----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:16:19]------------------------- Compiled with OpenMP support (max 32 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.498715488466488 -4.829813605000001 0.000000000000000 b 3.498715488466488 4.829813605000001 0.000000000000000 c -3.265880147937263 0.000000000000000 4.479741844794588 Atomic positions (fractional): *1 K 0.62363577341377 0.37636422658623 0.25000000000000 39.098 2 K 0.37636422658623 0.62363577341377 0.75000000000000 39.098 *3 Na 0.72992895619830 0.27007104380171 0.75000000000000 22.990 4 Na 0.27007104380170 0.72992895619830 0.25000000000000 22.990 *5 Zn 0.98938211637894 0.01061788362106 0.25000000000000 65.380 6 Zn 0.01061788362106 0.98938211637894 0.75000000000000 65.380 *7 O 0.07435473746957 0.28793991729304 0.13138888319034 15.999 8 O 0.71206008270696 0.92564526253043 0.36861111680966 15.999 9 O 0.28793991729304 0.07435473746957 0.63138888319034 15.999 10 O 0.92564526253043 0.71206008270696 0.86861111680966 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.997430976932976 0.000000000000000 0.000000000000000 b 0.000000000000000 9.659627210000002 0.000000000000000 c -3.265880147937263 0.000000000000000 4.479741844794588 Atomic positions (fractional): *1 K 0.50000000000000 0.87636422658623 0.25000000000000 39.098 > 1 2 K 0.00000000000000 0.62363577341377 0.75000000000000 39.098 > 2 3 K 0.00000000000000 0.37636422658622 0.25000000000000 39.098 > 1 4 K 0.50000000000000 0.12363577341378 0.75000000000000 39.098 > 2 *5 Na 0.50000000000000 0.77007104380170 0.75000000000000 22.990 > 3 6 Na 0.00000000000000 0.72992895619830 0.25000000000000 22.990 > 4 7 Na 0.00000000000000 0.27007104380170 0.75000000000000 22.990 > 3 8 Na 0.50000000000000 0.22992895619830 0.25000000000000 22.990 > 4 *9 Zn 0.50000000000000 0.51061788362106 0.25000000000000 65.380 > 5 10 Zn 0.00000000000000 0.98938211637894 0.75000000000000 65.380 > 6 11 Zn 0.00000000000000 0.01061788362106 0.25000000000000 65.380 > 5 12 Zn 0.50000000000000 0.48938211637894 0.75000000000000 65.380 > 6 *13 O 0.68114732738131 0.60679258991174 0.13138888319034 15.999 > 7 14 O 0.31885267261869 0.60679258991174 0.36861111680966 15.999 > 8 15 O 0.18114732738131 0.89320741008826 0.63138888319034 15.999 > 9 16 O 0.81885267261869 0.89320741008826 0.86861111680966 15.999 > 10 17 O 0.18114732738131 0.10679258991174 0.13138888319034 15.999 > 7 18 O 0.81885267261869 0.10679258991174 0.36861111680966 15.999 > 8 19 O 0.68114732738131 0.39320741008826 0.63138888319034 15.999 > 9 20 O 0.31885267261869 0.39320741008826 0.86861111680966 15.999 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 13.994861953865952 0.000000000000000 0.000000000000000 b 0.000000000000000 9.659627210000002 0.000000000000000 c -6.531760295874526 0.000000000000000 8.959483689589176 Atomic positions (fractional): *1 K 0.25000000000000 0.87636422658623 0.12500000000000 39.098 > 1 2 K 0.75000000000000 0.87636422658623 0.12500000000000 39.098 > 1 3 K 0.25000000000000 0.87636422658623 0.62500000000000 39.098 > 1 4 K 0.75000000000000 0.87636422658623 0.62500000000000 39.098 > 1 5 K 0.00000000000000 0.62363577341377 0.37500000000000 39.098 > 2 6 K 0.50000000000000 0.62363577341377 0.37500000000000 39.098 > 2 7 K 0.00000000000000 0.62363577341377 0.87500000000000 39.098 > 2 8 K 0.50000000000000 0.62363577341377 0.87500000000000 39.098 > 2 9 K 0.00000000000000 0.37636422658622 0.12500000000000 39.098 > 1 10 K 0.50000000000000 0.37636422658622 0.12500000000000 39.098 > 1 11 K 0.00000000000000 0.37636422658622 0.62500000000000 39.098 > 1 12 K 0.50000000000000 0.37636422658622 0.62500000000000 39.098 > 1 13 K 0.25000000000000 0.12363577341378 0.37500000000000 39.098 > 2 14 K 0.75000000000000 0.12363577341378 0.37500000000000 39.098 > 2 15 K 0.25000000000000 0.12363577341378 0.87500000000000 39.098 > 2 16 K 0.75000000000000 0.12363577341378 0.87500000000000 39.098 > 2 *17 Na 0.25000000000000 0.77007104380170 0.37500000000000 22.990 > 3 18 Na 0.75000000000000 0.77007104380170 0.37500000000000 22.990 > 3 19 Na 0.25000000000000 0.77007104380170 0.87500000000000 22.990 > 3 20 Na 0.75000000000000 0.77007104380170 0.87500000000000 22.990 > 3 21 Na 0.00000000000000 0.72992895619830 0.12500000000000 22.990 > 4 22 Na 0.50000000000000 0.72992895619830 0.12500000000000 22.990 > 4 23 Na 0.00000000000000 0.72992895619830 0.62500000000000 22.990 > 4 24 Na 0.50000000000000 0.72992895619830 0.62500000000000 22.990 > 4 25 Na 0.00000000000000 0.27007104380170 0.37500000000000 22.990 > 3 26 Na 0.50000000000000 0.27007104380170 0.37500000000000 22.990 > 3 27 Na 0.00000000000000 0.27007104380170 0.87500000000000 22.990 > 3 28 Na 0.50000000000000 0.27007104380170 0.87500000000000 22.990 > 3 29 Na 0.25000000000000 0.22992895619830 0.12500000000000 22.990 > 4 30 Na 0.75000000000000 0.22992895619830 0.12500000000000 22.990 > 4 31 Na 0.25000000000000 0.22992895619830 0.62500000000000 22.990 > 4 32 Na 0.75000000000000 0.22992895619830 0.62500000000000 22.990 > 4 *33 Zn 0.25000000000000 0.51061788362106 0.12500000000000 65.380 > 5 34 Zn 0.75000000000000 0.51061788362106 0.12500000000000 65.380 > 5 35 Zn 0.25000000000000 0.51061788362106 0.62500000000000 65.380 > 5 36 Zn 0.75000000000000 0.51061788362106 0.62500000000000 65.380 > 5 37 Zn 0.00000000000000 0.98938211637894 0.37500000000000 65.380 > 6 38 Zn 0.50000000000000 0.98938211637894 0.37500000000000 65.380 > 6 39 Zn 0.00000000000000 0.98938211637894 0.87500000000000 65.380 > 6 40 Zn 0.50000000000000 0.98938211637894 0.87500000000000 65.380 > 6 41 Zn 0.00000000000000 0.01061788362106 0.12500000000000 65.380 > 5 42 Zn 0.50000000000000 0.01061788362106 0.12500000000000 65.380 > 5 43 Zn 0.00000000000000 0.01061788362106 0.62500000000000 65.380 > 5 44 Zn 0.50000000000000 0.01061788362106 0.62500000000000 65.380 > 5 45 Zn 0.25000000000000 0.48938211637894 0.37500000000000 65.380 > 6 46 Zn 0.75000000000000 0.48938211637894 0.37500000000000 65.380 > 6 47 Zn 0.25000000000000 0.48938211637894 0.87500000000000 65.380 > 6 48 Zn 0.75000000000000 0.48938211637894 0.87500000000000 65.380 > 6 *49 O 0.34057366369065 0.60679258991174 0.06569444159517 15.999 > 7 50 O 0.84057366369065 0.60679258991174 0.06569444159517 15.999 > 7 51 O 0.34057366369065 0.60679258991174 0.56569444159517 15.999 > 7 52 O 0.84057366369065 0.60679258991174 0.56569444159517 15.999 > 7 53 O 0.15942633630935 0.60679258991174 0.18430555840483 15.999 > 8 54 O 0.65942633630935 0.60679258991174 0.18430555840483 15.999 > 8 55 O 0.15942633630935 0.60679258991174 0.68430555840483 15.999 > 8 56 O 0.65942633630935 0.60679258991174 0.68430555840483 15.999 > 8 57 O 0.09057366369065 0.89320741008826 0.31569444159517 15.999 > 9 58 O 0.59057366369065 0.89320741008826 0.31569444159517 15.999 > 9 59 O 0.09057366369065 0.89320741008826 0.81569444159517 15.999 > 9 60 O 0.59057366369065 0.89320741008826 0.81569444159517 15.999 > 9 61 O 0.40942633630935 0.89320741008826 0.43430555840483 15.999 > 10 62 O 0.90942633630935 0.89320741008826 0.43430555840483 15.999 > 10 63 O 0.40942633630935 0.89320741008826 0.93430555840483 15.999 > 10 64 O 0.90942633630935 0.89320741008826 0.93430555840483 15.999 > 10 65 O 0.09057366369065 0.10679258991174 0.06569444159517 15.999 > 7 66 O 0.59057366369065 0.10679258991174 0.06569444159517 15.999 > 7 67 O 0.09057366369065 0.10679258991174 0.56569444159517 15.999 > 7 68 O 0.59057366369065 0.10679258991174 0.56569444159517 15.999 > 7 69 O 0.40942633630935 0.10679258991174 0.18430555840483 15.999 > 8 70 O 0.90942633630935 0.10679258991174 0.18430555840483 15.999 > 8 71 O 0.40942633630935 0.10679258991174 0.68430555840483 15.999 > 8 72 O 0.90942633630935 0.10679258991174 0.68430555840483 15.999 > 8 73 O 0.34057366369065 0.39320741008826 0.31569444159517 15.999 > 9 74 O 0.84057366369065 0.39320741008826 0.31569444159517 15.999 > 9 75 O 0.34057366369065 0.39320741008826 0.81569444159517 15.999 > 9 76 O 0.84057366369065 0.39320741008826 0.81569444159517 15.999 > 9 77 O 0.15942633630935 0.39320741008826 0.43430555840483 15.999 > 10 78 O 0.65942633630935 0.39320741008826 0.43430555840483 15.999 > 10 79 O 0.15942633630935 0.39320741008826 0.93430555840483 15.999 > 10 80 O 0.65942633630935 0.39320741008826 0.93430555840483 15.999 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4075989 0.0000000 -0.1952993 0.0000000 3.2830276 0.0000000 -0.1952987 0.0000000 3.5510807 -------------------------- Born effective charges -------------------------- 1 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 2 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 3 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 4 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 5 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 6 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 7 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 8 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 9 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 10 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 4224/4224 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 984 Number of blocks in projector: 984 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 182 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 182 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 134 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 134 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 134 Use standard eigh solver. Tree of FC basis block matrices: - (984, 961), data: False |-- (134, 130), data: True |-- (134, 130), data: True |-- (134, 130), data: True |-- (182, 180), data: True |-- (182, 180), data: True |-- (218, 211), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 320 - Time: 0.182 Solver_block: 200 / 320 - Time: 0.173 Solver_block: 300 / 320 - Time: 0.172 Solver_block: 320 / 320 - Time: 0.044 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.583 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 4224/4224 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 984 Number of blocks in projector: 984 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 182 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 182 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 134 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 134 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 134 Use standard eigh solver. Tree of FC basis block matrices: - (984, 961), data: False |-- (134, 130), data: True |-- (134, 130), data: True |-- (134, 130), data: True |-- (182, 180), data: True |-- (182, 180), data: True |-- (218, 211), 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 2026-01-08 13:16:31]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:16:32]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.498715488466488 -4.829813605000001 0.000000000000000 b 3.498715488466488 4.829813605000001 0.000000000000000 c -3.265880147937263 0.000000000000000 4.479741844794588 Atomic positions (fractional): 1 K 0.62363577341377 0.37636422658623 0.25000000000000 39.098 2 K 0.37636422658623 0.62363577341377 0.75000000000000 39.098 3 Na 0.72992895619830 0.27007104380171 0.75000000000000 22.990 4 Na 0.27007104380170 0.72992895619830 0.25000000000000 22.990 5 Zn 0.98938211637894 0.01061788362106 0.25000000000000 65.380 6 Zn 0.01061788362106 0.98938211637894 0.75000000000000 65.380 7 O 0.07435473746957 0.28793991729304 0.13138888319034 15.999 8 O 0.71206008270696 0.92564526253043 0.36861111680966 15.999 9 O 0.28793991729304 0.07435473746957 0.63138888319034 15.999 10 O 0.92564526253043 0.71206008270696 0.86861111680966 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.994861953865952 0.000000000000000 0.000000000000000 b 0.000000000000000 9.659627210000002 0.000000000000000 c -6.531760295874526 0.000000000000000 8.959483689589176 Atomic positions (fractional): 1 K 0.25000000000000 0.87636422658623 0.12500000000000 39.098 > 1 2 K 0.75000000000000 0.87636422658623 0.12500000000000 39.098 > 1 3 K 0.25000000000000 0.87636422658623 0.62500000000000 39.098 > 1 4 K 0.75000000000000 0.87636422658623 0.62500000000000 39.098 > 1 5 K 0.00000000000000 0.62363577341377 0.37500000000000 39.098 > 5 6 K 0.50000000000000 0.62363577341377 0.37500000000000 39.098 > 5 7 K 0.00000000000000 0.62363577341377 0.87500000000000 39.098 > 5 8 K 0.50000000000000 0.62363577341377 0.87500000000000 39.098 > 5 9 K 0.00000000000000 0.37636422658622 0.12500000000000 39.098 > 1 10 K 0.50000000000000 0.37636422658622 0.12500000000000 39.098 > 1 11 K 0.00000000000000 0.37636422658622 0.62500000000000 39.098 > 1 12 K 0.50000000000000 0.37636422658622 0.62500000000000 39.098 > 1 13 K 0.25000000000000 0.12363577341378 0.37500000000000 39.098 > 5 14 K 0.75000000000000 0.12363577341378 0.37500000000000 39.098 > 5 15 K 0.25000000000000 0.12363577341378 0.87500000000000 39.098 > 5 16 K 0.75000000000000 0.12363577341378 0.87500000000000 39.098 > 5 17 Na 0.25000000000000 0.77007104380170 0.37500000000000 22.990 > 17 18 Na 0.75000000000000 0.77007104380170 0.37500000000000 22.990 > 17 19 Na 0.25000000000000 0.77007104380170 0.87500000000000 22.990 > 17 20 Na 0.75000000000000 0.77007104380170 0.87500000000000 22.990 > 17 21 Na 0.00000000000000 0.72992895619830 0.12500000000000 22.990 > 21 22 Na 0.50000000000000 0.72992895619830 0.12500000000000 22.990 > 21 23 Na 0.00000000000000 0.72992895619830 0.62500000000000 22.990 > 21 24 Na 0.50000000000000 0.72992895619830 0.62500000000000 22.990 > 21 25 Na 0.00000000000000 0.27007104380170 0.37500000000000 22.990 > 17 26 Na 0.50000000000000 0.27007104380170 0.37500000000000 22.990 > 17 27 Na 0.00000000000000 0.27007104380170 0.87500000000000 22.990 > 17 28 Na 0.50000000000000 0.27007104380170 0.87500000000000 22.990 > 17 29 Na 0.25000000000000 0.22992895619830 0.12500000000000 22.990 > 21 30 Na 0.75000000000000 0.22992895619830 0.12500000000000 22.990 > 21 31 Na 0.25000000000000 0.22992895619830 0.62500000000000 22.990 > 21 32 Na 0.75000000000000 0.22992895619830 0.62500000000000 22.990 > 21 33 Zn 0.25000000000000 0.51061788362106 0.12500000000000 65.380 > 33 34 Zn 0.75000000000000 0.51061788362106 0.12500000000000 65.380 > 33 35 Zn 0.25000000000000 0.51061788362106 0.62500000000000 65.380 > 33 36 Zn 0.75000000000000 0.51061788362106 0.62500000000000 65.380 > 33 37 Zn 0.00000000000000 0.98938211637894 0.37500000000000 65.380 > 37 38 Zn 0.50000000000000 0.98938211637894 0.37500000000000 65.380 > 37 39 Zn 0.00000000000000 0.98938211637894 0.87500000000000 65.380 > 37 40 Zn 0.50000000000000 0.98938211637894 0.87500000000000 65.380 > 37 41 Zn 0.00000000000000 0.01061788362106 0.12500000000000 65.380 > 33 42 Zn 0.50000000000000 0.01061788362106 0.12500000000000 65.380 > 33 43 Zn 0.00000000000000 0.01061788362106 0.62500000000000 65.380 > 33 44 Zn 0.50000000000000 0.01061788362106 0.62500000000000 65.380 > 33 45 Zn 0.25000000000000 0.48938211637894 0.37500000000000 65.380 > 37 46 Zn 0.75000000000000 0.48938211637894 0.37500000000000 65.380 > 37 47 Zn 0.25000000000000 0.48938211637894 0.87500000000000 65.380 > 37 48 Zn 0.75000000000000 0.48938211637894 0.87500000000000 65.380 > 37 49 O 0.34057366369065 0.60679258991174 0.06569444159517 15.999 > 49 50 O 0.84057366369065 0.60679258991174 0.06569444159517 15.999 > 49 51 O 0.34057366369065 0.60679258991174 0.56569444159517 15.999 > 49 52 O 0.84057366369065 0.60679258991174 0.56569444159517 15.999 > 49 53 O 0.15942633630935 0.60679258991174 0.18430555840483 15.999 > 53 54 O 0.65942633630935 0.60679258991174 0.18430555840483 15.999 > 53 55 O 0.15942633630935 0.60679258991174 0.68430555840483 15.999 > 53 56 O 0.65942633630935 0.60679258991174 0.68430555840483 15.999 > 53 57 O 0.09057366369065 0.89320741008826 0.31569444159517 15.999 > 57 58 O 0.59057366369065 0.89320741008826 0.31569444159517 15.999 > 57 59 O 0.09057366369065 0.89320741008826 0.81569444159517 15.999 > 57 60 O 0.59057366369065 0.89320741008826 0.81569444159517 15.999 > 57 61 O 0.40942633630935 0.89320741008826 0.43430555840483 15.999 > 61 62 O 0.90942633630935 0.89320741008826 0.43430555840483 15.999 > 61 63 O 0.40942633630935 0.89320741008826 0.93430555840483 15.999 > 61 64 O 0.90942633630935 0.89320741008826 0.93430555840483 15.999 > 61 65 O 0.09057366369065 0.10679258991174 0.06569444159517 15.999 > 49 66 O 0.59057366369065 0.10679258991174 0.06569444159517 15.999 > 49 67 O 0.09057366369065 0.10679258991174 0.56569444159517 15.999 > 49 68 O 0.59057366369065 0.10679258991174 0.56569444159517 15.999 > 49 69 O 0.40942633630935 0.10679258991174 0.18430555840483 15.999 > 53 70 O 0.90942633630935 0.10679258991174 0.18430555840483 15.999 > 53 71 O 0.40942633630935 0.10679258991174 0.68430555840483 15.999 > 53 72 O 0.90942633630935 0.10679258991174 0.68430555840483 15.999 > 53 73 O 0.34057366369065 0.39320741008826 0.31569444159517 15.999 > 57 74 O 0.84057366369065 0.39320741008826 0.31569444159517 15.999 > 57 75 O 0.34057366369065 0.39320741008826 0.81569444159517 15.999 > 57 76 O 0.84057366369065 0.39320741008826 0.81569444159517 15.999 > 57 77 O 0.15942633630935 0.39320741008826 0.43430555840483 15.999 > 61 78 O 0.65942633630935 0.39320741008826 0.43430555840483 15.999 > 61 79 O 0.15942633630935 0.39320741008826 0.93430555840483 15.999 > 61 80 O 0.65942633630935 0.39320741008826 0.93430555840483 15.999 > 61 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.4075989 0.0000000 -0.1952993 0.0000000 3.2830276 0.0000000 -0.1952987 0.0000000 3.5510807 -------------------------- Born effective charges -------------------------- 1 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 2 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 3 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 4 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 5 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 6 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 7 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 8 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 9 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 10 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 ---------------------------------------------------------------------------- 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] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0059 0.0000 0.0081] [ 0.0059 0.0000 -0.0081] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000001 (yyx) -0.00000001 (yyx) -0.00000001 (yxy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (xz) 0.00000001 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:16:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:16:42]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.498715488466488 -4.829813605000001 0.000000000000000 b 3.498715488466488 4.829813605000001 0.000000000000000 c -3.265880147937263 0.000000000000000 4.479741844794588 Atomic positions (fractional): 1 K 0.62363577341377 0.37636422658623 0.25000000000000 39.098 2 K 0.37636422658623 0.62363577341377 0.75000000000000 39.098 3 Na 0.72992895619830 0.27007104380171 0.75000000000000 22.990 4 Na 0.27007104380170 0.72992895619830 0.25000000000000 22.990 5 Zn 0.98938211637894 0.01061788362106 0.25000000000000 65.380 6 Zn 0.01061788362106 0.98938211637894 0.75000000000000 65.380 7 O 0.07435473746957 0.28793991729304 0.13138888319034 15.999 8 O 0.71206008270696 0.92564526253043 0.36861111680966 15.999 9 O 0.28793991729304 0.07435473746957 0.63138888319034 15.999 10 O 0.92564526253043 0.71206008270696 0.86861111680966 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 13.994861953865952 0.000000000000000 0.000000000000000 b 0.000000000000000 9.659627210000002 0.000000000000000 c -6.531760295874526 0.000000000000000 8.959483689589176 Atomic positions (fractional): 1 K 0.25000000000000 0.87636422658623 0.12500000000000 39.098 > 1 2 K 0.75000000000000 0.87636422658623 0.12500000000000 39.098 > 1 3 K 0.25000000000000 0.87636422658623 0.62500000000000 39.098 > 1 4 K 0.75000000000000 0.87636422658623 0.62500000000000 39.098 > 1 5 K 0.00000000000000 0.62363577341377 0.37500000000000 39.098 > 5 6 K 0.50000000000000 0.62363577341377 0.37500000000000 39.098 > 5 7 K 0.00000000000000 0.62363577341377 0.87500000000000 39.098 > 5 8 K 0.50000000000000 0.62363577341377 0.87500000000000 39.098 > 5 9 K 0.00000000000000 0.37636422658622 0.12500000000000 39.098 > 1 10 K 0.50000000000000 0.37636422658622 0.12500000000000 39.098 > 1 11 K 0.00000000000000 0.37636422658622 0.62500000000000 39.098 > 1 12 K 0.50000000000000 0.37636422658622 0.62500000000000 39.098 > 1 13 K 0.25000000000000 0.12363577341378 0.37500000000000 39.098 > 5 14 K 0.75000000000000 0.12363577341378 0.37500000000000 39.098 > 5 15 K 0.25000000000000 0.12363577341378 0.87500000000000 39.098 > 5 16 K 0.75000000000000 0.12363577341378 0.87500000000000 39.098 > 5 17 Na 0.25000000000000 0.77007104380170 0.37500000000000 22.990 > 17 18 Na 0.75000000000000 0.77007104380170 0.37500000000000 22.990 > 17 19 Na 0.25000000000000 0.77007104380170 0.87500000000000 22.990 > 17 20 Na 0.75000000000000 0.77007104380170 0.87500000000000 22.990 > 17 21 Na 0.00000000000000 0.72992895619830 0.12500000000000 22.990 > 21 22 Na 0.50000000000000 0.72992895619830 0.12500000000000 22.990 > 21 23 Na 0.00000000000000 0.72992895619830 0.62500000000000 22.990 > 21 24 Na 0.50000000000000 0.72992895619830 0.62500000000000 22.990 > 21 25 Na 0.00000000000000 0.27007104380170 0.37500000000000 22.990 > 17 26 Na 0.50000000000000 0.27007104380170 0.37500000000000 22.990 > 17 27 Na 0.00000000000000 0.27007104380170 0.87500000000000 22.990 > 17 28 Na 0.50000000000000 0.27007104380170 0.87500000000000 22.990 > 17 29 Na 0.25000000000000 0.22992895619830 0.12500000000000 22.990 > 21 30 Na 0.75000000000000 0.22992895619830 0.12500000000000 22.990 > 21 31 Na 0.25000000000000 0.22992895619830 0.62500000000000 22.990 > 21 32 Na 0.75000000000000 0.22992895619830 0.62500000000000 22.990 > 21 33 Zn 0.25000000000000 0.51061788362106 0.12500000000000 65.380 > 33 34 Zn 0.75000000000000 0.51061788362106 0.12500000000000 65.380 > 33 35 Zn 0.25000000000000 0.51061788362106 0.62500000000000 65.380 > 33 36 Zn 0.75000000000000 0.51061788362106 0.62500000000000 65.380 > 33 37 Zn 0.00000000000000 0.98938211637894 0.37500000000000 65.380 > 37 38 Zn 0.50000000000000 0.98938211637894 0.37500000000000 65.380 > 37 39 Zn 0.00000000000000 0.98938211637894 0.87500000000000 65.380 > 37 40 Zn 0.50000000000000 0.98938211637894 0.87500000000000 65.380 > 37 41 Zn 0.00000000000000 0.01061788362106 0.12500000000000 65.380 > 33 42 Zn 0.50000000000000 0.01061788362106 0.12500000000000 65.380 > 33 43 Zn 0.00000000000000 0.01061788362106 0.62500000000000 65.380 > 33 44 Zn 0.50000000000000 0.01061788362106 0.62500000000000 65.380 > 33 45 Zn 0.25000000000000 0.48938211637894 0.37500000000000 65.380 > 37 46 Zn 0.75000000000000 0.48938211637894 0.37500000000000 65.380 > 37 47 Zn 0.25000000000000 0.48938211637894 0.87500000000000 65.380 > 37 48 Zn 0.75000000000000 0.48938211637894 0.87500000000000 65.380 > 37 49 O 0.34057366369065 0.60679258991174 0.06569444159517 15.999 > 49 50 O 0.84057366369065 0.60679258991174 0.06569444159517 15.999 > 49 51 O 0.34057366369065 0.60679258991174 0.56569444159517 15.999 > 49 52 O 0.84057366369065 0.60679258991174 0.56569444159517 15.999 > 49 53 O 0.15942633630935 0.60679258991174 0.18430555840483 15.999 > 53 54 O 0.65942633630935 0.60679258991174 0.18430555840483 15.999 > 53 55 O 0.15942633630935 0.60679258991174 0.68430555840483 15.999 > 53 56 O 0.65942633630935 0.60679258991174 0.68430555840483 15.999 > 53 57 O 0.09057366369065 0.89320741008826 0.31569444159517 15.999 > 57 58 O 0.59057366369065 0.89320741008826 0.31569444159517 15.999 > 57 59 O 0.09057366369065 0.89320741008826 0.81569444159517 15.999 > 57 60 O 0.59057366369065 0.89320741008826 0.81569444159517 15.999 > 57 61 O 0.40942633630935 0.89320741008826 0.43430555840483 15.999 > 61 62 O 0.90942633630935 0.89320741008826 0.43430555840483 15.999 > 61 63 O 0.40942633630935 0.89320741008826 0.93430555840483 15.999 > 61 64 O 0.90942633630935 0.89320741008826 0.93430555840483 15.999 > 61 65 O 0.09057366369065 0.10679258991174 0.06569444159517 15.999 > 49 66 O 0.59057366369065 0.10679258991174 0.06569444159517 15.999 > 49 67 O 0.09057366369065 0.10679258991174 0.56569444159517 15.999 > 49 68 O 0.59057366369065 0.10679258991174 0.56569444159517 15.999 > 49 69 O 0.40942633630935 0.10679258991174 0.18430555840483 15.999 > 53 70 O 0.90942633630935 0.10679258991174 0.18430555840483 15.999 > 53 71 O 0.40942633630935 0.10679258991174 0.68430555840483 15.999 > 53 72 O 0.90942633630935 0.10679258991174 0.68430555840483 15.999 > 53 73 O 0.34057366369065 0.39320741008826 0.31569444159517 15.999 > 57 74 O 0.84057366369065 0.39320741008826 0.31569444159517 15.999 > 57 75 O 0.34057366369065 0.39320741008826 0.81569444159517 15.999 > 57 76 O 0.84057366369065 0.39320741008826 0.81569444159517 15.999 > 57 77 O 0.15942633630935 0.39320741008826 0.43430555840483 15.999 > 61 78 O 0.65942633630935 0.39320741008826 0.43430555840483 15.999 > 61 79 O 0.15942633630935 0.39320741008826 0.93430555840483 15.999 > 61 80 O 0.65942633630935 0.39320741008826 0.93430555840483 15.999 > 61 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.4075989 0.0000000 -0.1952993 0.0000000 3.2830276 0.0000000 -0.1952987 0.0000000 3.5510807 -------------------------- Born effective charges -------------------------- 1 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 2 K 1.1721611 0.0000000 0.1289743 0.0000000 1.1512411 0.0000000 0.0885124 0.0000000 1.2061382 3 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 4 Na 0.9162327 0.0000000 0.0075059 0.0000000 1.0699678 0.0000000 0.0353780 0.0000000 0.9006900 5 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 6 Zn 1.6997504 0.0000000 -0.4980922 0.0000000 1.3576928 0.0000000 -0.4532188 0.0000000 1.9955767 7 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 8 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 9 O -1.8940721 0.2525635 0.1808060 0.2517438 -1.7894508 0.1814265 0.1646642 0.2281572 -2.0512025 10 O -1.8940721 -0.2525635 0.1808060 -0.2517438 -1.7894508 -0.1814265 0.1646642 -0.2281572 -2.0512025 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000001 (yyx) -0.00000001 (yyx) -0.00000001 (yxy) 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 ... [ 10 10 11 ] 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: 0.78, Number of G-points: 301, Lambda: 0.15 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/306) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.630 ( 0.000 0.000 0.000) 0.000 2.368 ( 0.000 0.000 0.000) 0.000 2.636 ( 0.000 0.000 0.000) 0.000 2.649 ( 0.000 0.000 0.000) 0.000 3.100 ( 0.000 0.000 0.000) 0.000 3.868 ( 0.000 0.000 0.000) 0.000 4.214 ( 0.000 0.000 0.000) 0.000 4.454 ( 0.000 0.000 0.000) 0.000 5.363 ( 0.000 0.000 0.000) 0.000 5.819 ( 0.000 0.000 0.000) 0.000 6.749 ( 0.000 0.000 0.000) 0.000 6.881 ( 0.000 0.000 0.000) 0.000 7.195 ( 0.000 0.000 0.000) 0.000 7.247 ( 0.000 0.000 0.000) 0.000 7.404 ( 0.000 0.000 0.000) 0.000 7.545 ( 0.000 0.000 0.000) 0.000 7.923 ( 0.000 0.000 0.000) 0.000 8.355 ( 0.000 0.000 0.000) 0.000 8.761 ( 0.000 0.000 0.000) 0.000 9.766 ( 0.000 0.000 0.000) 0.000 10.582 ( 0.000 0.000 0.000) 0.000 10.942 ( 0.000 0.000 0.000) 0.000 11.338 ( 0.000 0.000 0.000) 0.000 13.113 ( 0.000 0.000 0.000) 0.000 14.183 ( 0.000 0.000 0.000) 0.000 15.539 ( 0.000 0.000 0.000) 0.000 15.635 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/306) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.422 ( 15.324 -2.602 15.645) 22.053 0.613 ( 21.660 -13.952 14.710) 29.668 1.054 ( 39.876 -19.952 21.108) 49.333 2.005 ( 31.260 28.360 -17.311) 45.619 2.399 ( 4.448 -0.951 -1.929) 4.941 2.695 ( 1.383 -5.899 1.394) 6.217 2.889 ( -9.977 -20.154 -16.430) 27.851 3.239 ( 10.045 -11.554 -6.385) 16.589 3.934 ( 9.654 0.405 -0.723) 9.689 4.158 ( -2.909 3.359 -3.015) 5.370 4.755 ( 0.435 10.785 16.322) 19.568 5.315 ( -1.906 4.204 -2.514) 5.256 5.782 ( -6.840 -1.637 -3.788) 7.989 6.699 ( -1.547 1.960 -4.159) 4.851 6.846 ( -5.309 -0.496 -1.835) 5.639 7.007 ( -2.081 13.685 -2.557) 14.077 7.414 ( -0.027 -16.171 -1.392) 16.230 7.528 ( 0.349 -3.741 5.166) 6.388 7.802 ( 2.479 5.363 -9.370) 11.077 8.015 ( 9.086 -6.648 -11.283) 15.939 8.452 ( -2.290 -14.293 -12.905) 19.392 8.763 ( -0.210 -8.868 -8.273) 12.130 10.590 ( -0.188 3.022 4.938) 5.792 10.616 ( -44.295 31.573 96.732) 110.977 10.930 ( 1.337 0.874 -3.213) 3.588 11.683 ( -51.755 -40.206 27.731) 71.163 13.987 ( 26.192 29.261 -7.826) 40.043 15.104 ( 27.764 0.473 -49.440) 56.704 15.590 ( 2.988 -4.356 -2.442) 5.819 15.664 ( 4.394 -2.245 -1.819) 5.259 ======================= Grid point 2 (3/306) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.806 ( 13.362 -1.781 13.764) 19.266 1.207 ( 20.203 -13.308 14.355) 28.131 1.806 ( 19.129 1.436 -0.167) 19.184 2.081 ( 21.467 -0.975 4.136) 21.884 2.462 ( 6.754 0.002 -2.100) 7.073 2.815 ( -5.571 -7.363 -2.637) 9.603 2.878 ( 6.692 -12.834 7.624) 16.359 3.459 ( 11.645 -6.824 0.376) 13.502 4.002 ( -5.076 5.180 -5.855) 9.321 4.102 ( 14.390 0.742 -1.585) 14.496 4.823 ( 3.766 6.909 6.979) 10.517 5.171 ( -4.920 7.798 -3.106) 9.729 5.656 ( -9.750 -6.671 -3.547) 12.334 6.590 ( -4.841 4.103 -6.457) 9.054 6.668 ( -4.828 3.418 -6.922) 9.105 6.879 ( -4.242 5.494 2.661) 7.434 7.481 ( -1.847 -6.438 -7.819) 10.296 7.629 ( 2.152 0.409 6.349) 6.716 7.743 ( 0.359 -0.863 1.344) 1.637 8.089 ( 5.349 -2.200 -2.695) 6.380 8.421 ( -2.080 -2.833 -4.171) 5.454 8.762 ( -0.320 -11.263 -11.326) 15.976 10.618 ( 2.492 0.819 1.153) 2.866 10.677 ( -24.366 13.118 53.190) 59.958 10.900 ( 3.663 1.085 -7.133) 8.091 11.629 ( -26.157 -18.849 10.060) 33.774 13.973 ( 13.461 15.235 -4.822) 20.894 14.977 ( 9.553 2.603 -21.829) 23.970 15.632 ( 0.836 -2.308 -0.486) 2.502 15.758 ( 5.694 -4.546 -2.606) 7.738 ======================= Grid point 3 (4/306) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.118 ( 9.436 -1.126 11.570) 14.972 1.742 ( 16.063 -10.887 8.288) 21.100 1.820 ( 7.401 6.600 -3.991) 10.690 2.382 ( 7.627 -5.596 -2.631) 9.819 2.553 ( 4.978 3.424 5.449) 8.136 2.821 ( -0.988 -5.235 0.061) 5.328 3.361 ( 18.691 -14.259 15.247) 28.021 3.718 ( 10.691 -4.594 3.909) 12.276 3.783 ( -6.339 2.503 -7.164) 9.888 4.283 ( 13.054 -0.314 -3.016) 13.401 4.819 ( 1.350 9.211 -0.494) 9.322 4.990 ( -3.990 7.335 -1.817) 8.545 5.602 ( -6.528 -8.155 1.359) 10.534 6.315 ( -8.241 7.704 -10.345) 15.306 6.585 ( -0.002 -1.203 -5.572) 5.700 6.772 ( -8.301 3.814 3.012) 9.619 7.406 ( -0.262 1.380 -4.428) 4.645 7.696 ( 1.282 1.972 3.938) 4.587 7.810 ( -1.658 -9.356 0.045) 9.502 8.161 ( 4.082 0.649 2.028) 4.604 8.366 ( -1.628 1.341 -2.525) 3.290 8.749 ( -0.642 -8.792 -9.862) 13.228 10.667 ( 3.571 0.360 0.929) 3.708 10.745 ( -18.881 6.489 38.111) 43.024 10.870 ( 7.130 0.403 -11.817) 13.807 11.539 ( -16.918 -10.426 3.064) 20.108 13.958 ( 8.395 9.518 -3.345) 13.125 14.880 ( 4.499 1.661 -11.743) 12.684 15.659 ( 0.606 -1.642 -0.198) 1.762 15.846 ( 3.659 -3.465 -1.724) 5.326 ======================= Grid point 4 (5/306) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 4.071 -0.801 8.089) 9.091 1.734 ( 3.725 4.091 -7.229) 9.103 2.155 ( 8.454 -7.370 6.931) 13.184 2.478 ( 5.489 -3.476 -2.608) 7.001 2.623 ( 0.949 3.734 7.603) 8.523 2.885 ( 2.359 -4.847 0.219) 5.395 3.485 ( -7.578 5.520 -8.585) 12.712 3.876 ( 14.345 -3.370 10.499) 18.093 4.070 ( 10.072 -12.577 10.081) 19.006 4.353 ( 0.038 -2.199 -7.952) 8.251 4.727 ( 2.323 9.599 2.101) 10.097 4.861 ( -0.512 5.338 -5.713) 7.836 5.658 ( -2.955 -6.729 6.890) 10.074 6.028 ( -5.438 6.128 -11.147) 13.834 6.530 ( -0.603 0.927 -5.295) 5.409 6.658 ( -6.797 0.773 2.789) 7.387 7.385 ( 1.852 0.843 -0.168) 2.042 7.707 ( -0.583 0.951 0.646) 1.289 7.868 ( -1.715 -7.211 -0.957) 7.474 8.228 ( 2.789 3.021 4.416) 6.034 8.303 ( -0.975 1.156 -2.789) 3.173 8.725 ( -0.739 -4.676 -5.867) 7.539 10.724 ( 2.927 0.402 1.117) 3.159 10.789 ( -13.151 3.036 23.639) 27.221 10.854 ( 7.709 -0.402 -11.408) 13.775 11.440 ( -9.460 -4.876 0.048) 10.643 13.948 ( 4.279 4.789 -1.737) 6.653 14.826 ( 2.009 0.638 -5.314) 5.717 15.678 ( 0.328 -0.933 -0.113) 0.995 15.897 ( 1.690 -1.736 -0.856) 2.569 ======================= Grid point 5 (6/306) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 276 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 0.000 -0.000 0.000) 0.000 1.698 ( 0.000 -0.000 0.000) 0.000 2.276 ( 0.000 -0.000 0.000) 0.000 2.534 ( 0.000 0.000 -0.000) 0.000 2.660 ( 0.000 -0.000 0.000) 0.000 2.963 ( 0.000 -0.000 0.000) 0.000 3.309 ( 0.000 0.000 0.000) 0.000 4.131 ( -0.000 -0.000 -0.000) 0.000 4.215 ( 0.000 0.000 0.000) 0.000 4.311 ( 0.000 -0.000 0.000) 0.000 4.707 ( 0.000 -0.000 0.000) 0.000 4.788 ( 0.000 -0.000 -0.000) 0.000 5.768 ( 0.000 0.000 -0.000) 0.000 5.838 ( 0.000 -0.000 0.000) 0.000 6.479 ( 0.000 -0.000 0.000) 0.000 6.625 ( 0.000 -0.000 0.000) 0.000 7.403 ( 0.000 -0.000 0.000) 0.000 7.695 ( 0.000 -0.000 0.000) 0.000 7.888 ( 0.000 0.000 0.000) 0.000 8.259 ( 0.000 0.000 0.000) 0.000 8.272 ( -0.000 -0.000 -0.000) 0.000 8.711 ( 0.000 -0.000 0.000) 0.000 10.750 ( 0.000 -0.000 0.000) 0.000 10.802 ( -0.000 0.000 0.000) 0.000 10.854 ( 0.000 -0.000 -0.000) 0.000 11.394 ( 0.000 -0.000 0.000) 0.000 13.945 ( 0.000 -0.000 0.000) 0.000 14.810 ( 0.000 -0.000 0.000) 0.000 15.685 ( 0.000 -0.000 0.000) 0.000 15.913 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/306) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( 15.753 0.000 16.031) 22.476 1.024 ( 24.693 0.000 13.184) 27.992 1.762 ( 35.074 0.000 15.623) 38.396 2.224 ( 2.269 0.000 -12.450) 12.655 2.431 ( 26.222 0.000 -20.438) 33.246 2.674 ( -6.524 -0.000 10.869) 12.676 2.745 ( 4.613 0.000 5.363) 7.074 3.361 ( 11.397 0.000 5.346) 12.588 4.063 ( -6.313 -0.000 -6.036) 8.734 4.108 ( 15.066 0.000 -2.055) 15.206 4.919 ( 1.205 0.000 8.789) 8.871 5.253 ( -3.325 -0.000 -5.308) 6.263 5.575 ( -12.106 -0.000 -4.651) 12.968 6.627 ( -2.656 -0.000 -5.246) 5.880 6.687 ( -8.998 -0.000 -6.961) 11.377 7.014 ( -3.920 -0.000 -2.040) 4.419 7.314 ( 1.900 0.000 -2.455) 3.104 7.608 ( 1.057 0.000 7.443) 7.517 7.788 ( -2.710 -0.000 -1.184) 2.957 8.100 ( 14.260 0.000 -5.006) 15.113 8.346 ( 1.993 0.000 -3.779) 4.272 8.629 ( -3.987 -0.000 -3.123) 5.065 10.619 ( 1.769 0.000 1.282) 2.185 10.898 ( -22.638 -0.000 28.607) 36.481 10.945 ( -28.755 -0.000 39.016) 48.467 11.314 ( -2.145 -0.000 0.455) 2.193 14.189 ( 1.082 0.000 -0.656) 1.265 15.021 ( 21.721 0.000 -40.525) 45.979 15.587 ( 1.774 0.000 2.087) 2.739 15.692 ( 4.343 0.000 -1.461) 4.582 ======================= Grid point 13 (8/306) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( 13.923 4.800 13.048) 19.676 1.536 ( 19.993 -7.458 13.533) 25.269 2.023 ( 8.708 11.298 -10.171) 17.519 2.237 ( 9.727 -8.706 -7.612) 15.111 2.624 ( 9.862 3.625 1.282) 10.585 2.722 ( -1.168 -4.106 3.154) 5.307 3.088 ( 20.550 -8.802 20.631) 30.420 3.612 ( 12.305 -3.424 5.307) 13.832 3.856 ( -9.344 2.130 -9.478) 13.478 4.279 ( 11.906 -0.090 -4.493) 12.726 4.987 ( 2.849 5.382 1.816) 6.355 5.114 ( -5.005 4.509 -4.856) 8.304 5.438 ( -6.907 -6.508 1.883) 9.675 6.438 ( -8.519 3.810 -10.795) 14.269 6.546 ( -2.731 -2.272 -5.613) 6.643 6.900 ( -6.189 6.875 1.923) 9.448 7.340 ( 0.868 -6.223 -4.635) 7.807 7.670 ( -2.358 -1.661 4.381) 5.245 7.730 ( -4.214 -0.082 0.902) 4.310 8.228 ( 9.589 5.232 0.657) 10.943 8.362 ( 3.253 -3.262 -4.346) 6.333 8.592 ( -1.080 -4.360 -1.748) 4.820 10.668 ( 3.648 -0.010 0.604) 3.698 10.860 ( -10.954 1.459 12.645) 16.793 10.906 ( -14.903 4.808 21.751) 26.802 11.330 ( -7.350 -7.918 3.184) 11.264 14.163 ( 3.271 7.452 -1.244) 8.233 14.888 ( 8.172 -0.396 -24.274) 25.616 15.643 ( 1.834 0.064 2.324) 2.961 15.761 ( 4.064 -3.551 -1.091) 5.506 ======================= Grid point 14 (9/306) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 9.985 6.880 9.487) 15.396 1.867 ( 6.435 7.346 -7.652) 12.407 2.022 ( 12.037 -4.416 8.897) 15.606 2.360 ( 7.529 -8.177 -7.073) 13.175 2.688 ( -1.528 2.497 7.756) 8.290 2.788 ( 3.753 -3.589 -1.096) 5.307 3.574 ( -10.483 2.591 -10.974) 15.396 3.717 ( 18.914 -9.574 19.509) 28.810 3.878 ( 11.810 -5.427 3.753) 13.529 4.315 ( 0.130 -1.222 -7.316) 7.418 4.928 ( 0.690 8.448 -2.692) 8.893 4.951 ( -4.381 3.360 -4.294) 6.995 5.531 ( 1.330 -5.405 8.260) 9.961 6.165 ( -4.565 6.325 -11.894) 14.224 6.500 ( 0.312 -3.875 -5.822) 7.000 6.743 ( -8.549 7.448 3.395) 11.836 7.370 ( 1.650 -3.416 -1.962) 4.271 7.685 ( -4.841 -5.853 0.392) 7.606 7.693 ( -3.588 -2.710 1.123) 4.635 8.275 ( 3.766 1.858 -2.345) 4.810 8.404 ( 4.951 5.189 2.092) 7.471 8.633 ( 1.264 -3.590 0.645) 3.860 10.728 ( 4.835 0.118 -1.449) 5.049 10.817 ( 2.048 -0.216 -7.430) 7.710 10.887 ( -16.465 3.088 24.959) 30.059 11.333 ( -5.423 -4.951 3.394) 8.090 14.108 ( 3.722 9.422 -2.129) 10.352 14.781 ( 1.506 -4.485 -13.863) 14.648 15.683 ( 1.700 1.429 2.170) 3.105 15.840 ( 2.318 -3.512 -0.132) 4.210 ======================= Grid point 15 (10/306) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( 6.117 8.917 3.566) 11.386 1.764 ( 2.409 6.207 -6.346) 9.198 2.254 ( 5.520 -1.945 2.647) 6.424 2.485 ( 2.821 -5.716 -0.031) 6.374 2.689 ( -3.064 2.865 2.234) 4.752 2.894 ( 3.717 -5.058 1.135) 6.379 3.324 ( -5.872 0.483 -6.329) 8.647 4.058 ( 2.047 -5.886 -7.073) 9.426 4.183 ( 6.435 -5.684 8.799) 12.294 4.230 ( 0.754 -2.417 4.360) 5.042 4.782 ( -7.112 5.122 -1.969) 8.983 4.824 ( -2.788 2.667 -6.129) 7.242 5.721 ( 6.117 -1.787 9.958) 11.823 5.952 ( 1.116 7.781 -9.868) 12.616 6.504 ( 4.367 -0.994 -5.936) 7.436 6.612 ( -6.803 2.114 5.059) 8.738 7.405 ( 0.156 -0.344 0.184) 0.420 7.658 ( -3.937 -3.686 -0.248) 5.399 7.731 ( -1.952 -9.870 0.386) 10.068 8.261 ( 1.735 0.345 -5.301) 5.589 8.423 ( 3.409 10.031 5.112) 11.764 8.710 ( 2.442 -0.249 5.112) 5.670 10.748 ( 2.005 -0.343 -5.719) 6.070 10.778 ( 8.764 -1.390 -15.800) 18.121 10.882 ( -15.549 1.816 22.527) 27.432 11.379 ( 2.123 -1.294 4.797) 5.403 14.030 ( 1.217 7.800 -2.538) 8.293 14.738 ( -1.260 -6.693 -5.991) 9.070 15.708 ( 1.240 2.098 1.983) 3.142 15.892 ( 0.432 -2.013 0.747) 2.190 ======================= Grid point 16 (11/306) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( 2.000 10.481 -6.666) 12.581 1.711 ( -0.713 1.758 2.344) 3.016 2.301 ( 0.003 5.318 -0.813) 5.380 2.523 ( -4.116 -2.114 2.584) 5.300 2.553 ( -4.814 1.534 -9.940) 11.151 2.939 ( -2.054 -0.549 1.059) 2.375 3.366 ( 6.179 -5.511 4.906) 9.624 3.870 ( -13.453 -3.377 -9.783) 16.974 4.285 ( -2.191 5.921 -6.812) 9.288 4.379 ( 4.751 -0.835 7.596) 8.998 4.586 ( -10.454 -2.332 -4.715) 11.702 4.755 ( -3.058 -3.817 3.201) 5.845 5.813 ( 5.495 8.308 -7.121) 12.245 5.945 ( 6.043 -1.358 9.873) 11.655 6.528 ( 3.827 1.264 2.016) 4.507 6.627 ( 1.984 -3.333 0.078) 3.880 7.368 ( -3.996 -0.478 -0.930) 4.131 7.640 ( -4.493 -5.677 -1.813) 7.463 7.858 ( 3.675 -6.144 4.074) 8.237 8.216 ( 1.770 1.457 -5.693) 6.137 8.408 ( 2.023 9.790 4.794) 11.087 8.808 ( 2.402 3.071 9.470) 10.242 10.695 ( 4.230 -2.639 -15.025) 15.831 10.742 ( 6.114 -0.844 -14.250) 15.529 10.872 ( -12.971 1.039 17.735) 21.997 11.521 ( 11.038 2.779 5.165) 12.500 13.934 ( -3.256 3.438 -1.616) 5.003 14.754 ( -1.747 -6.168 0.081) 6.412 15.715 ( 0.420 2.448 1.662) 2.989 15.909 ( -1.467 -0.538 1.353) 2.067 ======================= Grid point 17 (12/306) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( -3.742 9.936 -10.198) 14.722 1.727 ( -2.277 -0.938 3.600) 4.361 2.026 ( -13.571 15.026 -7.642) 21.641 2.446 ( 0.705 -3.295 -10.723) 11.240 2.496 ( -5.328 1.557 4.997) 7.469 2.919 ( -0.243 3.454 1.696) 3.855 3.523 ( -8.017 -0.130 -0.923) 8.070 3.645 ( -3.416 -5.161 -0.923) 6.258 3.972 ( -7.972 14.414 -9.974) 19.256 4.293 ( -14.686 0.621 0.191) 14.700 4.640 ( 3.633 -7.712 1.759) 8.705 4.821 ( -1.430 -8.483 1.749) 8.779 5.767 ( 7.215 7.940 -2.422) 10.999 6.164 ( 6.835 -5.465 8.118) 11.937 6.604 ( 0.147 0.824 5.815) 5.875 6.713 ( 7.520 -3.274 -2.939) 8.713 7.335 ( -2.893 -4.275 1.408) 5.350 7.604 ( -5.392 -6.658 -3.784) 9.365 7.981 ( 3.761 4.772 3.793) 7.163 8.185 ( 3.286 2.197 -1.935) 4.401 8.396 ( 2.673 5.943 3.434) 7.366 8.905 ( 1.101 5.861 12.924) 14.233 10.605 ( 6.094 -4.944 -24.691) 25.908 10.682 ( 3.141 -0.225 -10.472) 10.935 10.864 ( -9.221 -0.090 12.458) 15.499 11.726 ( 18.568 7.257 2.815) 20.133 13.835 ( -8.588 -1.812 0.591) 8.796 14.816 ( -1.112 -4.496 5.140) 6.919 15.704 ( -0.555 2.474 1.264) 2.833 15.887 ( -3.726 0.575 1.444) 4.037 ======================= Grid point 18 (13/306) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( -6.776 10.324 -11.264) 16.715 1.521 ( -15.259 15.522 -12.218) 24.961 1.738 ( -6.948 0.089 4.337) 8.191 2.272 ( -11.259 10.837 -8.435) 17.758 2.441 ( -4.768 -0.967 0.426) 4.883 2.928 ( 5.624 3.936 2.302) 7.240 3.195 ( -10.384 14.610 -5.963) 18.890 3.568 ( -10.966 3.619 -3.181) 11.977 3.881 ( 3.514 -4.971 5.686) 8.330 4.086 ( -13.603 -0.581 -0.144) 13.616 4.689 ( -5.050 -5.677 -3.298) 8.283 4.966 ( 4.837 -11.091 0.758) 12.124 5.803 ( 8.377 6.985 2.107) 11.108 6.419 ( 7.110 -9.632 5.617) 13.224 6.629 ( -2.177 -0.302 4.290) 4.821 6.818 ( 5.855 -2.571 -2.817) 6.988 7.419 ( 0.129 -8.220 4.950) 9.596 7.551 ( -4.618 -6.024 -4.379) 8.763 7.931 ( 0.897 11.753 -0.614) 11.803 8.203 ( 2.423 7.820 4.841) 9.511 8.459 ( 6.872 1.848 3.495) 7.928 8.981 ( -1.518 8.492 16.276) 18.421 10.443 ( 6.890 -8.007 -37.560) 39.017 10.629 ( 0.758 0.221 -4.879) 4.942 10.873 ( -4.803 -1.391 7.043) 8.638 11.954 ( 27.136 12.059 -2.147) 29.772 13.731 ( -15.906 -6.795 3.462) 17.639 14.925 ( 0.194 -2.675 10.249) 10.594 15.676 ( -1.728 1.985 0.928) 2.791 15.818 ( -6.280 1.172 0.694) 6.426 ======================= Grid point 19 (14/306) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.611 ( -5.961 11.996 -12.428) 18.273 1.006 ( -12.327 22.240 -8.677) 26.867 1.590 ( -14.779 18.940 -4.020) 24.358 1.758 ( -19.349 7.867 -4.064) 21.279 2.399 ( -1.793 -0.944 -1.675) 2.629 2.914 ( -2.441 14.183 -2.014) 14.532 3.058 ( 12.532 3.309 2.640) 13.228 3.402 ( -10.357 1.790 8.666) 13.622 3.923 ( -9.053 -0.447 0.341) 9.071 4.047 ( 2.161 -6.717 4.412) 8.322 4.590 ( -5.700 -4.918 -10.514) 12.931 5.148 ( 2.574 -10.520 1.001) 10.876 5.877 ( 6.376 5.955 2.751) 9.148 6.629 ( 1.289 -5.781 2.767) 6.538 6.701 ( 2.308 -10.201 3.424) 11.005 6.868 ( 2.190 -1.538 -2.201) 3.465 7.478 ( -4.046 -6.166 -3.319) 8.087 7.618 ( 3.352 -7.176 5.357) 9.562 7.786 ( -0.741 13.589 -1.196) 13.662 8.188 ( 0.562 9.253 5.769) 10.919 8.622 ( 11.801 4.181 8.610) 15.195 9.030 ( -5.679 11.276 24.315) 27.397 10.168 ( 6.237 -11.391 -54.240) 55.773 10.597 ( 0.095 0.309 -1.859) 1.887 10.899 ( -1.601 -2.025 2.915) 3.894 12.235 ( 42.771 15.300 -9.581) 46.425 13.554 ( -31.269 -10.182 7.005) 33.623 15.094 ( 2.116 -0.603 15.708) 15.861 15.621 ( -6.575 -0.337 -0.378) 6.595 15.710 ( -4.813 1.907 -0.829) 5.243 ======================= Grid point 20 (15/306) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.321 ( 0.000 15.036 0.000) 15.036 0.595 ( 0.000 28.003 0.000) 28.003 0.957 ( 0.000 45.065 0.000) 45.065 1.604 ( -0.000 -1.615 -0.000) 1.615 2.378 ( 0.000 0.377 0.000) 0.377 2.763 ( 0.000 10.396 0.000) 10.396 3.138 ( 0.000 3.325 0.000) 3.325 3.473 ( -0.000 -5.706 -0.000) 5.706 3.859 ( -0.000 -0.607 -0.000) 0.607 4.159 ( -0.000 -5.130 -0.000) 5.130 4.456 ( 0.000 0.092 0.000) 0.092 5.267 ( -0.000 -8.260 -0.000) 8.260 5.883 ( 0.000 5.222 0.000) 5.222 6.702 ( -0.000 -4.353 -0.000) 4.353 6.869 ( -0.000 -6.507 -0.000) 6.507 6.889 ( -0.000 -8.841 -0.000) 8.841 7.475 ( -0.000 -2.483 -0.000) 2.483 7.605 ( 0.000 15.212 0.000) 15.212 7.784 ( -0.000 -9.566 -0.000) 9.566 8.143 ( 0.000 7.737 0.000) 7.737 8.784 ( 0.000 2.029 0.000) 2.029 9.198 ( 0.000 2.581 0.000) 2.581 9.766 ( 0.000 0.016 0.000) 0.016 10.585 ( 0.000 0.269 0.000) 0.269 10.924 ( -0.000 -1.729 -0.000) 1.729 12.669 ( -0.000 -1.020 -0.000) 1.020 13.159 ( 0.000 4.347 0.000) 4.347 15.264 ( 0.000 0.462 0.000) 0.462 15.513 ( -0.000 -2.494 -0.000) 2.494 15.658 ( 0.000 2.019 0.000) 2.019 ======================= Grid point 23 (16/306) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( 11.051 0.000 10.090) 14.965 1.897 ( 14.621 0.000 13.679) 20.022 2.075 ( 5.969 0.000 -11.606) 13.051 2.202 ( 8.108 0.000 -9.294) 12.334 2.717 ( -3.559 -0.000 8.231) 8.967 2.750 ( 6.771 0.000 -3.385) 7.570 3.573 ( -0.140 -0.000 2.660) 2.664 3.630 ( 9.421 0.000 7.625) 12.120 3.820 ( 11.962 0.000 3.208) 12.385 4.303 ( -0.054 -0.000 -6.980) 6.980 4.980 ( -3.530 -0.000 -4.462) 5.690 5.037 ( -3.887 -0.000 -5.356) 6.618 5.463 ( 5.179 0.000 10.683) 11.872 6.248 ( -2.953 -0.000 -11.716) 12.083 6.436 ( -2.320 -0.000 -5.344) 5.826 6.860 ( -7.909 -0.000 2.249) 8.223 7.291 ( 2.015 0.000 -1.980) 2.825 7.637 ( -4.768 -0.000 1.064) 4.886 7.659 ( -5.624 -0.000 0.920) 5.698 8.298 ( 2.525 0.000 -6.839) 7.290 8.458 ( 10.188 0.000 4.305) 11.060 8.596 ( 0.655 0.000 4.743) 4.788 10.729 ( 5.660 0.000 -2.397) 6.147 10.812 ( 3.757 0.000 -11.464) 12.064 10.928 ( -24.396 -0.000 32.463) 40.608 11.272 ( -1.245 -0.000 3.342) 3.566 14.239 ( 2.444 0.000 1.285) 2.761 14.707 ( 1.656 0.000 -21.371) 21.435 15.716 ( 2.129 0.000 4.237) 4.741 15.783 ( 3.059 0.000 -0.588) 3.115 ======================= Grid point 24 (17/306) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 7.455 6.054 5.867) 11.253 1.945 ( 3.901 10.249 -9.279) 14.365 2.210 ( 7.972 -1.734 0.895) 8.208 2.296 ( 3.764 -10.728 2.997) 11.757 2.756 ( 0.413 2.760 4.735) 5.497 2.811 ( 4.289 -2.465 -1.203) 5.091 3.312 ( -10.024 -1.101 -9.727) 14.011 3.951 ( 3.405 -3.174 -10.038) 11.065 4.066 ( 11.199 -3.444 15.832) 19.696 4.214 ( -2.526 -0.258 2.573) 3.615 4.863 ( -7.514 2.092 -4.324) 8.919 4.869 ( -6.790 1.385 -6.572) 9.550 5.703 ( 10.272 -0.247 11.000) 15.052 6.117 ( 4.329 7.058 -9.599) 12.677 6.397 ( 1.370 -6.309 -5.951) 8.781 6.734 ( -7.747 5.824 2.635) 10.044 7.349 ( 1.662 -4.485 1.034) 4.894 7.563 ( -6.578 -1.978 -0.711) 6.906 7.621 ( -2.178 -2.319 1.902) 3.706 8.266 ( 3.140 0.136 -6.672) 7.375 8.601 ( 4.699 6.397 6.457) 10.232 8.690 ( 3.042 -2.065 7.209) 8.092 10.735 ( 5.981 -0.585 -16.888) 17.925 10.762 ( 5.745 -0.213 -8.057) 9.898 10.912 ( -20.027 0.885 26.656) 33.353 11.353 ( 3.986 -0.863 7.754) 8.761 14.234 ( 2.281 10.274 -1.170) 10.589 14.556 ( -2.334 -9.548 -12.514) 15.912 15.763 ( 1.396 2.992 3.214) 4.608 15.837 ( 1.186 -2.973 1.067) 3.374 ======================= Grid point 25 (18/306) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( 4.016 13.127 -3.136) 14.081 1.788 ( 0.182 5.514 -3.889) 6.750 2.294 ( 5.840 -6.233 -8.641) 12.150 2.448 ( -5.673 -2.794 11.460) 13.089 2.702 ( -1.721 10.451 -3.892) 11.285 2.876 ( -0.037 -4.007 0.796) 4.086 3.241 ( 3.091 -7.513 -0.070) 8.124 3.775 ( -11.140 -4.459 -12.574) 17.381 4.308 ( 2.596 -1.903 4.524) 5.553 4.330 ( 6.355 -2.277 5.673) 8.817 4.602 ( -14.784 1.484 -5.503) 15.845 4.734 ( -5.449 1.199 -3.204) 6.434 5.951 ( 9.284 2.136 9.140) 13.202 6.012 ( 5.863 9.750 -6.628) 13.167 6.473 ( 6.080 -8.484 -5.844) 11.962 6.618 ( -4.606 4.252 4.211) 7.552 7.360 ( -5.272 -0.962 -0.803) 5.419 7.490 ( -7.823 -7.101 -1.933) 10.741 7.743 ( 8.104 -3.838 6.996) 11.373 8.246 ( 4.064 1.135 -5.836) 7.201 8.618 ( 0.725 9.014 6.173) 10.949 8.843 ( 3.423 0.212 10.182) 10.744 10.640 ( 6.533 -2.163 -21.225) 22.312 10.736 ( 3.585 -0.065 -9.512) 10.165 10.892 ( -15.793 0.778 20.190) 25.645 11.557 ( 11.332 0.900 9.593) 14.874 14.076 ( -2.719 9.603 -5.757) 11.522 14.581 ( -0.065 -10.098 -1.562) 10.219 15.772 ( 0.208 2.878 2.195) 3.626 15.880 ( -1.154 -2.031 1.782) 2.939 ======================= Grid point 26 (19/306) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -3.313 13.352 -9.002) 16.441 1.757 ( 0.614 3.202 -0.319) 3.276 2.296 ( -8.401 -4.835 -9.231) 13.385 2.375 ( -0.897 12.720 -0.633) 12.767 2.554 ( -0.028 3.433 1.509) 3.751 2.933 ( -0.314 -2.305 3.707) 4.377 3.432 ( 6.048 -8.247 2.842) 10.615 3.538 ( -13.609 -4.108 -6.219) 15.516 4.235 ( -2.644 8.584 -10.400) 13.742 4.316 ( -16.086 2.199 -2.416) 16.415 4.508 ( 6.324 -4.876 2.732) 8.440 4.669 ( -6.134 -5.383 2.434) 8.516 5.940 ( 7.405 8.969 -4.620) 12.515 6.124 ( 5.106 1.576 7.741) 9.406 6.595 ( 2.213 -7.501 -1.612) 7.985 6.622 ( 3.909 -0.176 2.312) 4.545 7.261 ( -7.362 -2.427 -0.679) 7.781 7.439 ( -7.423 -8.547 -2.916) 11.690 8.009 ( 11.671 -0.502 8.664) 14.544 8.241 ( 5.628 2.764 -3.520) 7.190 8.579 ( -0.102 9.724 4.712) 10.806 8.987 ( 1.301 2.092 12.986) 13.218 10.515 ( 5.359 -3.542 -25.455) 26.253 10.682 ( 2.185 0.090 -8.216) 8.502 10.866 ( -11.700 0.257 13.872) 18.149 11.835 ( 16.917 3.467 8.471) 19.234 13.876 ( -6.897 5.078 -4.061) 9.479 14.697 ( 2.544 -6.692 3.214) 7.848 15.756 ( -1.398 2.469 1.645) 3.279 15.878 ( -3.642 -1.149 1.105) 3.976 ======================= Grid point 27 (20/306) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -6.588 12.598 -9.087) 16.873 1.690 ( -3.605 3.669 -4.065) 6.556 1.955 ( -11.104 14.962 -4.587) 19.188 2.332 ( 1.375 -0.902 -4.832) 5.104 2.539 ( -1.026 6.990 1.763) 7.282 2.982 ( 1.928 1.016 3.142) 3.824 3.350 ( -11.460 0.108 0.509) 11.472 3.568 ( -0.644 -4.496 -2.629) 5.248 3.939 ( -4.213 11.437 -5.894) 13.538 4.083 ( -11.917 0.437 -1.729) 12.050 4.590 ( -5.019 -3.982 -0.237) 6.411 4.742 ( 3.731 -9.892 0.841) 10.605 5.941 ( 7.663 6.595 -0.538) 10.124 6.273 ( 5.516 -3.628 5.138) 8.366 6.625 ( -3.705 -1.230 2.753) 4.777 6.737 ( 5.890 -4.939 -3.066) 8.275 7.240 ( -3.824 -8.350 2.400) 9.493 7.394 ( -6.232 -8.350 -3.435) 10.971 8.139 ( 5.050 8.198 0.077) 9.629 8.353 ( 10.057 4.864 7.869) 13.665 8.536 ( 2.913 6.402 2.693) 7.531 9.104 ( -1.799 3.593 15.699) 16.205 10.321 ( 2.449 -4.196 -30.863) 31.243 10.633 ( 1.160 0.191 -5.226) 5.357 10.848 ( -7.016 -0.924 7.995) 10.676 12.132 ( 20.863 5.476 