 21.678 19.623 ( -10.494 -4.271 -0.155) 11.331 20.073 ( 4.556 2.075 -10.804) 11.907 21.380 ( 3.730 11.770 1.893) 12.491 21.984 ( -10.698 -0.920 -4.142) 11.509 22.504 ( 4.520 -6.945 5.246) 9.807 23.096 ( -0.837 -6.079 1.735) 6.377 23.254 ( 6.504 1.055 2.159) 6.934 23.382 ( 15.610 -2.531 -10.962) 19.242 ======================= Grid point 202 (116/156) ======================= q-point: ( 0.15 0.65 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( 5.546 -11.290 10.360) 16.296 3.291 ( 7.563 -4.884 2.452) 9.331 3.708 ( -8.836 -7.660 -1.712) 11.819 3.914 ( 4.638 0.682 -4.520) 6.512 4.291 ( 8.441 8.440 -6.072) 13.392 5.386 ( 5.129 13.105 10.065) 17.302 5.554 ( 13.732 0.268 -3.782) 14.245 5.709 ( 0.503 3.862 -9.391) 10.167 6.258 ( 16.618 -3.813 0.642) 17.061 6.477 ( 6.994 3.637 -7.745) 11.051 6.916 ( 1.702 -7.794 1.825) 8.184 7.274 ( 3.306 -7.678 2.873) 8.840 7.503 ( 2.826 -4.369 -3.050) 6.031 7.627 ( 3.852 -3.206 3.491) 6.108 8.203 ( -15.198 13.326 -4.332) 20.672 8.914 ( -7.612 -9.096 -4.575) 12.712 9.923 ( -24.639 -10.910 -0.880) 26.961 10.753 ( 3.451 -8.764 8.113) 12.432 11.012 ( 2.308 0.939 -3.966) 4.684 11.578 ( 6.124 -6.360 0.901) 8.875 12.830 ( -5.089 13.454 -2.582) 14.614 13.783 ( 4.657 0.095 29.386) 29.753 14.642 ( 11.610 -1.459 -1.843) 11.845 15.118 ( -8.594 -4.994 -18.791) 21.258 15.518 ( -1.398 -1.440 2.145) 2.938 15.770 ( 5.157 -1.630 -1.627) 5.649 16.599 ( -17.033 9.271 1.880) 19.483 17.607 ( -3.907 13.127 -0.447) 13.704 19.415 ( -0.985 -10.854 3.443) 11.430 20.160 ( 8.278 3.829 -5.014) 10.408 21.272 ( -7.434 -1.453 2.002) 7.835 21.527 ( -4.994 18.763 -7.212) 20.713 22.805 ( 0.809 -11.550 8.193) 14.184 23.020 ( -1.688 -6.205 -2.002) 6.735 23.391 ( -0.785 0.859 1.135) 1.626 23.830 ( 11.779 9.833 -3.183) 15.671 ======================= Grid point 203 (117/156) ======================= q-point: ( 0.20 -0.20 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.325 ( -17.700 -15.281 0.000) 23.383 2.511 ( -27.422 -0.461 0.000) 27.426 3.789 ( 11.936 -0.126 -0.000) 11.937 4.143 ( -2.296 9.089 0.000) 9.374 4.617 ( -1.064 -6.750 -0.000) 6.834 5.201 ( -30.360 -4.538 0.000) 30.698 5.661 ( -3.534 6.975 0.000) 7.819 6.162 ( 2.317 -4.964 -0.000) 5.478 6.385 ( 9.437 0.645 -0.000) 9.459 6.883 ( -2.014 -7.894 -0.000) 8.147 7.029 ( 12.347 16.281 0.000) 20.433 7.151 ( -8.656 -2.508 0.000) 9.012 7.433 ( 16.250 -5.422 -0.000) 17.131 7.634 ( 2.134 -17.220 -0.000) 17.351 8.254 ( -9.438 -2.076 0.000) 9.663 8.647 ( 12.727 21.546 0.000) 25.024 9.112 ( -6.645 9.920 0.000) 11.940 10.942 ( 13.198 -3.799 -0.000) 13.734 11.341 ( 4.819 3.296 -0.000) 5.839 11.473 ( -2.901 -10.241 -0.000) 10.644 12.601 ( -16.604 8.876 0.000) 18.827 13.917 ( -13.115 -18.205 -0.000) 22.437 14.506 ( 7.350 -0.954 -0.000) 7.412 15.104 ( 5.323 3.265 -0.000) 6.244 15.298 ( -8.704 1.904 0.000) 8.909 15.835 ( -3.341 6.111 0.000) 6.965 16.465 ( 2.104 3.102 0.000) 3.749 17.919 ( 12.216 -1.605 -0.000) 12.321 19.308 ( 7.715 -12.478 -0.000) 14.670 20.467 ( 1.978 1.204 -0.000) 2.316 21.283 ( 9.202 2.273 -0.000) 9.479 21.709 ( -7.354 20.752 0.000) 22.016 22.656 ( 2.144 -9.825 -0.000) 10.056 22.853 ( 2.374 -6.895 -0.000) 7.292 23.297 ( -3.707 0.043 0.000) 3.708 24.268 ( 1.432 3.599 0.000) 3.873 ======================= Grid point 205 (118/156) ======================= q-point: ( 0.20 0.20 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 156 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -0.000 -0.000 28.657) 28.657 1.149 ( -0.000 -0.000 28.657) 28.657 2.413 ( -0.000 -0.000 59.681) 59.681 4.063 ( 0.000 0.000 -10.820) 10.820 4.063 ( 0.000 0.000 -10.820) 10.820 4.308 ( -0.000 -0.000 2.548) 2.548 4.841 ( 0.000 0.000 -2.684) 2.684 5.684 ( 0.000 0.000 -4.730) 4.730 5.684 ( 0.000 0.000 -4.730) 4.730 6.691 ( 0.000 0.000 -10.539) 10.539 6.691 ( 0.000 0.000 -10.539) 10.539 7.314 ( 0.000 0.000 -17.499) 17.499 7.634 ( 0.000 0.000 -5.995) 5.995 7.634 ( 0.000 0.000 -5.995) 5.995 8.784 ( -0.000 -0.000 7.552) 7.552 10.079 ( 0.000 0.000 -9.241) 9.241 10.887 ( 0.000 0.000 -4.309) 4.309 10.887 ( 0.000 0.000 -4.309) 4.309 11.020 ( -0.000 -0.000 6.979) 6.979 11.802 ( 0.000 0.000 -2.550) 2.550 12.217 ( -0.000 -0.000 33.987) 33.987 13.104 ( 0.000 0.000 -1.531) 1.531 13.104 ( 0.000 0.000 -1.531) 1.531 15.108 ( -0.000 -0.000 8.916) 8.916 15.108 ( -0.000 -0.000 8.916) 8.916 16.525 ( 0.000 0.000 -17.123) 17.123 18.800 ( 0.000 0.000 -5.458) 5.458 18.997 ( 0.000 0.000 -4.677) 4.677 19.949 ( 0.000 0.000 -1.700) 1.700 19.949 ( 0.000 0.000 -1.700) 1.700 21.227 ( -0.000 -0.000 3.743) 3.743 21.736 ( 0.000 0.000 -2.947) 2.947 22.352 ( -0.000 -0.000 7.494) 7.494 22.907 ( -0.000 -0.000 1.412) 1.412 22.907 ( -0.000 -0.000 1.412) 1.412 23.129 ( 0.000 0.000 -2.439) 2.439 ======================= Grid point 206 (119/156) ======================= q-point: ( 0.20 0.40 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( 14.526 4.447 19.137) 24.434 2.379 ( 22.520 -2.858 14.694) 27.041 3.623 ( 3.812 -2.344 6.267) 7.701 3.938 ( 5.403 0.974 -12.631) 13.772 4.225 ( 17.932 0.954 14.714) 23.215 4.503 ( 6.007 -1.393 5.894) 8.531 4.951 ( 10.574 -0.357 -1.255) 10.654 5.745 ( 6.554 5.918 -13.574) 16.194 6.005 ( 7.420 -4.934 -14.622) 17.123 6.603 ( 6.257 11.656 -9.738) 16.427 6.745 ( 10.902 -9.633 3.834) 15.045 6.909 ( 1.250 1.125 -14.990) 15.084 7.441 ( -3.240 -7.144 -6.798) 10.380 7.555 ( 3.461 5.303 -9.078) 11.069 9.023 ( -0.507 -1.373 0.733) 1.637 9.318 ( -22.191 2.354 -3.030) 22.520 10.365 ( -21.932 -4.159 26.195) 34.416 10.737 ( -3.971 3.157 -5.936) 7.808 10.983 ( 4.803 -2.478 -7.499) 9.244 11.528 ( -6.405 -5.309 -6.514) 10.566 12.954 ( 0.856 0.536 37.245) 37.259 13.233 ( 5.059 14.989 -0.465) 15.827 13.905 ( 23.207 -9.503 -8.679) 26.536 15.267 ( -0.451 -0.058 9.363) 9.374 15.397 ( 5.261 0.825 6.887) 8.706 16.005 ( -4.143 -0.288 -25.219) 25.559 17.498 ( -34.913 -1.487 17.711) 39.177 18.353 ( -15.331 2.480 -3.456) 15.910 19.635 ( -10.060 5.900 -3.239) 12.104 20.090 ( 4.041 -0.769 -7.904) 8.910 21.318 ( -2.020 -15.267 1.309) 15.456 22.157 ( 0.509 16.633 -5.879) 17.648 22.377 ( -0.068 -5.154 4.633) 6.931 22.971 ( 0.440 -4.921 -0.791) 5.003 23.262 ( 5.561 0.326 2.269) 6.015 23.400 ( 19.730 2.596 -6.662) 20.986 ======================= Grid point 207 (120/156) ======================= q-point: ( 0.20 0.60 -0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( -0.193 -4.544 6.845) 8.219 3.207 ( 10.848 -2.775 0.877) 11.232 3.555 ( -10.798 -5.222 -4.330) 12.752 3.955 ( 6.933 2.170 -1.909) 7.511 4.447 ( 7.856 6.808 -5.873) 11.940 5.436 ( 9.333 -5.496 6.722) 12.747 5.636 ( 9.660 2.158 -7.482) 12.408 5.753 ( 12.649 -1.620 4.810) 13.629 6.085 ( 8.958 -7.301 -5.108) 12.635 6.628 ( 8.742 9.261 -9.897) 16.128 6.939 ( 0.136 8.313 3.335) 8.958 7.135 ( -3.407 -4.748 2.732) 6.451 7.427 ( 5.904 -2.773 -2.939) 7.154 7.622 ( 2.941 2.518 0.572) 3.914 8.396 ( -15.972 -7.420 4.064) 18.074 8.731 ( -5.385 5.306 -9.921) 12.474 9.854 ( -22.780 4.624 3.402) 23.493 10.604 ( 1.010 -4.858 2.817) 5.706 11.044 ( 5.350 1.485 -2.169) 5.961 11.394 ( 5.059 -10.935 -1.295) 12.118 13.132 ( -6.479 14.530 -1.707) 16.000 13.744 ( 0.628 -3.570 31.405) 31.613 14.517 ( 10.701 -9.812 -4.472) 15.192 15.103 ( -4.857 2.830 -19.543) 20.335 15.524 ( -2.171 2.132 3.285) 4.478 15.758 ( 5.600 0.371 -1.104) 5.720 16.739 ( -14.947 4.036 4.127) 16.023 17.758 ( -6.477 0.285 -0.599) 6.511 19.237 ( -4.173 -5.775 -2.086) 7.424 20.234 ( 7.131 3.109 -1.057) 7.851 21.174 ( -2.697 -5.398 -0.277) 6.040 21.981 ( -3.357 22.362 -4.776) 23.111 22.538 ( 0.301 -13.794 9.960) 17.016 22.871 ( -0.621 -7.649 -6.331) 9.949 23.398 ( -0.850 -0.398 1.100) 1.446 23.993 ( 11.303 5.468 -0.293) 12.560 ======================= Grid point 225 (121/156) ======================= q-point: ( 0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.143 ( 8.091 4.180 3.565) 9.780 3.377 ( 0.214 0.099 4.338) 4.344 3.552 ( -1.587 2.157 -5.900) 6.479 3.738 ( -10.248 -12.916 -3.245) 16.804 4.218 ( -2.650 -0.907 6.774) 7.330 4.585 ( -3.885 -5.701 -0.216) 6.902 5.494 ( 2.347 5.533 2.022) 6.341 5.725 ( -1.383 -5.967 -2.429) 6.589 6.760 ( 4.306 8.569 -7.572) 12.219 6.861 ( 4.096 -4.223 10.098) 11.687 7.448 ( 7.761 7.402 -5.670) 12.132 7.571 ( 4.040 7.621 3.239) 9.214 7.817 ( 14.364 8.276 -1.971) 16.695 8.075 ( 0.996 -0.962 -1.924) 2.370 8.329 ( -9.936 9.366 -10.286) 17.095 8.482 ( -7.687 -15.846 11.949) 21.283 10.722 ( 0.480 13.995 9.836) 17.113 10.848 ( -0.395 -4.802 -3.511) 5.962 11.060 ( 5.773 -2.226 -5.384) 8.202 11.389 ( 0.447 -3.142 -1.262) 3.416 12.791 ( 6.478 14.734 7.242) 17.649 13.708 ( 1.305 -10.306 -9.702) 14.215 14.431 ( 4.520 4.891 -2.925) 7.274 15.196 ( -7.295 -3.536 5.230) 9.647 15.806 ( 5.574 2.700 6.194) 8.759 15.942 ( -3.284 -1.913 1.483) 4.080 16.231 ( -2.997 3.996 -4.302) 6.592 16.662 ( -9.373 -13.593 -2.133) 16.648 19.767 ( 8.131 -1.979 -2.938) 8.869 20.353 ( -10.742 -0.261 -1.098) 10.801 20.725 ( 2.598 -2.900 -2.963) 4.893 21.082 ( -8.793 -1.815 6.103) 10.857 22.956 ( 4.264 5.253 1.545) 6.940 23.124 ( 6.304 -2.758 -0.006) 6.881 23.217 ( -2.626 -0.089 1.553) 3.053 23.654 ( -8.544 -5.170 -3.798) 10.684 ======================= Grid point 228 (122/156) ======================= q-point: ( 0.20 -0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.532 ( 4.022 12.816 0.000) 13.433 3.067 ( 4.108 19.426 0.000) 19.856 3.535 ( 2.388 -13.251 -0.000) 13.464 4.178 ( 2.859 -8.531 -0.000) 8.997 4.500 ( -7.461 3.701 0.000) 8.328 5.438 ( -13.932 10.048 0.000) 17.177 5.641 ( 3.265 -11.552 -0.000) 12.005 5.833 ( -15.544 -9.540 0.000) 18.238 6.114 ( -6.939 -12.804 -0.000) 14.563 6.986 ( 3.357 13.507 0.000) 13.918 7.099 ( 13.422 -15.442 -0.000) 20.460 7.236 ( 8.101 -5.276 -0.000) 9.668 7.289 ( -4.711 12.845 0.000) 13.681 7.493 ( 1.973 5.393 0.000) 5.743 8.171 ( -3.464 -8.539 -0.000) 9.215 8.974 ( 20.841 -0.183 -0.000) 20.842 9.749 ( 21.661 18.298 -0.000) 28.356 10.622 ( -2.637 -8.926 -0.000) 9.308 11.208 ( -13.497 -4.008 0.000) 14.080 11.246 ( 1.495 -8.492 -0.000) 8.622 13.088 ( 4.731 17.241 0.000) 17.879 13.886 ( -8.669 10.710 0.000) 13.779 14.308 ( -6.378 -7.924 -0.000) 10.172 15.067 ( 6.650 -5.483 -0.000) 8.619 15.564 ( 5.392 7.908 0.000) 9.571 15.875 ( 1.363 -4.964 -0.000) 5.147 16.604 ( 1.913 8.093 0.000) 8.316 17.562 ( -15.396 -4.868 0.000) 16.147 19.080 ( -1.017 -1.129 -0.000) 1.520 20.434 ( 2.514 -5.907 -0.000) 6.420 21.134 ( -3.167 -4.064 -0.000) 5.152 22.202 ( 2.828 10.973 0.000) 11.331 22.416 ( -1.549 -2.764 -0.000) 3.169 22.651 ( -4.030 -4.226 -0.000) 5.840 23.342 ( -1.861 2.302 0.000) 2.960 24.228 ( -1.306 -5.404 -0.000) 5.559 ======================= Grid point 230 (123/156) ======================= q-point: ( 0.20 0.20 0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 255 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.336 ( -2.405 -4.093 4.289) 6.398 3.336 ( 2.405 4.093 4.289) 6.398 3.438 ( 0.641 -3.062 -4.470) 5.456 3.438 ( -0.641 3.062 -4.470) 5.456 4.352 ( -4.799 -6.908 0.745) 8.445 4.352 ( 4.799 6.908 0.745) 8.445 5.645 ( -0.291 -4.361 2.606) 5.089 5.645 ( 0.291 4.361 2.606) 5.089 6.880 ( 4.114 -6.283 2.607) 7.950 6.880 ( -4.114 6.283 2.607) 7.950 7.688 ( -1.102 -5.292 -3.689) 6.544 7.688 ( 1.102 5.292 -3.689) 6.544 8.046 ( -3.971 -7.056 2.144) 8.375 8.046 ( 3.971 7.056 2.144) 8.375 8.266 ( -6.983 -0.919 -1.840) 7.280 8.266 ( 6.983 0.919 -1.840) 7.280 10.789 ( -2.421 0.676 0.919) 2.676 10.789 ( 2.421 -0.676 0.919) 2.676 11.267 ( -1.286 -8.235 -1.467) 8.462 11.267 ( 1.286 8.235 -1.467) 8.462 13.297 ( -8.758 -16.343 -0.319) 18.544 13.297 ( 8.758 16.343 -0.319) 18.544 14.819 ( -8.526 -12.422 -1.979) 15.196 14.819 ( 8.526 12.422 -1.979) 15.196 15.891 ( -1.087 0.200 3.533) 3.702 15.891 ( 1.087 -0.200 3.533) 3.702 16.337 ( -0.631 -8.577 -1.483) 8.727 16.337 ( 0.631 8.577 -1.483) 8.727 20.006 ( -6.788 -8.505 0.145) 10.882 20.006 ( 6.787 8.505 0.145) 10.882 20.872 ( -1.249 -7.620 -0.145) 7.723 20.872 ( 1.249 7.620 -0.145) 7.723 23.107 ( -2.715 -2.605 0.837) 3.854 23.107 ( 2.715 2.605 0.837) 3.854 23.347 ( -7.958 -5.829 -0.846) 9.901 23.347 ( 7.958 5.829 -0.846) 9.901 ======================= Grid point 234 (124/156) ======================= q-point: ( 0.20 -0.20 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( 12.023 6.971 -0.000) 13.898 3.177 ( 0.511 -13.021 -0.000) 13.031 3.522 ( 1.671 7.649 0.000) 7.830 3.976 ( -1.389 -10.199 -0.000) 10.293 4.554 ( -1.035 11.216 0.000) 11.263 5.097 ( -16.140 -11.233 0.000) 19.665 5.436 ( -4.134 -6.547 -0.000) 7.744 5.539 ( 8.022 -5.427 -0.000) 9.685 5.726 ( -12.564 0.151 0.000) 12.565 7.032 ( 8.739 -16.630 -0.000) 18.786 7.271 ( 9.794 -0.609 -0.000) 9.813 7.384 ( 4.529 -12.650 -0.000) 13.436 7.494 ( 11.238 6.500 -0.000) 12.982 7.522 ( -4.023 6.705 0.000) 7.819 8.040 ( 2.635 -1.816 -0.000) 3.200 9.387 ( 8.261 6.138 -0.000) 10.292 10.496 ( 3.738 6.021 0.000) 7.087 10.617 ( 21.293 9.795 -0.000) 23.438 10.836 ( -8.360 -6.445 0.000) 10.556 11.103 ( 0.604 -6.186 -0.000) 6.216 13.504 ( -0.764 18.123 0.000) 18.139 13.838 ( -15.861 -15.113 0.000) 21.908 13.987 ( 3.020 5.111 0.000) 5.936 15.160 ( 9.794 -3.687 -0.000) 10.465 15.785 ( 0.993 -4.954 -0.000) 5.052 15.793 ( 6.111 1.660 -0.000) 6.332 16.796 ( -2.736 11.232 0.000) 11.561 17.101 ( -27.962 4.133 0.000) 28.266 19.189 ( 6.242 5.403 -0.000) 8.255 20.298 ( -0.119 -9.556 -0.000) 9.556 20.990 ( -5.728 -0.748 0.000) 5.776 22.041 ( -18.564 4.618 0.000) 19.129 22.621 ( 6.245 1.278 -0.000) 6.374 22.734 ( 13.814 5.539 -0.000) 14.883 23.313 ( -3.904 0.726 0.000) 3.971 23.990 ( -6.088 -9.653 -0.000) 11.413 ======================= Grid point 239 (125/156) ======================= q-point: ( 0.20 0.80 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.032 ( 8.815 -5.687 -0.000) 10.491 3.243 ( 10.247 1.164 -0.000) 10.312 3.668 ( -0.072 5.531 0.000) 5.531 3.831 ( 0.815 -0.775 -0.000) 1.124 4.495 ( -14.455 -13.572 0.000) 19.828 4.858 ( 0.067 15.607 0.000) 15.607 5.321 ( 5.542 -4.433 -0.000) 7.097 5.584 ( -6.882 3.167 0.000) 7.576 5.815 ( 17.539 3.033 -0.000) 17.799 6.652 ( 0.730 -21.968 -0.000) 21.980 7.289 ( 16.817 -16.959 -0.000) 23.883 7.451 ( 12.632 -4.119 -0.000) 13.287 7.554 ( -4.586 1.967 0.000) 4.990 7.763 ( 7.719 -0.832 -0.000) 7.764 8.034 ( -6.053 2.260 0.000) 6.461 9.370 ( -13.656 -1.308 0.000) 13.719 10.626 ( -3.443 -7.900 -0.000) 8.618 10.648 ( 2.879 6.321 0.000) 6.946 11.109 ( 3.419 3.414 -0.000) 4.831 11.288 ( 21.079 5.909 -0.000) 21.892 13.101 ( -18.904 -17.510 0.000) 25.767 13.780 ( -3.792 14.447 0.000) 14.936 14.246 ( 12.227 3.866 -0.000) 12.824 15.243 ( 7.257 -7.100 -0.000) 10.153 15.718 ( 0.829 -3.883 -0.000) 3.971 15.862 ( 5.470 -6.493 -0.000) 8.490 16.625 ( -32.669 12.525 0.000) 34.987 16.988 ( -4.110 15.194 0.000) 15.740 19.517 ( 10.008 9.083 -0.000) 13.515 20.058 ( -0.587 -12.435 -0.000) 12.449 20.906 ( -6.402 6.192 0.000) 8.907 21.737 ( -17.278 1.553 0.000) 17.348 22.969 ( 14.922 9.265 -0.000) 17.564 23.063 ( 7.129 4.257 -0.000) 8.303 23.216 ( -5.170 -0.656 0.000) 5.212 23.632 ( -6.421 -10.605 -0.000) 12.398 ======================= Grid point 244 (126/156) ======================= q-point: ( 0.20 0.60 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( 8.900 -6.147 7.934) 13.414 2.897 ( 0.031 -12.797 1.166) 12.850 3.570 ( -2.508 -1.043 2.400) 3.625 3.879 ( 3.149 -4.786 -9.361) 10.976 4.552 ( 10.769 0.664 -7.010) 12.866 4.898 ( -11.722 -17.688 11.746) 24.254 5.328 ( -1.756 -13.655 5.313) 14.757 5.620 ( 1.629 2.532 -8.373) 8.897 5.905 ( -3.694 -5.709 -4.833) 8.342 6.599 ( 10.350 -12.134 -17.442) 23.634 6.992 ( -5.730 -20.042 2.131) 20.954 7.128 ( 2.568 0.375 0.350) 2.619 7.221 ( 11.093 -2.642 1.705) 11.530 7.632 ( 4.818 -5.566 -4.023) 8.389 8.437 ( -15.716 21.550 -2.547) 26.794 9.251 ( 14.405 9.334 1.477) 17.228 10.386 ( 7.070 14.323 13.246) 20.751 10.633 ( 2.247 5.704 -1.894) 6.417 10.898 ( -3.814 -6.750 -4.562) 8.996 11.165 ( -4.970 3.627 -6.339) 8.834 13.502 ( 5.612 3.281 12.996) 14.531 13.712 ( 4.951 -1.359 14.143) 15.046 13.994 ( -13.135 -13.976 3.254) 19.454 15.256 ( 3.602 3.101 -21.202) 21.728 15.587 ( 3.641 -1.909 1.338) 4.323 15.664 ( 1.523 -5.931 0.336) 6.133 17.093 ( -5.013 20.168 9.069) 22.674 17.843 ( -15.821 15.217 -2.722) 22.119 19.362 ( 1.528 10.285 -7.376) 12.748 20.134 ( 0.175 -6.991 -0.740) 7.032 21.055 ( -5.546 -0.508 -0.165) 5.572 22.304 ( -12.034 3.490 11.023) 16.688 22.454 ( 15.882 1.276 -1.627) 16.016 22.789 ( 0.604 3.316 -9.158) 9.759 23.365 ( -2.118 -1.599 1.399) 2.999 23.768 ( 0.864 -16.239 -0.536) 16.271 ======================= Grid point 245 (127/156) ======================= q-point: ( 0.20 -0.20 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.193 ( 9.802 -5.981 -0.000) 11.482 3.405 ( 4.769 -2.987 -0.000) 5.627 3.795 ( 1.876 6.121 0.000) 6.402 3.932 ( -10.652 -13.398 -0.000) 17.117 4.026 ( 7.063 9.765 0.000) 12.052 5.142 ( -0.705 17.567 0.000) 17.581 5.507 ( -5.543 1.768 0.000) 5.818 5.532 ( 13.014 2.228 -0.000) 13.203 6.246 ( 15.226 3.653 -0.000) 15.658 6.446 ( 11.568 -8.615 -0.000) 14.424 7.223 ( 6.396 -16.917 -0.000) 18.086 7.488 ( 6.908 -7.710 -0.000) 10.352 7.592 ( 9.421 -6.875 -0.000) 11.662 7.788 ( 4.066 -6.162 -0.000) 7.382 7.868 ( -17.584 8.673 0.000) 19.607 8.993 ( -15.300 -1.649 0.000) 15.389 10.182 ( -17.960 -15.479 0.000) 23.710 10.864 ( 6.442 5.079 -0.000) 8.204 11.117 ( -0.852 -9.799 -0.000) 9.836 11.673 ( 10.947 -1.259 -0.000) 11.020 12.609 ( -9.461 2.908 0.000) 9.897 14.022 ( 3.780 9.730 0.000) 10.439 14.584 ( 11.031 4.614 -0.000) 11.957 15.078 ( -2.126 -15.394 -0.000) 15.540 15.632 ( -2.005 -3.848 -0.000) 4.339 15.797 ( 0.841 -3.808 -0.000) 3.900 16.361 ( -18.848 13.895 0.000) 23.416 17.275 ( -0.893 17.370 0.000) 17.393 19.775 ( 2.340 -16.370 -0.000) 16.537 19.940 ( 12.025 8.856 -0.000) 14.934 21.021 ( -6.433 17.844 0.000) 18.968 21.397 ( -13.464 -2.644 0.000) 13.722 23.059 ( -4.601 -3.863 0.000) 6.007 23.141 ( 0.887 -5.898 -0.000) 5.965 23.395 ( -2.500 -1.400 0.000) 2.865 23.537 ( 14.284 13.101 -0.000) 19.382 ======================= Grid point 249 (128/156) ======================= q-point: ( 0.20 0.60 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.638 ( 8.527 -9.944 7.648) 15.168 2.907 ( 13.478 -7.514 7.730) 17.259 3.544 ( 2.849 0.649 2.618) 3.923 3.897 ( 5.559 -2.617 -12.245) 13.700 4.400 ( -6.789 -10.814 8.079) 15.110 4.871 ( 14.568 3.416 -0.415) 14.969 5.136 ( 2.941 -6.724 3.801) 8.265 5.698 ( 0.374 -6.098 -6.844) 9.174 5.828 ( 7.120 4.342 -7.426) 11.167 6.339 ( -4.555 -13.297 -5.927) 15.255 6.716 ( 11.847 -10.761 -10.890) 19.358 7.225 ( 4.781 0.279 -1.137) 4.922 7.342 ( 9.084 -7.653 4.911) 12.853 7.594 ( 4.947 -7.014 -6.602) 10.829 8.576 ( -14.779 19.228 -2.760) 24.408 9.410 ( -2.739 -5.223 2.362) 6.353 10.634 ( -3.944 -0.604 -0.815) 4.073 10.697 ( -1.905 5.106 10.491) 11.822 10.947 ( 10.399 2.405 -2.163) 10.891 11.300 ( 1.386 9.364 -5.883) 11.145 13.138 ( -14.653 -13.698 0.562) 20.066 13.727 ( -4.087 2.262 34.806) 35.118 14.009 ( 18.197 -0.235 -4.276) 18.695 15.349 ( 1.439 -0.256 -22.313) 22.361 15.561 ( 0.879 -5.405 3.874) 6.708 15.620 ( 4.615 -3.148 -1.719) 5.845 17.308 ( -18.646 19.403 13.796) 30.240 17.725 ( -21.529 15.941 -8.351) 28.060 19.617 ( 1.519 7.237 -4.667) 8.744 19.920 ( -2.807 -7.640 -3.625) 8.910 21.113 ( 2.216 10.744 0.284) 10.974 22.044 ( -15.944 -2.657 2.150) 16.306 22.715 ( 10.163 1.095 7.615) 12.746 23.077 ( 12.508 4.679 -8.494) 15.827 23.254 ( -2.535 -3.263 1.487) 4.391 23.445 ( 1.031 -13.067 -1.668) 13.213 ======================= Grid point 250 (129/156) ======================= q-point: ( 0.20 -0.20 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.967 ( -6.734 -17.780 -0.000) 19.012 3.125 ( -21.488 -6.982 0.000) 22.594 3.637 ( 7.469 -6.884 -0.000) 10.157 3.985 ( 2.488 6.348 0.000) 6.819 4.485 ( 11.910 7.816 -0.000) 14.245 5.491 ( -0.899 4.969 0.000) 5.050 5.543 ( -9.263 15.094 0.000) 17.709 5.867 ( 18.847 7.079 -0.000) 20.133 6.502 ( 0.578 -12.314 -0.000) 12.328 6.586 ( 10.788 5.216 -0.000) 11.983 6.971 ( 1.418 -4.549 -0.000) 4.765 7.382 ( 5.021 -12.903 -0.000) 13.846 7.453 ( -6.951 -6.309 0.000) 9.387 7.788 ( 6.501 -7.068 -0.000) 9.603 7.998 ( 3.487 19.877 0.000) 20.180 8.695 ( -6.413 -10.884 -0.000) 12.632 9.361 ( -25.860 -8.902 0.000) 27.350 10.889 ( 5.556 -11.147 -0.000) 12.455 11.115 ( 8.191 4.084 -0.000) 9.152 11.699 ( 0.983 -7.215 -0.000) 7.282 12.642 ( -10.396 13.325 0.000) 16.901 14.309 ( 8.509 4.261 -0.000) 9.516 14.567 ( -10.673 -19.099 -0.000) 21.879 14.879 ( 7.855 4.951 -0.000) 9.285 15.471 ( -6.523 -2.598 0.000) 7.022 15.784 ( -1.194 2.629 0.000) 2.887 16.364 ( -4.834 8.507 0.000) 9.784 17.632 ( 5.472 11.256 0.000) 12.515 19.497 ( 5.271 -17.513 -0.000) 18.289 20.316 ( 9.333 4.110 -0.000) 10.198 21.165 ( -3.201 -0.236 0.000) 3.210 21.345 ( -5.824 24.457 0.000) 25.141 22.861 ( -3.088 -7.324 -0.000) 7.948 22.985 ( 1.256 -8.900 -0.000) 8.988 23.358 ( -3.012 1.001 0.000) 3.174 24.025 ( 8.528 9.909 0.000) 13.074 ======================= Grid point 253 (130/156) ======================= q-point: ( 0.20 0.40 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( 7.376 -14.890 19.963) 25.974 2.078 ( 18.599 -12.238 18.970) 29.250 3.549 ( 2.928 -1.165 19.219) 19.476 3.903 ( 1.328 -8.012 2.844) 8.605 3.958 ( 7.450 -1.277 -5.319) 9.243 4.485 ( 6.450 -6.571 3.226) 9.757 4.856 ( 3.817 -3.715 -0.184) 5.330 5.669 ( 0.312 -8.996 -8.717) 12.531 5.871 ( 13.422 -5.130 -16.611) 21.963 6.448 ( -4.773 0.301 -5.559) 7.333 6.720 ( 10.949 -7.425 -4.608) 14.008 6.910 ( 1.094 -1.957 -19.011) 19.143 7.428 ( -1.034 3.905 -8.286) 9.218 7.558 ( 2.630 -4.465 -9.636) 10.941 9.008 ( 1.390 -1.187 4.326) 4.697 9.570 ( -12.855 11.712 -5.238) 18.162 10.679 ( -12.617 15.115 18.808) 27.229 10.792 ( -3.862 1.470 -2.435) 4.797 10.931 ( 4.347 -2.598 -6.691) 8.392 11.608 ( -2.075 7.943 -4.235) 9.237 12.929 ( -1.819 0.398 36.817) 36.864 13.181 ( -5.162 -12.657 2.793) 13.952 13.592 ( 23.214 -9.960 -7.429) 26.331 15.301 ( 2.797 -0.448 7.698) 8.203 15.313 ( 0.644 -3.379 8.088) 8.789 16.052 ( -2.000 2.159 -26.324) 26.488 17.977 ( -27.534 30.623 16.254) 44.273 18.484 ( -12.613 9.119 -4.610) 16.233 19.854 ( -10.848 -5.418 -3.997) 12.768 19.972 ( 5.944 3.936 -8.188) 10.857 21.258 ( 4.847 11.946 2.813) 13.195 22.156 ( -0.722 -16.951 -9.044) 19.226 22.401 ( 2.907 2.107 7.776) 8.565 23.011 ( 10.099 1.517 -2.815) 10.593 23.106 ( 1.831 -9.489 1.335) 9.756 23.186 ( 4.910 -6.417 -2.355) 8.416 ======================= Grid point 254 (131/156) ======================= q-point: ( 0.20 0.60 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 10.983 -7.151 12.940) 18.418 3.052 ( 14.278 -6.332 4.868) 16.360 3.708 ( 6.528 2.338 2.317) 7.311 3.889 ( 1.095 -7.781 -8.618) 11.662 4.221 ( -1.461 4.183 -5.885) 7.367 5.216 ( 9.420 5.299 6.688) 12.710 5.244 ( 16.239 -1.062 5.553) 17.195 5.673 ( 5.147 -2.814 -11.039) 12.501 5.969 ( 8.643 -3.692 -0.232) 9.401 6.325 ( 7.116 5.515 -11.792) 14.836 6.786 ( 9.179 -3.722 -5.903) 11.531 7.241 ( 2.619 -6.260 5.949) 9.024 7.403 ( 4.529 0.118 -5.040) 6.777 7.537 ( 6.016 -8.151 -2.252) 10.378 8.575 ( -19.312 15.771 -2.263) 25.037 9.092 ( -8.904 -11.301 -1.407) 14.456 10.353 ( -16.349 -5.612 -1.206) 17.328 10.730 ( -1.233 -2.351 13.748) 14.002 11.017 ( -0.992 -3.891 -2.216) 4.586 11.424 ( 6.001 -3.816 -7.450) 10.299 12.906 ( -2.926 10.246 -1.519) 10.764 13.738 ( 0.036 1.749 35.305) 35.348 14.350 ( 16.605 -2.690 -2.414) 16.994 15.255 ( -4.901 -4.243 -23.116) 24.008 15.521 ( 1.131 -1.005 4.510) 4.757 15.664 ( 4.891 -1.771 -2.348) 5.707 17.047 ( -26.102 7.899 7.098) 28.180 17.771 ( -11.578 15.897 -2.954) 19.887 19.490 ( -5.880 -7.746 2.911) 10.152 19.998 ( 7.058 4.691 -7.814) 11.527 21.419 ( -4.816 6.562 3.865) 9.010 21.654 ( -8.401 4.700 -7.544) 12.230 22.758 ( 3.652 -10.677 9.268) 14.602 23.063 ( -2.106 -7.281 -2.264) 7.911 23.377 ( 2.355 0.448 1.407) 2.779 23.544 ( 15.461 8.591 -5.391) 18.491 ======================= Grid point 255 (132/156) ======================= q-point: ( 0.25 -0.25 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.625 ( -11.211 -12.542 -0.000) 16.823 3.034 ( -22.544 -1.380 0.000) 22.587 3.533 ( 12.275 -2.590 -0.000) 12.546 4.100 ( 5.415 4.708 -0.000) 7.175 4.572 ( 6.124 0.493 -0.000) 6.144 5.581 ( 5.300 3.345 -0.000) 6.267 5.621 ( -7.967 -3.965 0.000) 8.899 6.101 ( 14.653 9.027 -0.000) 17.210 6.186 ( 2.426 -17.251 -0.000) 17.421 6.778 ( 12.390 13.778 0.000) 18.530 6.960 ( -4.066 1.198 0.000) 4.239 7.172 ( 6.602 -4.502 -0.000) 7.991 7.357 ( -7.749 -3.253 0.000) 8.404 7.626 ( -1.361 -9.032 -0.000) 9.134 8.359 ( -2.917 -15.702 -0.000) 15.970 8.482 ( 2.348 25.203 0.000) 25.312 9.407 ( -20.514 10.770 0.000) 23.169 10.710 ( 8.167 -6.166 -0.000) 10.234 11.191 ( 8.502 3.223 -0.000) 9.092 11.491 ( 2.150 -12.489 -0.000) 12.672 12.909 ( -12.732 11.671 0.000) 17.272 14.176 ( -11.620 -17.783 -0.000) 21.243 14.366 ( 5.937 0.603 -0.000) 5.968 14.963 ( 8.223 3.745 -0.000) 9.035 15.473 ( -7.612 2.747 0.000) 8.093 15.836 ( 3.107 2.319 -0.000) 3.877 16.521 ( -7.870 