5.115) 22.168 13.691 ( -10.648 2.156 -0.803) 10.894 14.858 ( 5.479 -3.823 6.480) 9.308 15.710 ( -4.664 1.178 0.872) 4.889 15.825 ( -4.805 -0.015 -0.457) 4.827 ======================= Grid point 28 (21/306) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.866 ( -6.552 12.487 -8.561) 16.496 1.442 ( -6.818 17.344 -4.914) 19.273 1.700 ( -5.085 6.634 -1.312) 8.461 2.259 ( -2.153 19.726 -4.291) 20.302 2.377 ( -5.215 3.206 -0.040) 6.122 3.080 ( 8.518 -1.053 2.126) 8.843 3.201 ( -4.676 9.790 1.523) 10.956 3.410 ( -9.217 2.023 -4.362) 10.396 3.912 ( -0.291 -3.945 3.890) 5.548 3.926 ( -6.228 0.035 -0.706) 6.268 4.517 ( -5.047 -2.671 -4.564) 7.310 4.917 ( 3.072 -11.184 0.670) 11.618 5.992 ( 5.791 4.893 1.613) 7.751 6.453 ( 5.319 -7.618 2.121) 9.530 6.597 ( -4.616 -2.414 1.815) 5.517 6.814 ( 2.464 -4.069 -2.357) 5.309 7.327 ( -2.756 -7.955 0.341) 8.426 7.402 ( -1.334 -11.926 0.227) 12.003 8.073 ( 2.024 12.584 -0.662) 12.763 8.390 ( 0.615 9.959 3.907) 10.715 8.690 ( 13.348 2.580 6.671) 15.144 9.190 ( -5.470 4.849 19.887) 21.188 10.028 ( -0.252 -3.607 -35.194) 35.379 10.603 ( 0.411 0.257 -2.253) 2.304 10.854 ( -2.761 -2.119 3.328) 4.815 12.423 ( 22.991 4.473 0.411) 23.426 13.493 ( -15.072 2.470 1.871) 15.387 15.073 ( 9.129 -1.583 9.227) 13.076 15.594 ( -11.333 -1.895 -2.624) 11.787 15.754 ( -1.872 2.290 -0.723) 3.045 ======================= Grid point 29 (22/306) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( 0.000 13.698 0.000) 13.698 1.141 ( 0.000 24.032 0.000) 24.032 1.606 ( 0.000 2.599 0.000) 2.599 1.836 ( 0.000 38.898 0.000) 38.898 2.364 ( -0.000 -1.791 -0.000) 1.791 3.038 ( 0.000 14.602 0.000) 14.602 3.212 ( 0.000 2.974 0.000) 2.974 3.321 ( -0.000 -7.933 -0.000) 7.933 3.855 ( 0.000 0.387 0.000) 0.387 4.019 ( -0.000 -7.590 -0.000) 7.590 4.453 ( -0.000 -0.457 -0.000) 0.457 5.059 ( -0.000 -11.146 -0.000) 11.146 5.998 ( 0.000 5.229 0.000) 5.229 6.585 ( -0.000 -6.474 -0.000) 6.474 6.627 ( -0.000 -8.948 -0.000) 8.948 6.851 ( -0.000 -2.478 -0.000) 2.478 7.364 ( -0.000 -6.370 -0.000) 6.370 7.549 ( -0.000 -13.201 -0.000) 13.201 7.936 ( 0.000 15.199 0.000) 15.199 8.317 ( 0.000 8.949 0.000) 8.949 8.834 ( 0.000 2.470 0.000) 2.470 9.261 ( 0.000 3.153 0.000) 3.153 9.768 ( 0.000 0.290 0.000) 0.290 10.592 ( 0.000 0.316 0.000) 0.316 10.877 ( -0.000 -2.534 -0.000) 2.534 12.640 ( -0.000 -1.640 -0.000) 1.640 13.285 ( 0.000 7.527 0.000) 7.527 15.280 ( 0.000 1.068 0.000) 1.068 15.439 ( -0.000 -4.565 -0.000) 4.565 15.711 ( 0.000 2.891 0.000) 2.891 ======================= Grid point 34 (23/306) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( 2.671 0.000 0.424) 2.704 1.962 ( 1.699 0.000 -10.121) 10.262 2.148 ( 0.446 0.000 -7.590) 7.603 2.415 ( 0.371 0.000 13.187) 13.193 2.822 ( 1.378 0.000 0.236) 1.398 2.883 ( 6.908 0.000 1.658) 7.104 3.100 ( -5.622 -0.000 -5.614) 7.945 3.726 ( -8.904 -0.000 -13.993) 16.586 4.280 ( 3.427 0.000 8.670) 9.323 4.305 ( 5.287 0.000 5.523) 7.646 4.618 ( -15.070 -0.000 -6.340) 16.350 4.754 ( -5.677 -0.000 -4.703) 7.373 5.975 ( 10.670 0.000 10.420) 14.914 6.194 ( 9.356 0.000 -7.296) 11.865 6.303 ( 1.773 0.000 -6.102) 6.354 6.682 ( -6.088 -0.000 1.133) 6.193 7.324 ( -3.986 -0.000 1.212) 4.166 7.424 ( -9.400 -0.000 -2.376) 9.695 7.704 ( 9.168 0.000 7.603) 11.910 8.258 ( 4.884 0.000 -5.766) 7.556 8.731 ( -1.714 -0.000 7.276) 7.475 8.830 ( 5.487 0.000 9.531) 10.998 10.617 ( 6.621 0.000 -22.056) 23.028 10.736 ( 3.581 0.000 -9.318) 9.982 10.901 ( -16.856 -0.000 21.104) 27.009 11.565 ( 11.308 0.000 11.331) 16.008 14.253 ( -6.880 -0.000 -13.657) 15.292 14.401 ( 5.088 0.000 4.301) 6.662 15.830 ( 0.536 0.000 0.139) 0.553 15.831 ( -1.532 -0.000 4.137) 4.412 ======================= Grid point 35 (24/306) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -4.119 10.879 -9.131) 14.788 1.825 ( 0.012 2.329 -2.541) 3.447 2.115 ( -3.123 -8.807 -7.767) 12.151 2.533 ( 0.040 1.084 10.116) 10.174 2.787 ( -1.776 16.969 -4.306) 17.596 2.866 ( 0.889 -2.204 3.050) 3.867 3.166 ( 0.943 -16.004 -1.644) 16.116 3.508 ( -4.428 -0.023 -6.143) 7.573 4.320 ( -6.113 2.363 -3.794) 7.573 4.357 ( -7.368 -0.355 -3.811) 8.303 4.441 ( 4.460 -1.584 4.127) 6.280 4.616 ( -7.964 -0.286 -1.370) 8.086 6.144 ( 6.498 10.508 -5.210) 13.409 6.190 ( 6.203 3.325 8.107) 10.736 6.388 ( 4.702 -11.293 -4.836) 13.154 6.622 ( -2.092 -0.162 0.976) 2.315 7.236 ( -10.307 -0.029 -1.833) 10.469 7.288 ( -7.247 -4.984 -0.873) 8.838 7.997 ( 16.011 -0.344 10.775) 19.302 8.283 ( 6.279 1.100 -3.870) 7.457 8.740 ( -2.592 4.703 5.707) 7.836 9.001 ( 2.178 -0.195 12.054) 12.251 10.464 ( 4.892 -1.321 -24.704) 25.218 10.684 ( 2.510 0.044 -8.512) 8.875 10.872 ( -13.113 0.193 14.816) 19.786 11.878 ( 15.285 0.893 11.668) 19.250 13.995 ( -7.413 4.602 -8.774) 12.374 14.566 ( 6.609 -4.629 4.478) 9.228 15.803 ( -3.132 2.046 1.891) 4.191 15.847 ( -2.441 -1.696 0.957) 3.123 ======================= Grid point 36 (25/306) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.450 ( -7.826 12.158 -8.823) 16.938 1.765 ( -1.150 3.089 -2.570) 4.180 2.042 ( -7.165 -5.246 -6.534) 11.025 2.510 ( -2.313 16.647 -1.881) 16.912 2.628 ( 3.157 2.096 2.903) 4.774 2.953 ( 0.965 -3.422 4.444) 5.691 3.238 ( -6.637 -10.658 -2.371) 12.777 3.503 ( 4.274 -0.074 0.894) 4.367 4.106 ( -11.638 1.662 -1.646) 11.870 4.182 ( -3.098 9.093 -10.609) 14.311 4.523 ( -5.632 -2.373 1.673) 6.336 4.579 ( 2.759 -5.478 1.702) 6.365 6.090 ( 6.537 8.159 -3.361) 10.982 6.280 ( 2.911 3.884 5.792) 7.556 6.507 ( 1.585 -9.615 -2.724) 10.119 6.661 ( 1.992 -3.281 0.607) 3.886 7.087 ( -10.266 -5.804 -0.911) 11.828 7.246 ( -5.261 -5.199 -1.036) 7.469 8.278 ( 8.971 5.330 1.442) 10.534 8.395 ( 14.814 -0.044 7.474) 16.593 8.688 ( -2.504 6.597 3.320) 7.798 9.143 ( -1.389 0.599 14.440) 14.520 10.259 ( 1.392 -1.925 -26.943) 27.047 10.636 ( 1.702 0.087 -6.008) 6.245 10.837 ( -8.796 -0.260 8.812) 12.454 12.201 ( 15.698 1.663 9.255) 18.299 13.775 ( -7.166 4.669 -4.462) 9.647 14.775 ( 9.333 -3.796 5.420) 11.441 15.723 ( -8.592 0.167 0.345) 8.601 15.827 ( -1.732 0.246 -0.006) 1.749 ======================= Grid point 37 (26/306) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -7.417 12.201 -6.849) 15.836 1.667 ( -1.948 6.541 -2.313) 7.206 1.887 ( -6.049 5.687 -3.279) 8.926 2.351 ( 0.148 5.987 -1.855) 6.270 2.656 ( 2.604 8.630 1.497) 9.137 3.043 ( 2.477 -2.222 2.869) 4.394 3.223 ( -5.636 -4.782 2.418) 7.777 3.507 ( -1.012 4.554 -4.434) 6.436 3.934 ( -6.609 3.578 1.111) 7.597 3.966 ( -1.677 6.092 -5.059) 8.094 4.470 ( -4.588 -1.930 -0.929) 5.063 4.710 ( 2.697 -8.301 0.730) 8.759 6.087 ( 4.859 4.913 -0.656) 6.941 6.359 ( 3.741 -1.189 3.491) 5.253 6.551 ( -2.968 -3.772 -1.164) 4.939 6.714 ( 1.266 -4.214 -1.454) 4.634 7.092 ( -3.879 -13.914 1.339) 14.506 7.225 ( -3.225 -4.962 -1.168) 6.032 8.292 ( 4.297 8.441 -0.515) 9.486 8.584 ( -0.868 8.230 3.286) 8.904 8.728 ( 13.844 1.078 6.032) 15.139 9.252 ( -4.382 1.505 16.685) 17.317 9.985 ( -1.727 -1.040 -26.774) 26.850 10.607 ( 0.810 0.096 -2.850) 2.965 10.818 ( -4.017 -1.285 3.817) 5.688 12.467 ( 12.458 0.589 4.670) 13.317 13.595 ( -6.352 6.030 -1.231) 8.844 15.027 ( 12.559 -2.654 6.640) 14.453 15.557 ( -13.396 -1.370 -2.934) 13.782 15.798 ( -0.775 1.758 -0.115) 1.924 ======================= Grid point 38 (27/306) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.893 ( 0.000 12.908 0.000) 12.908 1.537 ( 0.000 12.690 0.000) 12.690 1.736 ( 0.000 9.635 0.000) 9.635 2.324 ( -0.000 -0.688 -0.000) 0.688 2.506 ( 0.000 23.499 0.000) 23.499 3.133 ( -0.000 -5.314 -0.000) 5.314 3.229 ( -0.000 -1.871 -0.000) 1.871 3.355 ( 0.000 10.870 0.000) 10.870 3.876 ( 0.000 1.519 0.000) 1.519 3.909 ( -0.000 -0.841 -0.000) 0.841 4.438 ( -0.000 -0.901 -0.000) 0.901 4.831 ( -0.000 -10.288 -0.000) 10.288 6.085 ( 0.000 3.411 0.000) 3.411 6.459 ( -0.000 -4.970 -0.000) 4.970 6.521 ( -0.000 -1.838 -0.000) 1.838 6.768 ( -0.000 -5.326 -0.000) 5.326 7.241 ( -0.000 -5.016 -0.000) 5.016 7.242 ( -0.000 -16.117 -0.000) 16.117 8.215 ( 0.000 11.541 0.000) 11.541 8.502 ( 0.000 8.486 0.000) 8.486 8.877 ( 0.000 1.552 0.000) 1.552 9.316 ( 0.000 1.986 0.000) 1.986 9.779 ( 0.000 0.659 0.000) 0.659 10.597 ( 0.000 0.161 0.000) 0.161 10.828 ( -0.000 -2.095 -0.000) 2.095 12.605 ( -0.000 -1.701 -0.000) 1.701 13.455 ( 0.000 8.401 0.000) 8.401 15.307 ( 0.000 1.392 0.000) 1.392 15.332 ( -0.000 -5.481 -0.000) 5.481 15.769 ( 0.000 2.517 0.000) 2.517 ======================= Grid point 45 (28/306) ======================= q-point: (-0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -9.508 -0.000 -10.991) 14.533 1.790 ( -0.531 -0.000 -1.841) 1.917 1.949 ( -4.610 -0.000 -4.188) 6.229 2.645 ( 2.665 0.000 5.776) 6.361 2.799 ( -8.685 -0.000 -6.167) 10.652 2.892 ( 0.128 0.000 5.156) 5.158 3.028 ( 2.179 0.000 -1.462) 2.624 3.515 ( 6.085 0.000 -0.022) 6.085 4.129 ( -11.408 -0.000 -1.656) 11.527 4.275 ( -1.441 -0.000 -9.434) 9.543 4.499 ( -7.935 -0.000 2.329) 8.270 4.522 ( 3.979 0.000 1.408) 4.221 6.278 ( 4.641 0.000 -4.862) 6.721 6.292 ( 4.801 0.000 -3.072) 5.700 6.362 ( 2.139 0.000 6.906) 7.230 6.595 ( 0.121 0.000 -0.778) 0.787 7.027 ( -13.266 -0.000 -2.191) 13.446 7.191 ( -4.224 -0.000 0.347) 4.238 8.354 ( 6.755 0.000 -1.878) 7.011 8.373 ( 19.080 0.000 11.030) 22.039 8.763 ( -3.998 -0.000 3.608) 5.385 9.146 ( -0.895 -0.000 13.906) 13.935 10.239 ( 1.311 0.000 -25.660) 25.694 10.637 ( 1.876 0.000 -6.289) 6.563 10.835 ( -9.417 -0.000 9.063) 13.069 12.216 ( 13.930 0.000 10.522) 17.458 13.832 ( -6.595 -0.000 -6.011) 8.924 14.729 ( 11.160 0.000 5.433) 12.413 15.723 ( -10.008 -0.000 0.104) 10.008 15.831 ( -0.573 -0.000 0.356) 0.675 ======================= Grid point 47 (29/306) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( -8.305 6.991 -7.522) 13.207 1.760 ( -0.777 2.283 -1.086) 2.645 1.876 ( -3.349 -3.055 -2.042) 4.972 2.566 ( -3.990 10.211 -4.120) 11.712 2.729 ( 2.181 0.985 3.556) 4.286 2.976 ( 0.550 -3.444 4.951) 6.056 3.079 ( -0.100 -6.936 -1.929) 7.200 3.599 ( 5.433 3.327 0.214) 6.374 3.976 ( -7.839 1.292 0.242) 7.949 4.122 ( -2.022 5.062 -7.715) 9.447 4.439 ( -4.466 -0.929 1.493) 4.800 4.591 ( 2.318 -2.950 0.362) 3.769 6.216 ( 3.490 7.596 -2.214) 8.648 6.402 ( -0.391 3.058 4.327) 5.313 6.405 ( 3.098 -7.600 -2.872) 8.695 6.645 ( 2.727 -4.390 -0.600) 5.203 6.859 ( -10.468 -5.937 -0.493) 12.044 7.157 ( -2.290 -1.686 0.089) 2.845 8.415 ( 5.173 3.179 -0.452) 6.089 8.709 ( 0.607 3.487 3.402) 4.909 8.737 ( 11.695 -0.143 5.284) 12.834 9.266 ( -3.435 0.146 15.421) 15.799 9.974 ( -1.973 -0.198 -23.258) 23.342 10.608 ( 1.024 0.010 -3.230) 3.388 10.801 ( -4.782 -0.368 4.048) 6.276 12.469 ( 8.645 -0.111 6.106) 10.584 13.698 ( -3.797 3.011 -2.523) 5.463 14.978 ( 14.163 -1.541 5.403) 15.237 15.540 ( -13.819 -0.387 -2.526) 14.054 15.823 ( -0.449 0.635 0.197) 0.802 ======================= Grid point 48 (30/306) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 0.000 10.308 0.000) 10.308 1.705 ( 0.000 5.080 0.000) 5.080 1.859 ( 0.000 0.139 0.000) 0.139 2.415 ( 0.000 9.387 0.000) 9.387 2.751 ( 0.000 2.765 0.000) 2.765 3.051 ( -0.000 -3.437 -0.000) 3.437 3.132 ( -0.000 -6.869 -0.000) 6.869 3.562 ( 0.000 9.426 0.000) 9.426 3.907 ( 0.000 1.188 0.000) 1.188 4.000 ( 0.000 7.039 0.000) 7.039 4.420 ( -0.000 -0.763 -0.000) 0.763 4.657 ( -0.000 -6.068 -0.000) 6.068 6.168 ( 0.000 5.258 0.000) 5.258 6.409 ( 0.000 0.654 0.000) 0.654 6.473 ( -0.000 -5.132 -0.000) 5.132 6.679 ( -0.000 -1.593 -0.000) 1.593 6.906 ( -0.000 -15.363 -0.000) 15.363 7.162 ( -0.000 -2.656 -0.000) 2.656 8.404 ( 0.000 6.427 0.000) 6.427 8.650 ( 0.000 5.367 0.000) 5.367 8.896 ( 0.000 0.401 0.000) 0.401 9.342 ( 0.000 0.590 0.000) 0.590 9.793 ( 0.000 0.619 0.000) 0.619 10.599 ( 0.000 0.013 0.000) 0.013 10.795 ( -0.000 -1.017 -0.000) 1.017 12.575 ( -0.000 -1.119 -0.000) 1.119 13.609 ( 0.000 5.873 0.000) 5.873 15.228 ( -0.000 -4.088 -0.000) 4.088 15.333 ( 0.000 1.007 0.000) 1.007 15.810 ( 0.000 1.392 0.000) 1.392 ======================= Grid point 58 (31/306) ======================= q-point: ( 0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 0.000 0.000 0.000) 0.000 1.759 ( 0.000 0.000 0.000) 0.000 1.832 ( -0.000 -0.000 -0.000) 0.000 2.562 ( 0.000 0.000 0.000) 0.000 2.766 ( 0.000 0.000 0.000) 0.000 3.002 ( 0.000 0.000 0.000) 0.000 3.025 ( 0.000 0.000 0.000) 0.000 3.677 ( 0.000 0.000 0.000) 0.000 3.920 ( 0.000 0.000 0.000) 0.000 4.088 ( 0.000 0.000 0.000) 0.000 4.411 ( 0.000 0.000 0.000) 0.000 4.593 ( 0.000 0.000 0.000) 0.000 6.284 ( -0.000 -0.000 -0.000) 0.000 6.346 ( 0.000 0.000 0.000) 0.000 6.453 ( 0.000 0.000 0.000) 0.000 6.677 ( 0.000 0.000 0.000) 0.000 6.699 ( 0.000 0.000 0.000) 0.000 7.134 ( 0.000 0.000 0.000) 0.000 8.472 ( 0.000 0.000 0.000) 0.000 8.708 ( 0.000 0.000 0.000) 0.000 8.899 ( 0.000 0.000 0.000) 0.000 9.347 ( 0.000 0.000 0.000) 0.000 9.800 ( 0.000 0.000 0.000) 0.000 10.599 ( 0.000 0.000 0.000) 0.000 10.785 ( 0.000 0.000 0.000) 0.000 12.562 ( 0.000 0.000 0.000) 0.000 13.674 ( 0.000 0.000 0.000) 0.000 15.182 ( 0.000 0.000 0.000) 0.000 15.344 ( 0.000 0.000 0.000) 0.000 15.824 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 105 (32/306) ======================= q-point: ( 0.00 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.339 ( 14.010 0.000 16.357) 21.537 0.536 ( 13.036 0.000 25.235) 28.403 1.128 ( -14.362 -0.000 54.481) 56.342 1.777 ( -17.542 -0.000 12.388) 21.475 2.190 ( 0.300 0.000 -12.272) 12.275 2.656 ( 1.252 0.000 0.730) 1.449 2.818 ( -0.101 -0.000 12.544) 12.544 3.174 ( -2.053 -0.000 7.070) 7.362 3.897 ( -2.883 -0.000 2.871) 4.069 4.137 ( 1.683 0.000 -7.289) 7.480 4.799 ( 11.193 0.000 1.039) 11.241 5.351 ( -3.305 -0.000 -1.124) 3.491 5.795 ( -1.695 -0.000 -2.506) 3.026 6.666 ( -0.768 -0.000 -7.562) 7.601 6.853 ( -0.880 -0.000 -4.490) 4.575 6.997 ( 4.896 0.000 -12.966) 13.860 7.241 ( 1.906 0.000 -0.895) 2.106 7.476 ( 6.843 0.000 2.280) 7.213 7.587 ( 7.815 0.000 3.385) 8.517 7.924 ( 0.604 0.000 0.135) 0.619 8.356 ( -2.843 -0.000 -0.082) 2.844 8.701 ( 0.074 0.000 -5.588) 5.588 10.605 ( -0.426 -0.000 2.004) 2.048 10.891 ( -2.492 -0.000 -4.805) 5.413 11.361 ( -0.859 -0.000 2.429) 2.577 12.866 ( 95.976 0.000 0.585) 95.978 14.188 ( -1.128 -0.000 0.415) 1.202 14.454 (-123.450 -0.000 -1.693) 123.462 15.537 ( 1.526 0.000 -0.233) 1.544 15.627 ( 0.368 0.000 -0.766) 0.850 ======================= Grid point 106 (33/306) ======================= q-point: ( 0.10 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( 17.527 -5.996 15.887) 24.404 1.038 ( 9.819 -9.558 23.715) 27.390 1.641 ( 8.738 -4.607 31.657) 33.162 1.935 ( 10.285 4.825 10.645) 15.568 2.159 ( 7.586 -11.349 -12.570) 18.557 2.760 ( 5.736 -6.083 5.733) 10.138 2.922 ( -7.444 -3.733 11.435) 14.146 3.307 ( 7.362 -2.348 7.924) 11.068 3.953 ( 6.127 -0.212 2.618) 6.666 4.029 ( -1.950 3.209 -9.548) 10.260 4.875 ( 5.518 5.692 0.715) 7.960 5.255 ( -4.583 2.912 -3.074) 6.239 5.696 ( -8.193 -3.510 -3.991) 9.766 6.568 ( 0.095 1.358 -8.243) 8.354 6.686 ( -5.557 1.976 -14.110) 15.293 6.955 ( 2.275 4.575 -1.525) 5.333 7.301 ( 2.267 -8.149 -5.350) 10.009 7.606 ( 6.064 -1.940 -0.021) 6.367 7.732 ( 6.654 3.960 1.687) 7.925 7.965 ( 4.561 -2.307 1.238) 5.259 8.340 ( -1.551 -5.303 -2.972) 6.273 8.634 ( -1.210 -2.244 -6.562) 7.040 10.611 ( 0.829 2.209 0.892) 2.522 10.805 ( -0.701 -0.309 -6.895) 6.937 11.327 ( -3.368 7.360 7.512) 11.043 12.718 ( -83.049 2.922 40.691) 92.528 13.791 ( 37.626 30.161 -10.280) 49.306 14.460 ( 7.208 -25.652 -15.057) 30.606 15.580 ( 2.611 -1.880 0.154) 3.221 15.647 ( 2.743 -1.680 -0.792) 3.313 ======================= Grid point 107 (34/306) ======================= q-point: ( 0.20 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( 6.130 -0.786 21.678) 22.542 1.520 ( 13.693 -10.154 14.729) 22.528 1.817 ( -0.946 3.132 4.021) 5.184 2.152 ( 5.770 -9.766 -1.867) 11.496 2.420 ( 16.395 -2.620 4.964) 17.330 2.941 ( -8.966 -1.338 10.993) 14.249 3.129 ( 16.356 -11.511 17.386) 26.501 3.555 ( 10.281 -4.484 7.382) 13.428 3.826 ( -5.340 4.154 -11.208) 13.091 4.105 ( 9.699 -0.865 1.925) 9.926 4.866 ( 3.368 7.971 -1.473) 8.778 5.103 ( -5.574 5.324 -3.472) 8.454 5.617 ( -6.376 -7.583 0.115) 9.909 6.377 ( -7.586 5.103 -14.733) 17.339 6.502 ( 0.853 -0.245 -8.717) 8.762 6.905 ( -2.207 4.649 0.114) 5.148 7.332 ( 1.418 -4.053 -5.281) 6.806 7.685 ( 4.556 -2.560 -3.282) 6.171 7.750 ( 1.366 2.587 0.295) 2.940 8.096 ( 7.212 -0.336 2.051) 7.506 8.339 ( -1.072 -3.824 -3.759) 5.469 8.600 ( 0.831 -4.656 -5.541) 7.285 10.594 ( 3.720 3.148 -5.461) 7.319 10.748 ( -0.720 -2.183 -4.128) 4.725 11.286 ( -6.102 6.359 11.343) 14.365 12.142 ( -53.305 -0.239 33.180) 62.789 13.862 ( 18.431 15.215 -6.535) 24.778 14.598 ( 8.422 -10.647 -14.079) 19.557 15.625 ( 2.112 -0.526 -0.274) 2.194 15.729 ( 4.838 -3.839 -0.747) 6.221 ======================= Grid point 108 (35/306) ======================= q-point: ( 0.30 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -2.258 0.576 18.738) 18.882 1.722 ( 0.143 1.873 2.719) 3.305 1.984 ( 11.189 -6.932 3.933) 13.738 2.323 ( 5.064 -9.393 4.578) 11.612 2.649 ( 8.742 -0.937 2.622) 9.175 2.931 ( -8.204 -0.502 9.141) 12.293 3.533 ( -2.756 4.682 -8.262) 9.889 3.723 ( 14.150 -5.877 11.394) 19.094 3.861 ( 11.280 -11.721 7.973) 18.116 4.240 ( 5.067 -1.679 -1.482) 5.540 4.800 ( 2.299 7.520 -0.724) 7.896 4.927 ( -5.028 6.827 -2.947) 8.976 5.677 ( -1.703 -8.002 5.430) 9.819 6.052 ( -7.185 5.438 -15.088) 17.574 6.439 ( 1.400 -1.026 -8.625) 8.798 6.800 ( -5.173 4.519 0.145) 6.871 7.346 ( 2.833 -0.583 -1.591) 3.301 7.733 ( 1.753 -0.778 -1.325) 2.331 7.738 ( 1.224 -4.362 -5.819) 7.375 8.193 ( 4.172 -0.750 -1.198) 4.405 8.309 ( 1.293 3.129 -1.834) 3.850 8.636 ( 2.635 -4.062 -1.656) 5.117 10.539 ( 6.105 2.068 -13.168) 14.661 10.738 ( -1.163 -2.777 -0.856) 3.130 11.259 ( -6.849 5.096 12.808) 15.393 11.809 ( -35.025 0.339 22.411) 41.583 13.892 ( 9.914 7.544 -3.422) 12.920 14.665 ( 5.998 -6.394 -8.627) 12.300 15.653 ( 2.167 0.248 -0.411) 2.220 15.823 ( 4.131 -2.752 -0.553) 4.994 ======================= Grid point 109 (36/306) ======================= q-point: ( 0.40 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( -6.694 1.402 6.278) 9.283 1.788 ( -3.756 -1.522 13.560) 14.153 2.148 ( 7.742 -2.592 -5.393) 9.785 2.548 ( 0.982 -4.845 9.297) 10.529 2.756 ( -0.339 1.558 3.203) 3.577 2.935 ( -1.315 -2.663 4.589) 5.466 3.323 ( -4.174 1.712 -6.017) 7.520 4.028 ( 8.632 -5.257 2.438) 10.397 4.190 ( 3.561 -3.961 0.063) 5.327 4.247 ( 3.126 -2.080 -1.533) 4.055 4.786 ( -2.479 5.411 1.210) 6.073 4.805 ( 1.172 1.713 5.137) 5.540 5.770 ( -4.224 3.209 -10.274) 11.563 5.824 ( 1.883 -4.829 5.636) 7.657 6.386 ( 3.448 -0.244 -8.381) 9.066 6.696 ( -4.278 2.498 0.812) 5.020 7.382 ( 2.913 0.476 -0.960) 3.104 7.706 ( -1.024 -0.126 -1.632) 1.931 7.786 ( 3.857 -5.768 -5.263) 8.709 8.187 ( 0.253 -2.177 -7.340) 7.660 8.303 ( 4.309 6.419 1.809) 7.940 8.713 ( 3.668 -0.294 3.061) 4.786 10.455 ( 7.052 1.026 -17.767) 19.143 10.740 ( -1.633 -3.049 -1.278) 3.687 11.249 ( -7.229 4.889 13.812) 16.338 11.588 ( -21.049 1.809 14.511) 25.630 13.922 ( 4.277 1.781 -0.896) 4.719 14.733 ( 3.991 -5.292 -3.412) 7.455 15.673 ( 2.105 1.062 -0.453) 2.401 15.888 ( 2.705 -0.971 -0.072) 2.875 ======================= Grid point 110 (37/306) ======================= q-point: (-0.50 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -9.817 0.579 4.341) 10.749 1.883 ( -7.566 -4.510 13.947) 16.496 2.182 ( 4.248 3.118 -4.822) 7.143 2.561 ( -9.291 1.248 -3.123) 9.881 2.675 ( -7.666 -0.336 3.867) 8.593 2.967 ( -1.174 2.733 1.916) 3.538 3.384 ( 7.564 -6.120 5.932) 11.396 3.960 ( -8.797 0.448 -11.120) 14.186 4.172 ( -4.887 5.271 -8.458) 11.100 4.364 ( 9.702 -2.712 7.208) 12.387 4.735 ( -7.381 -0.747 2.426) 7.806 4.894 ( -1.953 -4.671 7.488) 9.039 5.608 ( 2.459 5.550 -7.597) 9.725 5.998 ( 3.611 -5.450 8.064) 10.381 6.401 ( 8.948 -1.679 -6.440) 11.151 6.650 ( -1.081 1.645 1.363) 2.394 7.383 ( 0.487 -0.152 -2.183) 2.242 7.677 ( 0.073 -1.185 -4.262) 4.424 7.847 ( 5.579 1.812 -1.617) 6.084 8.141 ( 0.173 -4.442 -7.154) 8.422 8.316 ( 2.865 4.163 1.550) 5.286 8.805 ( 4.990 3.973 6.183) 8.883 10.346 ( 7.129 0.632 -21.238) 22.411 10.722 ( -2.585 -2.877 -2.191) 4.445 11.217 ( -11.380 4.236 13.941) 18.488 11.491 ( -4.866 4.237 8.779) 10.895 13.958 ( -0.448 -2.947 1.312) 3.257 14.820 ( 2.158 -5.423 1.235) 5.966 15.681 ( 1.797 1.869 -0.488) 2.638 15.920 ( 1.198 0.654 0.467) 1.443 ======================= Grid point 111 (38/306) ======================= q-point: (-0.40 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -15.450 0.548 5.345) 16.358 1.934 ( -10.489 -2.751 2.440) 11.115 2.042 ( -10.885 8.846 6.985) 15.669 2.379 ( -3.005 -4.226 -9.820) 11.105 2.618 ( -7.123 0.110 2.610) 7.587 2.928 ( -2.723 4.974 4.362) 7.155 3.592 ( -10.589 5.086 -6.640) 13.494 3.669 ( 4.746 -1.204 -0.915) 4.981 3.923 ( -10.310 5.307 -2.620) 11.888 4.524 ( -9.242 1.694 8.403) 12.605 4.697 ( 0.922 -12.568 -1.277) 12.666 4.940 ( -3.908 -3.456 1.105) 5.333 5.568 ( 7.030 6.714 -1.206) 9.796 6.210 ( 6.342 -7.450 6.544) 11.771 6.530 ( 12.688 -3.160 -5.442) 14.163 6.644 ( 0.854 2.572 1.646) 3.171 7.392 ( 1.471 -2.861 -0.215) 3.224 7.636 ( 0.277 -1.322 -6.864) 6.996 7.839 ( 5.263 9.290 -3.743) 11.314 8.141 ( 0.190 -4.010 -2.978) 4.998 8.345 ( 2.285 0.224 1.817) 2.928 8.896 ( 6.417 8.126 7.214) 12.620 10.198 ( 5.947 0.621 -24.260) 24.986 10.685 ( -2.934 -1.838 -1.591) 3.810 11.140 ( -11.962 1.978 10.606) 16.108 11.516 ( 5.114 8.288 6.095) 11.488 13.997 ( -4.344 -6.629 3.107) 8.513 14.938 ( 0.638 -6.879 5.648) 8.923 15.675 ( 1.277 2.427 -0.540) 2.796 15.919 ( -0.545 1.870 0.983) 2.181 ======================= Grid point 112 (39/306) ======================= q-point: (-0.30 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -21.339 1.720 8.361) 22.983 1.538 ( -21.204 13.119 -6.231) 25.701 2.056 ( -13.366 -6.296 13.493) 20.008 2.280 ( -7.123 -1.955 -7.206) 10.319 2.507 ( -7.298 1.416 -2.587) 7.871 2.884 ( -1.548 4.998 3.264) 6.167 3.122 ( -14.654 15.480 -6.131) 22.181 3.692 ( -9.786 2.706 1.797) 10.311 3.913 ( 6.200 -4.206 5.003) 9.010 4.360 ( -18.353 -1.992 4.209) 18.935 4.765 ( -5.766 -3.123 -6.421) 9.178 5.009 ( 6.362 -10.540 1.318) 12.382 5.629 ( 9.173 7.286 3.425) 12.205 6.463 ( 8.126 -9.643 4.023) 13.237 6.656 ( 3.844 1.467 -0.235) 4.121 6.681 ( 9.227 -3.358 -3.954) 10.585 7.486 ( 5.177 -3.369 1.208) 6.293 7.569 ( -0.031 -0.107 -7.156) 7.157 7.746 ( 3.062 8.864 -6.111) 11.193 8.147 ( 0.711 0.403 -0.725) 1.092 8.409 ( 2.678 -1.138 2.074) 3.574 8.959 ( 8.408 12.612 4.190) 15.726 9.998 ( 1.886 0.730 -22.799) 22.888 10.650 ( -2.396 -0.313 0.285) 2.433 11.068 ( -9.518 -0.307 6.863) 11.738 11.563 ( 9.415 13.144 3.438) 16.530 14.034 ( -7.355 -9.365 4.172) 12.618 15.107 ( -0.323 -10.045 9.933) 14.131 15.658 ( 0.791 2.573 -0.510) 2.739 15.888 ( -2.982 1.882 1.856) 3.985 ======================= Grid point 113 (40/306) ======================= q-point: (-0.20 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.845 ( -23.589 5.057 11.167) 26.584 1.021 ( -25.368 13.776 0.092) 28.867 1.712 ( -34.759 16.873 -1.799) 38.680 2.205 ( -17.264 -18.782 7.657) 26.635 2.394 ( -1.713 0.670 -2.187) 2.858 2.781 ( -0.973 10.043 -2.564) 10.410 2.952 ( 0.498 1.099 4.537) 4.695 3.565 ( -6.907 7.158 6.247) 11.746 4.074 ( 5.339 -4.046 0.791) 6.745 4.159 ( -17.954 -1.433 4.157) 18.484 4.578 ( -5.854 -0.243 -13.010) 14.269 5.230 ( 3.659 -10.321 2.697) 11.278 5.731 ( 9.428 6.167 3.027) 11.665 6.665 ( 3.652 -4.025 0.629) 5.471 6.740 ( 8.284 -2.445 -0.248) 8.641 6.802 ( 6.513 -9.014 -4.136) 11.865 7.472 ( 1.883 4.243 -8.206) 9.428 7.542 ( 3.311 10.958 -2.051) 11.630 7.710 ( 4.514 -6.072 -3.602) 8.379 8.126 ( 1.109 2.431 -5.392) 6.018 8.481 ( 5.822 2.131 0.481) 6.219 8.913 ( 10.147 16.535 -13.382) 23.567 9.843 ( -5.395 0.208 9.756) 11.150 10.633 ( -1.521 1.444 3.044) 3.697 11.015 ( -7.000 -1.666 3.375) 7.948 11.577 ( 12.975 19.753 1.366) 23.673 14.067 ( -9.814 -12.125 4.452) 16.222 15.341 ( 0.030 -13.276 10.703) 17.053 15.638 ( 0.657 2.030 -0.281) 2.152 15.849 ( -7.385 -3.997 4.608) 9.578 ======================= Grid point 114 (41/306) ======================= q-point: (-0.10 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.479 ( -16.986 18.872 4.750) 25.832 0.602 ( -25.003 15.818 6.836) 30.366 1.069 ( -40.165 12.326 33.490) 53.728 2.164 ( -25.259 -26.471 -6.441) 37.151 2.399 ( -8.406 -6.119 2.555) 10.707 2.677 ( -0.150 5.360 -0.531) 5.389 2.956 ( 4.824 11.962 -14.165) 19.158 3.319 ( -11.935 18.043 -10.184) 23.911 3.977 ( -12.848 -0.278 3.305) 13.269 4.144 ( 3.439 -2.728 -5.642) 7.149 4.502 ( 5.351 -1.724 11.729) 13.007 5.353 ( -0.984 -5.551 1.495) 5.833 5.805 ( 4.964 3.297 -0.661) 5.996 6.715 ( 0.937 -2.474 -3.235) 4.179 6.834 ( 5.541 0.322 -1.663) 5.794 6.980 ( 5.754 -13.596 -6.583) 16.165 7.335 ( 3.239 14.132 -6.264) 15.794 7.470 ( 5.789 8.524 -1.449) 10.405 7.706 ( -1.502 4.679 -23.668) 24.172 7.943 ( -0.952 6.505 -7.173) 9.730 8.446 ( 0.995 9.807 -5.494) 11.285 8.735 ( 2.463 3.108 -4.975) 6.362 10.432 ( 18.637 -23.242 46.359) 55.106 10.710 ( 12.384 -0.824 35.980) 38.061 10.964 ( -4.773 -1.422 -0.546) 5.010 11.593 ( 28.723 35.168 8.724) 46.237 14.105 ( -11.837 -17.063 4.220) 21.191 15.514 ( 1.494 -3.389 0.593) 3.751 15.627 ( 0.582 1.114 -2.002) 2.364 15.838 ( -28.534 -29.557 -12.177) 42.850 ======================= Grid point 116 (42/306) ======================= q-point: ( 0.10 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.283 ( 24.877 0.000 11.593) 27.446 1.346 ( 2.508 0.000 28.058) 28.169 1.943 ( 7.120 0.000 6.637) 9.734 1.961 ( 2.599 0.000 -12.598) 12.863 2.384 ( 18.412 0.000 7.645) 19.936 2.925 ( -9.006 -0.000 13.279) 16.045 2.996 ( 15.484 0.000 20.213) 25.462 3.507 ( 9.495 0.000 8.289) 12.604 3.873 ( -6.122 -0.000 -12.221) 13.669 4.097 ( 10.097 0.000 1.076) 10.154 4.969 ( 4.212 0.000 -2.603) 4.952 5.158 ( -5.300 -0.000 -3.636) 6.427 5.522 ( -7.720 -0.000 -0.089) 7.721 6.439 ( -7.168 -0.000 -16.550) 18.035 6.489 ( -0.281 -0.000 -8.111) 8.116 6.989 ( -0.180 -0.000 -0.677) 0.701 7.242 ( 1.065 0.000 -2.766) 2.964 7.659 ( 4.387 0.000 -3.711) 5.746 7.787 ( -2.159 -0.000 0.011) 2.159 8.121 ( 12.054 0.000 4.546) 12.882 8.256 ( -0.494 -0.000 -4.765) 4.791 8.559 ( 0.588 0.000 -3.439) 3.489 10.643 ( 0.823 0.000 0.650) 1.049 10.710 ( 1.289 0.000 -10.993) 11.069 11.359 ( -4.070 -0.000 4.544) 6.100 12.134 ( -61.449 -0.000 42.793) 74.881 14.190 ( 0.864 0.000 0.860) 1.219 14.335 ( 27.938 0.000 -27.070) 38.901 15.627 ( 3.574 0.000 1.842) 4.021 15.673 ( 3.731 0.000 -0.921) 3.843 ======================= Grid point 117 (43/306) ======================= q-point: ( 0.20 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( 3.313 8.016 21.783) 23.446 1.775 ( 13.077 -2.053 7.252) 15.094 1.865 ( 6.600 -0.160 -3.591) 7.515 2.110 ( 5.215 -9.521 -0.196) 10.857 2.619 ( 9.748 -1.200 0.755) 9.851 2.928 ( -9.290 0.071 12.216) 15.347 3.551 ( 21.107 -4.500 22.374) 31.086 3.618 ( -8.988 0.798 -12.589) 15.489 3.727 ( 8.853 -2.719 5.123) 10.584 4.220 ( 5.507 -0.400 -1.064) 5.623 4.929 ( 0.734 3.712 -6.073) 7.155 5.039 ( -4.569 3.640 -1.777) 6.106 5.534 ( 0.465 -4.737 6.498) 8.055 6.149 ( -5.783 3.123 -16.687) 17.935 6.406 ( -0.494 -1.591 -8.075) 8.245 6.924 ( -3.995 5.895 0.421) 7.134 7.273 ( 2.083 -5.066 -1.143) 5.596 7.648 ( 1.585 -1.416 -6.950) 7.268 7.739 ( -3.745 -0.502 -0.287) 3.790 8.195 ( 1.665 0.466 -5.585) 5.846 8.350 ( 10.085 0.528 4.247) 10.956 8.582 ( 4.416 -0.982 -0.303) 4.534 10.591 ( 3.214 2.651 -11.908) 12.616 10.676 ( 0.773 -2.893 -2.880) 4.155 11.343 ( -4.424 2.444 7.566) 9.098 11.802 ( -42.426 -0.547 33.028) 53.768 14.126 ( 7.032 13.377 -4.053) 15.647 14.465 ( 9.511 -12.008 -15.119) 21.523 15.682 ( 3.612 2.474 1.138) 4.523 15.752 ( 4.328 -3.714 0.242) 5.708 ======================= Grid point 118 (44/306) ======================= q-point: ( 0.30 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 0.104 10.933 5.342) 12.169 1.799 ( -1.221 2.322 8.506) 8.902 2.086 ( 9.215 -2.995 -2.873) 10.106 2.380 ( 7.401 -11.720 9.385) 16.739 2.751 ( 6.315 -2.045 -0.027) 6.638 2.905 ( -9.447 0.920 9.669) 13.549 3.352 ( -7.918 0.487 -9.676) 12.512 3.889 ( 3.707 -6.373 -2.117) 7.671 4.068 ( 14.310 -5.396 12.338) 19.650 4.242 ( 0.479 0.271 -0.098) 0.559 4.832 ( -1.120 2.376 -4.352) 5.083 4.923 ( -5.645 4.780 0.997) 7.464 5.706 ( 4.847 -3.630 8.511) 10.445 5.900 ( 0.390 5.850 -13.013) 14.273 6.351 ( 1.909 -3.247 -8.388) 9.195 6.790 ( -5.748 6.443 1.121) 8.707 7.362 ( 3.192 -3.348 0.672) 4.674 7.616 ( 0.299 -5.297 -7.793) 9.427 7.700 ( -2.905 -2.160 0.789) 3.706 8.152 ( 1.795 -1.154 -8.073) 8.350 8.474 ( 8.026 8.182 2.977) 11.842 8.695 ( 6.676 -1.565 3.740) 7.811 10.480 ( 4.195 1.210 -15.595) 16.195 10.681 ( 0.431 -2.434 -3.372) 4.180 11.349 ( -4.645 4.426 12.113) 13.707 11.596 ( -27.140 -0.781 21.808) 34.825 14.047 ( 5.062 9.844 -4.558) 11.971 14.560 ( 3.508 -11.110 -6.709) 13.444 15.713 ( 3.315 2.708 0.586) 4.321 15.848 ( 3.178 -2.727 0.882) 4.279 ======================= Grid point 119 (45/306) ======================= q-point: ( 0.40 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( -2.263 9.568 0.528) 9.847 1.843 ( -5.605 0.830 11.263) 12.608 2.180 ( 6.503 -2.909 -4.831) 8.607 2.586 ( -1.270 -1.490 4.717) 5.107 2.716 ( -10.740 6.024 1.089) 12.362 2.939 ( 0.934 -5.302 4.062) 6.744 3.269 ( 2.431 -4.671 0.727) 5.316 3.874 ( -7.936 -7.506 -7.481) 13.240 4.250 ( 2.764 1.841 -6.307) 7.128 4.309 ( 6.438 -1.476 3.426) 7.441 4.769 ( -12.720 2.138 1.194) 12.954 4.809 ( -2.146 -2.477 5.097) 6.060 5.747 ( 5.194 7.818 -7.264) 11.869 5.930 ( 7.127 -1.286 8.350) 11.054 6.365 ( 7.033 -3.288 -7.461) 10.767 6.685 ( -3.530 2.794 2.014) 4.932 7.391 ( -0.465 0.493 -2.228) 2.329 7.594 ( -2.010 -6.503 -6.792) 9.616 7.772 ( 3.816 -5.305 4.815) 8.118 8.103 ( 3.099 -0.455 -9.230) 9.747 8.490 ( 5.762 10.560 0.886) 12.063 8.859 ( 7.275 0.965 7.012) 10.150 10.358 ( 4.326 0.426 -18.228) 18.740 10.668 ( -0.550 -2.235 -3.396) 4.103 11.313 ( -15.730 4.721 16.338) 23.165 11.548 ( -2.318 1.301 11.006) 11.322 13.975 ( 0.630 4.475 -2.829) 5.332 14.662 ( 1.597 -9.544 -1.002) 9.728 15.731 ( 2.556 2.816 0.204) 3.809 15.912 ( 1.351 -1.270 1.020) 2.116 ======================= Grid point 120 (46/306) ======================= q-point: (-0.50 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -7.648 8.330 1.961) 11.477 1.861 ( -7.573 -1.286 9.592) 12.288 2.238 ( 4.875 -1.668 -4.432) 6.797 2.357 ( -14.967 10.740 -5.063) 19.105 2.622 ( -5.804 0.742 3.864) 7.012 2.999 ( -1.610 0.532 4.575) 4.879 3.465 ( 6.373 -8.949 4.194) 11.760 3.716 ( -11.407 -2.624 -5.211) 12.812 4.066 ( -4.392 8.186 -11.520) 14.799 4.473 ( 3.239 -8.193 -2.262) 9.096 4.567 ( -12.714 2.249 6.737) 14.564 4.852 ( -6.428 -4.738 4.124) 8.988 5.708 ( 7.753 7.091 -2.724) 10.854 6.112 ( 5.689 -1.277 6.308) 8.590 6.470 ( 11.554 -3.718 -5.267) 13.231 6.673 ( -0.228 0.294 2.335) 2.365 7.342 ( -2.040 -1.651 -1.988) 3.293 7.552 ( -3.268 -6.209 -6.562) 9.607 7.942 ( 7.051 0.347 1.280) 7.174 8.083 ( 5.934 -1.034 -4.564) 7.557 8.457 ( 4.109 9.527 -0.202) 10.377 9.020 ( 7.389 3.771 8.104) 11.597 10.208 ( 3.114 0.305 -20.363) 20.601 10.647 ( -1.316 -1.745 -1.731) 2.788 11.189 ( -15.578 2.525 11.627) 19.602 11.671 ( 8.983 6.346 8.601) 13.962 13.916 ( -4.170 -0.836 0.034) 4.253 14.783 ( 1.207 -8.079 3.015) 8.708 15.731 ( 1.514 2.862 -0.149) 3.242 15.932 ( -1.027 -0.413 0.520) 1.223 ======================= Grid point 121 (47/306) ======================= q-point: (-0.40 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.204 ( -13.706 7.873 6.039) 16.921 1.773 ( -14.098 6.464 -0.761) 15.528 2.020 ( -14.802 5.860 7.426) 17.566 2.255 ( 2.058 -0.814 -5.450) 5.883 2.550 ( -4.519 2.955 -0.340) 5.410 2.993 ( -2.347 4.340 5.167) 7.144 3.432 ( -10.726 11.192 -6.935) 16.982 3.640 ( -4.002 -6.894 -1.011) 8.035 3.868 ( -1.012 1.230 0.716) 1.747 4.316 ( -17.353 -2.080 1.897) 17.580 4.681 ( -0.174 -4.808 1.642) 5.083 4.822 ( -2.167 -6.898 -0.668) 7.261 5.761 ( 9.069 5.603 1.601) 10.780 6.279 ( 6.217 -5.993 3.071) 9.165 6.624 ( 10.464 -3.814 -5.103) 12.251 6.685 ( -0.308 1.153 1.895) 2.240 7.368 ( 0.717 -6.662 1.047) 6.782 7.494 ( -3.673 -5.803 -6.582) 9.512 7.937 ( 6.370 7.640 -7.594) 12.515 8.213 ( 9.400 3.261 3.088) 10.417 8.428 ( 3.815 4.580 -0.054) 5.960 9.151 ( 7.889 6.152 5.026) 11.196 10.014 ( -0.531 0.760 -18.753) 18.776 10.636 ( -1.618 -0.984 1.022) 2.152 11.072 ( -11.849 0.574 6.997) 13.773 11.826 ( 14.595 11.449 6.016) 19.501 13.871 ( -9.001 -5.395 3.041) 10.925 14.932 ( 1.883 -7.349 6.335) 9.883 15.713 ( 0.475 2.748 -0.347) 2.810 15.898 ( -4.360 -0.569 -0.975) 4.504 ======================= Grid point 122 (48/306) ======================= q-point: (-0.30 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( -18.166 8.185 13.855) 24.269 1.372 ( -16.241 18.209 -2.004) 24.482 1.907 ( -17.213 -2.573 10.081) 20.113 2.135 ( -9.735 12.738 -2.788) 16.273 2.418 ( -5.257 3.021 -0.526) 6.086 2.982 ( 3.315 5.148 2.028) 6.450 3.092 ( -4.901 14.212 -4.524) 15.700 3.577 ( -9.400 -4.016 2.251) 10.467 3.965 ( 3.311 -5.947 1.416) 6.953 4.127 ( -15.964 -1.373 4.097) 16.538 4.572 ( -7.751 -0.305 -5.894) 9.742 4.994 ( 4.738 -11.570 2.077) 12.673 5.858 ( 8.221 5.422 2.738) 10.222 6.469 ( 6.235 -10.035 -0.854) 11.845 6.672 ( -0.435 -2.267 -0.681) 2.407 6.751 ( 7.084 -1.771 -2.393) 7.684 7.434 ( -3.600 -5.645 -4.741) 8.204 7.505 ( 3.736 -9.036 0.625) 9.798 7.844 ( 6.008 11.949 -7.482) 15.324 8.256 ( 5.407 8.816 -2.272) 10.589 8.517 ( 10.659 1.685 1.812) 10.942 9.169 ( 8.545 8.374 -14.793) 19.025 9.851 ( -5.623 0.518 4.518) 7.231 10.645 ( -1.980 -0.149 4.778) 5.174 10.988 ( -7.996 -1.065 3.502) 8.794 11.975 ( 20.651 16.721 2.948) 26.735 13.823 ( -15.270 -9.388 5.596) 18.779 15.127 ( 3.265 -7.514 9.144) 12.278 15.682 ( -0.999 2.002 -0.271) 2.253 15.791 ( -8.807 -1.829 -4.163) 9.911 ======================= Grid point 123 (49/306) ======================= q-point: (-0.20 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.843 ( -14.585 10.115 21.847) 28.149 0.971 ( -11.215 22.185 6.697) 25.745 1.588 ( -19.968 31.343 8.492) 38.122 1.848 ( -20.145 -4.083 9.675) 22.718 2.378 ( -1.258 -0.309 0.870) 1.561 2.879 ( 0.438 13.169 -1.482) 13.259 3.056 ( 9.108 2.607 -2.427) 9.780 3.479 ( -11.225 -1.079 -4.198) 12.032 3.970 ( -12.485 -0.244 4.055) 13.129 4.047 ( 2.106 -6.120 -5.933) 8.780 4.480 ( -0.042 -0.471 4.203) 4.229 5.173 ( 0.922 -10.703 1.483) 10.844 5.911 ( 4.251 5.833 0.471) 7.233 6.605 ( 2.586 -8.275 -5.202) 10.111 6.722 ( 1.502 -8.800 -1.411) 9.039 6.831 ( 4.619 -1.039 -1.069) 4.854 7.419 ( 0.128 -4.539 -2.084) 4.996 7.638 ( 2.788 -8.106 -3.949) 9.438 7.708 ( 4.939 14.552 -7.178) 16.961 8.162 ( 3.167 10.064 -9.797) 14.398 8.656 ( 14.822 6.749 -7.546) 17.950 8.877 ( -1.345 9.625 -24.323) 26.192 10.088 ( 3.449 -9.673 35.299) 36.763 10.698 ( -3.037 -0.649 13.977) 14.318 10.935 ( -4.333 -1.639 0.406) 4.650 12.182 ( 34.441 19.558 2.568) 39.690 13.721 ( -28.164 -14.029 8.958) 32.715 15.349 ( 0.745 -7.545 8.151) 11.132 15.547 ( -16.683 -4.135 -8.843) 19.330 15.668 ( 0.607 2.607 -1.957) 3.316 ======================= Grid point 124 (50/306) ======================= q-point: (-0.10 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.719 ( -2.246 20.394 11.977) 23.758 0.849 ( 3.428 19.717 18.959) 27.567 1.310 ( -5.199 21.730 39.019) 44.964 1.758 ( -10.486 -0.702 14.111) 17.595 2.334 ( 0.827 4.186 -8.705) 9.695 2.768 ( 1.826 10.197 0.610) 10.377 3.060 ( 2.414 12.426 -10.903) 16.706 3.215 ( -6.170 3.720 6.262) 9.545 3.897 ( -2.937 0.135 3.645) 4.683 4.067 ( 1.269 -5.972 -6.991) 9.281 4.669 ( 7.065 -7.671 7.424) 12.802 5.267 ( -2.156 -7.686 -0.265) 7.987 5.857 ( -2.330 5.223 -2.473) 6.231 6.620 ( 0.401 -4.072 -7.162) 8.248 6.802 ( -0.874 -9.877 -8.082) 12.792 6.888 ( 2.890 -2.062 -0.344) 3.567 7.466 ( 4.766 7.963 -7.566) 11.974 7.542 ( 1.867 2.164 -4.081) 4.982 7.641 ( 5.237 4.111 -5.883) 8.885 7.985 ( 2.459 8.798 -4.813) 10.326 8.489 ( -0.446 10.796 -8.853) 13.969 8.731 ( 1.732 2.908 -5.636) 6.574 10.527 ( 3.848 -8.117 3.703) 9.716 10.868 ( -3.795 -2.369 0.614) 4.515 11.051 ( -0.091 -17.250 26.564) 31.674 12.813 ( 61.608 -5.537 5.866) 62.134 13.412 ( -63.432 -17.437 20.362) 68.865 14.987 ( -25.259 12.095 -17.147) 32.838 15.547 ( 4.576 -0.631 0.844) 4.696 15.645 ( 1.347 1.970 -0.935) 2.563 ======================= Grid point 127 (51/306) ======================= q-point: ( 0.20 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 5.066 0.000 -10.617) 11.763 1.840 ( -3.907 -0.000 19.348) 19.739 2.098 ( 2.435 0.000 -0.238) 2.447 2.135 ( 18.844 0.000 8.195) 20.549 2.723 ( 5.501 0.000 0.689) 5.544 2.926 ( -8.390 -0.000 11.335) 14.103 3.351 ( -9.959 -0.000 -10.881) 14.750 3.818 ( 2.767 0.000 -3.286) 4.296 4.009 ( 15.551 0.000 15.556) 21.996 4.245 ( 0.502 0.000 0.877) 1.011 4.862 ( -1.573 -0.000 -6.151) 6.349 4.974 ( -7.672 -0.000 -0.748) 7.708 5.667 ( 8.169 0.000 9.524) 12.548 5.977 ( 2.715 0.000 -13.606) 13.874 6.299 ( -0.869 -0.000 -7.914) 7.961 6.887 ( -6.441 -0.000 0.176) 6.443 7.290 ( 3.821 0.000 1.941) 4.286 7.572 ( -0.351 -0.000 -7.543) 7.551 7.673 ( -3.877 -0.000 0.594) 3.922 8.140 ( 2.386 0.000 -8.330) 8.665 8.586 ( 11.167 0.000 7.108) 13.238 8.657 ( 5.983 0.000 0.137) 5.984 10.495 ( 2.175 0.000 -14.687) 14.847 10.652 ( 1.965 0.000 -4.093) 4.540 11.404 ( -0.240 -0.000 9.067) 9.070 11.580 ( -32.803 -0.000 26.965) 42.464 14.295 ( 2.746 0.000 4.314) 5.114 14.300 ( 5.742 0.000 -18.266) 19.147 15.768 ( 3.674 0.000 -1.048) 3.820 15.794 ( 3.512 0.000 3.232) 4.773 ======================= Grid point 128 (52/306) ======================= q-point: ( 0.30 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( 3.065 6.965 -8.377) 11.317 1.905 ( -5.717 3.476 11.751) 13.523 2.116 ( 2.173 -1.240 -2.102) 3.268 2.482 ( 8.714 -6.905 6.816) 13.040 2.808 ( 3.630 -1.485 1.780) 4.307 2.897 ( -8.031 5.420 8.045) 12.594 3.172 ( -4.647 -4.575 -3.094) 7.218 3.732 ( -6.998 -4.352 -8.850) 12.092 4.262 ( 6.236 -0.068 0.832) 6.292 4.295 ( 3.474 -0.302 2.703) 4.412 4.785 ( -5.958 0.713 -0.176) 6.003 4.804 ( -11.437 0.050 -0.017) 11.437 5.905 ( 10.260 3.899 3.226) 11.440 5.933 ( 9.185 3.218 -1.626) 9.867 6.253 ( 2.845 -5.931 -7.593) 10.046 6.767 ( -6.411 3.658 0.190) 7.383 7.370 ( 0.526 -2.653 0.107) 2.707 7.484 ( -2.774 -2.086 -6.907) 7.729 7.694 ( 3.091 -2.024 5.545) 6.663 8.100 ( 5.034 -0.014 -9.358) 10.626 8.687 ( 6.078 7.272 -0.185) 9.479 8.839 ( 8.834 -2.598 7.152) 11.659 10.363 ( 1.853 0.099 -16.054) 16.161 10.635 ( 1.116 -0.865 -4.286) 4.512 11.395 ( -23.236 2.568 19.076) 30.173 11.553 ( 4.037 -0.382 11.337) 12.040 14.118 ( 0.418 7.742 -9.838) 12.526 14.452 ( 2.578 -9.293 2.321) 9.920 15.788 ( 2.630 2.266 -0.463) 3.502 15.876 ( 1.619 -1.775 2.179) 3.243 ======================= Grid point 129 (53/306) ======================= q-point: (-0.60 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -2.392 9.246 -5.569) 11.056 1.888 ( -6.397 2.727 8.904) 11.298 2.134 ( 0.922 -4.667 -5.499) 7.271 2.597 ( -0.699 3.852 -0.951) 4.029 2.701 ( -9.939 12.151 7.990) 17.614 2.937 ( 0.737 -5.433 4.229) 6.924 3.272 ( 4.622 -10.132 2.718) 11.463 3.587 ( -10.558 -7.383 -4.757) 13.733 4.213 ( 0.465 5.348 -11.607) 12.789 4.365 ( 2.359 -2.770 -3.162) 4.820 4.604 ( -13.510 1.069 6.260) 14.928 4.767 ( -7.119 -2.905 4.901) 9.118 5.877 ( 7.787 9.411 -4.620) 13.060 6.140 ( 7.660 2.804 7.920) 11.369 6.343 ( 8.112 -8.639 -6.293) 13.418 6.678 ( -2.792 0.601 1.330) 3.151 7.324 ( -4.905 -0.278 -3.183) 5.854 7.411 ( -4.603 -6.334 -5.287) 9.448 7.907 ( 10.994 -2.070 8.213) 13.878 8.092 ( 8.251 0.987 -8.929) 12.197 8.660 ( 4.418 8.670 -2.867) 10.144 9.055 ( 7.649 -0.056 8.641) 11.540 10.210 ( 0.813 -0.087 -17.253) 17.273 10.618 ( -0.004 -1.003 -2.115) 2.340 11.235 ( -18.901 1.721 12.643) 22.805 11.771 ( 11.409 3.249 10.851) 16.077 13.954 ( -3.632 3.784 -5.463) 7.573 14.613 ( 2.886 -7.746 4.355) 9.343 15.788 ( 1.426 2.450 -0.471) 2.874 15.911 ( -1.368 -1.370 0.756) 2.078 ======================= Grid point 130 (54/306) ======================= q-point: (-0.50 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -8.366 8.950 -1.597) 12.355 1.847 ( -8.666 3.028 8.059) 12.215 2.092 ( -4.251 -2.634 -7.671) 9.156 2.391 ( -5.257 14.506 2.006) 15.559 2.630 ( -2.183 4.861 4.510) 6.981 3.020 ( -0.851 -2.122 4.182) 4.767 3.452 ( -1.846 -10.895 0.596) 11.066 3.496 ( -6.042 -3.229 0.490) 6.868 3.992 ( -1.233 8.828 -11.641) 14.662 4.279 ( -11.975 -1.429 -1.269) 12.126 4.599 ( -0.075 -2.451 5.937) 6.424 4.718 ( -8.867 -3.619 1.933) 9.770 5.878 ( 8.429 6.384 -1.336) 10.658 6.246 ( 4.188 2.488 4.174) 6.415 6.496 ( 7.824 -8.482 -5.177) 12.647 6.692 ( -0.095 -1.003 1.970) 2.212 7.243 ( -4.810 -4.940 -1.503) 7.057 7.358 ( -4.887 -6.541 -4.717) 9.429 8.063 ( 9.970 4.888 -6.648) 12.942 8.234 ( 14.876 -0.491 5.417) 15.839 8.586 ( 3.374 8.555 -4.459) 10.221 9.230 ( 6.490 1.908 6.525) 9.399 10.026 ( -1.994 0.368 -15.753) 15.883 10.615 ( -0.893 -0.858 1.146) 1.687 11.087 ( -14.246 0.735 7.151) 15.957 12.017 ( 15.355 6.747 8.717) 18.902 13.823 ( -7.214 0.394 -0.955) 7.288 14.789 ( 4.322 -6.451 5.828) 9.709 15.768 ( -0.140 2.418 -0.441) 2.461 15.876 ( -4.794 -1.271 -1.679) 5.237 ======================= Grid point 131 (55/306) ======================= q-point: (-0.40 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.159 ( -13.463 7.800 5.539) 16.516 1.696 ( -10.283 11.529 2.257) 15.613 1.928 ( -10.696 4.037 3.411) 11.931 2.289 ( 0.089 4.825 1.925) 5.196 2.578 ( -1.846 9.693 2.741) 10.240 3.048 ( -0.381 1.288 3.040) 3.323 3.378 ( -4.564 9.768 -3.531) 11.345 3.451 ( -8.327 -7.156 -2.059) 11.171 3.878 ( 1.837 -0.463 -1.522) 2.430 4.109 ( -13.490 -0.241 3.473) 13.932 4.564 ( -8.292 -0.469 -1.285) 8.404 4.779 ( 2.972 -8.654 2.825) 9.576 5.947 ( 8.017 3.633 0.851) 8.843 6.337 ( 5.077 -2.307 1.210) 5.706 6.597 ( 1.242 -5.910 -4.417) 7.482 6.713 ( 1.762 -1.270 0.237) 2.185 7.280 ( -1.954 -10.452 1.036) 10.683 7.315 ( -3.672 -6.854 -4.200) 8.838 8.058 ( 9.682 8.582 -7.592) 15.001 8.446 ( 7.691 8.455 -2.645) 11.732 8.553 ( 11.815 1.923 1.237) 12.034 9.292 ( 5.449 4.094 -9.342) 11.564 9.863 ( -5.595 0.552 0.987) 5.708 10.635 ( -1.817 -0.658 4.836) 5.207 10.969 ( -9.687 -0.714 3.431) 10.302 12.242 ( 17.618 9.089 5.036) 20.454 13.710 ( -11.417 -1.718 2.729) 11.864 14.998 ( 6.918 -5.455 7.187) 11.370 15.705 ( -7.652 0.006 -1.766) 7.853 15.780 ( -2.799 0.805 -3.841) 4.820 ======================= Grid point 132 (56/306) ======================= q-point: (-0.30 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( -13.923 6.266 17.381) 23.134 1.423 ( -5.860 19.788 2.303) 20.766 1.809 ( -11.096 3.591 11.332) 16.262 2.235 ( -1.661 18.155 3.166) 18.504 2.404 ( -7.062 9.055 3.531) 12.014 3.077 ( 4.237 0.311 -2.306) 4.834 3.180 ( 3.470 13.314 -3.235) 14.134 3.392 ( -10.542 -5.526 1.662) 12.018 3.915 ( 0.584 -5.149 -3.514) 6.261 3.979 ( -10.454 0.764 4.917) 11.578 4.472 ( -2.692 -0.329 1.367) 3.037 4.942 ( 1.394 -10.925 1.772) 11.155 6.015 ( 4.494 3.805 0.410) 5.903 6.448 ( 5.194 -5.166 -2.552) 7.757 6.584 ( -3.082 -5.359 -2.950) 6.850 6.788 ( 3.758 -3.300 -0.138) 5.003 7.301 ( -1.276 -5.902 -1.793) 6.299 7.404 ( -0.483 -13.425 -1.281) 13.494 7.997 ( 7.561 12.415 -7.064) 16.162 8.353 ( 3.098 8.638 -7.602) 11.916 8.751 ( 13.918 3.191 -0.986) 14.313 9.061 ( -0.378 7.553 -26.380) 27.443 9.968 ( -0.254 -3.125 23.928) 24.133 10.681 ( -3.423 -0.872 10.280) 10.870 10.898 ( -5.533 -1.857 0.995) 5.921 12.449 ( 19.395 7.473 1.531) 20.841 13.568 ( -17.592 -1.582 5.369) 18.461 15.243 ( 8.679 -4.018 7.328) 12.048 15.486 ( -15.267 -2.013 -8.179) 17.436 15.725 ( 0.779 2.772 -1.836) 3.415 ======================= Grid point 133 (57/306) ======================= q-point: (-0.20 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -8.806 6.516 21.718) 24.324 1.237 ( 1.958 20.584 11.820) 23.816 1.781 ( -8.841 3.294 16.513) 19.019 1.952 ( 0.001 33.650 12.399) 35.862 2.357 ( 0.325 -0.736 -2.484) 2.611 3.016 ( 2.494 10.561 -1.785) 10.998 3.185 ( 3.739 2.152 -7.483) 8.637 3.287 ( -4.631 3.214 6.109) 8.313 3.911 ( -3.383 1.033 5.256) 6.335 3.929 ( 0.460 -6.014 -6.512) 8.876 4.547 ( 3.529 -4.373 5.543) 7.893 5.067 ( -1.733 -10.890 0.694) 11.049 5.976 ( -2.067 5.672 -2.024) 6.367 6.523 ( 3.910 -4.352 -5.422) 7.977 6.583 ( -2.892 -9.370 -4.734) 10.889 6.862 ( 2.159 -1.927 0.507) 2.938 7.373 ( 2.402 -7.525 0.328) 7.906 7.489 ( -0.105 -9.844 -5.579) 11.315 7.874 ( 5.460 14.724 -6.733) 17.086 8.202 ( 2.504 10.074 -9.975) 14.396 8.694 ( -5.765 7.303 -14.961) 17.618 8.823 ( 8.929 5.936 -8.470) 13.664 10.326 ( 6.810 -8.566 15.522) 18.991 10.795 ( -6.459 -3.523 19.994) 21.305 10.873 ( -2.135 -3.484 2.811) 4.959 12.687 ( 9.032 -5.524 3.811) 11.253 13.348 ( -16.294 4.777 6.202) 18.077 15.119 ( -14.903 3.310 -11.696) 19.232 15.500 ( 8.768 -3.365 2.963) 9.848 15.698 ( 1.704 2.766 -1.143) 3.444 ======================= Grid point 134 (58/306) ======================= q-point: (-0.10 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( -0.798 10.307 19.406) 21.988 1.312 ( 9.434 15.492 18.102) 25.626 1.764 ( -6.911 4.736 15.697) 17.793 2.015 ( 14.475 13.953 18.783) 27.514 2.319 ( 6.122 3.480 -10.129) 12.336 2.962 ( 3.625 9.654 4.487) 11.246 3.034 ( -5.525 7.212 3.906) 9.889 3.389 ( 9.934 5.267 6.059) 12.772 3.917 ( -1.528 -6.684 -8.218) 10.703 3.967 ( 5.274 1.169 4.295) 6.901 4.722 ( 4.745 -7.554 2.362) 9.228 5.127 ( -4.201 -8.959 -1.256) 9.975 5.814 ( -6.769 6.941 -2.958) 10.136 6.523 ( -1.878 -4.005 -7.496) 8.704 6.564 ( -1.073 -7.096 -10.047) 12.347 6.894 ( -0.316 -1.413 0.098) 1.451 7.418 ( 0.308 -2.202 -9.748) 9.998 7.573 ( 5.557 -5.509 3.164) 8.440 7.752 ( 5.315 9.492 -4.804) 11.892 8.069 ( 3.023 7.261 -3.091) 8.451 8.463 ( -4.004 4.787 -5.277) 8.173 8.733 ( 2.026 6.937 -9.260) 11.746 10.536 ( 4.887 -4.349 -1.412) 6.692 10.809 ( -2.134 -0.050 -1.350) 2.526 11.107 ( -5.956 -11.242 22.774) 26.086 12.599 ( -51.936 -7.496 23.508) 57.499 13.441 ( 28.964 -4.204 -4.267) 29.577 14.788 ( -2.795 8.211 -13.266) 15.850 15.612 ( 3.452 0.840 -0.859) 3.656 15.704 ( 4.626 2.866 -0.890) 5.514 ======================= Grid point 138 (59/306) ======================= q-point: ( 0.30 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 1.737 0.000 -12.498) 12.618 1.901 ( -6.493 -0.000 4.108) 7.683 2.104 ( -5.112 -0.000 4.761) 6.985 2.605 ( 4.411 0.000 2.757) 5.202 2.863 ( 1.454 0.000 3.752) 4.024 2.973 ( -2.846 -0.000 7.890) 8.388 3.050 ( -3.835 -0.000 1.339) 4.062 3.500 ( -7.509 -0.000 -7.367) 10.520 4.274 ( 2.052 0.000 -9.495) 9.714 4.336 ( 1.619 0.000 -3.422) 3.786 4.613 ( -13.797 -0.000 6.422) 15.219 4.738 ( -7.147 -0.000 4.013) 8.196 6.047 ( 10.497 0.000 -5.907) 12.045 6.168 ( 5.313 0.000 2.244) 5.768 6.186 ( 8.228 0.000 1.307) 8.331 6.690 ( -5.512 -0.000 -1.026) 5.607 7.319 ( -3.570 -0.000 -1.766) 3.983 7.339 ( -6.827 -0.000 -5.786) 8.949 7.884 ( 12.641 0.000 9.459) 15.788 8.104 ( 9.047 0.000 -9.474) 13.100 8.763 ( 3.930 0.000 -5.001) 6.361 9.045 ( 8.097 0.000 9.878) 12.773 10.208 ( -0.093 -0.000 -16.006) 16.006 10.607 ( 0.567 0.000 -2.363) 2.430 11.254 ( -20.225 -0.000 13.022) 24.054 11.804 ( 12.106 0.000 11.796) 16.903 14.011 ( -3.943 -0.000 -9.751) 10.518 14.516 ( 4.283 0.000 7.063) 8.261 15.819 ( 1.580 0.000 -1.252) 2.016 15.890 ( -1.687 -0.000 1.551) 2.292 ======================= Grid point 139 (60/306) ======================= q-point: (-0.60 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( -3.947 5.124 -11.263) 12.988 1.868 ( -4.994 -1.586 3.790) 6.467 2.059 ( -8.106 0.759 5.582) 9.871 2.620 ( 0.767 4.442 -4.166) 6.138 2.825 ( -7.600 15.013 9.475) 19.311 2.938 ( 1.123 -3.732 2.718) 4.752 3.177 ( -5.147 -15.220 4.698) 16.740 3.425 ( 2.443 -2.212 -2.458) 4.111 4.142 ( 0.466 4.586 -12.967) 13.762 4.255 ( -6.736 -0.961 -3.986) 7.886 4.576 ( -4.464 -0.287 8.821) 9.890 4.666 ( -9.702 -1.317 3.950) 10.558 6.044 ( 7.437 9.426 -3.756) 12.581 6.273 ( 5.697 -8.997 -3.609) 11.244 6.356 ( 4.954 3.126 5.479) 8.021 6.637 ( -1.723 -3.476 -0.252) 3.888 7.173 ( -9.271 -1.673 -4.020) 10.242 7.257 ( -4.069 -2.698 -2.397) 5.439 8.143 ( 12.181 2.720 -6.895) 14.259 8.213 ( 16.977 -1.288 6.777) 18.325 8.722 ( 3.195 3.776 -7.801) 9.237 9.246 ( 5.726 0.119 8.896) 10.580 10.030 ( -2.564 0.058 -14.136) 14.367 10.603 ( -0.357 -0.301 0.992) 1.096 11.099 ( -15.700 0.323 7.162) 17.260 12.107 ( 14.434 2.079 10.378) 17.899 13.855 ( -5.552 1.575 -4.795) 7.504 14.682 ( 6.051 -3.187 6.886) 9.705 15.811 ( -0.388 1.674 -1.005) 1.991 15.849 ( -4.981 -1.279 -1.116) 5.262 ======================= Grid point 140 (61/306) ======================= q-point: (-0.50 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -8.139 5.871 -5.329) 11.363 1.843 ( -5.619 2.572 5.082) 8.001 1.979 ( -9.191 1.523 5.596) 10.867 2.466 ( -2.631 10.628 -1.810) 11.098 2.747 ( -1.580 7.530 7.945) 11.060 3.014 ( 1.123 -4.223 0.340) 4.383 3.259 ( -8.179 -10.436 4.727) 14.077 3.478 ( 3.673 0.835 -3.050) 4.847 3.971 ( 1.728 6.871 -8.723) 11.238 4.116 ( -10.247 0.584 1.357) 10.352 4.557 ( -8.624 -0.158 1.781) 8.807 4.651 ( -0.856 -3.725 5.499) 6.696 6.040 ( 7.241 5.993 -1.543) 9.525 6.357 ( 2.834 2.259 1.234) 3.829 6.437 ( 3.416 -7.309 -2.680) 8.502 6.678 ( -0.256 -3.470 0.266) 3.490 7.064 ( -7.816 -8.305 -1.177) 11.465 7.212 ( -3.092 -3.442 -2.314) 5.173 8.198 ( 12.208 4.877 -8.000) 15.389 8.542 ( 17.690 1.056 4.869) 18.378 8.630 ( 3.296 4.776 -8.623) 10.394 9.351 ( 3.377 1.799 -3.038) 4.886 9.872 ( -5.226 0.329 -1.089) 5.348 10.623 ( -1.419 -0.393 4.562) 4.794 10.958 ( -11.019 -0.387 2.974) 11.419 12.365 ( 12.861 3.321 6.464) 14.773 13.724 ( -6.486 2.076 -0.427) 6.823 14.897 ( 9.014 -4.029 6.584) 11.867 15.698 ( -10.918 -0.313 -2.908) 11.303 15.804 ( 0.331 1.054 -2.204) 2.465 ======================= Grid point 141 (62/306) ======================= q-point: (-0.40 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.123 ( -7.480 5.850 5.872) 11.165 1.743 ( -4.645 10.316 3.624) 11.880 1.900 ( -8.566 3.742 9.932) 13.639 2.360 ( -1.287 5.796 3.197) 6.743 2.721 ( -1.251 10.072 4.874) 11.259 