6.093 0.000) 9.953 17.741 ( 4.437 -1.484 -0.000) 4.678 19.201 ( 2.397 -10.523 -0.000) 10.792 20.382 ( 6.269 2.575 -0.000) 6.778 21.162 ( 2.383 -0.255 -0.000) 2.397 21.840 ( -5.318 22.744 0.000) 23.358 22.656 ( -1.900 -12.404 -0.000) 12.549 22.794 ( 3.241 -8.897 -0.000) 9.469 23.365 ( -2.843 -0.375 0.000) 2.868 24.187 ( 6.569 5.249 -0.000) 8.409 ======================= Grid point 258 (133/156) ======================= q-point: ( 0.25 0.35 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( 10.715 3.122 23.570) 26.079 1.916 ( 20.379 -2.734 20.465) 29.011 3.525 ( 4.105 -0.621 32.937) 33.198 3.842 ( 2.844 1.806 -12.409) 12.858 3.936 ( 10.186 -1.680 -0.761) 10.352 4.404 ( 3.790 0.166 2.829) 4.732 4.824 ( 2.165 0.002 0.511) 2.225 5.622 ( 5.075 4.838 -9.461) 11.776 5.750 ( 14.637 -4.757 -12.087) 19.570 6.523 ( 1.544 6.621 -7.389) 10.041 6.571 ( 5.614 -6.368 -3.933) 9.356 6.899 ( 0.001 0.225 -23.023) 23.024 7.476 ( -0.454 -3.356 -9.021) 9.636 7.498 ( 1.928 3.082 -9.547) 10.216 8.983 ( 3.109 0.002 6.728) 7.412 9.709 ( -14.448 0.305 -8.704) 16.870 10.805 ( -2.674 1.634 -1.968) 3.700 10.853 ( -13.405 -3.441 9.106) 16.566 10.901 ( -6.296 1.487 2.320) 6.872 11.664 ( -5.991 -2.433 -4.919) 8.125 12.952 ( -0.479 0.100 40.634) 40.637 13.130 ( 4.274 9.765 -0.237) 10.662 13.397 ( 24.035 -7.603 -4.558) 25.617 15.270 ( -0.015 -0.167 8.093) 8.095 15.305 ( 3.276 0.265 7.433) 8.127 16.074 ( -2.369 -0.041 -26.862) 26.966 18.322 ( -41.599 -2.096 9.413) 42.702 18.620 ( -9.752 1.987 -2.795) 10.337 19.825 ( -7.710 5.041 -2.697) 9.598 20.003 ( 4.876 -2.158 -7.033) 8.826 21.333 ( 0.587 -9.317 3.937) 10.131 21.957 ( 18.960 8.665 -11.784) 23.946 22.436 ( -5.278 -1.111 9.402) 10.839 22.951 ( 1.268 -4.008 0.660) 4.256 23.051 ( 11.459 2.727 -1.208) 11.841 23.136 ( 5.963 0.327 -1.261) 6.104 ======================= Grid point 259 (134/156) ======================= q-point: ( 0.25 0.55 -0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( 7.934 0.148 12.744) 15.013 2.941 ( 14.615 -4.041 2.945) 15.447 3.661 ( 0.691 -5.857 -0.083) 5.898 3.822 ( 6.184 1.721 -8.484) 10.639 4.356 ( 0.401 8.206 -6.621) 10.551 5.114 ( 18.478 -8.132 3.585) 20.504 5.354 ( 16.009 1.685 19.392) 25.203 5.598 ( 4.623 -1.502 -11.063) 12.084 5.934 ( 5.794 0.009 -6.321) 8.575 6.440 ( 8.891 5.357 -17.568) 20.405 6.875 ( 6.449 11.393 -0.770) 13.114 7.117 ( 8.997 -5.308 4.982) 11.573 7.292 ( 2.057 -8.983 -4.578) 10.290 7.520 ( 6.311 4.851 -3.503) 8.697 8.781 ( -18.087 -14.361 -1.630) 23.153 8.928 ( -13.477 14.240 -1.343) 19.652 10.294 ( -19.192 0.659 4.140) 19.645 10.656 ( -5.394 -3.368 9.774) 11.661 10.959 ( 3.554 -2.229 -4.042) 5.825 11.301 ( 1.823 -7.206 -7.843) 10.806 13.207 ( -0.886 16.929 -0.795) 16.971 13.736 ( 0.364 -1.917 34.724) 34.779 14.229 ( 16.702 -8.965 -0.216) 18.957 15.212 ( -5.242 0.234 -23.217) 23.803 15.529 ( 1.431 1.726 2.684) 3.498 15.647 ( 5.150 0.059 -1.994) 5.523 17.139 ( -24.160 0.920 7.387) 25.281 17.983 ( -14.509 2.708 -1.410) 14.827 19.373 ( -8.547 -3.005 -2.751) 9.468 20.089 ( 6.517 3.738 -3.136) 8.141 21.254 ( -4.654 -12.630 0.279) 13.463 22.033 ( -1.317 22.689 -5.100) 23.292 22.530 ( 0.213 -10.715 9.911) 14.598 22.895 ( -1.404 -8.199 -5.707) 10.088 23.387 ( 2.248 -0.034 1.538) 2.724 23.699 ( 16.944 5.722 -1.949) 17.990 ======================= Grid point 285 (135/156) ======================= q-point: ( 0.25 -0.25 0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( 4.361 7.480 0.000) 8.658 3.172 ( -0.409 -12.651 -0.000) 12.657 3.478 ( 1.675 10.731 0.000) 10.861 3.976 ( 1.016 -10.614 -0.000) 10.662 4.510 ( 4.769 -2.631 -0.000) 5.446 5.365 ( -9.351 -14.615 -0.000) 17.351 5.476 ( -2.692 -2.929 -0.000) 3.978 5.647 ( -13.629 -8.545 0.000) 16.087 5.951 ( -6.866 -3.673 0.000) 7.786 6.750 ( 15.644 -17.664 -0.000) 23.596 7.132 ( 3.510 -0.213 -0.000) 3.516 7.241 ( 12.647 4.785 -0.000) 13.522 7.354 ( -0.792 -10.483 -0.000) 10.512 7.635 ( -2.813 6.301 0.000) 6.900 8.090 ( -11.394 5.352 0.000) 12.588 9.055 ( 21.393 8.065 -0.000) 22.862 10.133 ( 18.227 18.050 -0.000) 25.652 10.548 ( -2.631 1.986 0.000) 3.297 11.038 ( -4.235 -9.824 -0.000) 10.698 11.128 ( -8.193 -4.340 0.000) 9.271 13.391 ( 10.875 11.661 0.000) 15.945 14.089 ( -11.483 8.874 0.000) 14.512 14.118 ( -10.724 -11.028 -0.000) 15.383 14.956 ( 9.649 -4.883 -0.000) 10.814 15.672 ( 5.265 2.134 -0.000) 5.680 15.760 ( 1.318 -5.742 -0.000) 5.892 16.828 ( 0.079 13.680 0.000) 13.680 17.578 ( -16.804 6.587 0.000) 18.049 19.126 ( -0.438 5.408 0.000) 5.426 20.286 ( 1.648 -7.855 -0.000) 8.026 21.078 ( -3.610 -1.832 0.000) 4.048 22.377 ( 13.173 0.623 -0.000) 13.188 22.418 ( -10.078 7.931 0.000) 12.825 22.589 ( -3.045 -1.463 0.000) 3.379 23.379 ( -2.388 1.141 0.000) 2.647 24.058 ( -0.214 -11.223 -0.000) 11.225 ======================= Grid point 290 (136/156) ======================= q-point: (-0.75 -0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.907 ( 3.488 -11.560 -0.000) 12.075 3.019 ( 10.809 1.520 -0.000) 10.915 3.646 ( 1.790 2.720 0.000) 3.256 3.800 ( 1.917 -6.523 -0.000) 6.799 4.720 ( 11.606 5.951 -0.000) 13.043 4.781 ( -12.696 -16.475 -0.000) 20.799 5.302 ( -2.341 -6.324 -0.000) 6.743 5.583 ( 4.416 8.302 0.000) 9.403 5.731 ( -7.049 -1.919 0.000) 7.306 6.646 ( 3.686 -20.021 -0.000) 20.357 6.972 ( 9.755 -20.635 -0.000) 22.825 7.232 ( 7.930 -1.995 -0.000) 8.177 7.553 ( 12.915 -1.827 -0.000) 13.043 7.632 ( -1.514 -2.864 -0.000) 3.240 8.161 ( -8.105 15.202 0.000) 17.228 9.481 ( 3.591 1.743 -0.000) 3.992 10.631 ( -0.918 7.624 0.000) 7.679 10.705 ( -5.700 -5.874 -0.000) 8.185 10.834 ( 21.164 9.278 -0.000) 23.108 11.068 ( 0.647 3.414 0.000) 3.475 13.493 ( -18.323 -17.945 0.000) 25.647 13.834 ( 5.938 13.188 0.000) 14.463 14.068 ( -1.440 3.379 0.000) 3.673 15.075 ( 8.966 -4.607 -0.000) 10.080 15.687 ( 1.940 -4.536 -0.000) 4.934 15.749 ( 5.180 -4.840 -0.000) 7.089 17.088 ( -5.131 17.312 0.000) 18.056 17.294 ( -30.642 13.100 0.000) 33.325 19.353 ( 5.728 9.816 0.000) 11.365 20.097 ( -2.566 -9.935 -0.000) 10.261 20.992 ( -2.345 1.909 0.000) 3.024 22.101 ( -17.428 0.967 0.000) 17.455 22.707 ( 9.536 6.716 -0.000) 11.664 22.851 ( 13.442 5.179 -0.000) 14.405 23.313 ( -4.055 -0.911 0.000) 4.156 23.738 ( -3.546 -14.478 -0.000) 14.905 ======================= Grid point 296 (137/156) ======================= q-point: ( 0.25 0.75 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.941 ( 12.742 -3.930 -0.000) 13.334 3.216 ( 11.131 -3.817 -0.000) 11.767 3.737 ( 4.063 1.299 -0.000) 4.265 3.848 ( 7.084 1.275 -0.000) 7.198 4.233 ( -13.251 -10.607 0.000) 16.973 5.136 ( 4.632 12.267 0.000) 13.112 5.242 ( 11.576 -3.012 -0.000) 11.961 5.603 ( -2.878 -1.204 0.000) 3.120 5.966 ( 11.150 9.914 -0.000) 14.920 6.263 ( 4.705 -14.667 -0.000) 15.403 6.941 ( 16.939 -15.682 -0.000) 23.084 7.369 ( 10.311 -3.325 -0.000) 10.834 7.483 ( -2.215 -6.850 -0.000) 7.199 7.674 ( 8.212 -7.098 -0.000) 10.855 8.222 ( -16.348 14.075 0.000) 21.572 9.281 ( -11.353 -7.156 0.000) 13.420 10.460 ( -9.398 -7.560 0.000) 12.061 10.777 ( 1.806 5.681 0.000) 5.962 11.166 ( -3.093 -0.777 0.000) 3.190 11.354 ( 18.438 0.511 -0.000) 18.445 12.834 ( -12.825 -6.157 0.000) 14.226 14.046 ( -5.353 10.805 0.000) 12.058 14.315 ( 14.951 3.211 -0.000) 15.292 15.059 ( 3.194 -10.654 -0.000) 11.122 15.641 ( 1.002 -3.290 -0.000) 3.439 15.728 ( 4.489 -5.531 -0.000) 7.124 16.900 ( -31.013 12.696 0.000) 33.511 17.351 ( -6.136 19.334 0.000) 20.284 19.720 ( 9.106 10.043 0.000) 13.556 19.787 ( -3.124 -13.438 -0.000) 13.796 21.115 ( -2.401 14.417 0.000) 14.616 21.711 ( -16.553 -4.475 0.000) 17.147 23.083 ( 5.194 -4.366 -0.000) 6.785 23.111 ( 3.868 -0.546 -0.000) 3.907 23.261 ( 7.696 9.109 0.000) 11.925 23.431 ( -0.965 -6.489 -0.000) 6.560 ======================= Grid point 301 (138/156) ======================= q-point: ( 0.25 0.55 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( 5.048 -12.499 10.017) 16.795 2.656 ( 8.956 -11.724 10.320) 18.004 3.533 ( -1.841 -1.473 -2.074) 3.140 3.771 ( 5.908 -5.431 -12.356) 14.733 4.552 ( -6.351 -13.567 12.337) 19.406 4.588 ( 10.017 0.135 -2.089) 10.233 5.093 ( 1.542 -8.383 11.885) 14.625 5.654 ( 8.011 0.015 -7.081) 10.692 5.732 ( -2.355 -10.905 -6.893) 13.114 6.399 ( 3.480 -6.775 -21.593) 22.897 6.610 ( -5.650 -14.511 -1.143) 15.614 7.014 ( 16.991 -10.884 1.627) 20.244 7.227 ( -1.518 2.533 -4.390) 5.291 7.503 ( 4.644 -6.114 -6.165) 9.847 8.858 ( -11.802 17.590 -2.103) 21.286 9.390 ( 4.193 3.696 1.783) 5.867 10.665 ( 1.449 10.169 6.323) 12.061 10.763 ( -2.580 8.227 8.476) 12.091 10.813 ( -0.800 -0.743 -5.705) 5.808 11.306 ( -1.621 9.479 -7.014) 11.902 13.415 ( -8.830 -13.461 5.261) 16.936 13.620 ( 16.118 -5.847 -3.709) 17.542 13.818 ( -4.115 -1.822 34.865) 35.154 15.319 ( 1.221 2.789 -20.135) 20.364 15.528 ( 2.879 -4.640 2.992) 6.227 15.552 ( 1.005 -3.355 -6.885) 7.724 17.598 ( -10.336 28.171 9.325) 31.423 18.171 ( -17.218 15.062 -2.116) 22.974 19.581 ( 1.481 10.285 -7.999) 13.114 19.997 ( -2.535 -6.328 -0.926) 6.880 21.095 ( -3.725 5.459 0.617) 6.638 22.306 ( -4.026 -5.897 -1.044) 7.216 22.499 ( 8.537 3.796 8.254) 12.467 22.860 ( 4.918 3.256 -7.715) 9.711 23.295 ( -1.090 -5.419 1.375) 5.696 23.405 ( 3.008 -17.143 -1.075) 17.438 ======================= Grid point 302 (139/156) ======================= q-point: ( 0.25 -0.25 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.000 ( 3.391 -11.688 -0.000) 12.170 3.314 ( 6.760 -5.228 -0.000) 8.545 3.658 ( -12.201 -11.647 0.000) 16.868 3.891 ( 6.130 3.398 -0.000) 7.009 4.227 ( 11.142 8.871 -0.000) 14.242 5.489 ( 14.400 10.384 -0.000) 17.754 5.537 ( -2.669 0.894 0.000) 2.815 5.590 ( 6.905 8.275 0.000) 10.777 6.298 ( 15.095 -8.899 -0.000) 17.523 6.367 ( 10.400 7.074 -0.000) 12.578 6.930 ( 5.815 -7.853 -0.000) 9.771 7.306 ( 1.101 -8.658 -0.000) 8.727 7.463 ( 5.194 -5.172 -0.000) 7.330 7.673 ( 5.124 -4.248 -0.000) 6.656 8.157 ( -16.337 18.056 0.000) 24.349 8.866 ( -9.911 -12.172 -0.000) 15.697 9.909 ( -24.949 -8.994 0.000) 26.521 10.857 ( -3.290 -12.862 -0.000) 13.276 10.957 ( 6.385 3.842 -0.000) 7.452 11.582 ( 10.196 -7.375 -0.000) 12.584 12.805 ( -5.594 13.881 0.000) 14.966 14.196 ( 2.256 6.598 0.000) 6.973 14.673 ( 11.802 4.140 -0.000) 12.507 14.738 ( -5.797 -17.163 -0.000) 18.116 15.574 ( -3.064 -1.312 0.000) 3.334 15.745 ( 4.150 -1.291 -0.000) 4.346 16.616 ( -18.932 10.382 0.000) 21.592 17.604 ( -2.853 13.105 0.000) 13.412 19.452 ( -0.862 -14.232 -0.000) 14.258 20.107 ( 10.219 7.021 -0.000) 12.399 21.302 ( -9.548 -6.125 0.000) 11.343 21.446 ( -3.863 22.750 0.000) 23.076 22.937 ( -3.881 -8.136 -0.000) 9.014 22.948 ( 2.380 -11.160 -0.000) 11.411 23.402 ( -1.060 0.915 0.000) 1.400 23.800 ( 13.137 11.668 -0.000) 17.571 ======================= Grid point 306 (140/156) ======================= q-point: ( 0.25 0.55 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.466 ( 11.296 -6.260 13.735) 18.853 2.733 ( 16.136 -8.255 9.605) 20.513 3.577 ( 4.999 2.154 -2.514) 5.996 3.805 ( 6.196 -6.544 -12.083) 15.074 4.275 ( -2.675 -0.216 4.510) 5.248 4.875 ( 17.296 -3.908 2.349) 17.887 5.071 ( 5.630 0.421 16.239) 17.193 5.539 ( 4.810 -6.721 -8.631) 11.950 5.841 ( 7.899 -2.165 -5.997) 10.151 6.237 ( -0.157 1.528 -12.598) 12.692 6.589 ( 9.184 -1.008 -12.965) 15.920 7.084 ( 13.095 -12.049 5.211) 18.542 7.310 ( 3.885 3.324 -5.180) 7.279 7.443 ( 2.424 -7.202 -7.339) 10.565 8.935 ( -13.736 14.430 -0.434) 19.927 9.273 ( -8.906 -6.782 -0.852) 11.227 10.607 ( -8.948 -0.416 -2.413) 9.277 10.810 ( -6.494 3.792 13.192) 15.185 10.951 ( 6.087 -2.119 0.662) 6.479 11.428 ( -4.638 1.259 -8.413) 9.689 12.979 ( -4.735 0.926 -0.856) 4.900 13.752 ( 0.187 -0.672 35.279) 35.286 13.970 ( 18.892 -3.198 2.317) 19.300 15.331 ( -2.648 -1.377 -22.535) 22.732 15.480 ( 2.493 -1.885 4.910) 5.821 15.572 ( 3.917 -1.642 -6.677) 7.914 17.649 ( -30.652 11.052 11.235) 34.466 18.061 ( -15.869 16.419 -5.388) 23.461 19.639 ( -7.997 -4.376 1.966) 9.325 19.881 ( 3.838 3.887 -8.739) 10.306 21.425 ( 3.973 16.761 2.419) 17.394 21.875 ( -11.329 -12.274 -5.457) 17.572 22.660 ( 5.498 -5.851 9.179) 12.195 23.081 ( 2.195 -5.765 -4.492) 7.631 23.229 ( 12.486 2.777 -3.029) 13.145 23.293 ( 5.562 -1.467 0.924) 5.826 ======================= Grid point 307 (141/156) ======================= q-point: ( 0.30 -0.30 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.781 ( -3.673 -7.599 -0.000) 8.440 3.214 ( 10.827 -3.826 -0.000) 11.483 3.494 ( -13.207 -3.973 0.000) 13.792 3.944 ( 9.165 1.960 -0.000) 9.373 4.387 ( 9.681 6.817 -0.000) 11.841 5.493 ( 16.404 -3.597 -0.000) 16.794 5.531 ( 0.326 -1.655 -0.000) 1.687 5.899 ( 6.499 12.509 0.000) 14.096 5.997 ( 13.442 -18.346 -0.000) 22.744 6.507 ( 13.913 7.328 -0.000) 15.725 6.974 ( 2.050 9.688 0.000) 9.902 7.164 ( -2.097 -4.327 -0.000) 4.808 7.386 ( 4.513 -2.395 -0.000) 5.109 7.633 ( 3.072 0.401 -0.000) 3.098 8.485 ( -10.462 -22.500 -0.000) 24.813 8.585 ( -12.157 22.730 0.000) 25.777 9.874 ( -23.065 5.930 0.000) 23.815 10.646 ( -2.637 -7.230 -0.000) 7.696 11.022 ( 7.200 2.435 -0.000) 7.600 11.378 ( 8.305 -11.994 -0.000) 14.588 13.114 ( -6.958 15.010 0.000) 16.545 14.254 ( 5.763 -1.872 -0.000) 6.060 14.387 ( -8.680 -16.345 -0.000) 18.507 14.780 ( 8.713 6.850 -0.000) 11.083 15.588 ( -3.076 2.588 0.000) 4.020 15.739 ( 5.530 0.542 -0.000) 5.556 16.777 ( -16.682 5.070 0.000) 17.436 17.754 ( -5.811 0.031 0.000) 5.811 19.215 ( -3.752 -8.147 -0.000) 8.969 20.224 ( 8.358 4.312 -0.000) 9.405 21.172 ( -2.822 -5.792 -0.000) 6.443 21.931 ( -3.500 23.418 0.000) 23.678 22.719 ( -3.766 -12.869 -0.000) 13.408 22.726 ( 3.163 -9.469 -0.000) 9.983 23.409 ( -1.176 -0.494 0.000) 1.275 23.993 ( 12.273 6.493 -0.000) 13.885 ======================= Grid point 310 (142/156) ======================= q-point: ( 0.30 0.30 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 131 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( -0.000 -0.000 25.625) 25.625 1.672 ( -0.000 -0.000 25.625) 25.625 3.489 ( -0.000 -0.000 51.325) 51.325 3.817 ( 0.000 0.000 -14.352) 14.352 3.817 ( 0.000 0.000 -14.352) 14.352 4.361 ( -0.000 -0.000 2.858) 2.858 4.815 ( -0.000 -0.000 1.139) 1.139 5.563 ( 0.000 0.000 -7.721) 7.721 5.563 ( 0.000 0.000 -7.721) 7.721 6.513 ( 0.000 0.000 -7.536) 7.536 6.513 ( 0.000 0.000 -7.536) 7.536 6.901 ( 0.000 0.000 -25.568) 25.568 7.477 ( 0.000 0.000 -9.427) 9.427 7.477 ( 0.000 0.000 -9.427) 9.427 8.943 ( -0.000 -0.000 9.068) 9.068 9.868 ( 0.000 0.000 -12.472) 12.472 10.831 ( 0.000 0.000 -1.536) 1.536 10.831 ( 0.000 0.000 -1.536) 1.536 11.174 ( -0.000 -0.000 8.803) 8.803 11.739 ( 0.000 0.000 -4.068) 4.068 12.969 ( -0.000 -0.000 43.433) 43.433 13.082 ( 0.000 0.000 -0.764) 0.764 13.082 ( 0.000 0.000 -0.764) 0.764 15.270 ( -0.000 -0.000 7.541) 7.541 15.270 ( -0.000 -0.000 7.541) 7.541 16.099 ( 0.000 0.000 -27.349) 27.349 18.712 ( 0.000 0.000 -3.330) 3.330 18.897 ( 0.000 0.000 -5.561) 5.561 19.915 ( 0.000 0.000 -1.669) 1.669 19.915 ( 0.000 0.000 -1.669) 1.669 21.307 ( -0.000 -0.000 4.510) 4.510 21.669 ( 0.000 0.000 -4.010) 4.010 22.512 ( -0.000 -0.000 8.930) 8.930 22.934 ( -0.000 -0.000 1.356) 1.356 22.934 ( -0.000 -0.000 1.356) 1.356 23.067 ( 0.000 0.000 -4.061) 4.061 ======================= Grid point 311 (143/156) ======================= q-point: ( 0.30 0.50 -0.30) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 502 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( 11.037 1.859 16.259) 19.739 2.607 ( 17.327 -3.117 8.387) 19.501 3.601 ( 3.506 -2.342 -4.285) 6.012 3.691 ( 6.211 -0.435 -11.730) 13.280 4.371 ( -0.186 8.245 0.757) 8.282 4.740 ( 16.918 -8.432 7.503) 20.338 5.080 ( 9.173 -0.111 20.093) 22.088 5.510 ( 3.643 4.216 -8.340) 10.030 5.790 ( 9.516 -2.600 -7.711) 12.521 6.304 ( 3.259 3.993 -22.566) 23.147 6.695 ( 9.997 11.475 -5.435) 16.161 6.823 ( 16.123 -12.452 3.590) 20.686 7.308 ( -1.115 -5.594 -6.191) 8.418 7.401 ( 4.643 4.961 -6.170) 9.178 9.045 ( -7.812 -5.553 1.406) 9.687 9.261 ( -16.043 7.080 -2.756) 17.751 10.619 ( -11.437 1.573 -1.321) 11.620 10.832 ( -12.573 -2.204 17.087) 21.329 10.876 ( 3.742 -3.968 -2.945) 6.199 11.371 ( -7.733 -4.460 -9.875) 13.312 13.181 ( 2.944 16.401 -0.645) 16.676 13.673 ( 10.372 -7.132 15.843) 20.235 13.896 ( 10.432 -3.602 23.646) 26.095 15.309 ( -3.933 -0.405 -19.435) 19.833 15.479 ( 3.133 1.464 1.653) 3.833 15.550 ( 3.958 -0.517 -7.903) 8.854 17.734 ( -32.707 -2.087 7.415) 33.602 18.312 ( -16.063 4.422 -0.925) 16.686 19.570 ( -10.072 -1.100 -3.044) 10.579 19.975 ( 4.334 3.956 -3.941) 7.068 21.350 ( -4.202 -18.682 1.713) 19.225 22.004 ( 5.299 21.491 -6.752) 23.142 22.543 ( -1.795 -5.056 9.258) 10.700 22.919 ( -0.750 -7.971 -4.422) 9.146 23.295 ( 7.266 1.113 1.169) 7.444 23.324 ( 17.332 4.332 -1.814) 17.957 ======================= Grid point 343 (144/156) ======================= q-point: (-0.70 -0.30 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( 6.646 0.524 -0.000) 6.666 2.879 ( -0.870 -14.070 -0.000) 14.097 3.615 ( 0.535 0.695 0.000) 0.877 3.763 ( 1.535 -9.479 -0.000) 9.603 4.476 ( 10.764 1.469 -0.000) 10.864 4.998 ( -8.066 -18.579 -0.000) 20.255 5.386 ( -5.580 -7.820 -0.000) 9.607 5.590 ( -4.161 3.731 0.000) 5.589 5.857 ( -3.614 -6.755 -0.000) 7.661 6.386 ( 15.860 -17.122 -0.000) 23.339 7.009 ( -8.581 -20.160 -0.000) 21.911 7.133 ( 3.203 0.451 -0.000) 3.235 7.243 ( 14.946 -4.735 -0.000) 15.678 7.592 ( 4.665 -7.049 -0.000) 8.453 8.411 ( -15.689 20.908 0.000) 26.140 9.267 ( 15.160 10.483 -0.000) 18.431 10.467 ( 13.140 13.668 0.000) 18.960 10.686 ( -4.204 10.501 0.000) 11.311 10.848 ( -6.284 -7.895 -0.000) 10.091 11.085 ( -2.845 1.259 0.000) 3.111 13.556 ( 16.800 4.113 -0.000) 17.296 13.834 ( -14.231 -16.602 -0.000) 21.866 14.260 ( -12.604 7.929 0.000) 14.891 14.875 ( 10.316 -2.930 -0.000) 10.724 15.647 ( 1.726 -5.145 -0.000) 5.427 15.654 ( 3.864 -3.328 -0.000) 5.100 17.182 ( -3.481 20.888 0.000) 21.177 17.816 ( -17.856 15.397 0.000) 23.577 19.288 ( 0.387 9.650 0.000) 9.658 20.127 ( 0.606 -7.254 -0.000) 7.279 21.053 ( -5.446 -0.225 0.000) 5.450 22.367 ( 2.774 -1.347 -0.000) 3.084 22.581 ( 1.761 6.862 0.000) 7.084 22.600 ( 0.707 2.512 0.000) 2.609 23.379 ( -2.176 -1.471 0.000) 2.627 23.765 ( 1.177 -16.875 -0.000) 16.916 ======================= Grid point 349 (145/156) ======================= q-point: ( 0.30 0.70 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( 8.400 -7.051 -0.000) 10.967 2.985 ( 11.179 -4.862 -0.000) 12.191 3.634 ( 5.397 -2.911 -0.000) 6.132 3.707 ( 6.359 -2.902 -0.000) 6.990 4.474 ( -9.998 -12.385 -0.000) 15.917 4.842 ( 16.072 5.180 -0.000) 16.886 5.205 ( -1.539 -1.540 -0.000) 2.177 5.625 ( -0.495 -7.901 -0.000) 7.917 5.781 ( 7.132 8.866 0.000) 11.378 6.251 ( -0.276 -16.984 -0.000) 16.987 6.608 ( 12.394 -13.466 -0.000) 18.301 7.208 ( 4.811 -0.096 -0.000) 4.812 7.425 ( 15.824 -9.811 -0.000) 18.619 7.501 ( 1.079 -7.597 -0.000) 7.673 8.548 ( -15.169 19.797 0.000) 24.940 9.433 ( -3.039 -6.100 -0.000) 6.815 10.613 ( -6.398 -2.818 0.000) 6.991 10.782 ( -1.204 6.205 0.000) 6.321 10.989 ( 14.486 5.855 -0.000) 15.625 11.211 ( -0.830 8.199 0.000) 8.241 13.134 ( -15.640 -15.082 0.000) 21.727 13.968 ( 18.324 -0.528 -0.000) 18.332 14.210 ( -9.566 10.781 0.000) 14.413 14.964 ( 5.762 -6.200 -0.000) 8.464 15.601 ( 2.555 -3.658 -0.000) 4.461 15.636 ( 4.143 -5.302 -0.000) 6.729 17.510 ( -8.749 23.079 0.000) 24.682 17.575 ( -32.714 12.663 0.000) 35.079 19.569 ( 5.448 10.550 0.000) 11.874 19.886 ( -5.895 -10.440 -0.000) 11.989 21.116 ( 1.975 10.966 0.000) 11.143 22.060 ( -16.440 -5.804 0.000) 17.435 22.874 ( 12.416 8.640 -0.000) 15.126 22.909 ( 11.623 -1.115 -0.000) 11.676 23.269 ( -2.574 -3.397 -0.000) 4.262 23.435 ( 0.666 -12.611 -0.000) 12.629 ======================= Grid point 355 (146/156) ======================= q-point: ( 0.30 0.70 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.848 ( 10.497 -4.940 -0.000) 11.601 3.094 ( 12.234 -7.403 -0.000) 14.300 3.741 ( 8.121 -0.298 -0.000) 8.127 3.789 ( 3.555 -7.281 -0.000) 8.103 4.153 ( -5.867 3.387 0.000) 6.775 5.186 ( 15.040 -2.579 -0.000) 15.260 5.414 ( 8.166 15.108 0.000) 17.174 5.551 ( 2.680 -3.224 -0.000) 4.192 6.023 ( 8.701 -10.944 -0.000) 13.982 6.146 ( 11.360 6.028 -0.000) 12.860 6.725 ( 12.522 -2.468 -0.000) 12.762 7.321 ( 6.982 -2.129 -0.000) 7.299 7.332 ( -2.127 -7.172 -0.000) 7.481 7.514 ( 11.294 -6.711 -0.000) 13.137 8.553 ( -20.060 17.215 0.000) 26.434 9.077 ( -9.994 -12.679 -0.000) 16.145 10.332 ( -15.704 -4.401 0.000) 16.309 10.872 ( 1.693 3.321 0.000) 3.728 11.034 ( -12.704 -10.604 0.000) 16.549 11.314 ( 14.240 -4.197 -0.000) 14.846 12.890 ( -3.285 10.620 0.000) 11.117 14.166 ( 4.533 -0.244 -0.000) 4.540 14.434 ( 8.057 9.171 0.000) 12.208 14.812 ( -1.661 -12.965 -0.000) 13.071 15.592 ( 1.148 -1.204 -0.000) 1.663 15.646 ( 4.944 -2.393 -0.000) 5.492 17.116 ( -28.799 7.731 0.000) 29.819 17.742 ( -10.102 16.991 0.000) 19.767 19.525 ( -5.944 -11.260 -0.000) 12.732 19.913 ( 8.311 8.345 0.000) 11.778 21.496 ( -0.568 21.869 0.000) 21.876 21.541 ( -13.139 -11.876 0.000) 17.711 22.883 ( 4.007 -12.110 -0.000) 12.756 23.007 ( -2.501 -8.007 -0.000) 8.389 23.391 ( 2.374 0.636 -0.000) 2.458 23.494 ( 15.905 11.103 -0.000) 19.397 ======================= Grid point 360 (147/156) ======================= q-point: ( 0.30 0.50 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 6.311 -8.536 14.501) 17.972 2.413 ( 13.626 -10.728 14.949) 22.896 3.522 ( 0.157 0.486 -7.289) 7.307 3.667 ( 6.286 -4.695 -13.444) 15.566 4.333 ( -3.122 -5.758 13.583) 15.080 4.563 ( 12.076 -3.517 3.764) 13.129 4.996 ( 1.679 -1.466 18.398) 18.532 5.502 ( -0.769 -8.961 -7.575) 11.759 5.625 ( 11.255 -2.660 -7.275) 13.663 6.306 ( -3.803 -2.621 -18.796) 19.355 6.442 ( 3.284 -1.891 -11.305) 11.924 6.759 ( 15.927 -12.528 -0.291) 20.266 7.280 ( -0.536 2.509 -6.094) 6.612 7.392 ( 2.771 -4.510 -6.863) 8.668 9.101 ( -3.217 5.149 5.164) 7.970 9.454 ( -7.270 4.006 -6.342) 10.446 10.744 ( -4.569 1.587 -0.739) 4.893 10.832 ( 2.957 1.043 -3.272) 4.531 11.015 ( -10.534 11.652 13.761) 20.883 11.505 ( -2.100 7.637 -6.318) 10.132 13.113 ( -8.020 -10.790 -0.378) 13.450 13.484 ( 20.858 -7.797 -2.047) 22.362 13.824 ( -0.691 0.985 43.440) 43.457 15.364 ( -0.493 1.405 -13.791) 13.872 15.436 ( 1.494 -3.269 4.469) 5.735 15.510 ( 1.916 -1.314 -17.464) 17.618 18.192 ( -18.572 26.107 6.914) 32.776 18.416 ( -17.527 8.290 -2.469) 19.545 19.760 ( -1.643 6.160 -4.660) 7.897 19.878 ( -4.285 -4.150 -2.335) 6.406 21.307 ( 4.349 14.475 2.030) 15.250 22.005 ( 2.504 -22.058 -5.642) 22.906 22.582 ( 0.116 3.218 9.559) 10.087 22.920 ( 6.855 2.876 -6.079) 9.603 23.133 ( 2.326 -8.796 1.343) 9.197 23.168 ( 5.251 -5.721 -0.355) 7.774 ======================= Grid point 361 (148/156) ======================= q-point: ( 0.35 0.65 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( 4.418 -1.183 -0.000) 4.574 2.948 ( 13.492 -5.752 -0.000) 14.667 3.652 ( 0.223 -4.496 -0.000) 4.502 3.741 ( 9.942 0.469 -0.000) 9.953 4.284 ( -1.286 8.050 0.000) 8.152 5.120 ( 18.025 -4.166 -0.000) 18.500 5.484 ( 6.682 -3.475 -0.000) 7.532 5.743 ( 8.510 14.605 0.000) 16.904 5.767 ( 5.476 -12.405 -0.000) 13.560 6.206 ( 15.047 1.731 -0.000) 15.146 6.869 ( 8.418 14.267 0.000) 16.565 7.203 ( 13.039 -9.002 -0.000) 15.844 7.205 ( -2.111 -4.600 -0.000) 5.061 7.489 ( 8.910 3.834 -0.000) 9.700 8.763 ( -15.070 -17.129 -0.000) 22.815 8.917 ( -17.709 17.780 0.000) 25.094 10.305 ( -17.783 2.640 0.000) 17.978 10.818 ( -13.170 -8.804 0.000) 15.841 10.909 ( 3.861 0.036 -0.000) 3.862 11.195 ( 7.582 -6.700 -0.000) 10.118 13.196 ( -1.101 17.268 0.000) 17.303 14.069 ( 13.341 -8.365 -0.000) 15.746 14.535 ( -5.764 -13.650 -0.000) 14.817 14.652 ( 2.780 11.076 0.000) 11.419 15.596 ( 1.939 1.591 -0.000) 2.509 15.625 ( 5.295 0.187 -0.000) 5.298 17.209 ( -25.119 1.334 0.000) 25.154 17.971 ( -14.482 3.042 0.000) 14.798 19.344 ( -8.290 -5.914 0.000) 10.183 20.059 ( 7.243 5.605 -0.000) 9.159 21.258 ( -5.153 -13.676 -0.000) 14.615 21.979 ( -0.822 23.791 0.000) 23.806 22.672 ( 1.873 -7.363 -0.000) 7.597 22.796 ( -3.344 -12.182 -0.000) 12.632 23.402 ( 2.173 -0.102 -0.000) 2.175 23.683 ( 17.419 6.780 -0.000) 18.692 ======================= Grid point 366 (149/156) ======================= q-point: ( 0.35 0.45 -0.35) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 500 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 8.473 1.669 18.007) 19.971 2.267 ( 14.003 -1.847 14.961) 20.575 3.550 ( 1.246 0.495 -9.962) 10.052 3.583 ( 3.894 -1.186 -12.865) 13.494 4.329 ( 4.672 4.064 15.360) 16.561 4.470 ( 7.425 -3.880 4.804) 9.657 4.986 ( 0.497 -0.210 20.956) 20.963 5.446 ( 2.687 4.071 -7.150) 8.655 5.555 ( 11.492 -3.588 -7.343) 14.102 6.299 ( -1.822 1.629 -24.905) 25.025 6.503 ( 7.829 7.464 -8.018) 13.464 6.532 ( 10.720 -8.712 -1.775) 13.927 7.317 ( 0.082 -2.743 -6.616) 7.162 7.334 ( 1.967 2.691 -6.628) 7.419 9.129 ( -1.139 -0.436 8.524) 8.611 9.523 ( -8.789 0.838 -10.397) 13.640 10.774 ( -4.501 1.156 -0.795) 4.715 10.826 ( 0.929 -1.450 -1.477) 2.269 11.154 ( -15.835 0.107 13.060) 20.526 11.548 ( -7.875 -2.360 -7.238) 10.953 13.110 ( 3.225 10.773 -0.382) 11.251 13.306 ( 18.970 -8.797 -1.350) 20.954 13.835 ( -0.061 -0.043 44.920) 44.920 15.368 ( -1.753 -0.423 -6.414) 6.662 15.414 ( 2.679 0.672 3.566) 4.510 15.494 ( 1.456 -0.184 -24.865) 24.908 18.412 ( -29.213 -3.455 1.486) 29.454 18.597 ( -10.934 3.941 -0.002) 11.623 19.773 ( -9.012 -1.179 -2.430) 9.408 19.910 ( 2.037 2.993 -2.780) 4.565 21.411 ( -1.275 -13.226 3.943) 13.860 21.780 ( 15.061 12.672 -6.960) 20.877 22.613 ( -4.726 -0.388 8.647) 9.862 22.926 ( -0.117 -5.914 -3.669) 6.961 23.030 ( 8.594 4.144 -0.286) 9.545 23.130 ( 9.206 0.470 0.139) 9.219 ======================= Grid point 403 (150/156) ======================= q-point: (-0.65 -0.35 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( 1.154 -11.336 -0.000) 11.394 2.761 ( 9.834 -6.856 -0.000) 11.988 3.545 ( 2.452 -5.461 -0.000) 5.986 3.600 ( 3.764 -6.112 -0.000) 7.178 4.557 ( 11.327 4.318 -0.000) 12.122 4.649 ( -7.154 -14.466 -0.000) 16.138 5.251 ( -2.668 -3.579 -0.000) 4.464 5.661 ( -2.334 -11.705 -0.000) 11.936 5.682 ( 1.521 3.757 0.000) 4.053 6.068 ( 14.687 -13.158 -0.000) 19.719 6.611 ( -9.657 -16.528 -0.000) 19.142 7.034 ( 19.651 -11.706 -0.000) 22.873 7.182 ( -0.600 1.242 0.000) 1.379 7.440 ( 4.432 -6.851 -0.000) 8.159 8.837 ( -12.466 19.108 0.000) 22.815 9.408 ( 5.224 2.118 -0.000) 5.637 10.688 ( 7.120 7.927 0.000) 10.655 10.740 ( -5.796 -2.212 0.000) 6.204 10.937 ( -6.777 12.714 0.000) 14.408 11.202 ( 1.460 9.655 0.000) 9.764 13.450 ( -14.360 -19.473 -0.000) 24.195 13.566 ( 20.100 -2.756 -0.000) 20.288 14.421 ( -10.450 7.632 0.000) 12.940 14.826 ( 7.629 -2.194 -0.000) 7.939 15.550 ( 2.114 -4.167 -0.000) 4.673 15.564 ( 2.705 -4.722 -0.000) 5.442 17.688 ( -7.767 27.462 0.000) 28.540 18.151 ( -20.046 15.384 0.000) 25.269 19.502 ( 0.906 10.575 0.000) 10.614 19.988 ( -2.333 -6.379 -0.000) 6.792 21.101 ( -3.767 5.917 0.000) 7.014 22.282 ( 2.220 -8.546 -0.000) 8.830 22.687 ( 5.225 5.651 0.000) 7.697 22.690 ( 2.510 3.453 0.000) 4.268 23.308 ( -1.020 -5.569 -0.000) 5.661 23.397 ( 3.082 -16.874 -0.000) 17.153 ======================= Grid point 409 (151/156) ======================= q-point: ( 0.35 0.65 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( 11.256 -2.874 -0.000) 11.617 2.835 ( 12.732 -8.757 -0.000) 15.453 3.572 ( 7.728 -2.317 -0.000) 8.068 3.644 ( 7.964 -4.097 -0.000) 8.956 4.312 ( -7.073 -2.332 0.000) 7.447 4.867 ( 15.155 -2.683 -0.000) 15.390 5.304 ( 2.609 10.766 0.000) 11.078 5.447 ( 4.764 -8.172 -0.000) 9.459 5.901 ( 11.618 2.404 -0.000) 11.864 5.954 ( 0.954 -12.308 -0.000) 12.345 6.470 ( 10.457 1.154 -0.000) 10.520 7.149 ( 15.096 -12.148 -0.000) 19.377 7.262 ( 6.673 1.217 -0.000) 6.783 7.354 ( 0.320 -6.400 -0.000) 6.408 8.931 ( -15.596 16.841 0.000) 22.953 9.262 ( -7.617 -9.478 -0.000) 12.160 10.584 ( -9.508 -0.201 0.000) 9.510 10.863 ( 1.246 1.342 0.000) 1.832 11.087 ( 4.300 3.950 -0.000) 5.839 11.292 ( -10.245 -2.402 0.000) 10.523 12.969 ( -4.991 1.172 0.000) 5.127 13.888 ( 19.278 -6.427 -0.000) 20.321 14.441 ( -5.374 10.871 0.000) 12.127 14.816 ( 1.092 -8.144 -0.000) 8.216 15.543 ( 3.174 -1.828 -0.000) 3.663 15.551 ( 4.133 -2.747 -0.000) 4.963 17.771 ( -33.306 5.665 0.000) 33.784 17.993 ( -13.362 21.834 0.000) 25.598 19.680 ( -8.647 -8.953 -0.000) 12.447 19.773 ( 5.042 9.074 0.000) 10.381 21.453 ( 4.919 21.142 0.000) 21.707 21.816 ( -12.278 -18.385 -0.000) 22.108 22.781 ( 5.483 -8.630 -0.000) 10.225 22.995 ( 5.870 -0.297 -0.000) 5.878 23.212 ( 8.124 0.779 -0.000) 8.161 23.303 ( 5.935 -1.026 -0.000) 6.023 ======================= Grid point 415 (152/156) ======================= q-point: ( 0.40 0.60 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.615 ( 10.047 3.681 -0.000) 10.700 2.669 ( 13.324 -6.179 -0.000) 14.687 3.554 ( 6.592 -3.273 -0.000) 7.360 3.554 ( 7.779 0.696 -0.000) 7.810 4.369 ( -4.342 6.747 0.000) 8.023 4.777 ( 14.820 -5.400 -0.000) 15.773 5.317 ( 6.106 -4.286 -0.000) 7.461 5.573 ( 7.550 12.625 0.000) 14.710 5.744 ( -0.457 -7.322 -0.000) 7.337 5.901 ( 13.687 -0.209 -0.000) 13.689 6.652 ( 11.471 15.317 0.000) 19.136 6.864 ( 18.317 -13.804 -0.000) 22.936 7.241 ( -1.087 -4.446 -0.000) 4.577 7.339 ( 5.186 4.843 -0.000) 7.096 9.063 ( -13.143 -9.881 0.000) 16.443 9.229 ( -10.936 11.769 0.000) 16.065 10.600 ( -10.996 1.910 0.000) 11.160 10.839 ( 2.903 -3.356 -0.000) 4.438 11.131 ( -15.525 -10.707 0.000) 18.859 11.157 ( -4.937 2.816 0.000) 5.683 13.174 ( 2.763 16.482 0.000) 16.712 13.711 ( 20.263 -10.689 -0.000) 22.909 14.631 ( -3.645 -9.697 -0.000) 10.359 14.650 ( -1.609 9.334 0.000) 9.472 15.524 ( 4.328 0.117 -0.000) 4.330 15.529 ( 3.947 0.555 -0.000) 3.986 17.801 ( -31.301 -2.542 0.000) 31.404 18.306 ( -16.599 5.550 0.000) 17.502 19.538 ( -10.049 -4.478 0.000) 11.002 19.938 ( 4.248 6.398 0.000) 7.679 21.369 ( -5.205 -21.066 -0.000) 21.700 21.936 ( 6.077 23.707 0.000) 24.474 22.660 ( -1.027 -2.446 -0.000) 2.652 22.849 ( -1.629 -10.859 -0.000) 10.980 23.306 ( 17.626 5.568 -0.000) 18.485 23.310 ( 6.726 0.599 -0.000) 6.753 ======================= Grid point 420 (153/156) ======================= q-point: ( 0.40 0.40 -0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 156 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.107 ( -0.000 -0.000 18.548) 18.548 2.107 ( -0.000 -0.000 18.548) 18.548 3.541 ( 0.000 0.000 -13.216) 13.216 3.541 ( 0.000 0.000 -13.216) 13.216 4.254 ( -0.000 -0.000 23.105) 23.105 4.411 ( -0.000 -0.000 2.152) 2.152 5.001 ( -0.000 -0.000 23.426) 23.426 5.412 ( 0.000 0.000 -6.945) 6.945 5.412 ( 0.000 0.000 -6.945) 6.945 6.338 ( 0.000 0.000 -33.039) 33.039 6.411 ( 0.000 0.000 -3.227) 3.227 6.411 ( 0.000 0.000 -3.227) 3.227 7.314 ( 0.000 0.000 -6.656) 6.656 7.314 ( 0.000 0.000 -6.656) 6.656 9.133 ( -0.000 -0.000 10.831) 10.831 9.614 ( 0.000 0.000 -13.600) 13.600 10.820 ( -0.000 -0.000 0.078) 0.078 10.820 ( -0.000 -0.000 0.078) 0.078 11.347 ( -0.000 -0.000 9.020) 9.020 11.644 ( 0.000 0.000 -5.964) 5.964 13.073 ( 0.000 0.000 -0.229) 0.229 13.073 ( 0.000 0.000 -0.229) 0.229 13.839 ( -0.000 -0.000 46.255) 46.255 15.384 ( -0.000 -0.000 4.159) 4.159 15.384 ( -0.000 -0.000 4.159) 4.159 15.482 ( 0.000 0.000 -36.755) 36.755 18.680 ( -0.000 -0.000 0.094) 0.094 18.793 ( 0.000 0.000 -5.046) 5.046 19.889 ( 0.000 0.000 -1.017) 1.017 19.889 ( 0.000 0.000 -1.017) 1.017 21.397 ( -0.000 -0.000 4.889) 4.889 21.585 ( 0.000 0.000 -4.684) 4.684 22.684 ( -0.000 -0.000 8.798) 8.798 22.956 ( -0.000 -0.000 0.811) 0.811 22.956 ( -0.000 -0.000 0.811) 0.811 22.972 ( 0.000 0.000 -5.877) 5.877 ======================= Grid point 465 (154/156) ======================= q-point: ( 0.40 0.60 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( 5.291 -5.777 -0.000) 7.834 2.577 ( 11.551 -9.735 -0.000) 15.106 3.450 ( 3.478 -3.000 -0.000) 4.593 3.501 ( 5.380 -3.901 -0.000) 6.645 4.431 ( -4.910 -5.852 -0.000) 7.639 4.590 ( 11.205 -1.394 -0.000) 11.291 5.277 ( 0.770 5.849 0.000) 5.899 5.420 ( -1.832 -10.193 -0.000) 10.356 5.717 ( 4.836 -0.613 -0.000) 4.874 5.849 ( 9.584 -8.293 -0.000) 12.674 6.386 ( -2.812 -4.277 -0.000) 5.118 6.762 ( 18.829 -13.239 -0.000) 23.017 7.219 ( -0.255 2.090 0.000) 2.106 7.322 ( 2.447 -4.550 -0.000) 5.166 9.170 ( -7.565 12.709 0.000) 14.791 9.372 ( -2.534 -4.182 -0.000) 4.889 10.739 ( -5.577 1.315 0.000) 5.730 10.800 ( 2.612 2.993 0.000) 3.972 11.180 ( -10.394 10.418 0.000) 14.716 11.411 ( -1.135 7.538 0.000) 7.623 13.108 ( -8.248 -10.844 -0.000) 13.624 13.461 ( 20.786 -7.021 -0.000) 21.939 14.569 ( -6.318 6.574 0.000) 9.118 14.772 ( 3.116 -3.217 -0.000) 4.479 15.480 ( 2.493 -2.397 -0.000) 3.459 15.482 ( 2.429 -2.903 -0.000) 3.785 18.257 ( -11.297 25.327 0.000) 27.732 18.391 ( -23.267 6.896 0.000) 24.268 19.712 ( 0.694 9.746 0.000) 9.771 19.857 ( -7.193 -6.213 0.000) 9.505 21.328 ( 4.256 15.939 0.000) 16.498 21.950 ( 2.493 -23.341 -0.000) 23.474 22.719 ( -1.979 -0.179 0.000) 1.987 22.818 ( 7.584 6.504 -0.000) 9.991 23.150 ( 0.982 -9.343 -0.000) 9.395 23.162 ( 7.268 -5.103 -0.000) 8.880 ======================= Grid point 471 (155/156) ======================= q-point: ( 0.45 0.55 -0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( 8.760 3.916 -0.000) 9.595 2.419 ( 9.947 -4.273 -0.000) 10.826 3.432 ( 3.953 1.262 -0.000) 4.149 3.436 ( 4.231 -1.860 -0.000) 4.622 4.421 ( -0.958 4.526 0.000) 4.626 4.525 ( 9.011 -4.175 -0.000) 9.932 5.284 ( -2.400 -2.711 -0.000) 3.621 5.424 ( 6.900 4.984 -0.000) 8.512 5.694 ( 5.442 1.546 -0.000) 5.657 5.718 ( 3.608 -4.077 -0.000) 5.444 6.449 ( 6.915 10.085 0.000) 12.228 6.524 ( 12.979 -9.490 -0.000) 16.078 7.249 ( 0.062 -2.522 -0.000) 2.523 7.267 ( 2.033 2.590 0.000) 3.292 9.281 ( -7.489 -4.335 0.000) 8.653 9.351 ( -1.787 4.796 0.000) 5.118 10.768 ( -5.340 1.177 0.000) 5.469 10.814 ( -0.298 -1.557 -0.000) 1.586 11.354 ( -11.856 6.071 0.000) 13.320 11.404 ( -9.906 -8.208 0.000) 12.864 13.106 ( 3.072 10.833 0.000) 11.261 13.291 ( 18.383 -8.993 -0.000) 20.465 14.688 ( -1.856 -4.983 -0.000) 5.318 14.689 ( -1.645 4.942 0.000) 5.209 15.452 ( 2.544 0.060 -0.000) 2.545 15.455 ( 2.814 0.040 -0.000) 2.814 18.422 ( -25.647 -3.784 0.000) 25.925 18.599 ( -10.643 4.529 0.000) 11.566 19.747 ( -9.848 -3.921 0.000) 10.600 19.885 ( 1.049 5.353 0.000) 5.455 21.459 ( -3.167 -18.709 -0.000) 18.975 21.705 ( 15.081 18.187 0.000) 23.626 22.725 ( -5.455 1.731 0.000) 5.723 22.859 ( 0.690 -7.219 -0.000) 7.252 23.030 ( 7.794 3.341 -0.000) 8.480 23.132 ( 10.024 0.550 -0.000) 10.039 ======================= Grid point 527 (156/156) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 5.87e-04 5.87e-04 5.25e-05 5.25e-05 Number of triplets: 81 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( -0.000 -0.000 0.000) 0.000 2.307 ( -0.000 -0.000 0.000) 0.000 3.391 ( -0.000 -0.000 0.000) 0.000 3.391 ( -0.000 -0.000 0.000) 0.000 4.428 ( 0.000 0.000 -1.241) 1.241 4.428 ( -0.000 -0.000 1.241) 1.241 5.339 ( -0.000 -0.000 0.000) 0.000 5.339 ( -0.000 -0.000 0.000) 0.000 5.649 ( 0.000 0.000 -37.869) 37.869 5.649 ( -0.000 -0.000 37.869) 37.869 6.381 ( -0.000 -0.000 0.000) 0.000 6.381 ( -0.000 -0.000 0.000) 0.000 7.247 ( -0.000 -0.000 0.000) 0.000 7.247 ( -0.000 -0.000 0.000) 0.000 9.360 ( 0.000 0.000 -12.710) 12.710 9.360 ( -0.000 -0.000 12.710) 12.710 10.823 ( -0.000 -0.000 0.000) 0.000 10.823 ( -0.000 -0.000 0.000) 0.000 11.511 ( 0.000 0.000 -7.857) 7.857 11.511 ( -0.000 -0.000 7.857) 7.857 13.071 ( -0.000 -0.000 0.000) 0.000 13.071 ( -0.000 -0.000 0.000) 0.000 14.707 ( 0.000 0.000 -43.539) 43.539 14.707 ( -0.000 -0.000 43.539) 43.539 15.425 ( -0.000 -0.000 0.000) 0.000 15.425 ( -0.000 -0.000 0.000) 0.000 18.713 ( 0.000 0.000 -3.134) 3.134 18.713 ( -0.000 -0.000 3.134) 3.134 19.879 ( -0.000 -0.000 0.000) 0.000 19.879 ( -0.000 -0.000 0.000) 0.000 21.492 ( 0.000 0.000 -4.962) 4.962 21.492 ( -0.000 -0.000 4.962) 4.962 22.843 ( 0.000 0.000 -7.601) 7.601 22.843 ( -0.000 -0.000 7.601) 7.601 22.964 ( -0.000 -0.000 0.000) 0.000 22.964 ( -0.000 -0.000 0.000) 0.000 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/36000 10.0 3091.814 3091.814 4424.473 -0.000 -0.000 -0.000 3/36000 20.0 1494.685 1494.685 1286.142 -0.000 -0.000 -0.000 3/36000 30.0 575.204 575.204 463.846 -0.000 -0.000 -0.000 3/36000 40.0 275.293 275.293 209.912 -0.000 -0.000 -0.000 3/36000 50.0 159.559 159.559 117.072 -0.000 -0.000 -0.000 3/36000 60.0 106.257 106.257 75.918 -0.000 -0.000 -0.000 3/36000 70.0 77.862 77.862 54.660 -0.000 -0.000 -0.000 3/36000 80.0 60.921 60.921 42.299 -0.000 -0.000 -0.000 3/36000 90.0 49.897 49.897 34.424 -0.000 -0.000 -0.000 3/36000 100.0 42.228 42.228 29.038 -0.000 -0.000 -0.000 3/36000 110.0 36.610 36.610 25.145 -0.000 -0.000 -0.000 3/36000 120.0 32.323 32.323 22.205 -0.000 -0.000 -0.000 3/36000 130.0 28.947 28.947 19.908 -0.000 -0.000 -0.000 3/36000 140.0 26.219 26.219 18.062 -0.000 -0.000 -0.000 3/36000 150.0 23.970 23.970 16.545 -0.000 -0.000 -0.000 3/36000 160.0 22.082 22.082 15.274 -0.000 -0.000 -0.000 3/36000 170.0 20.476 20.476 14.194 -0.000 -0.000 -0.000 3/36000 180.0 19.092 19.092 13.263 -0.000 -0.000 -0.000 3/36000 190.0 17.888 17.888 12.453 -0.000 -0.000 -0.000 3/36000 200.0 16.830 16.830 11.740 -0.000 -0.000 -0.000 3/36000 210.0 15.894 15.894 11.108 -0.000 -0.000 -0.000 3/36000 220.0 15.060 15.060 10.543 -0.000 -0.000 -0.000 3/36000 230.0 14.311 14.311 10.035 -0.000 -0.000 -0.000 3/36000 240.0 13.636 13.636 9.576 -0.000 -0.000 -0.000 3/36000 250.0 13.023 13.023 9.158 -0.000 -0.000 -0.000 3/36000 260.0 12.465 12.465 8.777 -0.000 -0.000 -0.000 3/36000 270.0 11.954 11.954 8.427 -0.000 -0.000 -0.000 3/36000 280.0 11.485 11.485 8.105 -0.000 -0.000 -0.000 3/36000 290.0 11.053 11.053 7.808 -0.000 -0.000 -0.000 3/36000 300.0 10.652 10.652 7.532 -0.000 -0.000 -0.000 3/36000 310.0 10.281 10.281 7.275 -0.000 -0.000 -0.000 3/36000 320.0 9.936 9.936 7.036 -0.000 -0.000 -0.000 3/36000 330.0 9.614 9.614 6.813 -0.000 -0.000 -0.000 3/36000 340.0 9.312 9.312 6.604 -0.000 -0.000 -0.000 3/36000 350.0 9.030 9.030 6.407 -0.000 -0.000 -0.000 3/36000 360.0 8.764 8.764 6.223 -0.000 -0.000 -0.000 3/36000 370.0 8.515 8.515 6.048 -0.000 -0.000 -0.000 3/36000 380.0 8.279 8.279 5.884 -0.000 -0.000 -0.000 3/36000 390.0 8.056 8.056 5.728 -0.000 -0.000 -0.000 3/36000 400.0 7.846 7.846 5.581 -0.000 -0.000 -0.000 3/36000 410.0 7.646 7.646 5.441 -0.000 -0.000 -0.000 3/36000 420.0 7.457 7.457 5.308 -0.000 -0.000 -0.000 3/36000 430.0 7.277 7.277 5.181 -0.000 -0.000 -0.000 3/36000 440.0 7.105 7.105 5.061 -0.000 -0.000 -0.000 3/36000 450.0 6.942 6.942 4.946 -0.000 -0.000 -0.000 3/36000 460.0 6.786 6.786 4.836 -0.000 -0.000 -0.000 3/36000 470.0 6.637 6.637 4.731 -0.000 -0.000 -0.000 3/36000 480.0 6.495 6.495 4.631 -0.000 -0.000 -0.000 3/36000 490.0 6.358 6.358 4.535 -0.000 -0.000 -0.000 3/36000 500.0 6.228 6.228 4.443 -0.000 -0.000 -0.000 3/36000 510.0 6.103 6.103 4.354 -0.000 -0.000 -0.000 3/36000 520.0 5.982 5.982 4.269 -0.000 -0.000 -0.000 3/36000 530.0 5.867 5.867 4.187 -0.000 -0.000 -0.000 3/36000 540.0 5.756 5.756 4.109 -0.000 -0.000 -0.000 3/36000 550.0 5.649 5.649 4.033 -0.000 -0.000 -0.000 3/36000 560.0 5.546 5.546 3.960 -0.000 -0.000 -0.000 3/36000 570.0 5.447 5.447 3.890 -0.000 -0.000 -0.000 3/36000 580.0 5.351 5.351 3.822 -0.000 -0.000 -0.000 3/36000 590.0 5.259 5.259 3.757 -0.000 -0.000 -0.000 3/36000 600.0 5.170 5.170 3.693 -0.000 -0.000 -0.000 3/36000 610.0 5.083 5.083 3.632 -0.000 -0.000 -0.000 3/36000 620.0 5.000 5.000 3.573 -0.000 -0.000 -0.000 3/36000 630.0 4.920 4.920 3.516 -0.000 -0.000 -0.000 3/36000 640.0 4.842 4.842 3.461 -0.000 -0.000 -0.000 3/36000 650.0 4.766 4.766 3.407 -0.000 -0.000 -0.000 3/36000 660.0 4.693 4.693 3.355 -0.000 -0.000 -0.000 3/36000 670.0 4.622 4.622 3.304 -0.000 -0.000 -0.000 3/36000 680.0 4.553 4.553 3.255 -0.000 -0.000 -0.000 3/36000 690.0 4.486 4.486 3.208 -0.000 -0.000 -0.000 3/36000 700.0 4.422 4.422 3.162 -0.000 -0.000 -0.000 3/36000 710.0 4.359 4.359 3.117 -0.000 -0.000 -0.000 3/36000 720.0 4.297 4.297 3.073 -0.000 -0.000 -0.000 3/36000 730.0 4.238 4.238 3.031 -0.000 -0.000 -0.000 3/36000 740.0 4.180 4.180 2.990 -0.000 -0.000 -0.000 3/36000 750.0 4.124 4.124 2.950 -0.000 -0.000 -0.000 3/36000 760.0 4.069 4.069 2.911 -0.000 -0.000 -0.000 3/36000 770.0 4.016 4.016 2.873 -0.000 -0.000 -0.000 3/36000 780.0 3.964 3.964 2.836 -0.000 -0.000 -0.000 3/36000 790.0 3.913 3.913 2.800 -0.000 -0.000 -0.000 3/36000 800.0 3.864 3.864 2.765 -0.000 -0.000 -0.000 3/36000 810.0 3.816 3.816 2.730 -0.000 -0.000 -0.000 3/36000 820.0 3.769 3.769 2.697 -0.000 -0.000 -0.000 3/36000 830.0 3.723 3.723 2.664 -0.000 -0.000 -0.000 3/36000 840.0 3.679 3.679 2.632 -0.000 -0.000 -0.000 3/36000 850.0 3.635 3.635 2.601 -0.000 -0.000 -0.000 3/36000 860.0 3.592 3.592 2.571 -0.000 -0.000 -0.000 3/36000 870.0 3.551 3.551 2.541 -0.000 -0.000 -0.000 3/36000 880.0 3.510 3.510 2.512 -0.000 -0.000 -0.000 3/36000 890.0 3.471 3.471 2.484 -0.000 -0.000 -0.000 3/36000 900.0 3.432 3.432 2.456 -0.000 -0.000 -0.000 3/36000 910.0 3.394 3.394 2.429 -0.000 -0.000 -0.000 3/36000 920.0 3.357 3.357 2.403 -0.000 -0.000 -0.000 3/36000 930.0 3.320 3.320 2.377 -0.000 -0.000 -0.000 3/36000 940.0 3.285 3.285 2.352 -0.000 -0.000 -0.000 3/36000 950.0 3.250 3.250 2.327 -0.000 -0.000 -0.000 3/36000 960.0 3.216 3.216 2.302 -0.000 -0.000 -0.000 3/36000 970.0 3.183 3.183 2.279 -0.000 -0.000 -0.000 3/36000 980.0 3.150 3.150 2.255 -0.000 -0.000 -0.000 3/36000 990.0 3.118 3.118 2.233 -0.000 -0.000 -0.000 3/36000 1000.0 3.087 3.087 2.210 -0.000 -0.000 -0.000 3/36000 Thermal conductivity related properties were written into "kappa-m51020.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 23:31:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|