3.058 ( 1.127 -2.461 -1.706) 3.200 3.248 ( -6.730 -5.029 -2.232) 8.693 3.431 ( 1.669 7.565 0.540) 7.766 3.891 ( 1.841 3.685 -3.169) 5.197 4.004 ( -8.085 1.508 5.464) 9.874 4.466 ( -4.738 -0.221 0.921) 4.832 4.750 ( -0.184 -7.048 3.246) 7.762 6.080 ( 5.258 3.300 -0.226) 6.212 6.395 ( 3.052 -0.682 -0.076) 3.128 6.492 ( -0.348 -4.046 -4.091) 5.764 6.707 ( 0.887 -3.707 0.385) 3.831 7.103 ( -3.805 -14.593 -0.399) 15.086 7.198 ( -1.169 -4.108 -1.416) 4.499 8.212 ( 9.986 8.167 -7.601) 14.973 8.511 ( 3.406 6.291 -9.554) 11.935 8.798 ( 12.781 1.458 0.733) 12.885 9.188 ( -1.511 4.737 -21.417) 21.986 9.931 ( -1.016 -0.778 19.803) 19.844 10.665 ( -2.781 -0.603 8.348) 8.820 10.862 ( -6.474 -1.540 0.764) 6.699 12.533 ( 8.346 1.576 1.398) 8.607 13.607 ( -7.203 4.065 2.441) 8.624 15.157 ( 11.774 -4.269 5.974) 13.876 15.465 ( -15.143 -0.166 -6.122) 16.334 15.775 ( 0.901 1.924 -1.981) 2.905 ======================= Grid point 142 (63/306) ======================= q-point: (-0.30 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( -3.344 5.663 16.446) 17.712 1.621 ( 1.344 14.909 5.667) 16.006 1.880 ( -6.976 5.276 16.128) 18.347 2.346 ( -0.466 1.730 2.277) 2.897 2.554 ( -4.016 21.292 4.097) 22.052 3.066 ( 0.929 -2.710 -4.883) 5.661 3.186 ( -2.156 -2.618 -3.264) 4.707 3.435 ( 5.372 8.453 6.288) 11.825 3.851 ( 0.602 0.807 -3.171) 3.327 3.966 ( -2.864 3.642 7.087) 8.467 4.474 ( 1.161 -2.875 2.507) 3.987 4.846 ( -2.130 -9.662 1.463) 10.002 6.078 ( -0.505 4.284 -0.708) 4.371 6.419 ( -3.676 -5.819 -3.816) 7.870 6.481 ( 5.002 -0.092 -3.891) 6.338 6.791 ( 1.604 -4.868 1.802) 5.433 7.192 ( -0.866 -11.746 -3.496) 12.286 7.265 ( 1.975 -8.771 0.921) 9.037 8.148 ( 5.897 11.313 -7.063) 14.582 8.388 ( 3.724 7.794 -10.681) 13.737 8.794 ( -9.125 3.145 -10.192) 14.037 8.946 ( 9.658 5.111 -13.909) 17.688 10.209 ( 5.617 -3.087 19.406) 20.437 10.740 ( -4.978 -1.929 15.212) 16.122 10.817 ( -3.323 -2.266 0.050) 4.022 12.591 ( -2.849 -3.789 -1.415) 4.947 13.493 ( -3.165 8.036 3.750) 9.416 15.160 ( -14.885 0.650 -8.825) 17.316 15.427 ( 12.021 -3.200 3.956) 13.053 15.751 ( 1.529 2.242 -1.590) 3.145 ======================= Grid point 143 (64/306) ======================= q-point: (-0.20 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( -1.429 7.003 18.116) 19.475 1.644 ( 9.041 14.472 13.539) 21.783 1.874 ( -11.186 7.099 15.841) 20.651 2.332 ( 4.315 2.650 -2.049) 5.463 2.396 ( 3.227 15.751 5.961) 17.147 3.022 ( -5.007 -1.109 -0.963) 5.218 3.194 ( 6.391 3.215 1.205) 7.254 3.533 ( 9.194 6.592 6.220) 12.910 3.822 ( 1.164 0.768 -3.879) 4.122 4.009 ( 3.411 3.154 7.478) 8.804 4.584 ( 3.848 -5.721 1.278) 7.012 4.915 ( -4.441 -10.763 0.290) 11.647 5.961 ( -5.393 7.016 -1.220) 8.933 6.362 ( -5.993 -7.657 -7.102) 12.041 6.517 ( 5.361 -0.297 -5.892) 7.972 6.855 ( -1.146 -2.859 1.063) 3.259 7.265 ( 1.389 -9.833 -5.056) 11.144 7.427 ( 5.424 -8.546 2.246) 10.368 8.006 ( 3.334 12.655 -8.327) 15.512 8.234 ( 1.615 8.144 -7.788) 11.383 8.534 ( -7.015 2.433 -7.532) 10.576 8.874 ( 3.809 5.838 -10.341) 12.471 10.460 ( 7.711 -2.550 1.765) 8.311 10.798 ( -2.577 -1.058 1.461) 3.145 10.917 ( -6.683 -6.976 24.490) 26.326 12.456 ( -25.440 -5.854 4.014) 26.412 13.492 ( 11.199 6.685 1.702) 13.153 14.882 ( -7.446 1.974 -9.253) 12.039 15.613 ( 6.994 -0.756 -0.219) 7.038 15.750 ( 3.785 1.762 -0.975) 4.287 ======================= Grid point 144 (65/306) ======================= q-point: (-0.10 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -0.796 6.467 21.329) 22.302 1.734 ( 0.202 10.139 4.622) 11.144 1.837 ( 3.378 5.515 13.755) 15.199 2.340 ( 3.098 7.360 -1.232) 8.080 2.469 ( 10.939 2.576 6.375) 12.920 2.963 ( -6.945 0.394 5.884) 9.111 3.349 ( 14.965 6.033 8.434) 18.207 3.655 ( 5.120 -0.362 0.581) 5.165 3.787 ( 4.095 7.697 0.588) 8.739 4.137 ( 8.421 2.309 4.517) 9.831 4.699 ( 2.389 -7.462 -1.162) 7.921 4.945 ( -5.212 -9.537 -1.651) 10.993 5.789 ( -5.668 8.588 0.876) 10.327 6.244 ( -7.829 -6.961 -11.564) 15.604 6.504 ( 2.990 0.287 -7.983) 8.530 6.840 ( -4.154 -2.193 -0.618) 4.738 7.319 ( 2.580 -4.499 -4.294) 6.733 7.623 ( 5.844 -6.867 2.586) 9.380 7.847 ( 3.278 9.010 -7.992) 12.482 8.154 ( 2.732 4.592 -0.462) 5.363 8.375 ( -4.226 0.895 -4.917) 6.545 8.734 ( 0.675 6.910 -8.171) 10.722 10.540 ( 6.753 -1.793 -8.332) 10.874 10.780 ( -2.016 0.864 0.873) 2.361 11.135 ( -7.705 -7.383 19.970) 22.642 12.125 ( -37.227 -1.959 14.991) 40.180 13.680 ( 15.626 -2.234 -1.678) 15.874 14.730 ( 2.198 2.822 -8.593) 9.308 15.648 ( 1.992 1.455 -1.656) 2.971 15.793 ( 5.203 1.961 -1.323) 5.715 ======================= Grid point 149 (66/306) ======================= q-point: (-0.60 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -5.031 -0.000 -11.559) 12.607 1.845 ( -2.663 -0.000 3.488) 4.389 2.010 ( -13.076 -0.000 12.793) 18.293 2.597 ( -0.421 -0.000 -5.770) 5.786 2.898 ( -10.754 -0.000 10.630) 15.121 2.938 ( 3.263 0.000 -3.451) 4.750 3.082 ( -3.844 -0.000 9.110) 9.888 3.482 ( 8.564 0.000 -3.063) 9.096 4.058 ( 2.008 0.000 -10.197) 10.393 4.119 ( -8.134 -0.000 -0.351) 8.142 4.556 ( -9.181 -0.000 2.643) 9.554 4.615 ( -2.615 -0.000 7.978) 8.396 6.174 ( 6.347 0.000 -4.552) 7.810 6.243 ( 5.301 0.000 -1.665) 5.556 6.486 ( 0.371 0.000 5.017) 5.031 6.577 ( 0.208 0.000 -1.802) 1.814 6.982 ( -10.690 -0.000 -1.927) 10.863 7.175 ( -2.578 -0.000 -1.952) 3.233 8.251 ( 13.080 0.000 -8.487) 15.592 8.548 ( 18.391 0.000 6.059) 19.363 8.684 ( 3.071 0.000 -10.848) 11.275 9.370 ( 2.561 0.000 -0.128) 2.564 9.875 ( -4.990 -0.000 -1.785) 5.300 10.619 ( -1.215 -0.000 4.429) 4.592 10.954 ( -11.513 -0.000 2.682) 11.821 12.397 ( 10.939 0.000 6.881) 12.924 13.753 ( -4.679 -0.000 -1.721) 4.985 14.851 ( 9.770 0.000 6.558) 11.767 15.695 ( -11.315 -0.000 -2.860) 11.671 15.815 ( 0.736 0.000 -1.895) 2.033 ======================= Grid point 151 (67/306) ======================= q-point: (-0.50 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.223 ( -1.305 3.003 -3.067) 4.487 1.840 ( -1.833 0.453 1.421) 2.363 1.961 ( -13.057 2.231 16.634) 21.263 2.516 ( -0.231 6.267 -0.456) 6.287 2.838 ( -5.299 3.800 6.230) 9.018 2.964 ( 1.759 -4.970 -4.783) 7.118 3.141 ( -5.223 -4.758 6.406) 9.537 3.547 ( 7.065 3.147 -4.454) 8.925 3.996 ( -1.988 3.685 -1.180) 4.350 4.033 ( -0.837 1.061 1.298) 1.874 4.464 ( -6.108 -0.058 1.098) 6.206 4.663 ( -2.920 -1.622 6.801) 7.577 6.175 ( 5.572 5.626 -1.892) 8.141 6.344 ( 3.518 -5.933 -2.832) 7.456 6.467 ( -0.405 3.840 1.756) 4.242 6.630 ( 1.782 -5.161 -1.325) 5.618 6.862 ( -8.612 -6.301 1.036) 10.721 7.139 ( -0.870 -1.542 -1.820) 2.539 8.329 ( 11.433 2.936 -8.150) 14.344 8.602 ( 3.962 2.270 -11.607) 12.473 8.815 ( 12.142 0.317 1.573) 12.248 9.255 ( -2.879 1.673 -17.910) 18.217 9.924 ( -1.164 -0.079 18.926) 18.961 10.658 ( -2.308 -0.137 7.558) 7.903 10.838 ( -6.835 -0.654 0.021) 6.866 12.545 ( 3.877 0.042 0.988) 4.001 13.685 ( -2.908 2.450 1.262) 4.006 15.085 ( 12.130 -2.109 4.907) 13.254 15.468 ( -14.299 0.226 -4.302) 14.934 15.802 ( 0.983 0.662 -2.189) 2.489 ======================= Grid point 152 (68/306) ======================= q-point: (-0.40 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.231 ( 4.461 5.440 7.681) 10.416 1.815 ( -0.291 3.807 2.074) 4.345 1.957 ( -8.283 2.298 17.282) 19.302 2.466 ( 0.404 8.972 4.983) 10.270 2.780 ( -5.472 2.948 2.446) 6.680 2.982 ( -0.135 -5.658 -4.980) 7.538 3.148 ( -1.580 -1.233 -0.017) 2.005 3.543 ( 2.983 3.587 -1.257) 4.832 3.932 ( -0.584 3.860 2.052) 4.410 4.073 ( 3.523 6.222 7.082) 10.063 4.425 ( -1.056 -1.899 0.214) 2.184 4.700 ( -4.018 -4.002 4.191) 7.052 6.171 ( 1.983 5.049 -0.022) 5.424 6.350 ( -1.548 -0.744 -4.594) 4.905 6.482 ( 2.238 -1.521 -0.744) 2.806 6.692 ( 1.993 -3.286 1.451) 4.108 6.907 ( -1.547 -13.470 0.106) 13.559 7.150 ( 1.350 -3.436 -1.012) 3.828 8.330 ( 6.256 6.101 -7.192) 11.318 8.518 ( 6.180 4.580 -11.919) 14.185 8.837 ( -9.314 1.099 -7.620) 12.084 9.024 ( 6.171 2.485 -15.388) 16.764 10.177 ( 4.211 -0.469 21.841) 22.249 10.714 ( -3.628 -0.624 10.717) 11.332 10.776 ( -3.440 -1.660 -0.102) 3.821 12.530 ( -4.832 -2.088 -4.511) 6.932 13.645 ( 0.199 5.893 3.499) 6.856 15.146 ( -13.820 -1.545 -6.104) 15.187 15.385 ( 11.460 -0.825 3.297) 11.953 15.787 ( 1.465 1.172 -2.126) 2.835 ======================= Grid point 153 (69/306) ======================= q-point: (-0.30 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 4.659 7.603 12.726) 15.539 1.834 ( 1.489 4.416 8.956) 10.096 2.027 ( -1.612 4.361 14.103) 14.849 2.417 ( -1.001 9.426 4.563) 10.520 2.659 ( -6.124 6.553 1.584) 9.108 2.968 ( -1.880 -3.788 -3.833) 5.708 3.193 ( 7.987 -1.222 -0.259) 8.084 3.547 ( -1.025 -2.322 0.036) 2.538 3.958 ( 7.420 6.401 3.613) 10.445 4.130 ( 3.350 9.223 10.230) 14.175 4.480 ( 3.366 -4.549 -0.305) 5.667 4.719 ( -5.504 -7.118 1.746) 9.165 6.106 ( -3.169 7.035 0.877) 7.766 6.257 ( -4.291 -1.856 -6.764) 8.223 6.516 ( 4.099 -0.851 -4.303) 6.003 6.773 ( -1.759 -4.493 3.783) 6.131 7.050 ( 4.994 -10.618 -2.846) 12.074 7.249 ( 4.707 -7.619 1.407) 9.065 8.233 ( 0.822 8.851 -7.173) 11.422 8.390 ( 0.550 6.553 -12.322) 13.966 8.569 ( -6.176 0.968 -9.603) 11.458 8.963 ( 3.505 2.778 -9.774) 10.748 10.436 ( 7.574 0.108 7.538) 10.687 10.764 ( -2.601 -2.133 3.060) 4.547 10.815 ( -5.813 -3.029 18.689) 19.806 12.358 ( -15.507 -3.654 -5.774) 16.946 13.655 ( 5.761 8.052 4.663) 10.943 14.891 ( -11.279 -0.755 -6.711) 13.146 15.589 ( 10.135 -1.272 0.417) 10.223 15.781 ( 2.431 1.164 -1.654) 3.162 ======================= Grid point 154 (70/306) ======================= q-point: (-0.20 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 2.280 7.795 15.766) 17.735 1.867 ( -11.005 4.075 10.932) 16.038 2.073 ( 9.324 13.148 5.275) 16.960 2.417 ( 3.433 2.261 5.310) 6.715 2.557 ( -2.571 4.600 4.520) 6.943 2.944 ( -2.817 -2.506 -0.132) 3.773 3.383 ( 13.189 0.040 2.410) 13.407 3.560 ( -1.322 -6.492 -0.810) 6.674 4.062 ( 12.325 12.021 5.644) 18.118 4.208 ( 4.988 5.203 7.977) 10.751 4.570 ( 2.303 -4.867 -1.041) 5.484 4.738 ( -5.087 -9.499 0.453) 10.785 5.970 ( -5.064 8.889 1.679) 10.368 6.130 ( -6.078 -3.115 -8.631) 11.006 6.513 ( 3.229 0.146 -7.660) 8.314 6.787 ( -5.165 -3.254 1.016) 6.189 7.200 ( 6.770 -6.060 -1.570) 9.221 7.450 ( 7.033 -9.468 2.140) 11.987 8.015 ( -3.765 6.213 -10.662) 12.902 8.253 ( -0.168 4.356 -2.187) 4.877 8.421 ( -0.451 4.012 -8.319) 9.247 8.852 ( -0.107 4.219 -8.520) 9.508 10.526 ( 8.288 0.383 -9.408) 12.544 10.786 ( -2.832 -0.106 5.627) 6.300 10.998 ( -7.510 -5.770 22.719) 24.614 12.068 ( -24.122 -3.192 -0.219) 24.333 13.737 ( 9.508 6.559 3.570) 12.090 14.738 ( -2.613 -1.689 -5.341) 6.181 15.677 ( 3.713 1.169 -2.229) 4.486 15.811 ( 4.643 0.074 -1.395) 4.849 ======================= Grid point 155 (71/306) ======================= q-point: (-0.10 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( -6.339 6.959 16.769) 19.231 1.742 ( -5.442 3.837 6.384) 9.225 2.129 ( 8.347 7.220 -1.502) 11.138 2.481 ( 2.283 5.941 8.375) 10.519 2.639 ( 4.287 -1.775 7.121) 8.500 2.936 ( -3.112 -0.768 3.286) 4.591 3.432 ( -3.632 -4.162 -6.966) 8.890 3.768 ( 15.148 -0.891 8.737) 17.510 4.153 ( 10.427 13.752 6.379) 18.399 4.285 ( 3.880 1.978 -2.799) 5.177 4.653 ( 0.983 -6.549 4.609) 8.068 4.772 ( -2.152 -6.968 -1.424) 7.430 5.848 ( -2.769 8.146 4.071) 9.518 5.958 ( -7.789 -2.579 -11.047) 13.761 6.449 ( 1.481 0.405 -9.159) 9.287 6.739 ( -5.177 -2.206 -0.304) 5.636 7.319 ( 5.208 -2.230 -0.649) 5.702 7.648 ( 4.852 -6.634 1.103) 8.293 7.852 ( 0.899 2.122 -8.144) 8.464 8.227 ( 1.806 2.269 0.974) 3.059 8.290 ( -0.895 3.205 -6.805) 7.575 8.725 ( -0.590 4.003 -4.360) 5.948 10.510 ( 8.117 -0.640 -15.386) 17.408 10.788 ( -2.509 2.065 3.356) 4.672 11.151 ( -7.813 -5.095 16.760) 19.181 11.778 ( -26.044 -2.690 9.235) 27.764 13.840 ( 7.722 2.500 0.923) 8.169 14.726 ( 4.291 -0.352 -3.626) 5.629 15.667 ( 1.363 1.419 -2.120) 2.892 15.857 ( 3.843 0.465 -1.291) 4.080 ======================= Grid point 161 (72/306) ======================= q-point: ( 0.50 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( 8.912 0.000 3.075) 9.428 1.835 ( -0.943 0.000 1.517) 1.786 1.985 ( -11.352 0.000 19.498) 22.562 2.592 ( 4.275 0.000 2.894) 5.163 2.814 ( -7.911 0.000 4.595) 9.149 2.893 ( 1.084 0.000 -6.059) 6.156 3.114 ( -4.132 0.000 4.308) 5.969 3.590 ( 4.098 0.000 -7.340) 8.406 3.970 ( -2.481 0.000 4.250) 4.922 4.150 ( 7.223 0.000 5.680) 9.188 4.403 ( -2.347 0.000 -0.816) 2.485 4.666 ( -5.757 0.000 6.849) 8.947 6.262 ( 4.738 0.000 -2.692) 5.450 6.334 ( 2.404 0.000 -1.550) 2.861 6.451 ( -4.957 0.000 0.041) 4.957 6.662 ( 8.016 0.000 -1.368) 8.132 6.739 ( -6.142 0.000 4.068) 7.367 7.113 ( 1.133 0.000 -1.868) 2.185 8.394 ( 6.318 0.000 -7.412) 9.739 8.568 ( 7.722 0.000 -12.406) 14.613 8.847 ( -9.549 0.000 -6.831) 11.741 9.050 ( 4.506 0.000 -15.655) 16.291 10.174 ( 3.519 0.000 23.136) 23.402 10.709 ( -3.186 0.000 9.911) 10.410 10.756 ( -3.211 0.000 -1.143) 3.408 12.507 ( -5.057 0.000 -5.534) 7.496 13.710 ( 0.981 0.000 3.541) 3.675 15.124 ( -12.088 0.000 -4.789) 13.002 15.380 ( 9.668 0.000 2.668) 10.029 15.799 ( 1.479 0.000 -2.372) 2.795 ======================= Grid point 163 (73/306) ======================= q-point: (-0.40 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( 12.170 4.865 6.442) 14.604 1.863 ( 0.508 -0.746 4.634) 4.721 2.053 ( -6.269 0.059 18.187) 19.237 2.641 ( -0.184 5.795 2.138) 6.180 2.738 ( -3.758 6.333 5.064) 8.937 2.881 ( 0.195 -4.046 -3.337) 5.248 3.126 ( -0.132 -5.299 2.540) 5.878 3.529 ( -1.049 0.529 -5.880) 5.996 4.035 ( 5.133 1.820 6.081) 8.163 4.294 ( 3.834 4.309 7.008) 9.076 4.404 ( 4.238 -2.075 -0.773) 4.782 4.636 ( -7.697 -1.465 4.494) 9.032 6.245 ( 0.695 6.172 -0.944) 6.282 6.291 ( -1.382 3.685 -6.407) 7.519 6.435 ( -1.328 -6.334 -0.020) 6.472 6.700 ( -4.735 -2.705 5.889) 8.026 6.867 ( 12.125 -5.101 -0.164) 13.155 7.139 ( 3.406 -2.769 -1.443) 4.621 8.361 ( 0.915 3.234 -5.393) 6.355 8.494 ( -9.960 3.168 -14.304) 17.716 8.573 ( 3.684 -0.508 -12.235) 12.788 8.997 ( 2.889 0.712 -9.107) 9.581 10.448 ( 6.117 0.560 13.153) 14.517 10.728 ( -2.911 -0.993 4.408) 5.375 10.776 ( -4.066 -0.933 12.263) 12.953 12.306 ( -12.118 -1.304 -9.860) 15.677 13.786 ( 5.203 3.694 6.087) 8.819 14.868 ( -13.916 -0.942 -5.477) 14.984 15.570 ( 11.323 -0.505 0.527) 11.346 15.797 ( 1.946 0.405 -2.194) 2.960 ======================= Grid point 164 (74/306) ======================= q-point: (-0.30 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 7.717 8.554 8.447) 14.285 1.929 ( -4.643 1.541 9.871) 11.016 2.191 ( 3.529 -1.498 9.587) 10.325 2.529 ( -7.250 4.096 1.392) 8.443 2.678 ( -0.614 11.434 7.158) 13.504 2.874 ( -0.888 -3.002 -2.776) 4.184 3.331 ( 8.513 -10.341 6.310) 14.806 3.455 ( -0.624 0.841 -3.094) 3.266 4.193 ( 10.313 3.080 6.830) 12.747 4.318 ( 1.502 1.576 -0.595) 2.256 4.516 ( 2.880 0.341 2.538) 3.854 4.595 ( -4.538 -3.800 4.240) 7.281 6.130 ( -3.569 3.688 -8.922) 10.293 6.158 ( -3.116 8.121 2.041) 8.935 6.478 ( 1.914 -4.249 -4.531) 6.500 6.715 ( -6.519 -3.050 5.178) 8.866 7.096 ( 12.350 -3.613 -0.095) 12.868 7.258 ( 6.508 -8.071 0.250) 10.371 8.099 ( -13.438 2.270 -12.305) 18.361 8.322 ( -0.658 2.236 -2.298) 3.273 8.520 ( 6.849 4.446 -12.184) 14.667 8.910 ( -0.766 1.598 -7.914) 8.110 10.547 ( 8.422 1.276 -10.468) 13.496 10.787 ( -4.131 0.504 12.695) 13.360 10.896 ( -6.325 -4.072 20.389) 21.733 12.008 ( -17.173 -2.339 -9.345) 19.691 13.898 ( 7.889 7.673 7.504) 13.320 14.677 ( -7.728 -3.640 -4.283) 9.556 15.693 ( 6.491 0.401 -2.351) 6.915 15.808 ( 2.962 -0.220 -1.726) 3.435 ======================= Grid point 165 (75/306) ======================= q-point: (-0.20 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( -0.119 8.588 10.620) 13.659 1.860 ( -9.916 6.528 9.458) 15.179 2.266 ( 3.276 4.752 -5.068) 7.681 2.514 ( -1.699 -4.439 9.305) 10.449 2.667 ( 0.691 7.630 10.239) 12.788 2.884 ( 0.634 -3.578 -1.143) 3.809 3.366 ( -6.088 -3.647 -2.623) 7.566 3.712 ( 17.635 -3.480 9.697) 20.424 4.283 ( 0.693 -2.491 -7.512) 7.945 4.359 ( 4.026 5.133 1.610) 6.719 4.529 ( 0.122 -4.130 5.592) 6.953 4.702 ( 4.172 0.018 6.799) 7.977 5.932 ( -5.274 2.331 -10.776) 12.222 6.048 ( -4.472 8.775 4.779) 10.948 6.463 ( 2.743 0.523 -8.457) 8.906 6.686 ( -6.601 -2.664 2.669) 7.602 7.277 ( 8.646 -1.639 0.466) 8.813 7.469 ( 8.006 -10.073 0.214) 12.869 7.829 ( -8.005 -2.545 -8.380) 11.865 8.285 ( 0.255 2.781 0.648) 2.867 8.416 ( 3.950 7.291 -10.474) 13.359 8.790 ( -2.607 2.152 -5.748) 6.669 10.509 ( 8.793 0.386 -17.278) 19.391 10.830 ( -3.817 2.212 8.736) 9.787 11.054 ( -7.722 -4.306 18.996) 20.953 11.708 ( -18.761 -3.627 -2.778) 19.310 13.973 ( 5.278 9.524 5.104) 12.026 14.660 ( 1.614 -5.765 -0.436) 6.003 15.704 ( 1.931 1.905 -3.294) 4.267 15.847 ( 3.375 -1.180 -1.703) 3.960 ======================= Grid point 166 (76/306) ======================= q-point: (-0.10 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -12.439 7.564 6.013) 15.751 1.860 ( -3.908 5.129 15.325) 16.627 2.190 ( 2.739 1.546 -7.865) 8.471 2.605 ( -3.071 0.352 7.824) 8.413 2.721 ( -3.350 -0.876 6.114) 7.027 2.934 ( 1.609 -2.689 -0.412) 3.161 3.313 ( -0.151 0.585 1.009) 1.176 4.072 ( 13.704 -0.458 7.209) 15.491 4.186 ( -3.072 -3.138 -10.913) 11.764 4.292 ( -5.039 -1.092 -2.704) 5.822 4.690 ( 5.061 -0.575 5.782) 7.706 4.833 ( 3.390 2.175 9.404) 10.231 5.715 ( -5.922 -0.722 -11.966) 13.371 5.973 ( -1.696 8.197 7.460) 11.212 6.403 ( 4.774 2.288 -8.498) 10.013 6.653 ( -4.000 -2.356 1.023) 4.754 7.373 ( 3.930 -0.077 -1.085) 4.078 7.654 ( 3.704 -5.314 0.566) 6.502 7.764 ( 2.451 -7.312 -6.337) 9.982 8.270 ( 1.777 5.444 -4.031) 7.003 8.284 ( 0.174 4.344 -2.827) 5.186 8.713 ( -0.467 -0.212 -0.106) 0.524 10.440 ( 8.810 -0.423 -20.120) 21.968 10.805 ( -3.548 3.313 2.128) 5.300 11.157 ( -7.735 -3.900 14.482) 16.875 11.520 ( -15.817 -4.564 6.483) 17.692 13.975 ( 2.087 6.542 2.366) 7.263 14.772 ( 5.075 -1.502 1.752) 5.575 15.672 ( 0.845 0.903 -2.389) 2.690 15.886 ( 2.320 -1.118 -0.834) 2.707 ======================= Grid point 173 (77/306) ======================= q-point: ( 0.60 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( 13.468 0.000 1.712) 13.576 1.928 ( -1.330 -0.000 10.031) 10.119 2.153 ( -4.219 -0.000 15.803) 16.357 2.549 ( -8.728 -0.000 -1.610) 8.876 2.815 ( 0.744 0.000 -2.518) 2.626 2.986 ( 3.856 0.000 10.288) 10.987 3.072 ( -2.688 -0.000 3.597) 4.490 3.482 ( 3.862 0.000 -2.728) 4.729 4.233 ( 9.787 0.000 8.941) 13.256 4.302 ( 0.277 0.000 -6.281) 6.287 4.537 ( -9.989 -0.000 2.635) 10.331 4.559 ( 7.485 0.000 7.017) 10.260 6.194 ( -4.212 -0.000 -9.025) 9.960 6.288 ( 3.243 0.000 -5.471) 6.360 6.378 ( -3.160 -0.000 4.444) 5.453 6.679 ( -5.985 -0.000 8.580) 10.461 7.057 ( 15.348 0.000 0.487) 15.356 7.165 ( 5.287 0.000 -2.109) 5.692 8.121 ( -17.051 -0.000 -12.999) 21.440 8.345 ( -0.215 -0.000 -2.180) 2.191 8.570 ( 9.475 0.000 -13.787) 16.729 8.925 ( -1.120 -0.000 -7.467) 7.550 10.562 ( 8.291 0.000 -11.440) 14.128 10.806 ( -6.350 -0.000 23.148) 24.003 10.839 ( -4.197 -0.000 12.295) 12.992 11.982 ( -15.094 -0.000 -12.421) 19.548 13.992 ( 9.081 0.000 9.528) 13.163 14.628 ( -11.030 -0.000 -4.663) 11.976 15.696 ( 7.865 0.000 -2.327) 8.202 15.805 ( 1.998 0.000 -1.980) 2.813 ======================= Grid point 175 (78/306) ======================= q-point: (-0.30 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( 8.378 6.233 -0.249) 10.445 1.971 ( -9.012 3.270 12.121) 15.454 2.280 ( 0.402 -2.789 7.267) 7.794 2.419 ( -8.585 -2.457 2.379) 9.241 2.827 ( 1.641 -1.483 -0.372) 2.243 2.902 ( -3.509 13.494 6.022) 15.188 3.208 ( -4.136 -11.526 2.897) 12.583 3.671 ( 16.640 -0.419 9.228) 19.032 4.218 ( -0.989 -2.278 -11.187) 11.459 4.387 ( -9.062 -0.427 0.470) 9.084 4.510 ( 10.312 0.639 10.055) 14.417 4.716 ( 5.825 0.493 5.488) 8.018 5.994 ( -7.316 2.427 -10.297) 12.863 6.223 ( -0.358 7.395 -0.900) 7.458 6.421 ( 0.849 -4.774 -0.839) 4.921 6.675 ( -5.806 1.583 6.705) 9.010 7.246 ( 7.980 -2.313 -0.348) 8.316 7.287 ( 11.546 -4.674 -1.594) 12.558 7.789 ( -12.370 -1.077 -9.139) 15.417 8.326 ( -0.483 1.035 0.759) 1.371 8.535 ( 7.456 3.325 -12.974) 15.329 8.816 ( -3.778 0.523 -5.859) 6.991 10.518 ( 8.713 0.313 -18.324) 20.293 10.883 ( -4.915 2.753 12.666) 13.862 10.972 ( -7.550 -3.371 20.765) 22.351 11.648 ( -14.758 -1.746 -10.700) 18.312 14.191 ( 7.332 9.740 9.598) 15.516 14.505 ( -3.564 -7.938 -1.058) 8.765 15.739 ( 3.581 1.237 -4.105) 5.586 15.820 ( 2.115 -1.120 -1.721) 2.948 ======================= Grid point 176 (79/306) ======================= q-point: (-0.20 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( -11.986 9.772 3.666) 15.893 1.968 ( -1.076 3.914 8.661) 9.565 2.221 ( -4.626 2.103 -4.099) 6.529 2.512 ( -3.276 -8.300 9.598) 13.105 2.770 ( -6.894 4.837 3.000) 8.940 2.884 ( 0.408 -1.384 0.838) 1.669 3.303 ( 3.651 -2.253 6.175) 7.519 4.046 ( 14.694 -1.443 10.084) 17.880 4.079 ( -3.976 -5.710 -13.630) 15.304 4.233 ( -12.200 -2.767 -1.574) 12.609 4.747 ( 9.742 4.099 6.872) 12.608 4.856 ( 5.364 -0.259 8.075) 9.698 5.732 ( -9.656 1.577 -11.688) 15.242 6.141 ( -1.135 7.705 3.746) 8.642 6.457 ( 5.910 -0.208 -6.453) 8.753 6.625 ( -5.101 2.389 4.310) 7.092 7.369 ( 4.169 -1.802 0.281) 4.551 7.476 ( 9.363 -8.695 -3.448) 13.235 7.636 ( -2.919 -4.120 -3.890) 6.373 8.325 ( -0.106 1.823 2.176) 2.840 8.444 ( 4.007 7.072 -10.046) 12.922 8.704 ( -3.991 -0.628 -3.119) 5.104 10.436 ( 9.496 -0.013 -21.864) 23.837 10.878 ( -5.752 3.648 6.419) 9.359 11.087 ( -8.173 -2.898 16.445) 18.591 11.417 ( -11.044 -4.638 -2.540) 12.245 14.166 ( -0.330 10.899 3.009) 11.312 14.679 ( 6.240 -7.045 7.676) 12.144 15.704 ( 0.696 1.966 -4.095) 4.596 15.849 ( 1.640 -2.228 -1.395) 3.098 ======================= Grid point 177 (80/306) ======================= q-point: (-0.10 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( -15.918 7.403 4.544) 18.134 2.000 ( -5.429 3.585 13.103) 14.629 2.093 ( -5.024 -1.860 -6.555) 8.466 2.561 ( -7.912 -0.591 -0.114) 7.935 2.664 ( -6.104 -1.321 2.718) 6.811 2.893 ( -2.738 -2.376 2.293) 4.290 3.488 ( 10.268 3.239 8.439) 13.680 3.856 ( -11.226 -8.227 -16.720) 21.755 4.066 ( -11.148 -4.500 -4.233) 12.745 4.374 ( 7.983 -1.178 12.353) 14.755 4.829 ( 2.359 6.761 2.320) 7.527 4.973 ( -1.467 2.965 6.919) 7.669 5.516 ( -2.365 -3.477 -9.262) 10.172 6.135 ( 2.988 6.806 7.184) 10.338 6.474 ( 10.789 4.738 -7.698) 14.076 6.601 ( -2.365 -1.776 2.808) 4.078 7.398 ( 1.117 0.907 -0.691) 1.597 7.654 ( 2.738 -3.790 -4.634) 6.582 7.670 ( 7.142 -11.019 -2.251) 13.323 8.281 ( -2.526 6.673 -4.690) 8.539 8.331 ( 1.881 4.665 -0.704) 5.079 8.706 ( 1.212 -5.310 3.058) 6.246 10.334 ( 9.157 -0.488 -24.125) 25.809 10.785 ( -5.155 3.169 -0.670) 6.088 11.145 ( -9.416 -2.710 13.122) 16.376 11.380 ( -4.466 -6.002 5.154) 9.085 14.081 ( -1.619 8.138 2.671) 8.717 14.881 ( 4.330 0.525 7.568) 8.735 15.661 ( 0.472 0.048 -2.398) 2.444 15.884 ( 0.825 -2.694 -0.109) 2.820 ======================= Grid point 185 (81/306) ======================= q-point: (-0.30 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( -16.211 -0.000 10.388) 19.253 1.973 ( 6.839 0.000 -11.173) 13.100 2.294 ( -8.735 -0.000 4.496) 9.824 2.360 ( -3.033 -0.000 11.642) 12.031 2.850 ( -0.396 -0.000 3.658) 3.679 2.865 ( -11.456 -0.000 -0.495) 11.466 3.257 ( 8.299 0.000 9.009) 12.249 4.014 ( -6.248 -0.000 -15.687) 16.885 4.029 ( 15.572 0.000 13.383) 20.533 4.202 ( -13.106 -0.000 -1.727) 13.219 4.808 ( 11.466 0.000 11.706) 16.385 4.836 ( 5.599 0.000 2.367) 6.079 5.752 ( -11.579 -0.000 -11.716) 16.472 6.254 ( 1.783 0.000 -3.329) 3.776 6.402 ( -0.576 -0.000 3.038) 3.092 6.701 ( -1.267 -0.000 4.083) 4.275 7.282 ( 4.612 0.000 -2.574) 5.282 7.425 ( 10.309 0.000 -2.461) 10.599 7.590 ( -4.034 -0.000 -3.708) 5.480 8.345 ( -0.435 -0.000 3.027) 3.058 8.525 ( 6.321 0.000 -11.432) 13.063 8.694 ( -6.269 -0.000 -3.947) 7.408 10.437 ( 9.628 0.000 -22.495) 24.469 10.930 ( -6.993 -0.000 8.260) 10.823 11.047 ( -8.811 -0.000 19.105) 21.039 11.362 ( -8.492 -0.000 -7.993) 11.662 14.337 ( -4.632 -0.000 -2.259) 5.154 14.551 ( 10.038 0.000 15.390) 18.374 15.733 ( 1.368 0.000 -5.203) 5.380 15.816 ( 0.770 0.000 -1.165) 1.396 ======================= Grid point 186 (82/306) ======================= q-point: (-0.20 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -18.509 8.351 4.147) 20.725 1.912 ( -4.993 -6.599 -9.805) 12.830 2.215 ( -6.581 7.458 9.558) 13.794 2.458 ( -5.684 -6.992 9.004) 12.739 2.690 ( -7.704 2.533 -2.229) 8.410 2.875 ( -4.116 -0.385 5.781) 7.107 3.503 ( 11.084 -1.238 5.463) 12.419 3.719 ( -13.765 -3.198 -13.826) 19.770 3.993 ( -13.583 -2.155 -3.218) 14.125 4.350 ( 7.593 -0.728 13.731) 15.708 4.930 ( 6.359 2.088 2.078) 7.008 5.033 ( 3.521 2.535 8.954) 9.949 5.462 ( -9.024 -1.583 -12.702) 15.661 6.252 ( 4.077 4.085 2.198) 6.176 6.461 ( 3.320 -3.493 0.052) 4.819 6.699 ( 3.448 7.114 0.044) 7.905 7.347 ( 0.950 -6.416 0.470) 6.503 7.510 ( 8.148 -0.499 -5.855) 10.045 7.592 ( 3.952 -2.859 -1.477) 5.096 8.366 ( -1.056 2.127 3.342) 4.100 8.461 ( 1.678 5.824 -7.406) 9.570 8.596 ( -3.789 -4.985 -1.500) 6.438 10.327 ( 10.221 -0.169 -26.012) 27.948 10.845 ( -8.413 2.051 0.722) 8.690 11.105 ( -8.996 -1.075 14.805) 17.357 11.273 ( -2.019 -3.404 0.599) 4.003 14.240 ( -2.616 5.353 0.286) 5.965 14.861 ( 7.099 -1.531 15.928) 17.506 15.678 ( -0.238 1.183 -4.568) 4.725 15.824 ( -0.109 -2.373 -0.565) 2.441 ======================= Grid point 187 (83/306) ======================= q-point: (-0.10 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -21.354 6.147 4.533) 22.679 1.763 ( -15.389 -10.564 -8.028) 20.320 2.146 ( -7.566 9.432 12.840) 17.637 2.451 ( -5.787 1.463 -2.474) 6.461 2.589 ( -5.007 -2.030 0.825) 5.465 2.864 ( -4.879 -0.509 4.754) 6.831 3.344 ( -20.546 -12.266 -14.184) 27.817 3.761 ( 9.018 3.469 5.813) 11.276 3.815 ( -11.700 -5.115 0.037) 12.769 4.499 ( -7.112 -0.745 9.992) 12.288 4.954 ( -5.507 9.659 -2.741) 11.451 5.000 ( 4.881 4.427 0.928) 6.654 5.417 ( 5.178 -8.076 -1.274) 9.677 6.349 ( 8.745 4.598 5.755) 11.434 6.560 ( 5.952 -3.242 -1.073) 6.862 6.671 ( 6.638 8.813 -2.500) 11.313 7.426 ( 1.472 -1.956 2.492) 3.494 7.572 ( 6.086 -6.282 -9.594) 12.983 7.672 ( 4.427 -3.522 -1.927) 5.976 8.257 ( -5.104 7.402 -2.722) 9.394 8.393 ( 0.889 3.086 0.673) 3.281 8.694 ( 3.370 -10.867 3.933) 12.039 10.186 ( 8.502 -0.469 -27.860) 29.132 10.719 ( -5.104 1.290 -1.551) 5.489 11.114 ( -9.470 -0.458 10.597) 14.219 11.349 ( 1.701 -7.029 3.760) 8.151 14.153 ( -3.034 7.129 2.451) 8.126 15.070 ( 2.453 5.620 13.306) 14.651 15.637 ( 0.294 -1.107 -2.153) 2.438 15.854 ( -0.784 -4.032 1.238) 4.290 ======================= Grid point 196 (84/306) ======================= q-point: (-0.20 -0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( -26.204 -0.000 7.874) 27.361 1.600 ( -12.720 -0.000 -13.824) 18.786 2.295 ( -3.138 -0.000 9.120) 9.645 2.405 ( -10.575 -0.000 8.528) 13.586 2.594 ( -2.795 -0.000 -4.252) 5.088 2.864 ( -5.359 -0.000 3.927) 6.644 3.202 ( -24.123 -0.000 -11.130) 26.567 3.743 ( -14.576 -0.000 -2.962) 14.874 3.802 ( 10.640 0.000 7.582) 13.065 4.492 ( -6.356 -0.000 10.746) 12.485 5.000 ( -1.574 -0.000 -4.847) 5.096 5.177 ( 1.329 0.000 7.877) 7.989 5.259 ( 5.007 0.000 -7.168) 8.743 6.398 ( 10.087 0.000 2.259) 10.337 6.512 ( 4.585 0.000 2.128) 5.055 6.814 ( 7.646 0.000 -2.182) 7.951 7.326 ( 1.015 0.000 0.138) 1.024 7.540 ( 5.500 0.000 -7.767) 9.517 7.637 ( 6.191 0.000 -1.236) 6.313 8.407 ( -1.353 -0.000 3.853) 4.083 8.428 ( -8.383 -0.000 -0.634) 8.407 8.506 ( 4.816 0.000 -3.413) 5.903 10.180 ( 9.626 0.000 -29.447) 30.981 10.734 ( -6.551 -0.000 -1.514) 6.724 11.114 ( -8.740 -0.000 11.719) 14.619 11.266 ( 0.699 0.000 1.908) 2.032 14.236 ( -2.030 -0.000 0.762) 2.168 15.139 ( 5.057 0.000 19.962) 20.592 15.628 ( -0.814 -0.000 -4.251) 4.328 15.797 ( -1.652 -0.000 0.952) 1.907 ======================= Grid point 197 (85/306) ======================= q-point: (-0.10 -0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( -26.340 4.782 5.594) 27.349 1.299 ( -23.168 -9.427 -6.072) 25.739 2.146 ( -26.270 1.738 -2.274) 26.425 2.350 ( -5.086 1.911 7.254) 9.063 2.510 ( -1.449 2.705 -5.708) 6.480 2.772 ( -4.121 -6.357 -7.413) 10.599 2.949 ( -15.523 0.869 16.029) 22.330 3.559 ( -12.908 -7.578 1.100) 15.009 3.987 ( 8.357 2.148 3.517) 9.318 4.391 ( -18.042 0.872 6.287) 19.126 4.811 ( -4.711 1.195 -14.331) 15.133 5.221 ( 5.193 8.758 5.132) 11.402 5.468 ( 11.457 -7.436 3.551) 14.113 6.570 ( 10.472 1.570 2.461) 10.871 6.618 ( 6.162 -1.830 1.054) 6.513 6.849 ( 8.419 10.011 -3.306) 13.492 7.390 ( 1.316 -10.250 -1.358) 10.422 7.514 ( 3.291 -1.115 -9.294) 9.922 7.708 ( 5.637 1.498 -1.666) 6.065 8.243 ( -5.689 8.708 -1.701) 10.540 8.428 ( -0.505 -0.176 2.181) 2.246 8.655 ( 5.860 -13.976 1.385) 15.218 9.987 ( 4.204 -0.273 -26.326) 26.661 10.649 ( -3.393 -0.239 -0.777) 3.489 11.087 ( -8.218 1.250 7.354) 11.099 11.336 ( 2.262 -7.107 1.873) 7.690 14.197 ( -2.706 4.763 2.056) 5.851 15.343 ( 1.643 10.878 16.356) 19.712 15.602 ( 0.422 -3.118 -1.314) 3.410 15.818 ( -2.380 -3.790 5.772) 7.304 ======================= Grid point 207 (86/306) ======================= q-point: (-0.10 -0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.796 ( -25.819 -0.000 -7.759) 26.959 0.867 ( -30.751 -0.000 12.592) 33.230 1.505 ( -47.669 -0.000 -1.098) 47.682 2.385 ( -1.122 -0.000 -1.920) 2.224 2.540 ( 4.096 0.000 2.348) 4.721 2.668 ( -1.139 -0.000 -0.905) 1.455 3.031 ( -7.229 -0.000 17.623) 19.048 3.321 ( -12.773 -0.000 1.960) 12.923 4.120 ( 6.174 0.000 -0.186) 6.177 4.175 ( -19.174 -0.000 4.341) 19.659 4.582 ( -3.463 -0.000 -18.678) 18.997 5.357 ( 0.502 0.000 4.639) 4.666 5.653 ( 13.347 0.000 1.562) 13.438 6.693 ( 4.031 0.000 1.235) 4.216 6.732 ( 9.725 0.000 -1.272) 9.808 7.021 ( 10.358 0.000 -4.275) 11.206 7.287 ( -0.860 -0.000 -4.044) 4.134 7.428 ( 0.035 0.000 -8.152) 8.152 7.795 ( 6.904 0.000 -3.401) 7.696 8.160 ( -2.603 -0.000 -19.389) 19.563 8.413 ( -3.124 -0.000 3.020) 4.346 8.661 ( 6.301 0.000 -0.369) 6.312 9.841 ( -5.255 -0.000 13.511) 14.497 10.606 ( -1.796 -0.000 0.200) 1.807 11.046 ( -6.839 -0.000 3.507) 7.685 11.323 ( 0.793 0.000 1.096) 1.353 14.213 ( -1.786 -0.000 1.524) 2.348 15.544 ( -0.209 -0.000 -2.097) 2.108 15.599 ( 2.753 0.000 4.042) 4.890 15.929 ( 2.206 0.000 23.019) 23.124 ======================= Grid point 208 (87/306) ======================= q-point: ( 0.00 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.659 ( 10.675 0.000 15.122) 18.510 1.005 ( 13.684 0.000 20.666) 24.785 1.947 ( -1.375 -0.000 -10.865) 10.951 2.125 ( -9.005 -0.000 21.998) 23.769 2.173 ( -21.985 -0.000 44.772) 49.878 2.700 ( 6.116 0.000 6.008) 8.573 3.066 ( 3.141 0.000 11.182) 11.615 3.369 ( -4.203 -0.000 11.335) 12.089 3.930 ( 2.649 0.000 -12.874) 13.143 3.988 ( -5.469 -0.000 6.356) 8.385 4.806 ( 6.234 0.000 -0.790) 6.284 5.321 ( -5.453 -0.000 -1.748) 5.726 5.728 ( -3.796 -0.000 -3.776) 5.355 6.472 ( 0.622 0.000 -10.971) 10.989 6.557 ( 1.201 0.000 -20.643) 20.678 6.880 ( 6.974 0.000 -1.885) 7.224 7.226 ( 0.953 0.000 -0.240) 0.982 7.427 ( 9.903 0.000 -7.541) 12.447 7.656 ( 9.710 0.000 2.680) 10.073 7.931 ( 1.762 0.000 0.699) 1.896 8.342 ( -4.882 -0.000 -1.647) 5.152 8.561 ( 0.583 0.000 -7.364) 7.387 10.648 ( -0.764 -0.000 1.786) 1.942 10.766 ( -4.777 -0.000 -6.940) 8.426 11.452 ( -2.030 -0.000 7.095) 7.380 12.877 ( 50.627 0.000 0.378) 50.628 14.193 ( -1.022 -0.000 -0.119) 1.029 14.399 ( -64.850 -0.000 -3.771) 64.960 15.533 ( 2.658 0.000 -0.081) 2.659 15.607 ( 0.591 0.000 -1.161) 1.303 ======================= Grid point 209 (88/306) ======================= q-point: ( 0.10 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( 19.051 -9.620 11.529) 24.257 1.447 ( 15.500 -2.754 16.190) 22.582 1.849 ( -1.321 -3.558 -9.204) 9.956 2.232 ( -14.185 -4.337 25.676) 29.652 2.361 ( 0.948 -0.739 16.563) 16.606 3.025 ( 13.063 -4.145 23.274) 27.010 3.161 ( -5.231 0.146 10.188) 11.453 3.503 ( 4.791 -1.458 10.737) 11.848 3.785 ( -1.361 2.241 -14.014) 14.257 4.045 ( 2.255 -1.193 6.486) 6.970 4.840 ( 4.792 3.756 -4.012) 7.292 5.201 ( -6.221 2.772 -2.041) 7.110 5.637 ( -5.828 -4.210 -1.424) 7.329 6.321 ( -3.254 1.413 -20.103) 20.414 6.381 ( 2.488 0.336 -10.584) 10.878 6.933 ( 3.367 2.413 -0.899) 4.239 7.236 ( 1.155 -1.414 -1.596) 2.425 7.479 ( 8.861 -2.712 -12.102) 15.242 7.757 ( 4.268 3.702 -0.152) 5.652 8.014 ( 7.182 -0.049 3.193) 7.860 8.282 ( -3.222 -4.858 -3.033) 6.571 8.502 ( 1.084 -0.919 -6.157) 6.318 10.573 ( -1.270 6.388 -5.153) 8.305 10.703 ( -2.409 -5.688 -2.269) 6.581 11.479 ( -4.565 1.853 9.160) 10.401 13.231 ( -29.766 -0.950 13.757) 32.805 13.609 ( 7.946 21.787 -7.201) 24.283 14.295 ( -0.977 -15.218 -3.983) 15.761 15.584 ( 3.186 -0.143 0.107) 3.191 15.629 ( 3.306 -2.049 -0.848) 3.981 ======================= Grid point 210 (89/306) ======================= q-point: ( 0.20 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 12.541 -6.288 8.876) 16.601 1.771 ( 3.451 -1.783 6.621) 7.677 1.820 ( 6.598 -3.242 1.791) 7.567 2.354 ( -9.870 -10.420 18.231) 23.203 2.557 ( 5.005 -1.418 9.816) 11.109 3.154 ( -7.276 1.403 8.271) 11.105 3.493 ( 8.108 1.886 4.475) 9.451 3.619 ( 3.963 -3.658 3.976) 6.701 3.724 ( 6.973 -4.898 8.627) 12.126 4.166 ( 3.694 -1.085 3.408) 5.142 4.799 ( 3.001 4.308 -4.404) 6.853 5.055 ( -5.666 5.556 -0.374) 7.944 5.660 ( -1.437 -7.493 3.757) 8.505 6.026 ( -5.863 2.774 -18.692) 19.785 6.311 ( 2.614 -0.298 -10.214) 10.548 6.897 ( -1.496 5.267 -0.561) 5.504 7.258 ( 4.741 -0.303 -4.019) 6.222 7.496 ( 6.492 -5.721 -12.641) 15.319 7.749 ( 0.926 2.147 -0.808) 2.474 8.124 ( 4.174 1.088 0.073) 4.314 8.279 ( 1.289 -1.678 -1.952) 2.879 8.508 ( 5.111 -3.364 -4.391) 7.531 10.435 ( -0.423 4.741 -7.280) 8.698 10.709 ( -2.027 -4.947 -1.638) 5.591 11.478 ( -5.987 2.701 10.067) 12.021 12.697 ( -46.775 7.725 20.277) 51.563 13.704 ( 21.466 8.202 -8.524) 24.510 14.413 ( 4.503 -11.065 -4.645) 12.817 15.616 ( 2.928 0.922 -0.647) 3.137 15.720 ( 5.195 -3.108 -0.190) 6.057 ======================= Grid point 211 (90/306) ======================= q-point: ( 0.30 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -3.745 -0.826 1.814) 4.242 1.932 ( 4.525 -6.238 2.539) 8.114 2.020 ( 2.627 0.623 13.821) 14.082 2.560 ( 3.104 -11.772 6.753) 13.922 2.725 ( -0.290 -1.306 12.649) 12.719 3.106 ( -7.838 2.141 6.788) 10.588 3.331 ( -4.480 1.849 -8.599) 9.870 3.890 ( 7.267 -3.346 3.522) 8.741 4.053 ( 9.538 -8.435 8.684) 15.412 4.195 ( 1.607 2.500 -2.739) 4.042 4.797 ( 2.164 -0.867 1.568) 2.809 4.948 ( -2.614 7.049 5.379) 9.244 5.727 ( -1.712 3.843 -13.899) 14.521 5.809 ( -0.719 -7.543 5.216) 9.199 6.246 ( 2.723 -0.505 -9.989) 10.366 6.791 ( -3.474 5.481 -0.881) 6.548 7.284 ( 7.894 1.444 -7.940) 11.289 7.535 ( 4.465 -7.901 -9.164) 12.897 7.743 ( 0.438 0.125 1.040) 1.135 8.103 ( -1.861 -1.811 -6.115) 6.643 8.303 ( 6.021 5.964 0.120) 8.475 8.611 ( 8.526 -3.026 -2.733) 9.451 10.313 ( -0.373 3.460 -6.944) 7.767 10.710 ( -2.144 -4.644 -2.066) 5.517 11.468 ( -5.127 3.754 9.983) 11.833 12.225 ( -34.485 7.694 15.639) 38.639 13.818 ( 11.087 2.044 -3.462) 11.794 14.552 ( 5.778 -8.513 -2.207) 10.522 15.640 ( 3.228 1.503 -0.981) 3.693 15.818 ( 4.782 -1.851 -0.140) 5.129 ======================= Grid point 212 (91/306) ======================= q-point: (-0.60 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -6.834 -1.351 4.104) 8.085 2.027 ( -0.039 -3.932 1.176) 4.105 2.146 ( -2.495 -1.249 10.309) 10.680 2.701 ( -4.453 -1.261 -0.277) 4.636 2.817 ( -4.786 0.106 9.884) 10.983 3.037 ( -5.543 0.417 4.589) 7.208 3.290 ( 3.016 -4.508 3.362) 6.381 3.921 ( -1.525 0.308 -10.765) 10.877 4.194 ( -3.726 -3.911 -0.798) 5.460 4.230 ( 9.473 -0.653 0.990) 9.547 4.884 ( -1.093 2.425 7.587) 8.040 4.948 ( -2.825 -3.344 7.457) 8.647 5.556 ( 2.172 4.914 -7.472) 9.203 5.965 ( 3.016 -5.432 5.691) 8.425 6.206 ( 5.633 -0.122 -8.750) 10.407 6.694 ( -1.779 3.200 -0.982) 3.790 7.283 ( 7.426 0.859 -10.636) 13.001 7.562 ( 1.845 -4.642 -7.651) 9.137 7.795 ( 3.153 0.165 2.410) 3.972 8.026 ( -0.741 -2.928 -7.065) 7.684 8.322 ( 4.570 5.109 -0.018) 6.855 8.732 ( 10.855 1.074 -3.387) 11.421 10.207 ( -1.860 2.564 -4.437) 5.451 10.701 ( -2.327 -3.942 -1.918) 4.963 11.462 ( -3.400 5.477 8.936) 11.019 11.875 ( -23.446 6.223 10.794) 26.551 13.913 ( 4.342 -2.535 0.241) 5.033 14.706 ( 4.899 -7.515 1.088) 9.037 15.656 ( 3.255 2.136 -1.299) 4.105 15.887 ( 3.610 -0.286 -0.240) 3.629 ======================= Grid point 213 (92/306) ======================= q-point: (-0.50 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( -10.353 -1.170 5.910) 11.978 2.059 ( -3.275 -1.812 3.540) 5.152 2.210 ( -1.752 -3.844 2.590) 4.955 2.483 ( -16.883 5.920 1.033) 17.920 2.768 ( -10.757 0.321 3.917) 11.452 3.054 ( -1.372 2.248 6.026) 6.576 3.502 ( 8.401 -6.646 4.502) 11.620 3.714 ( -5.864 5.024 -10.516) 13.046 4.083 ( -9.891 0.702 -0.006) 9.915 4.448 ( 10.234 -9.339 0.346) 13.859 4.818 ( -13.066 0.672 5.712) 14.276 5.017 ( -5.401 -2.439 4.662) 7.540 5.526 ( 6.362 5.538 -0.206) 8.437 6.123 ( 4.441 -4.726 4.033) 7.636 6.251 ( 12.586 -0.888 -7.713) 14.788 6.658 ( 1.243 1.995 -0.669) 2.444 7.273 ( 6.900 -1.098 -10.064) 12.251 7.536 ( 0.373 -2.469 -6.536) 6.996 7.792 ( 3.772 5.401 -7.081) 9.672 8.051 ( 2.340 -4.552 -0.126) 5.119 8.336 ( 2.767 1.704 0.177) 3.254 8.819 ( 13.010 5.504 -6.471) 15.538 10.115 ( -5.139 1.919 1.082) 5.592 10.689 ( -2.159 -2.511 -0.542) 3.356 11.410 ( -7.604 5.920 5.881) 11.290 11.678 ( -8.145 5.903 7.904) 12.793 14.000 ( -0.466 -5.618 2.850) 6.316 14.871 ( 3.420 -7.950 3.986) 9.528 15.660 ( 2.913 2.619 -1.592) 4.229 15.921 ( 2.098 0.768 -0.649) 2.327 ======================= Grid point 214 (93/306) ======================= q-point: (-0.40 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.454 ( -13.846 1.153 7.068) 15.589 1.931 ( -18.244 6.995 1.482) 19.595 2.220 ( -1.401 -5.365 -2.682) 6.159 2.319 ( -8.967 -0.216 12.021) 14.999 2.615 ( -11.836 0.154 -1.565) 11.940 3.018 ( -2.390 7.938 1.676) 8.458 3.429 ( -12.780 8.357 -1.880) 15.385 3.704 ( 2.865 -5.936 0.971) 6.662 3.967 ( -7.353 0.177 5.148) 8.977 4.602 ( -12.346 -7.644 -3.170) 14.863 4.738 ( 2.552 -3.573 7.486) 8.679 4.931 ( -8.936 -0.704 -0.235) 8.967 5.603 ( 8.728 5.392 3.479) 10.833 6.280 ( 5.910 -8.234 -0.196) 10.138 6.402 ( 15.564 -0.541 -5.867) 16.642 6.656 ( 2.438 2.377 -0.657) 3.468 7.308 ( 9.406 -2.297 -9.470) 13.544 7.500 ( -0.223 -2.378 -4.753) 5.319 7.690 ( 4.052 6.476 -10.420) 12.920 8.099 ( 3.092 1.147 -3.061) 4.500 8.385 ( 1.957 -2.134 2.183) 3.626 8.840 ( 13.228 9.281 -11.632) 19.910 10.059 ( -8.505 0.768 10.857) 13.813 10.686 ( -1.423 -0.487 2.245) 2.702 11.272 ( -10.274 2.304 2.773) 10.888 11.644 ( 2.808 10.038 5.790) 11.924 14.073 ( -3.894 -7.153 4.217) 9.171 15.057 ( 2.513 -9.765 6.083) 11.776 15.652 ( 2.328 2.801 -1.794) 4.060 15.918 ( 0.020 0.491 -1.473) 1.553 ======================= Grid point 215 (94/306) ======================= q-point: (-0.30 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( -16.107 7.505 5.963) 18.744 1.554 ( -24.168 9.194 5.011) 26.338 2.205 ( -7.828 0.443 4.340) 8.962 2.317 ( -20.990 -4.354 6.976) 22.543 2.439 ( 0.594 0.693 -0.130) 0.922 2.881 ( -1.017 10.792 -1.844) 10.995 3.165 ( -18.523 4.273 8.564) 20.849 3.725 ( -4.675 -1.150 -0.021) 4.814 3.971 ( 0.583 -1.486 -0.627) 1.715 4.433 ( -14.750 -3.356 2.805) 15.385 4.658 ( -13.785 3.074 -0.486) 14.132 5.053 ( 7.637 -11.827 2.705) 14.336 5.704 ( 8.599 6.664 3.158) 11.329 6.451 ( 7.684 -10.592 -5.896) 14.353 6.558 ( 12.834 -0.417 -4.062) 13.468 6.673 ( 3.713 0.672 -0.921) 3.884 7.346 ( 8.866 2.226 -10.697) 14.071 7.509 ( 2.830 -5.471 -4.556) 7.662 7.562 ( 3.753 8.160 -9.930) 13.390 8.048 ( 3.051 4.790 -9.149) 10.769 8.459 ( 1.301 -1.482 2.863) 3.476 8.760 ( 8.734 10.171 -13.108) 18.750 10.128 ( -6.462 -3.234 22.969) 24.078 10.713 ( 0.003 1.953 7.247) 7.506 11.147 ( -9.015 -0.589 1.414) 9.144 11.639 ( 7.405 14.872 3.722) 17.026 14.122 ( -6.092 -7.688 4.205) 10.672 15.268 ( 2.570 -11.015 6.030) 12.818 15.633 ( 1.804 2.597 -2.039) 3.762 15.884 ( -3.463 -3.213 -2.909) 5.548 ======================= Grid point 216 (95/306) ======================= q-point: (-0.20 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -17.429 15.042 6.823) 24.012 1.161 ( -22.616 14.708 4.441) 27.341 1.998 ( -29.559 7.044 27.239) 40.808 2.166 ( -7.144 -5.606 -4.233) 10.019 2.537 ( -5.663 -5.643 10.394) 13.113 2.754 ( -2.226 8.292 0.087) 8.586 2.967 ( -10.148 4.218 -1.387) 11.076 3.575 ( -11.737 6.810 -0.500) 13.579 3.971 ( 4.702 -3.126 -9.185) 10.782 4.269 ( -20.385 -1.056 6.373) 21.384 4.539 ( -0.484 -0.197 6.049) 6.072 5.279 ( 2.611 -10.774 2.044) 11.273 5.766 ( 7.399 7.039 0.470) 10.223 6.566 ( 5.687 -8.152 -9.748) 13.922 6.694 ( 8.986 -3.410 -4.536) 10.628 6.725 ( 6.578 -0.369 -4.112) 7.766 7.295 ( 7.085 8.132 -10.690) 15.185 7.443 ( 3.859 5.074 -7.013) 9.478 7.532 ( 3.435 -0.106 -9.133) 9.758 7.929 ( 1.736 4.904 -6.169) 8.070 8.488 ( -1.028 1.544 1.185) 2.201 8.662 ( 4.642 4.879 -6.994) 9.709 10.422 ( 1.614 -11.996 17.502) 21.280 10.861 ( 7.136 0.960 21.728) 22.890 11.050 ( -8.130 -1.522 2.149) 8.546 11.646 ( 14.398 20.412 5.835) 25.651 14.148 ( -7.081 -8.274 3.238) 11.361 15.445 ( 2.548 -6.048 1.764) 6.796 15.603 ( 0.918 1.982 -3.949) 4.513 15.813 ( -12.122 -12.375 -7.579) 18.908 ======================= Grid point 217 (96/306) ======================= q-point: (-0.10 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.673 ( -11.069 24.290 11.506) 29.067 0.790 ( -10.660 8.633 14.949) 20.289 1.954 ( -21.793 -0.006 40.287) 45.804 2.084 ( -5.598 -0.240 -0.343) 5.614 2.344 ( -30.554 4.321 5.420) 31.331 2.673 ( 0.160 4.411 -0.403) 4.432 2.896 ( 6.721 4.323 7.084) 10.679 3.383 ( -10.687 3.316 9.039) 14.384 3.978 ( 5.243 -2.770 -10.656) 12.194 4.073 ( -14.874 0.354 6.122) 16.088 4.680 ( 6.129 -2.886 4.554) 8.163 5.371 ( -2.936 -5.132 0.030) 5.912 5.781 ( 3.374 3.854 -1.927) 5.472 6.568 ( 0.513 -3.927 -10.577) 11.294 6.712 ( 5.415 -1.645 -18.064) 18.930 6.795 ( 8.167 0.788 -2.463) 8.566 7.214 ( 4.028 3.136 -4.075) 6.531 7.408 ( 7.331 8.095 -5.246) 12.116 7.511 ( 4.510 -2.158 -0.375) 5.013 7.907 ( 2.114 0.692 -0.463) 2.271 8.432 ( -4.289 2.253 0.283) 4.853 8.622 ( 2.813 1.393 -6.941) 7.618 10.606 ( -0.400 -5.640 2.482) 6.175 10.913 ( -5.948 0.902 -3.938) 7.191 11.340 ( 3.098 -10.144 11.538) 15.673 11.998 ( 50.309 12.571 21.909) 56.294 14.166 ( -6.415 -9.210 1.769) 11.362 15.341 ( -35.002 -4.160 -20.396) 40.724 15.510 ( 1.606 0.047 -0.701) 1.753 15.641 ( -6.021 -1.790 -2.116) 6.628 ======================= Grid point 219 (97/306) ======================= q-point: ( 0.10 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( 24.019 0.000 8.141) 25.361 1.749 ( 1.186 0.000 -7.181) 7.278 1.792 ( 11.156 0.000 13.430) 17.459 2.224 ( -14.093 -0.000 19.335) 23.926 2.541 ( 4.668 0.000 10.255) 11.267 3.168 ( -7.560 -0.000 9.041) 11.785 3.486 ( 15.806 0.000 23.075) 27.969 3.600 ( -4.856 -0.000 -11.900) 12.852 3.678 ( 5.517 0.000 8.472) 10.109 4.155 ( 4.486 0.000 4.633) 6.449 4.850 ( 2.745 0.000 -8.037) 8.493 5.121 ( -5.142 -0.000 0.339) 5.153 5.567 ( -1.396 -0.000 4.201) 4.427 6.060 ( -4.680 -0.000 -19.802) 20.348 6.305 ( 1.633 0.000 -9.912) 10.046 6.975 ( 0.834 0.000 -0.733) 1.110 7.229 ( 0.061 0.000 1.379) 1.380 7.441 ( 9.045 0.000 -17.061) 19.310 7.768 ( -1.605 -0.000 -1.832) 2.436 8.167 ( -3.234 -0.000 -4.156) 5.266 8.221 ( 12.906 0.000 4.502) 13.669 8.482 ( 4.556 0.000 -4.587) 6.465 10.506 ( -2.330 -0.000 -8.219) 8.543 10.637 ( -0.483 -0.000 -1.072) 1.176 11.508 ( -6.035 -0.000 9.841) 11.544 12.771 ( -49.681 -0.000 22.204) 54.418 13.875 ( 24.589 0.000 -19.240) 31.222 14.225 ( 2.049 0.000 2.623) 3.328 15.651 ( 3.804 0.000 -1.224) 3.997 15.660 ( 5.107 0.000 1.346) 5.282 ======================= Grid point 220 (98/306) ======================= q-point: ( 0.20 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 1.910 1.892 -4.342) 5.107 1.878 ( 15.811 2.419 4.934) 16.739 2.025 ( 3.807 -0.548 10.996) 11.650 2.289 ( -4.797 -11.386 11.124) 16.625 2.707 ( 1.837 -0.439 12.076) 12.222 3.137 ( -7.613 0.876 6.634) 10.135 3.364 ( -6.576 0.904 -10.410) 12.346 3.812 ( 1.519 -2.819 4.056) 5.168 3.944 ( 14.041 -2.278 13.182) 19.393 4.230 ( 1.755 0.826 1.374) 2.376 4.799 ( 1.764 0.454 -4.399) 4.761 5.061 ( -4.417 3.190 3.733) 6.604 5.678 ( 4.287 -3.688 7.338) 9.265 5.807 ( -1.424 2.426 -15.681) 15.932 6.225 ( 0.921 -1.044 -9.454) 9.556 6.918 ( -3.266 5.278 -0.924) 6.275 7.283 ( 3.747 -2.110 0.053) 4.301 7.399 ( 7.636 -3.176 -15.602) 17.658 7.725 ( -2.269 -0.979 -0.519) 2.525 8.077 ( -2.586 -0.678 -5.657) 6.257 8.427 ( 11.284 4.991 1.603) 12.443 8.546 ( 9.608 -3.209 -3.399) 10.685 10.379 ( -2.089 2.228 -7.220) 7.840 10.631 ( -0.666 -2.516 -1.698) 3.108 11.525 ( -4.597 1.503 10.256) 11.339 12.331 ( -39.875 2.474 18.678) 44.102 13.931 ( 14.334 6.727 -12.642) 20.261 14.355 ( 4.053 -8.572 2.173) 9.727 15.682 ( 4.251 2.203 -0.917) 4.875 15.768 ( 5.240 -2.453 0.959) 5.865 ======================= Grid point 221 (99/306) ======================= q-point: ( 0.30 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( -1.031 2.432 -1.366) 2.973 2.006 ( 4.364 3.936 3.207) 6.695 2.116 ( -4.787 -1.409 6.977) 8.578 2.553 ( 6.794 -13.400 3.464) 15.419 2.836 ( -2.295 1.367 12.770) 13.047 3.054 ( -9.728 2.617 4.104) 10.878 3.229 ( -1.634 -2.069 -1.552) 3.059 3.850 ( -5.348 -5.942 -0.431) 8.006 4.136 ( 5.481 -0.067 -5.930) 8.075 4.254 ( 3.233 0.996 0.140) 3.385 4.844 ( 1.496 -2.409 6.226) 6.842 4.980 ( -9.304 2.438 4.434) 10.591 5.676 ( 5.450 5.951 -7.062) 10.724 5.879 ( 7.519 -2.830 7.042) 10.684 6.176 ( 3.310 -2.799 -8.241) 9.312 6.788 ( -4.200 5.451 -1.367) 7.016 7.307 ( 7.184 1.214 -11.355) 13.492 7.430 ( 2.765 -6.995 -5.832) 9.518 7.746 ( 0.831 -3.147 4.003) 5.159 7.989 ( -1.148 -1.054 -7.472) 7.633 8.470 ( 8.069 7.550 -4.169) 11.811 8.731 ( 13.370 -1.257 -0.856) 13.457 10.256 ( -3.002 1.942 -5.083) 6.214 10.632 ( -0.925 -2.594 -0.860) 2.885 11.565 ( -1.009 4.012 10.106) 10.920 11.968 ( -29.637 2.838 12.836) 32.422 13.926 ( 6.525 3.224 -6.191) 9.555 14.530 ( 3.706 -8.609 3.331) 9.947 15.706 ( 3.943 2.480 -1.195) 4.809 15.865 ( 4.018 -1.618 0.440) 4.354 ======================= Grid point 222 (100/306) ======================= q-point: (-0.60 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -4.944 2.143 1.534) 5.602 2.039 ( -2.213 1.546 6.490) 7.029 2.117 ( -1.716 -4.219 -2.484) 5.187 2.626 ( -8.467 4.003 1.885) 9.554 2.826 ( -9.582 6.273 7.752) 13.830 3.020 ( 0.498 -4.822 3.741) 6.124 3.338 ( 3.751 -7.891 6.696) 11.008 3.778 ( -6.896 -1.510 -3.809) 8.021 4.063 ( -3.835 -0.597 -8.049) 8.936 4.309 ( 5.882 -3.342 -3.353) 7.550 4.848 ( -12.920 1.495 6.284) 14.445 4.949 ( -4.364 -3.506 7.481) 9.343 5.655 ( 6.841 7.195 -1.374) 10.022 6.078 ( 8.004 -0.096 5.518) 9.723 6.216 ( 8.727 -3.219 -6.731) 11.482 6.695 ( -0.879 1.843 -0.939) 2.247 7.266 ( 5.394 0.253 -11.287) 12.512 7.444 ( -0.653 -5.687 -6.411) 8.595 7.844 ( 4.094 0.506 -4.045) 5.777 7.961 ( 3.629 -3.948 1.115) 5.478 8.440 ( 6.309 6.923 -6.242) 11.256 8.905 ( 14.411 2.696 -3.140) 14.993 10.148 ( -5.411 1.186 -0.821) 5.600 10.643 ( -1.005 -1.887 1.216) 2.460 11.548 ( -11.506 6.898 7.359) 15.301 11.765 ( -5.962 2.404 8.932) 11.005 13.928 ( 0.610 -1.218 -1.222) 1.830 14.705 ( 2.699 -7.840 5.052) 9.709 15.716 ( 3.213 2.638 -1.581) 4.448 15.919 ( 1.779 -0.753 -0.635) 2.033 ======================= Grid point 223 (101/306) ======================= q-point: (-0.50 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( -9.297 1.674 4.943) 10.661 2.010 ( -8.779 0.369 -0.620) 8.808 2.119 ( -0.934 -2.299 1.916) 3.136 2.426 ( -10.547 8.316 5.639) 14.567 2.682 ( -8.891 6.711 4.210) 11.909 3.099 ( -1.065 -0.938 3.920) 4.169 3.537 ( -2.350 -7.089 3.755) 8.359 3.614 ( -1.852 5.306 -5.417) 7.806 3.931 ( -8.679 -2.989 -0.572) 9.197 4.400 ( 0.281 -9.076 -3.917) 9.889 4.738 ( -8.697 1.937 8.897) 12.592 4.912 ( -11.419 -1.601 2.557) 11.811 5.703 ( 8.275 4.869 1.750) 9.760 6.194 ( 4.765 0.277 1.651) 5.050 6.358 ( 13.073 -4.047 -5.331) 14.686 6.693 ( 1.726 0.684 -0.385) 1.896 7.249 ( 5.648 -2.936 -8.245) 10.416 7.412 ( -2.225 -5.383 -6.279) 8.565 7.795 ( 6.306 3.883 -11.032) 13.288 8.125 ( 8.070 -0.474 3.209) 8.698 8.394 ( 4.594 3.634 -5.534) 8.058 9.002 ( 13.749 6.378 -8.875) 17.563 10.069 ( -8.248 0.249 6.801) 10.693 10.672 ( -0.895 -0.879 4.348) 4.526 11.333 ( -14.799 3.279 2.817) 15.417 11.838 ( 8.092 8.265 7.242) 13.647 13.942 ( -4.233 -4.859 2.648) 6.967 14.879 ( 2.428 -7.567 6.307) 10.145 15.710 ( 2.339 2.715 -1.855) 4.035 15.913 ( -1.486 -0.713 -2.590) 3.070 ======================= Grid point 224 (102/306) ======================= q-point: (-0.40 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -11.947 2.851 9.006) 15.231 1.759 ( -15.022 9.161 -1.380) 17.649 2.132 ( -8.386 -1.894 6.171) 10.582 2.343 ( -5.687 2.445 9.175) 11.068 2.539 ( -3.572 9.126 2.545) 10.125 3.080 ( -0.904 5.738 -0.069) 5.809 3.313 ( -14.084 8.867 -0.061) 16.643 3.645 ( -4.556 -4.834 1.166) 6.744 3.904 ( -2.761 -5.112 0.865) 5.874 4.358 ( -12.123 -4.170 2.124) 12.994 4.703 ( -12.591 1.373 1.817) 12.795 4.849 ( 2.818 -6.915 3.477) 8.237 5.808 ( 8.556 3.503 2.260) 9.518 6.287 ( 5.950 -4.005 -2.045) 7.458 6.516 ( 10.234 -3.906 -5.250) 12.147 6.696 ( 1.367 1.100 -0.664) 1.876 7.318 ( 7.479 -4.879 -6.989) 11.340 7.375 ( -1.885 -6.216 -4.953) 8.168 7.728 ( 8.552 7.171 -11.446) 15.986 8.184 ( 8.047 7.270 -7.994) 13.473 8.430 ( 5.316 -1.098 1.349) 5.593 8.961 ( 8.652 8.891 -14.657) 19.203 10.077 ( -7.403 -1.747 15.867) 17.596 10.731 ( -0.691 -0.049 8.765) 8.792 11.147 ( -11.058 0.404 0.840) 11.097 11.940 ( 12.877 13.221 4.629) 19.027 13.956 ( -8.612 -7.397 5.055) 12.428 15.070 ( 3.430 -7.994 7.102) 11.230 15.690 ( 1.660 2.742 -2.003) 3.780 15.830 ( -6.381 -1.948 -5.609) 8.716 ======================= Grid point 225 (103/306) ======================= q-point: (-0.30 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -10.730 10.387 8.517) 17.192 1.449 ( -14.747 12.110 7.922) 20.661 2.045 ( -11.208 -0.161 2.863) 11.569 2.265 ( -12.865 12.166 16.060) 23.905 2.506 ( -3.282 3.092 10.185) 11.138 2.968 ( 1.295 11.080 -3.501) 11.692 3.065 ( -10.608 5.098 2.672) 12.069 3.600 ( -9.203 -3.266 0.468) 9.777 3.901 ( 0.202 -3.569 -6.567) 7.477 4.240 ( -15.865 -1.607 6.700) 17.297 4.549 ( -5.871 1.074 3.260) 6.801 5.045 ( 3.680 -11.134 2.705) 12.034 5.894 ( 6.680 4.774 0.401) 8.220 6.388 ( 5.870 -6.848 -6.568) 11.157 6.605 ( 3.482 -4.679 -4.950) 7.650 6.730 ( 5.494 -0.300 -1.051) 5.601 7.339 ( 0.997 -3.877 -4.039) 5.687 7.429 ( 7.009 -5.194 -10.393) 13.569 7.649 ( 7.946 9.663 -9.350) 15.619 8.086 ( 5.616 8.771 -11.666) 15.639 8.529 ( 6.274 2.283 -0.083) 6.677 8.797 ( 1.868 7.596 -11.599) 13.990 10.231 ( -1.604 -6.265 16.895) 18.090 10.855 ( 0.611 -1.118 15.421) 15.473 11.025 ( -8.191 -1.095 1.383) 8.379 12.043 ( 18.783 16.577 3.331) 25.273 13.947 ( -13.400 -9.630 6.161) 17.614 15.285 ( 4.715 -7.793 6.389) 11.126 15.632 ( -9.994 -1.954 -10.778) 14.827 15.669 ( -2.766 0.550 -1.222) 3.073 ======================= Grid point 226 (104/306) ======================= q-point: (-0.20 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.062 ( -5.686 15.559 8.950) 18.828 1.239 ( -6.155 22.716 10.740) 25.870 1.946 ( -7.931 1.429 12.334) 14.733 2.183 ( -13.353 10.102 27.647) 32.322 2.429 ( -19.801 3.649 8.558) 21.878 2.847 ( 2.722 11.419 -1.901) 11.892 2.993 ( 5.815 3.728 -0.435) 6.921 3.461 ( -11.515 2.275 4.225) 12.474 3.887 ( 3.096 -5.128 -9.195) 10.974 4.089 ( -13.869 1.244 7.605) 15.866 4.600 ( 2.476 -3.932 4.706) 6.613 5.203 ( -0.520 -10.112 1.198) 10.196 5.893 ( 2.220 5.991 -2.167) 6.747 6.446 ( 4.302 -6.526 -9.916) 12.626 6.622 ( 0.652 -5.964 -8.918) 10.748 6.806 ( 6.255 -0.093 -1.948) 6.552 7.350 ( 5.783 3.467 -12.404) 14.118 7.430 ( 5.050 -3.774 -3.623) 7.271 7.576 ( 5.519 7.544 -6.335) 11.292 7.974 ( 3.744 6.384 -5.186) 9.037 8.517 ( 0.473 5.669 -2.948) 6.407 8.674 ( 1.910 3.424 -6.742) 7.799 10.440 ( 1.262 -8.383 5.523) 10.118 10.927 ( -5.164 0.104 -0.647) 5.205 11.138 ( 1.673 -7.715 20.663) 22.120 12.284 ( 32.891 12.294 6.311) 35.676 13.894 ( -21.137 -13.438 7.529) 26.155 15.265 ( -24.624 -1.716 -14.641) 28.699 15.469 ( 4.831 -3.879 2.468) 6.669 15.640 ( 0.571 1.796 -1.113) 2.189 ======================= Grid point 227 (105/306) ======================= q-point: (-0.10 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( 2.159 19.888 12.789) 23.743 1.157 ( 11.682 15.843 14.229) 24.289 2.034 ( 4.519 3.805 -5.068) 7.783 2.146 ( -14.202 4.052 15.989) 21.766 2.237 ( -19.619 6.440 40.770) 45.701 2.804 ( 7.035 9.462 4.602) 12.657 3.089 ( 3.468 1.656 7.364) 8.307 3.395 ( -4.098 2.164 10.407) 11.392 3.874 ( 2.193 -4.758 -11.685) 12.806 4.009 ( -5.507 1.965 7.324) 9.372 4.737 ( 4.756 -5.614 0.515) 7.376 5.253 ( -4.341 -6.279 -1.103) 7.713 5.792 ( -3.485 5.537 -3.478) 7.410 6.438 ( 2.777 -3.057 -10.580) 11.357 6.530 ( -0.872 -3.247 -17.668) 17.985 6.869 ( 4.720 -0.736 -1.399) 4.978 7.259 ( 4.451 3.188 -7.545) 9.322 7.513 ( 6.098 6.156 -6.796) 11.012 7.587 ( 8.285 -5.623 1.742) 10.163 7.953 ( 3.016 2.734 -0.085) 4.072 8.411 ( -3.012 5.301 -2.249) 6.499 8.588 ( 0.894 2.816 -7.898) 8.433 10.545 ( 0.019 -6.925 -1.243) 7.035 10.827 ( -4.372 3.295 -1.992) 5.826 11.386 ( -1.422 -5.677 11.113) 12.559 12.870 ( 45.102 -1.746 0.945) 45.146 13.750 ( -39.776 -21.215 11.828) 46.606 14.699 ( -22.713 12.140 -11.635) 28.261 15.551 ( 3.302 0.740 -0.072) 3.385 15.624 ( 1.554 1.736 -1.150) 2.598 ======================= Grid point 230 (106/306) ======================= q-point: ( 0.20 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 1.277 0.000 -5.387) 5.536 2.095 ( -4.124 -0.000 5.061) 6.528 2.212 ( -4.281 -0.000 6.684) 7.938 2.245 ( 18.639 0.000 2.798) 18.848 2.854 ( -1.781 -0.000 15.304) 15.408 3.100 ( -5.706 -0.000 3.810) 6.861 3.201 ( -6.023 -0.000 -2.946) 6.704 3.772 ( -7.681 -0.000 0.864) 7.730 4.142 ( 7.761 0.000 -4.170) 8.811 4.264 ( 1.869 0.000 -0.505) 1.936 4.821 ( 1.376 0.000 4.373) 4.584 5.005 ( -11.001 -0.000 3.670) 11.597 5.753 ( 8.295 0.000 -7.253) 11.018 5.849 ( 10.044 0.000 7.806) 12.720 6.132 ( 0.415 0.000 -7.889) 7.900 6.863 ( -5.678 -0.000 -2.615) 6.251 7.328 ( 2.652 0.000 0.291) 2.668 7.333 ( 7.958 0.000 -15.666) 17.571 7.708 ( 0.278 0.000 3.800) 3.810 7.978 ( -0.852 -0.000 -7.349) 7.398 8.571 ( 8.729 0.000 -8.811) 12.403 8.700 ( 14.458 0.000 3.336) 14.838 10.278 ( -3.765 -0.000 -5.666) 6.802 10.603 ( -0.237 -0.000 -0.191) 0.304 11.609 ( 0.524 0.000 10.497) 10.510 11.997 ( -32.450 -0.000 13.823) 35.271 13.983 ( 7.486 0.000 -12.457) 14.533 14.418 ( 3.130 0.000 7.868) 8.468 15.739 ( 3.896 0.000 -1.786) 4.286 15.841 ( 4.463 0.000 1.291) 4.646 ======================= Grid point 231 (107/306) ======================= q-point: ( 0.30 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -1.264 0.481 -5.506) 5.670 2.038 ( -7.216 -1.718 1.233) 7.520 2.183 ( 1.446 9.629 6.105) 11.492 2.544 ( 6.601 -9.803 -0.268) 11.821 2.942 ( -3.572 0.475 10.243) 10.858 3.020 ( -6.305 7.807 4.568) 11.026 3.194 ( -0.649 -5.975 5.488) 8.139 3.662 ( -12.589 -5.855 2.475) 14.103 4.101 ( 3.065 2.293 -13.952) 14.467 4.274 ( 2.410 -0.749 -4.180) 4.883 4.869 ( -10.965 0.746 7.065) 13.065 4.893 ( -6.068 -1.763 7.806) 10.043 5.813 ( 9.031 6.779 -2.266) 11.517 6.070 ( 10.976 -2.393 -0.674) 11.254 6.134 ( 5.416 -2.454 1.859) 6.230 6.736 ( -4.846 1.634 -3.215) 6.041 7.275 ( 4.604 0.362 -12.478) 13.306 7.340 ( -0.757 -3.352 -4.339) 5.535 7.834 ( 6.877 -0.870 6.547) 9.535 7.910 ( 3.217 -0.909 -7.714) 8.408 8.560 ( 7.927 3.531 -11.843) 14.682 8.935 ( 14.468 0.482 1.217) 14.527 10.164 ( -5.777 0.364 -2.310) 6.232 10.614 ( -0.414 -0.761 2.261) 2.421 11.670 ( -20.680 4.169 8.228) 22.644 11.780 ( 2.060 -0.591 10.044) 10.270 13.933 ( 1.504 0.884 -6.896) 7.114 14.572 ( 2.644 -4.019 8.542) 9.804 15.760 ( 3.064 1.337 -2.101) 3.949 15.901 ( 1.878 -0.723 -0.021) 2.013 ======================= Grid point 232 (108/306) ======================= q-point: (-0.60 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -5.551 -0.142 -3.744) 6.697 1.977 ( -5.110 -2.081 -0.649) 5.556 2.180 ( -0.360 7.240 8.580) 11.232 2.560 ( -5.724 2.905 -1.552) 6.604 2.883 ( -7.096 10.865 7.720) 15.100 3.016 ( -0.349 -4.066 4.522) 6.091 3.354 ( 1.288 -8.819 6.156) 10.832 3.605 ( -11.850 -7.726 5.586) 15.209 3.936 ( 0.404 4.112 -13.961) 14.560 4.270 ( 0.943 -3.651 -5.115) 6.354 4.782 ( -10.357 1.851 10.106) 14.588 4.872 ( -10.564 -1.817 5.124) 11.881 5.829 ( 7.156 7.575 -0.205) 10.422 6.227 ( 8.120 -7.343 -4.445) 11.816 6.269 ( 7.224 4.660 3.834) 9.413 6.675 ( -0.054 -2.316 -1.483) 2.751 7.202 ( 1.050 -1.426 -9.069) 9.241 7.304 ( -2.447 -4.437 -5.198) 7.259 7.860 ( 8.565 2.372 -10.841) 14.018 8.088 ( 11.372 -2.100 6.625) 13.328 8.490 ( 6.768 4.204 -13.287) 15.493 9.104 ( 13.070 3.380 -4.180) 14.133 10.070 ( -7.927 -0.103 4.249) 8.995 10.653 ( -0.692 -0.776 5.214) 5.317 11.394 ( -19.149 2.230 3.073) 19.522 11.974 ( 11.453 4.661 8.616) 15.071 13.880 ( -2.990 -1.289 -1.420) 3.552 14.744 ( 2.578 -5.127 8.248) 10.048 15.758 ( 2.195 1.775 -2.355) 3.677 15.897 ( -2.028 -0.689 -2.204) 3.073 ======================= Grid point 233 (109/306) ======================= q-point: (-0.50 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -9.150 -1.690 1.215) 9.384 1.884 ( -5.333 3.141 -3.239) 6.985 2.192 ( -6.705 6.368 14.634) 17.311 2.415 ( -3.718 5.057 0.509) 6.297 2.769 ( -4.552 11.900 9.367) 15.814 3.076 ( -1.269 -4.551 0.411) 4.743 3.430 ( -6.132 -1.075 -1.629) 6.435 3.574 ( -8.952 -2.870 6.828) 11.619 3.808 ( 1.435 -1.072 -6.179) 6.433 4.260 ( -5.232 -4.837 -0.642) 7.154 4.728 ( -11.735 1.382 5.156) 12.892 4.777 ( -5.266 -0.884 5.795) 7.880 5.877 ( 7.491 4.139 0.808) 8.597 6.289 ( 3.971 3.150 0.105) 5.070 6.397 ( 7.820 -6.913 -4.588) 11.402 6.701 ( 0.618 -1.235 -0.793) 1.592 7.181 ( 1.013 -6.915 -4.964) 8.573 7.262 ( -2.531 -4.716 -4.667) 7.101 7.854 ( 12.280 4.842 -12.285) 18.032 8.307 ( 12.694 3.831 -3.752) 13.780 8.425 ( 7.302 0.912 -6.266) 9.665 9.121 ( 7.752 6.389 -12.118) 15.741 10.052 ( -7.247 -0.747 13.092) 14.983 10.720 ( -1.139 -0.797 8.749) 8.859 11.158 ( -13.873 0.567 0.382) 13.890 12.164 ( 13.930 8.218 5.278) 17.013 13.842 ( -7.019 -3.371 2.795) 8.273 14.929 ( 4.074 -5.699 7.775) 10.465 15.740 ( 1.483 1.964 -2.350) 3.403 15.803 ( -6.930 -0.718 -5.290) 8.748 ======================= Grid point 234 (110/306) ======================= q-point: (-0.40 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -9.750 -2.038 9.004) 13.427 1.694 ( -6.243 10.589 -1.759) 12.418 2.135 ( -9.674 8.131 14.130) 18.956 2.398 ( -2.339 2.568 7.657) 8.408 2.705 ( -2.416 12.248 11.067) 16.684 3.082 ( -1.548 -1.438 -1.579) 2.638 3.219 ( -7.531 8.604 -5.119) 12.528 3.534 ( -9.242 -1.360 5.922) 11.061 3.823 ( 1.161 -3.368 -3.989) 5.348 4.204 ( -10.508 -2.035 5.538) 12.051 4.577 ( -9.524 1.478 2.757) 10.025 4.854 ( 0.852 -6.249 4.554) 7.780 5.959 ( 7.210 2.165 -0.133) 7.530 6.323 ( 4.822 0.335 -2.490) 5.437 6.493 ( 2.405 -6.229 -5.629) 8.734 6.712 ( 2.132 -1.276 -0.616) 2.560 7.233 ( -0.793 -6.462 -3.745) 7.510 7.260 ( 0.832 -9.045 -3.560) 9.756 7.841 ( 13.226 8.093 -12.857) 20.143 8.249 ( 6.929 6.573 -14.111) 17.039 8.575 ( 12.366 2.026 -0.045) 12.530 8.957 ( 0.002 7.415 -14.019) 15.859 10.151 ( -2.639 -1.896 15.891) 16.220 10.825 ( -1.598 -1.577 13.313) 13.501 11.001 ( -9.146 -1.199 0.679) 9.249 12.312 ( 15.158 9.394 1.467) 17.893 13.795 ( -11.682 -4.493 5.395) 13.629 15.144 ( 6.603 -5.974 7.045) 11.354 15.597 ( -12.647 -0.483 -8.786) 15.407 15.714 ( 1.245 2.143 -2.261) 3.355 ======================= Grid point 235 (111/306) ======================= q-point: (-0.30 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -6.772 5.094 10.792) 13.722 1.530 ( -2.277 10.132 7.877) 13.034 2.079 ( -2.947 9.882 11.137) 15.178 2.395 ( -5.126 5.979 10.708) 13.292 2.593 ( -18.823 14.489 19.023) 30.432 3.023 ( -0.887 1.404 -1.480) 2.225 3.083 ( 7.667 6.516 -6.122) 11.778 3.471 ( -7.801 1.044 5.970) 9.878 3.805 ( 0.585 -2.231 -6.037) 6.462 4.123 ( -11.005 1.788 8.949) 14.296 4.534 ( -1.537 -2.323 3.269) 4.295 4.986 ( -0.252 -9.898 2.418) 10.192 6.001 ( 3.405 4.009 -1.841) 5.573 6.355 ( 5.361 -1.358 -6.565) 8.584 6.489 ( -2.270 -6.571 -6.224) 9.331 6.784 ( 5.075 -2.180 -0.963) 5.606 7.263 ( 0.152 -7.372 -3.640) 8.223 7.328 ( 2.353 -7.878 -4.765) 9.503 7.786 ( 11.154 11.060 -12.341) 19.976 8.129 ( 5.615 7.333 -11.184) 14.505 8.648 ( 5.345 6.355 -7.060) 10.899 8.753 ( -0.500 3.915 -6.828) 7.886 10.311 ( 1.537 -3.727 8.489) 9.398 10.915 ( -5.015 -1.160 2.155) 5.580 11.015 ( -1.912 -4.650 18.892) 19.550 12.467 ( 17.658 5.120 -0.045) 18.385 13.701 ( -17.848 -4.546 7.333) 19.824 15.271 ( -16.907 1.554 -11.651) 20.592 15.372 ( 7.742 -5.021 4.697) 10.355 15.687 ( 1.347 2.278 -1.887) 3.251 ======================= Grid point 236 (112/306) ======================= q-point: (-0.20 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( 0.981 10.714 11.128) 15.479 1.547 ( 2.779 14.694 12.797) 19.682 2.110 ( 9.000 7.040 2.005) 11.601 2.268 ( -19.155 6.307 9.908) 22.469 2.432 ( -14.023 11.761 29.800) 34.971 3.016 ( 5.642 6.851 2.808) 9.308 3.114 ( 4.416 1.247 -0.005) 4.589 3.454 ( -0.478 4.390 9.552) 10.523 3.775 ( 1.014 -3.504 -8.082) 8.867 4.069 ( -5.335 3.778 9.532) 11.558 4.613 ( 2.361 -5.790 1.116) 6.351 5.081 ( -3.301 -9.710 0.484) 10.268 5.926 ( -2.300 6.826 -2.450) 7.608 6.366 ( 4.892 -3.444 -10.761) 12.312 6.433 ( -3.111 -5.059 -9.660) 11.340 6.853 ( 3.586 -1.051 -1.416) 3.996 7.257 ( 1.696 -5.015 -11.004) 12.211 7.450 ( 5.851 -6.840 2.034) 9.228 7.687 ( 7.610 10.541 -9.901) 16.342 8.049 ( 4.721 5.972 -4.512) 8.849 8.506 ( -3.477 3.447 -6.011) 7.753 8.682 ( 3.059 5.846 -6.829) 9.496 10.417 ( 1.804 -4.701 -1.098) 5.153 10.874 ( -4.175 1.256 2.313) 4.936 11.253 ( -1.640 -6.524 16.563) 17.877 12.753 ( 17.745 -9.378 1.909) 20.161 13.521 ( -23.980 -1.154 9.983) 26.001 14.876 ( -13.736 6.018 -11.728) 19.038 15.539 ( 5.649 -1.817 1.101) 6.036 15.670 ( 2.389 2.331 -1.504) 3.661 ======================= Grid point 237 (113/306) ======================= q-point: (-0.10 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( 7.913 11.989 15.531) 21.156 1.583 ( 9.430 12.152 9.424) 18.038 1.953 ( -6.213 5.275 -7.286) 10.933 2.342 ( 0.126 4.060 20.678) 21.073 2.430 ( -8.198 7.402 19.432) 22.352 3.142 ( -3.453 -1.423 8.887) 9.640 3.171 ( 12.538 7.168 12.541) 19.127 3.563 ( 6.514 4.519 9.915) 12.695 3.719 ( -0.524 -2.644 -10.148) 10.500 4.093 ( 1.247 3.450 7.290) 8.161 4.720 ( 3.322 -6.813 -1.597) 7.746 5.095 ( -5.863 -7.157 -1.710) 9.409 5.775 ( -4.470 8.147 -0.565) 9.309 6.263 ( -4.858 -4.393 -17.293) 18.492 6.365 ( 4.034 -0.787 -9.915) 10.733 6.878 ( 0.257 -2.070 -1.229) 2.421 7.239 ( 4.931 -2.290 -8.241) 9.873 7.587 ( 5.540 7.171 -8.008) 12.093 7.642 ( 6.629 -6.264 0.517) 9.135 8.047 ( 4.967 3.251 0.084) 5.937 8.374 ( -3.801 1.985 -4.319) 6.086 8.573 ( 1.957 6.425 -6.845) 9.590 10.449 ( 0.792 -5.222 -5.700) 7.771 10.806 ( -3.334 4.206 0.337) 5.378 11.410 ( -4.286 -4.446 11.161) 12.756 13.009 ( -33.667 -23.322 13.151) 43.016 13.392 ( 15.718 5.245 0.902) 16.594 14.566 ( -2.360 9.624 -8.765) 13.229 15.593 ( 2.215 0.586 -0.962) 2.485 15.684 ( 4.724 2.601 -0.927) 5.472 ======================= Grid point 241 (114/306) ======================= q-point: (-0.70 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -3.654 -0.000 -8.488) 9.241 1.953 ( -5.316 -0.000 2.208) 5.756 2.309 ( -4.702 -0.000 11.863) 12.761 2.546 ( 5.182 0.000 -6.514) 8.324 2.934 ( -5.365 -0.000 3.650) 6.489 3.117 ( 1.949 0.000 3.616) 4.108 3.212 ( -5.123 -0.000 14.683) 15.551 3.470 ( -13.121 -0.000 4.889) 14.002 3.996 ( 2.783 0.000 -15.823) 16.066 4.233 ( 0.233 0.000 -5.538) 5.543 4.803 ( -10.528 -0.000 10.959) 15.196 4.851 ( -9.840 -0.000 6.008) 11.529 5.974 ( 8.010 0.000 -1.317) 8.118 6.077 ( 6.205 0.000 -4.015) 7.390 6.345 ( 9.353 0.000 6.943) 11.648 6.634 ( -3.729 -0.000 -4.476) 5.826 7.189 ( -0.781 -0.000 -9.201) 9.234 7.253 ( -2.134 -0.000 -4.558) 5.033 7.887 ( 9.254 0.000 -11.204) 14.531 8.063 ( 13.046 0.000 7.674) 15.136 8.537 ( 7.344 0.000 -16.044) 17.645 9.139 ( 12.694 0.000 -1.826) 12.825 10.068 ( -7.795 -0.000 3.443) 8.521 10.644 ( -0.578 -0.000 5.350) 5.381 11.418 ( -20.879 -0.000 3.197) 21.122 12.023 ( 12.384 0.000 9.217) 15.438 13.871 ( -2.127 -0.000 -3.825) 4.376 14.687 ( 2.586 0.000 9.610) 9.952 15.778 ( 2.128 0.000 -2.833) 3.543 15.889 ( -2.143 -0.000 -1.627) 2.690 ======================= Grid point 243 (115/306) ======================= q-point: (-0.60 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( -5.961 -1.451 -6.652) 9.049 1.916 ( -3.755 0.468 2.048) 4.303 2.333 ( -7.095 5.626 16.371) 18.708 2.513 ( -0.365 2.721 -4.071) 4.910 2.898 ( -2.274 -2.058 -1.272) 3.320 3.087 ( -6.399 9.497 10.552) 15.572 3.333 ( -2.283 -6.027 6.226) 8.961 3.430 ( -7.889 -7.995 6.744) 13.101 3.874 ( 4.732 3.610 -12.446) 13.796 4.182 ( -2.196 -2.210 -3.368) 4.588 4.742 ( -12.223 -0.047 3.806) 12.802 4.791 ( -7.228 1.233 11.695) 13.804 5.997 ( 6.055 7.045 -0.977) 9.341 6.205 ( 6.315 -8.473 -2.602) 10.883 6.435 ( 2.716 7.947 0.994) 8.457 6.616 ( 0.870 -7.028 -1.304) 7.201 7.081 ( -4.233 -2.200 -5.124) 7.001 7.189 ( -2.011 -2.070 -4.150) 5.055 7.924 ( 14.086 1.773 -12.687) 19.039 8.343 ( 16.373 0.415 4.098) 16.883 8.457 ( 7.016 1.236 -16.388) 17.869 9.215 ( 7.103 2.408 -10.038) 12.530 10.043 ( -6.936 -0.166 12.826) 14.582 10.706 ( -1.059 -0.448 8.181) 8.261 11.167 ( -15.875 0.240 0.155) 15.878 12.276 ( 12.941 2.642 5.723) 14.395 13.808 ( -4.321 -0.465 0.174) 4.349 14.841 ( 4.102 -2.413 8.627) 9.852 15.768 ( 1.549 0.685 -3.187) 3.609 15.796 ( -7.100 -0.082 -3.895) 8.099 ======================= Grid point 244 (116/306) ======================= q-point: (-0.50 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -5.322 -3.332 1.101) 6.374 1.850 ( -3.195 4.490 -0.751) 5.561 2.323 ( -12.794 8.326 21.623) 26.468 2.458 ( 1.728 3.642 1.543) 4.317 2.878 ( -1.716 0.665 0.568) 1.926 3.022 ( -5.249 1.596 5.309) 7.635 3.319 ( -6.834 1.032 -1.778) 7.137 3.489 ( -4.742 -5.059 7.167) 9.972 3.830 ( 7.283 4.507 -5.280) 10.062 4.149 ( -5.078 -3.215 1.699) 6.246 4.601 ( -10.894 0.624 2.678) 11.235 4.807 ( -4.483 1.104 9.774) 10.810 6.019 ( 6.579 4.048 -0.957) 7.784 6.328 ( 3.500 -5.446 -2.730) 7.026 6.399 ( 3.237 2.838 -2.623) 5.041 6.668 ( -0.182 -3.824 -1.245) 4.025 7.040 ( -4.050 -8.177 -1.534) 9.253 7.155 ( -1.148 -3.300 -3.071) 4.652 7.972 ( 15.734 4.360 -13.633) 21.271 8.351 ( 7.155 3.287 -15.990) 17.824 8.608 ( 15.458 1.063 0.637) 15.507 9.084 ( -1.043 4.500 -14.891) 15.591 10.137 ( -2.655 0.205 17.158) 17.363 10.795 ( -1.926 -1.253 11.457) 11.685 10.979 ( -10.673 -0.873 0.256) 10.712 12.440 ( 9.882 3.402 0.406) 10.459 13.755 ( -6.281 -0.027 3.334) 7.111 15.037 ( 7.063 -4.125 6.996) 10.763 15.604 ( -11.931 0.746 -6.153) 13.445 15.746 ( 1.461 0.990 -3.228) 3.679 ======================= Grid point 245 (117/306) ======================= q-point: (-0.40 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.299 ( -2.303 -3.331 10.380) 11.142 1.737 ( -0.019 8.317 -1.266) 8.413 2.287 ( -9.619 9.361 21.705) 25.519 2.486 ( -2.661 3.963 9.212) 10.376 2.831 ( -5.994 4.804 4.167) 8.739 3.005 ( -2.351 -2.639 -0.838) 3.632 3.151 ( -4.013 3.488 -4.716) 7.107 3.535 ( -1.966 1.171 7.374) 7.721 3.827 ( 4.734 5.710 -2.710) 7.897 4.144 ( -5.250 -0.274 7.917) 9.504 4.502 ( -5.871 -0.973 2.269) 6.369 4.842 ( -3.339 -2.808 5.927) 7.360 6.066 ( 5.618 2.760 -1.678) 6.480 6.361 ( -0.625 -4.065 -3.659) 5.504 6.386 ( 3.366 1.970 -5.767) 6.962 6.714 ( 2.975 -4.482 -0.326) 5.389 7.071 ( -3.427 -10.536 -2.785) 11.424 7.176 ( 0.938 -5.698 -0.463) 5.793 7.984 ( 14.428 7.630 -14.157) 21.606 8.254 ( 6.618 4.609 -13.533) 15.753 8.757 ( 10.217 3.822 -6.331) 12.613 8.831 ( -5.852 3.570 -10.596) 12.620 10.282 ( 1.570 0.530 10.729) 10.856 10.888 ( -5.914 -1.288 5.027) 7.868 10.932 ( -2.942 -3.520 15.083) 15.765 12.510 ( 5.538 -0.185 -3.903) 6.778 13.689 ( -7.826 2.335 5.473) 9.831 15.240 ( 1.019 -4.790 -1.131) 5.026 15.343 ( -6.709 2.417 -2.315) 7.497 15.725 ( 1.620 1.279 -2.799) 3.478 ======================= Grid point 246 (118/306) ======================= q-point: (-0.30 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( -1.069 2.362 12.713) 12.974 1.727 ( 7.824 5.601 4.568) 10.652 2.315 ( -1.476 9.754 17.511) 20.099 2.417 ( -14.085 8.780 8.426) 18.613 2.680 ( -9.171 10.058 9.885) 16.822 3.010 ( 0.064 -3.974 0.343) 3.989 3.115 ( 3.480 -2.159 -2.827) 4.977 3.576 ( 0.549 3.081 6.818) 7.502 3.803 ( 5.112 8.054 -0.560) 9.556 4.159 ( -3.235 4.621 10.916) 12.288 4.507 ( -0.070 -4.515 0.559) 4.550 4.890 ( -4.116 -7.385 2.845) 8.920 6.056 ( 0.624 5.321 -1.622) 5.598 6.280 ( -3.853 -4.572 -10.240) 11.858 6.388 ( 4.710 1.193 -5.054) 7.011 6.814 ( 4.062 -2.982 -0.084) 5.040 7.091 ( -0.903 -9.645 -6.578) 11.709 7.294 ( 3.911 -8.040 2.285) 9.228 7.918 ( 10.144 10.809 -13.997) 20.388 8.172 ( 5.611 5.366 -8.506) 11.516 8.558 ( -6.495 1.687 -10.592) 12.539 8.797 ( 4.611 4.655 -5.139) 8.327 10.365 ( 2.745 -0.403 -0.722) 2.867 10.887 ( -4.140 0.267 6.984) 8.123 11.128 ( -2.497 -5.551 18.367) 19.349 12.546 ( -1.918 -9.410 -3.035) 10.072 13.604 ( -5.765 6.965 7.042) 11.460 14.970 ( -12.926 3.196 -9.663) 16.452 15.488 ( 8.213 -2.654 2.289) 8.930 15.711 ( 2.300 1.511 -2.225) 3.539 ======================= Grid point 247 (119/306) ======================= q-point: (-0.20 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( 3.819 4.500 14.895) 16.022 1.860 ( 9.054 7.917 5.882) 13.388 2.102 ( -12.822 12.852 -1.805) 18.244 2.432 ( 0.997 5.268 18.542) 19.301 2.605 ( -8.546 7.828 14.839) 18.828 3.064 ( -3.357 -5.785 2.990) 7.326 3.240 ( 11.196 -0.710 4.593) 12.122 3.610 ( -0.877 -1.379 0.804) 1.821 3.824 ( 10.079 12.932 5.605) 17.327 4.185 ( 0.248 5.241 7.531) 9.178 4.586 ( 2.579 -5.788 0.476) 6.355 4.923 ( -5.840 -8.666 0.557) 10.465 5.947 ( -3.534 8.031 -0.393) 8.783 6.154 ( -4.444 -5.299 -13.166) 14.872 6.367 ( 4.255 1.257 -8.620) 9.695 6.848 ( -1.171 -1.090 -1.490) 2.186 7.137 ( 5.984 -6.975 -7.650) 11.957 7.482 ( 5.682 -8.441 3.001) 10.609 7.781 ( 5.633 10.101 -11.470) 16.289 8.134 ( 4.842 4.687 -3.066) 7.403 8.378 ( -4.920 -0.842 -7.991) 9.422 8.720 ( 1.701 6.604 -5.876) 9.002 10.370 ( 2.229 -2.145 -6.629) 7.315 10.881 ( -3.797 3.123 5.025) 7.030 11.309 ( -3.982 -5.044 13.444) 14.900 12.565 ( -19.216 -18.478 5.264) 27.173 13.565 ( 5.027 10.114 5.606) 12.609 14.705 ( -4.546 4.258 -8.143) 10.252 15.599 ( 3.861 -0.199 -0.954) 3.982 15.723 ( 4.453 1.178 -1.483) 4.839 ======================= Grid point 248 (120/306) ======================= q-point: (-0.10 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -0.025 5.766 13.537) 14.714 1.837 ( -2.211 7.522 7.230) 10.664 1.929 ( 6.489 7.038 -1.098) 9.635 2.570 ( -4.865 8.866 13.669) 17.004 2.594 ( 2.721 2.334 13.138) 13.618 3.098 ( -5.429 -4.465 5.541) 8.951 3.422 ( 1.794 -3.138 -3.250) 4.861 3.672 ( 9.202 -0.038 7.186) 11.675 3.925 ( 10.909 13.496 9.811) 19.935 4.200 ( 1.790 1.951 -0.819) 2.772 4.706 ( 3.862 -3.896 3.435) 6.472 4.914 ( -6.346 -7.628 -0.546) 9.938 5.820 ( -2.152 6.327 -0.480) 6.700 5.974 ( -6.504 -0.994 -12.262) 13.915 6.313 ( 3.452 0.274 -10.448) 11.006 6.810 ( -3.328 -2.882 -1.805) 4.759 7.222 ( 8.332 -3.238 -7.121) 11.428 7.650 ( 4.645 8.034 -9.745) 13.457 7.663 ( 4.483 -6.222 1.450) 7.805 8.146 ( 4.285 2.818 -0.609) 5.165 8.263 ( -2.903 -2.245 -5.664) 6.749 8.620 ( 2.761 6.288 -4.593) 8.262 10.347 ( 1.302 -3.432 -7.929) 8.738 10.813 ( -3.254 5.042 0.365) 6.012 11.405 ( -5.731 -4.129 10.325) 12.510 12.452 ( -33.950 -14.781 13.783) 39.510 13.663 ( 13.230 4.087 0.328) 13.851 14.587 ( 3.996 5.502 -5.381) 8.672 15.614 ( 1.922 0.467 -1.651) 2.577 15.770 ( 5.162 1.456 -0.941) 5.445 ======================= Grid point 253 (121/306) ======================= q-point: ( 0.40 -0.60 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -2.875 -0.000 -2.662) 3.918 1.894 ( -3.396 -0.000 1.867) 3.875 2.419 ( -14.321 -0.000 24.190) 28.112 2.515 ( 2.376 0.000 -1.931) 3.062 2.824 ( 0.942 0.000 -6.467) 6.535 3.112 ( -12.299 -0.000 9.379) 15.468 3.304 ( -9.501 -0.000 11.217) 14.701 3.404 ( 5.625 0.000 -3.783) 6.779 3.904 ( 9.317 0.000 -4.046) 10.158 4.102 ( -3.644 -0.000 -1.330) 3.879 4.605 ( -11.040 -0.000 2.369) 11.292 4.833 ( -6.388 -0.000 12.946) 14.437 6.096 ( 5.264 0.000 -3.549) 6.348 6.223 ( 5.425 0.000 -0.424) 5.442 6.509 ( 2.245 0.000 -4.975) 5.458 6.556 ( -1.128 -0.000 1.500) 1.877 6.957 ( -6.343 -0.000 -0.583) 6.370 7.118 ( -0.998 -0.000 -3.289) 3.437 8.018 ( 16.542 0.000 -13.886) 21.597 8.385 ( 7.182 0.000 -16.738) 18.214 8.619 ( 16.331 0.000 1.025) 16.363 9.132 ( -1.387 -0.000 -15.204) 15.267 10.143 ( -2.597 -0.000 18.309) 18.493 10.780 ( -1.736 -0.000 10.335) 10.479 10.969 ( -11.463 -0.000 0.227) 11.465 12.472 ( 7.598 0.000 -0.034) 7.598 13.761 ( -3.719 -0.000 2.403) 4.428 14.991 ( 7.030 0.000 6.999) 9.920 15.614 ( -11.760 -0.000 -4.830) 12.713 15.756 ( 1.619 0.000 -3.795) 4.126 ======================= Grid point 255 (122/306) ======================= q-point: (-0.50 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( 3.121 -1.840 4.726) 5.955 1.852 ( -1.759 2.752 0.488) 3.302 2.434 ( -16.668 4.116 26.786) 31.816 2.552 ( 2.795 1.996 4.392) 5.576 2.805 ( 3.218 -3.461 -7.731) 9.061 3.010 ( -10.936 2.172 7.646) 13.519 3.235 ( -7.155 3.626 1.382) 8.139 3.469 ( 3.033 -5.125 -1.687) 6.190 3.989 ( 5.510 7.507 1.490) 9.431 4.104 ( 2.148 -3.562 4.712) 6.286 4.485 ( -8.249 -0.552 1.015) 8.329 4.856 ( -7.560 2.003 11.723) 14.092 6.121 ( 6.388 2.080 -4.340) 7.998 6.290 ( 1.977 -2.074 -2.563) 3.844 6.458 ( 2.584 4.832 -2.635) 6.080 6.593 ( 1.188 -7.203 -2.293) 7.652 6.906 ( -5.760 -4.034 3.171) 7.714 7.093 ( 0.189 -2.198 -2.280) 3.172 8.092 ( 16.099 2.671 -14.544) 21.860 8.318 ( 7.311 1.539 -14.428) 16.247 8.805 ( 11.470 1.032 -3.472) 12.028 8.888 ( -8.268 1.544 -14.983) 17.182 10.306 ( 1.575 1.082 12.831) 12.973 10.868 ( -6.822 -0.514 6.788) 9.637 10.875 ( -2.826 -1.635 12.139) 12.570 12.493 ( 0.198 -0.729 -6.355) 6.400 13.745 ( -2.359 1.969 4.540) 5.482 15.159 ( 4.388 -2.337 1.353) 5.152 15.388 ( -9.468 1.356 -2.478) 9.880 15.740 ( 1.979 0.304 -3.706) 4.213 ======================= Grid point 256 (123/306) ======================= q-point: (-0.40 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.407 ( 5.961 -1.631 8.949) 10.875 1.829 ( 3.989 4.039 1.213) 5.805 2.451 ( -14.857 3.570 27.376) 31.352 2.607 ( -0.441 7.247 8.506) 11.183 2.781 ( -0.798 0.313 -5.106) 5.178 2.940 ( -6.540 -1.360 4.122) 7.850 3.115 ( 0.964 3.360 -2.971) 4.587 3.536 ( -1.587 -5.678 0.907) 5.965 4.000 ( 4.443 7.526 4.868) 10.004 4.246 ( 4.500 3.578 8.527) 10.284 4.421 ( -2.982 -3.652 -0.310) 4.725 4.825 ( -8.340 0.880 8.059) 11.631 6.131 ( 4.466 1.606 -5.745) 7.451 6.234 ( -3.341 0.985 -6.393) 7.281 6.437 ( 2.923 2.410 -2.801) 4.711 6.719 ( 7.574 -6.302 0.061) 9.853 6.915 ( -4.038 -5.721 0.866) 7.056 7.140 ( 2.113 -6.248 0.702) 6.633 8.104 ( 12.912 6.619 -14.822) 20.741 8.261 ( 6.540 3.153 -10.858) 13.062 8.577 ( -10.210 0.200 -14.172) 17.468 8.867 ( 4.763 2.161 -4.152) 6.678 10.385 ( 2.835 1.706 -1.136) 3.498 10.898 ( -4.067 1.039 12.394) 13.085 11.023 ( -3.046 -4.557 17.728) 18.556 12.389 ( -6.795 -5.423 -9.300) 12.731 13.748 ( 0.577 5.883 6.528) 8.806 15.008 ( -13.569 0.611 -7.357) 15.448 15.445 ( 8.826 -1.273 2.618) 9.293 15.731 ( 2.448 0.531 -3.125) 4.005 ======================= Grid point 257 (124/306) ======================= q-point: (-0.30 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 4.791 1.007 9.768) 10.926 1.926 ( 9.055 1.787 2.722) 9.623 2.414 ( -16.541 11.656 13.521) 24.337 2.560 ( -1.695 7.853 12.238) 14.639 2.716 ( -3.791 3.146 4.766) 6.854 2.937 ( -3.794 -4.825 2.883) 6.781 3.210 ( 12.749 -1.315 2.348) 13.030 3.552 ( -4.700 -4.544 1.266) 6.658 4.077 ( 8.942 9.418 7.879) 15.190 4.281 ( -0.779 2.619 0.972) 2.900 4.496 ( 4.274 -2.275 4.460) 6.583 4.788 ( -7.889 -3.254 5.239) 10.014 6.068 ( -4.794 -0.114 -11.363) 12.333 6.098 ( 1.374 3.936 -3.660) 5.548 6.414 ( 2.254 2.700 -4.496) 5.708 6.834 ( -1.931 0.080 1.652) 2.542 6.976 ( 8.856 -8.017 -4.703) 12.839 7.292 ( 4.154 -9.536 3.167) 10.872 7.986 ( 3.584 9.296 -13.980) 17.167 8.222 ( 4.939 3.467 -5.302) 8.032 8.348 ( -4.061 -2.105 -11.523) 12.397 8.827 ( 0.926 3.649 -4.827) 6.122 10.357 ( 2.559 0.565 -7.909) 8.331 10.944 ( -4.213 3.216 10.967) 12.181 11.209 ( -3.688 -4.459 15.721) 16.752 12.248 ( -14.572 -12.121 -4.617) 19.509 13.780 ( 4.967 9.927 7.535) 13.417 14.756 ( -8.493 0.852 -6.672) 10.834 15.585 ( 6.397 -0.963 -0.590) 6.496 15.738 ( 3.467 0.372 -2.331) 4.194 ======================= Grid point 258 (125/306) ======================= q-point: (-0.20 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 3.739 -0.361 8.389) 9.192 2.003 ( -2.619 6.023 5.894) 8.825 2.170 ( -4.130 15.005 4.519) 16.206 2.624 ( 1.059 0.958 7.519) 7.653 2.721 ( -4.140 4.913 14.701) 16.044 2.976 ( -3.982 -6.016 4.241) 8.369 3.402 ( 1.544 0.911 0.974) 2.040 3.619 ( 9.749 -4.802 6.127) 12.476 4.192 ( 8.155 8.745 5.334) 13.093 4.227 ( 0.951 2.040 -5.082) 5.558 4.643 ( 3.079 -2.999 8.322) 9.366 4.779 ( -4.980 -3.700 4.199) 7.492 5.865 ( -4.704 0.454 -13.024) 13.855 6.036 ( -0.577 4.650 -0.986) 4.788 6.344 ( 1.128 3.039 -7.577) 8.241 6.776 ( -4.263 -0.459 -1.679) 4.604 7.144 ( 11.304 -3.945 -5.452) 13.156 7.496 ( 5.196 -9.743 2.744) 11.378 7.795 ( -0.417 5.314 -9.854) 11.203 8.217 ( 3.829 3.171 -1.313) 5.142 8.228 ( 0.078 -0.123 -9.755) 9.756 8.735 ( -0.171 4.504 -4.565) 6.415 10.300 ( 2.021 -1.096 -9.294) 9.574 10.921 ( -4.450 5.492 4.808) 8.549 11.320 ( -5.152 -3.806 10.276) 12.108 12.134 ( -22.279 -15.143 5.555) 27.505 13.829 ( 7.008 10.774 5.357) 13.924 14.644 ( 1.446 0.190 -3.798) 4.068 15.627 ( 2.418 0.682 -2.462) 3.518 15.779 ( 4.728 -0.372 -1.586) 5.001 ======================= Grid point 259 (126/306) ======================= q-point: (-0.10 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( -8.433 5.393 2.501) 10.318 2.019 ( 1.855 1.824 10.892) 11.198 2.088 ( -1.958 8.139 6.326) 10.493 2.715 ( 7.420 3.239 -0.002) 8.096 2.767 ( -6.826 2.499 15.755) 17.351 3.029 ( -5.200 -5.325 6.367) 9.795 3.328 ( -4.233 2.075 -1.623) 4.986 3.924 ( 13.426 -0.219 4.336) 14.111 4.130 ( 0.408 -3.734 -9.873) 10.563 4.253 ( 3.402 9.418 4.383) 10.931 4.786 ( -2.405 -6.693 5.705) 9.117 4.849 ( 4.849 2.487 10.166) 11.534 5.665 ( -3.693 -1.323 -13.878) 14.421 5.973 ( -1.091 7.199 3.975) 8.295 6.250 ( 2.133 0.783 -9.513) 9.781 6.715 ( -3.095 -1.958 -1.774) 4.069 7.250 ( 9.447 -1.553 -8.105) 12.544 7.649 ( 2.563 -0.020 -6.102) 6.618 7.697 ( 3.508 -2.802 -0.287) 4.499 8.135 ( 0.098 1.269 -7.916) 8.017 8.240 ( 2.938 0.924 1.065) 3.259 8.670 ( 3.666 2.504 -3.790) 5.837 10.250 ( 0.743 -2.466 -7.696) 8.116 10.817 ( -3.767 5.695 -1.141) 6.923 11.382 ( -5.340 -4.269 9.140) 11.414 12.021 ( -25.577 -11.633 11.153) 30.231 13.870 ( 6.356 6.732 2.034) 9.479 14.676 ( 6.776 3.203 -1.024) 7.565 15.624 ( 1.931 -0.061 -2.107) 2.859 15.836 ( 4.364 -0.199 -0.881) 4.456 ======================= Grid point 265 (127/306) ======================= q-point: ( 0.50 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.385 ( 9.737 0.000 5.632) 11.248 1.875 ( 1.298 0.000 2.750) 3.041 2.482 ( -17.327 0.000 26.073) 31.306 2.672 ( 4.303 0.000 4.741) 6.403 2.776 ( 3.316 0.000 -4.292) 5.423 2.939 ( -8.513 -0.000 7.008) 11.026 3.199 ( -6.624 0.000 4.422) 7.964 3.425 ( 3.027 0.000 -7.771) 8.340 4.076 ( 1.312 -0.000 6.064) 6.204 4.290 ( 10.064 0.000 6.978) 12.247 4.378 ( -5.081 0.000 -1.212) 5.223 4.851 ( -11.467 0.000 10.938) 15.847 6.147 ( 6.086 0.000 -9.238) 11.062 6.264 ( -0.769 0.000 -5.653) 5.705 6.463 ( -2.883 0.000 0.996) 3.050 6.623 ( 12.983 0.000 -2.492) 13.220 6.866 ( -5.856 0.000 8.177) 10.057 7.067 ( 1.571 0.000 -2.383) 2.854 8.175 ( 14.385 0.000 -14.336) 20.309 8.296 ( 7.560 0.000 -11.807) 14.020 8.576 ( -12.672 0.000 -15.823) 20.272 8.889 ( 4.662 0.000 -3.817) 6.025 10.408 ( 2.677 0.000 -1.688) 3.165 10.930 ( -3.483 -0.000 19.328) 19.639 10.952 ( -3.676 0.000 13.058) 13.566 12.331 ( -7.534 0.000 -11.965) 14.139 13.814 ( 2.224 0.000 6.549) 6.916 15.010 ( -13.490 0.000 -6.265) 14.874 15.434 ( 8.239 0.000 2.555) 8.626 15.736 ( 2.644 0.000 -3.589) 4.458 ======================= Grid point 267 (128/306) ======================= q-point: (-0.40 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 10.043 -0.373 3.030) 10.497 1.965 ( 5.940 1.455 6.353) 8.818 2.500 ( -14.338 0.101 20.263) 24.823 2.678 ( -7.232 1.290 1.654) 7.531 2.781 ( 1.037 1.289 0.856) 1.862 2.970 ( -1.475 8.368 12.199) 14.867 3.185 ( 6.664 -1.397 2.617) 7.294 3.416 ( -2.323 -7.169 -3.398) 8.267 4.201 ( 5.929 3.222 9.305) 11.494 4.274 ( -2.718 -1.937 -5.021) 6.029 4.504 ( 7.812 1.753 6.633) 10.397 4.769 ( -12.889 0.002 8.577) 15.482 6.096 ( 2.418 3.045 -11.880) 12.500 6.156 ( 0.017 0.264 -8.989) 8.993 6.451 ( -1.330 0.690 1.771) 2.319 6.838 ( 15.501 -3.874 -2.468) 16.167 6.867 ( -5.567 2.365 8.515) 10.445 7.114 ( 3.129 -6.464 -0.261) 7.186 8.155 ( -0.022 6.920 -14.484) 16.052 8.258 ( -0.063 -1.548 -9.175) 9.305 8.297 ( 4.098 -1.464 -11.700) 12.484 8.875 ( 0.395 1.073 -4.158) 4.312 10.375 ( 2.264 0.681 -8.906) 9.215 11.012 ( -4.459 2.924 14.055) 15.032 11.128 ( -3.558 -3.062 19.920) 20.466 12.072 ( -12.287 -4.565 -13.094) 18.527 13.940 ( 6.903 4.526 8.937) 12.166 14.754 ( -12.282 -0.482 -5.859) 13.617 15.568 ( 7.669 -0.476 -0.463) 7.698 15.742 ( 3.084 0.053 -3.027) 4.322 ======================= Grid point 268 (129/306) ======================= q-point: (-0.30 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 7.120 -0.796 0.045) 7.165 2.110 ( 3.258 4.257 10.717) 11.983 2.423 ( -11.821 7.405 6.512) 15.394 2.611 ( -6.422 -2.545 8.321) 10.815 2.788 ( 2.299 2.059 0.270) 3.098 2.951 ( -6.295 5.972 13.673) 16.194 3.408 ( -4.603 -3.583 0.711) 5.876 3.490 ( 17.608 -5.392 8.136) 20.132 4.161 ( -2.726 -3.519 -10.371) 11.286 4.395 ( 8.462 7.109 9.644) 14.668 4.591 ( -3.007 -0.598 5.318) 6.138 4.742 ( -2.199 -2.288 8.286) 8.873 5.917 ( -2.597 4.543 -12.079) 13.164 6.092 ( 3.789 0.515 -9.279) 10.036 6.422 ( -1.691 3.346 -0.284) 3.760 6.802 ( -5.629 3.429 2.244) 6.962 7.072 ( 14.707 -2.589 -3.214) 15.275 7.275 ( 4.073 -11.010 2.409) 11.984 7.864 ( -9.736 1.646 -10.033) 14.077 8.237 ( 7.467 1.154 -11.290) 13.585 8.284 ( 4.761 2.310 -4.082) 6.683 8.802 ( -1.859 2.016 -4.159) 4.982 10.295 ( 1.802 0.260 -10.441) 10.598 11.036 ( -5.514 5.020 10.640) 12.992 11.262 ( -4.892 -1.356 12.249) 13.259 11.851 ( -15.674 -11.529 -4.859) 20.055 14.067 ( 7.075 11.074 8.637) 15.725 14.602 ( -3.481 -3.936 -2.951) 6.026 15.637 ( 4.102 0.265 -2.883) 5.021 15.765 ( 3.742 -0.743 -2.311) 4.460 ======================= Grid point 269 (130/306) ======================= q-point: (-0.20 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.787 ( 0.609 -0.058 -2.460) 2.535 2.133 ( -8.407 8.104 14.583) 18.682 2.255 ( -5.254 7.592 3.958) 10.046 2.707 ( -1.021 -5.335 8.909) 10.434 2.809 ( 3.675 3.087 -1.226) 4.953 2.949 ( -8.848 -0.682 11.749) 14.724 3.375 ( -4.435 0.824 4.524) 6.388 3.890 ( 18.332 -2.491 6.679) 19.669 4.037 ( -2.111 -5.124 -13.933) 14.995 4.400 ( -5.298 4.510 3.218) 7.666 4.694 ( 3.096 -0.913 9.573) 10.103 4.880 ( 4.926 -0.804 9.600) 10.820 5.692 ( -4.755 3.756 -12.304) 13.715 6.060 ( 4.221 1.076 -5.945) 7.370 6.325 ( -1.520 6.049 -3.211) 7.015 6.709 ( -4.237 1.744 -0.366) 4.596 7.226 ( 11.631 -0.764 -7.089) 13.642 7.483 ( 4.904 -11.682 1.928) 12.816 7.677 ( -4.668 -1.644 -6.351) 8.051 8.196 ( 6.092 4.265 -9.251) 11.869 8.293 ( 2.710 2.934 0.160) 3.998 8.711 ( -0.997 1.426 -4.520) 4.843 10.215 ( 0.832 -0.974 -8.870) 8.962 10.950 ( -5.964 7.140 1.443) 9.414 11.306 ( -4.885 -2.727 7.738) 9.549 11.761 ( -17.658 -13.154 6.515) 22.963 14.070 ( 2.436 11.719 4.101) 12.652 14.682 ( 7.175 -2.604 2.691) 8.093 15.633 ( 1.620 0.823 -3.420) 3.873 15.813 ( 3.828 -1.725 -1.630) 4.504 ======================= Grid point 270 (131/306) ======================= q-point: (-0.10 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( -9.114 4.442 2.754) 10.506 2.094 ( -0.985 1.816 0.209) 2.077 2.200 ( -7.001 5.026 14.708) 17.047 2.695 ( -11.323 -0.837 -2.901) 11.719 2.825 ( -4.395 0.073 7.436) 8.639 2.983 ( -2.997 -3.189 7.198) 8.424 3.399 ( 4.888 4.542 5.502) 8.648 3.868 ( -3.694 -4.045 -14.347) 15.357 4.161 ( 1.677 -2.989 -0.193) 3.432 4.349 ( 3.670 5.296 6.231) 8.963 4.827 ( 0.549 -1.176 7.639) 7.749 5.034 ( 0.738 3.005 8.944) 9.464 5.489 ( -2.586 -1.363 -8.939) 9.405 6.072 ( 4.959 3.066 -0.103) 5.831 6.231 ( 4.079 4.457 -5.958) 8.485 6.652 ( -1.623 -0.905 -1.162) 2.191 7.279 ( 8.330 0.493 -9.559) 12.688 7.601 ( 0.232 -0.759 -6.180) 6.230 7.680 ( 4.879 -10.274 -0.637) 11.391 8.126 ( 2.639 6.421 -5.985) 9.166 8.299 ( 1.101 2.175 1.771) 3.013 8.694 ( 5.977 -2.411 -5.045) 8.184 10.157 ( -1.407 -2.136 -4.608) 5.270 10.795 ( -4.449 5.145 -2.569) 7.271 11.356 ( -4.252 -4.366 7.438) 9.616 11.713 ( -17.080 -9.248 9.005) 21.409 14.028 ( 1.529 8.008 2.879) 8.646 14.825 ( 7.140 3.788 3.520) 8.816 15.624 ( 1.962 -0.871 -2.338) 3.174 15.872 ( 3.353 -1.808 -0.732) 3.879 ======================= Grid point 277 (132/306) ======================= q-point: (-0.40 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 9.242 0.000 -3.629) 9.929 2.160 ( 5.144 0.000 12.466) 13.486 2.488 ( -10.433 -0.000 11.697) 15.674 2.565 ( -10.028 -0.000 1.932) 10.212 2.811 ( -0.730 -0.000 4.779) 4.834 3.163 ( -7.260 -0.000 5.130) 8.890 3.210 ( -3.313 -0.000 10.884) 11.377 3.463 ( 19.595 0.000 3.004) 19.824 4.119 ( -3.401 -0.000 -10.972) 11.488 4.472 ( 10.164 0.000 13.731) 17.084 4.633 ( -15.948 -0.000 7.094) 17.455 4.669 ( 6.192 0.000 3.044) 6.900 5.995 ( -4.579 -0.000 -10.387) 11.351 6.077 ( 7.985 0.000 -14.334) 16.408 6.455 ( -2.374 -0.000 2.507) 3.453 6.875 ( -5.104 -0.000 6.572) 8.321 7.056 ( 13.278 0.000 1.622) 13.377 7.108 ( 5.461 0.000 -3.434) 6.451 7.878 ( -13.833 -0.000 -10.200) 17.187 8.252 ( 10.907 0.000 -12.206) 16.369 8.308 ( 5.239 0.000 -4.763) 7.081 8.822 ( -2.380 -0.000 -3.964) 4.624 10.299 ( 1.541 0.000 -10.827) 10.936 11.092 ( -5.283 -0.000 11.905) 13.024 11.260 ( -5.877 -0.000 19.187) 20.067 11.713 ( -13.141 -0.000 -14.048) 19.236 14.211 ( 11.519 0.000 11.854) 16.529 14.534 ( -9.480 -0.000 -4.671) 10.569 15.640 ( 5.114 0.000 -3.001) 5.929 15.757 ( 3.092 0.000 -2.696) 4.102 ======================= Grid point 278 (133/306) ======================= q-point: (-0.30 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( 5.667 -0.631 -7.317) 9.276 2.274 ( -10.849 4.113 16.131) 19.871 2.399 ( -6.421 6.606 3.954) 10.025 2.553 ( -3.040 -7.911 6.053) 10.414 2.875 ( 3.462 1.779 5.917) 7.083 3.005 ( -11.324 5.067 4.209) 13.101 3.323 ( -2.817 -4.835 8.678) 10.325 3.847 ( 21.172 -1.258 7.309) 22.434 3.950 ( -3.778 -2.409 -13.494) 14.219 4.462 ( -15.077 1.772 7.240) 16.819 4.731 ( 8.051 3.429 7.170) 11.313 4.818 ( 7.403 -4.287 8.418) 12.002 5.776 ( -8.146 2.901 -11.043) 14.026 6.059 ( 9.189 -0.361 -13.056) 15.969 6.423 ( -1.900 2.281 -0.468) 3.006 6.805 ( -6.437 6.446 3.697) 9.831 7.201 ( 11.099 -4.259 -6.595) 13.595 7.253 ( 6.509 -5.922 1.354) 8.903 7.643 ( -7.788 -1.065 -5.072) 9.355 8.270 ( 9.722 2.114 -10.713) 14.620 8.338 ( 3.286 1.184 -0.197) 3.499 8.729 ( -3.628 0.404 -4.789) 6.022 10.205 ( 0.413 -0.138 -9.633) 9.643 11.087 ( -7.642 4.509 5.977) 10.699 11.301 ( -5.939 3.506 7.668) 10.313 11.497 ( -11.772 -11.426 0.141) 16.406 14.315 ( -1.449 10.609 1.470) 10.808 14.576 ( 9.152 -6.882 8.793) 14.437 15.651 ( 2.375 0.648 -4.292) 4.948 15.779 ( 2.944 -1.186 -2.271) 3.903 ======================= Grid point 279 (134/306) ======================= q-point: (-0.20 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( -1.789 0.144 -5.943) 6.208 2.151 ( -14.408 3.755 9.583) 17.707 2.324 ( -6.478 5.926 10.380) 13.595 2.641 ( -3.905 -5.061 1.053) 6.478 2.817 ( -12.047 1.424 2.784) 12.446 2.981 ( -1.128 1.833 9.566) 9.806 3.426 ( 5.047 -2.464 1.320) 5.769 3.788 ( -6.274 -2.578 -7.751) 10.299 4.102 ( 1.153 -2.308 -1.106) 2.807 4.415 ( 1.085 1.660 13.612) 13.756 4.837 ( 5.226 1.091 2.835) 6.045 5.063 ( 4.770 0.425 11.023) 12.018 5.489 ( -10.288 0.701 -11.577) 15.503 6.088 ( 10.855 -0.175 -8.605) 13.853 6.366 ( 2.272 5.479 -2.075) 6.284 6.681 ( -4.458 4.739 0.348) 6.516 7.296 ( 10.689 0.437 -9.993) 14.639 7.421 ( 2.327 -11.988 0.543) 12.224 7.570 ( 0.242 -2.321 -2.944) 3.756 8.257 ( 6.399 5.354 -7.346) 11.116 8.361 ( 1.170 2.920 1.826) 3.637 8.640 ( -0.233 -2.535 -6.506) 6.986 10.123 ( -1.678 -1.114 -5.243) 5.617 10.912 ( -7.755 5.774 -2.987) 10.119 11.292 ( -3.771 -1.556 5.955) 7.218 11.508 ( -11.705 -9.820 8.447) 17.458 14.207 ( -1.202 8.037 1.340) 8.237 14.865 ( 10.394 0.345 9.904) 14.361 15.620 ( 1.022 0.464 -3.894) 4.052 15.820 ( 2.751 -2.770 -1.477) 4.174 ======================= Grid point 280 (135/306) ======================= q-point: (-0.10 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( -11.256 1.809 1.533) 11.504 2.045 ( -11.104 -2.861 4.964) 12.495 2.292 ( -6.344 4.925 11.301) 13.864 2.463 ( -11.804 3.430 -5.934) 13.649 2.761 ( -8.949 -2.290 4.675) 10.353 2.987 ( -5.690 -1.804 4.391) 7.410 3.506 ( 2.010 -6.274 -8.934) 11.100 3.694 ( -2.944 3.495 5.718) 7.320 4.032 ( -9.897 -3.671 1.431) 10.652 4.607 ( 8.611 4.418 9.165) 13.329 4.868 ( -5.670 5.984 1.343) 8.353 5.039 ( -8.543 0.221 -0.601) 8.567 5.415 ( 4.663 -5.479 0.496) 7.212 6.202 ( 12.455 0.544 -2.056) 12.635 6.332 ( 7.323 8.064 -4.297) 11.710 6.620 ( 0.052 -0.668 -0.955) 1.167 7.308 ( 8.530 1.998 -10.279) 13.506 7.522 ( 0.751 -5.199 -3.614) 6.376 7.631 ( 5.152 -7.420 -4.605) 10.139 8.166 ( 0.051 6.797 -5.297) 8.618 8.363 ( 1.176 2.984 2.523) 4.081 8.682 ( 8.921 -7.527 -7.898) 14.093 10.074 ( -5.201 -1.898 2.264) 5.981 10.746 ( -4.364 2.999 -2.366) 5.800 11.316 ( -5.375 -3.014 4.936) 7.895 11.531 ( -8.148 -7.854 7.266) 13.449 14.139 ( -1.114 7.003 2.979) 7.692 15.031 ( 5.848 7.436 7.034) 11.789 15.614 ( 1.967 -1.755 -2.306) 3.502 15.881 ( 2.482 -3.069 -0.337) 3.962 ======================= Grid point 288 (136/306) ======================= q-point: (-0.30 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 1.615 0.000 -10.056) 10.185 2.201 ( -21.311 -0.000 13.712) 25.342 2.403 ( -4.921 -0.000 3.953) 6.311 2.559 ( -2.030 -0.000 8.660) 8.895 2.862 ( -13.165 -0.000 0.315) 13.169 3.000 ( -2.138 -0.000 9.959) 10.186 3.369 ( 6.192 0.000 -3.239) 6.988 3.768 ( -6.278 -0.000 -1.974) 6.581 4.077 ( 0.589 0.000 -1.564) 1.672 4.433 ( -1.278 -0.000 17.213) 17.261 4.847 ( 7.318 0.000 -0.953) 7.380 5.068 ( 7.681 0.000 13.100) 15.186 5.498 ( -14.084 -0.000 -13.122) 19.249 6.086 ( 12.576 0.000 -11.157) 16.812 6.414 ( 1.305 0.000 -1.643) 2.099 6.782 ( -5.582 -0.000 0.915) 5.657 7.222 ( 6.790 0.000 -3.539) 7.657 7.336 ( 8.428 0.000 -5.133) 9.868 7.540 ( -1.284 -0.000 -1.644) 2.086 8.318 ( 8.663 0.000 -7.864) 11.700 8.396 ( 2.345 0.000 2.080) 3.134 8.607 ( -4.400 -0.000 -7.539) 8.729 10.111 ( -1.945 -0.000 -5.571) 5.901 10.988 ( -10.426 -0.000 -3.553) 11.015 11.296 ( -3.240 -0.000 2.137) 3.881 11.367 ( -8.692 -0.000 12.019) 14.833 14.303 ( -2.906 -0.000 -1.262) 3.168 14.862 ( 12.622 0.000 14.781) 19.437 15.630 ( 0.939 0.000 -4.750) 4.842 15.784 ( 2.127 0.000 -1.960) 2.892 ======================= Grid point 289 (137/306) ======================= q-point: (-0.20 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( -6.114 -0.498 -7.578) 9.750 2.003 ( -24.357 -0.799 12.230) 27.267 2.381 ( -3.078 2.704 5.669) 6.994 2.578 ( -7.255 4.919 2.494) 9.113 2.684 ( -9.173 -1.969 3.310) 9.949 2.961 ( -8.868 -2.668 -3.660) 9.958 3.392 ( -2.443 -2.682 -1.464) 3.912 3.764 ( 0.319 2.426 8.751) 9.087 3.952 ( -12.453 -3.166 0.352) 12.854 4.651 ( 2.482 0.770 14.942) 15.166 4.958 ( 6.948 0.655 1.259) 7.091 5.104 ( -10.807 6.742 -9.716) 16.020 5.291 ( 1.541 -6.282 2.793) 7.045 6.196 ( 14.951 -0.401 -5.892) 16.075 6.441 ( 5.649 1.290 -1.433) 5.969 6.690 ( 0.002 5.975 -3.018) 6.694 7.306 ( 6.873 -5.270 -7.586) 11.513 7.377 ( 4.036 -1.575 -3.599) 5.632 7.554 ( 3.893 -1.589 -2.454) 4.869 8.319 ( 2.982 7.157 -6.709) 10.253 8.418 ( 0.423 2.020 0.656) 2.165 8.519 ( 2.289 -7.855 -7.709) 11.242 10.044 ( -5.421 -0.802 2.615) 6.072 10.802 ( -7.131 1.836 -3.739) 8.259 11.290 ( -3.240 0.607 4.342) 5.451 11.381 ( -7.859 -5.594 7.595) 12.278 14.252 ( -1.416 3.135 0.793) 3.530 15.161 ( 9.950 4.111 12.810) 16.733 15.591 ( 0.507 -0.423 -3.843) 3.900 15.811 ( 2.019 -2.732 -0.613) 3.452 ======================= Grid point 290 (138/306) ======================= q-point: (-0.10 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -14.758 -2.120 -0.368) 14.914 1.785 ( -25.968 -5.450 7.934) 27.695 2.335 ( -8.953 6.917 1.819) 11.458 2.393 ( -1.157 4.408 3.037) 5.477 2.627 ( -14.413 -0.824 1.360) 14.500 2.835 ( -3.792 -8.512 -5.850) 11.003 3.311 ( -17.133 -1.042 9.439) 19.589 3.777 ( -2.655 0.103 -0.373) 2.683 3.928 ( -1.663 -2.527 6.677) 7.330 4.679 ( -15.333 2.279 3.403) 15.871 4.810 ( -7.692 -0.739 -4.139) 8.766 5.030 ( 7.916 9.942 1.506) 12.797 5.468 ( 7.279 -7.618 4.209) 11.347 6.380 ( 15.280 -0.844 -2.876) 15.571 6.487 ( 8.553 6.929 -3.891) 11.675 6.634 ( 3.774 2.512 -2.640) 5.246 7.327 ( 8.249 -0.825 -12.319) 14.849 7.452 ( 2.145 -7.441 -1.516) 7.891 7.592 ( 4.394 -0.814 -6.227) 7.665 8.142 ( -1.692 5.163 -9.689) 11.108 8.436 ( 1.024 2.019 2.790) 3.593 8.627 ( 9.424 -10.719 -9.253) 17.010 10.042 ( -8.456 -0.728 15.003) 17.237 10.693 ( -3.125 0.206 -0.446) 3.163 11.250 ( -7.495 0.373 3.255) 8.180 11.443 ( -1.735 -8.794 4.486) 10.023 14.206 ( -2.140 4.988 2.575) 6.008 15.282 ( 4.240 11.358 7.219) 14.110 15.597 ( 2.020 -2.525 -1.927) 3.764 15.884 ( 2.303 -2.788 1.299) 3.842 ======================= Grid point 299 (139/306) ======================= q-point: (-0.20 -0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.391 ( -13.850 -0.000 -5.844) 15.032 1.730 ( -29.234 -0.000 11.318) 31.349 2.421 ( 0.033 0.000 2.859) 2.859 2.529 ( -20.962 -0.000 3.360) 21.229 2.536 ( -7.051 -0.000 -1.285) 7.168 2.717 ( -3.321 -0.000 -6.413) 7.222 3.351 ( -12.807 -0.000 14.142) 19.080 3.732 ( -15.080 -0.000 2.010) 15.214 3.908 ( 6.196 0.000 3.257) 7.000 4.718 ( -13.423 -0.000 11.312) 17.554 4.774 ( -10.500 -0.000 -13.573) 17.160 5.210 ( 15.931 0.000 0.270) 15.933 5.325 ( 1.108 0.000 5.718) 5.824 6.366 ( 15.406 0.000 -3.777) 15.863 6.528 ( 6.881 0.000 -0.368) 6.891 6.726 ( 7.870 0.000 -8.017) 11.234 7.278 ( 2.301 0.000 -4.629) 5.169 7.369 ( 4.174 0.000 -7.948) 8.978 7.593 ( 6.398 0.000 -3.739) 7.410 8.243 ( -2.607 -0.000 -18.324) 18.508 8.437 ( 6.487 0.000 -1.395) 6.635 8.488 ( 0.740 0.000 2.197) 2.318 10.033 ( -8.334 -0.000 16.849) 18.797 10.695 ( -4.521 -0.000 -1.780) 4.859 11.287 ( -9.348 -0.000 5.277) 10.735 11.313 ( -0.571 -0.000 2.235) 2.307 14.260 ( -1.209 -0.000 1.242) 1.733 15.447 ( 8.033 0.000 8.849) 11.951 15.549 ( -0.019 -0.000 -3.388) 3.388 15.838 ( 3.346 0.000 3.379) 4.755 ======================= Grid point 300 (140/306) ======================= q-point: (-0.10 -0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( -21.000 -4.923 -0.394) 21.573 1.414 ( -29.231 -3.788 5.305) 29.949 2.170 ( -29.245 -0.649 10.765) 31.170 2.375 ( -6.773 -0.402 -6.030) 9.078 2.511 ( 1.749 4.453 6.158) 7.798 2.710 ( -1.864 -4.813 1.073) 5.272 3.206 ( -17.886 8.259 7.021) 20.914 3.627 ( -11.084 -9.683 3.398) 15.105 3.992 ( 6.098 0.742 -4.460) 7.591 4.504 ( -14.638 3.603 2.155) 15.228 4.583 ( -13.831 -3.894 -0.092) 14.369 5.304 ( 6.893 11.605 2.870) 13.800 5.536 ( 9.916 -9.329 2.660) 13.872 6.541 ( 13.769 -0.946 -4.366) 14.476 6.614 ( 6.591 1.684 -1.625) 6.995 6.729 ( 10.015 6.630 -9.105) 15.072 7.265 ( 3.038 -3.769 -8.815) 10.057 7.374 ( 2.587 -6.925 -5.296) 9.094 7.613 ( 5.741 2.759 -8.849) 10.903 8.005 ( -2.226 -0.062 -14.940) 15.105 8.483 ( -1.376 0.614 3.175) 3.514 8.576 ( 7.554 -6.001 -4.763) 10.760 10.200 ( -3.470 2.857 34.294) 34.588 10.656 ( -1.514 -2.685 2.251) 3.817 11.177 ( -8.748 2.103 1.922) 9.200 11.379 ( 0.815 -8.551 2.213) 8.870 14.238 ( -2.222 3.012 1.756) 4.134 15.477 ( 1.556 7.213 0.434) 7.392 15.586 ( 2.378 -2.024 -1.379) 3.413 15.955 ( 4.514 2.867 3.645) 6.472 ======================= Grid point 310 (141/306) ======================= q-point: (-0.10 -0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.762 ( -25.900 -0.000 4.721) 26.327 0.982 ( -30.026 -0.000 2.200) 30.106 1.926 ( -32.489 -0.000 34.451) 47.354 2.238 ( -3.712 -0.000 -8.749) 9.504 2.662 ( -3.385 -0.000 1.098) 3.558 2.676 ( 6.428 0.000 7.850) 10.146 2.901 ( -29.602 -0.000 -13.058) 32.354 3.432 ( -12.662 -0.000 8.107) 15.035 4.009 ( 6.599 0.000 -9.473) 11.545 4.280 ( -22.073 -0.000 6.081) 22.895 4.546 ( 2.662 0.000 7.898) 8.335 5.428 ( -1.463 -0.000 1.994) 2.473 5.658 ( 11.203 0.000 -0.087) 11.203 6.663 ( 2.772 0.000 -4.906) 5.635 6.673 ( 11.919 0.000 -4.588) 12.772 6.792 ( 10.505 0.000 -15.965) 19.111 7.200 ( 1.424 0.000 -4.275) 4.506 7.316 ( 3.685 0.000 -4.272) 5.642 7.553 ( 0.771 0.000 -11.741) 11.767 7.887 ( 0.976 0.000 -2.915) 3.074 8.470 ( -4.185 -0.000 2.480) 4.865 8.610 ( 6.150 0.000 -4.532) 7.640 10.629 ( -1.248 -0.000 1.880) 2.256 10.813 ( 23.291 0.000 44.525) 50.249 11.085 ( -6.116 -0.000 4.996) 7.898 11.359 ( 0.592 0.000 2.731) 2.795 14.239 ( -1.993 -0.000 0.799) 2.147 15.505 ( 0.687 0.000 -1.570) 1.714 15.580 ( 1.117 0.000 -3.720) 3.884 16.006 ( -3.961 -0.000 -11.276) 11.951 ======================= Grid point 311 (142/306) ======================= q-point: ( 0.00 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.951 ( 6.080 0.000 13.769) 15.052 1.363 ( 12.247 0.000 14.315) 18.839 1.784 ( -3.354 -0.000 -4.347) 5.491 2.559 ( -6.969 -0.000 10.393) 12.513 2.637 ( -7.432 -0.000 16.967) 18.523 3.250 ( 3.575 0.000 6.546) 7.459 3.260 ( -7.552 -0.000 41.732) 42.409 3.586 ( -1.657 -0.000 9.001) 9.152 3.629 ( 3.876 0.000 -15.895) 16.361 4.165 ( -7.727 -0.000 10.957) 13.407 4.758 ( 2.537 0.000 -3.916) 4.666 5.287 ( -5.482 -0.000 -1.291) 5.632 5.663 ( -2.912 -0.000 -1.937) 3.497 6.111 ( 3.138 0.000 -22.552) 22.769 6.234 ( 2.491 0.000 -12.358) 12.606 6.840 ( 8.649 0.000 -3.151) 9.205 7.184 ( 7.368 0.000 -14.784) 16.518 7.238 ( 0.809 0.000 1.172) 1.424 7.681 ( 8.035 0.000 0.014) 8.035 7.962 ( 4.087 0.000 2.475) 4.778 8.275 ( -4.006 -0.000 -5.135) 6.513 8.428 ( 0.282 0.000 -5.582) 5.589 10.632 ( -6.158 -0.000 -5.739) 8.417 10.660 ( -0.794 -0.000 -0.783) 1.115 11.661 ( -3.886 -0.000 13.410) 13.961 12.871 ( 36.247 0.000 -1.368) 36.272 14.178 ( 1.152 0.000 -1.423) 1.830 14.302 ( -45.663 -0.000 -5.532) 45.997 15.535 ( 3.106 0.000 0.333) 3.123 15.584 ( 0.488 0.000 -1.021) 1.131 ======================= Grid point 312 (143/306) ======================= q-point: ( 0.10 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( 15.820 -9.352 9.219) 20.561 1.696 ( 14.492 -1.777 8.045) 16.670 1.733 ( -1.582 -2.802 -0.785) 3.312 2.525 ( -7.014 -2.537 2.803) 7.968 2.796 ( -7.606 -2.407 27.760) 28.883 3.289 ( -2.529 1.367 2.124) 3.574 3.462 ( 0.084 1.237 -9.428) 9.509 3.648 ( 2.018 -1.344 26.047) 26.160 3.709 ( 4.189 -1.209 8.686) 9.718 4.213 ( -2.575 0.084 9.529) 9.871 4.729 ( 2.504 0.852 -5.778) 6.355 5.186 ( -5.382 3.420 1.003) 6.455 5.652 ( -1.855 -4.549 2.895) 5.702 5.897 ( -0.942 0.458 -20.648) 20.675 6.155 ( 4.115 0.353 -11.745) 12.450 6.910 ( 6.037 1.460 -2.897) 6.853 7.085 ( 6.801 4.203 -16.994) 18.780 7.287 ( 1.009 -5.633 -1.227) 5.853 7.734 ( 2.719 1.752 -1.262) 3.472 8.079 ( 7.216 1.976 2.852) 8.007 8.207 ( -1.442 -5.183 -4.387) 6.942 8.378 ( 2.129 0.085 -6.375) 6.722 10.473 ( -4.155 4.537 -3.459) 7.058 10.664 ( -1.473 -4.624 -2.232) 5.341 11.713 ( -7.387 1.541 13.507) 15.472 13.287 ( 29.520 1.820 -8.133) 30.674 13.577 ( -43.795 8.543 4.999) 44.900 14.250 ( 2.343 -7.211 -0.756) 7.620 15.581 ( 2.554 0.953 -0.478) 2.768 15.617 ( 4.396 -2.421 -0.291) 5.027 ======================= Grid point 313 (144/306) ======================= q-point: ( 0.20 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 5.120 -4.242 2.978) 7.285 1.779 ( 4.874 -5.753 2.156) 7.842 2.025 ( 14.155 -5.695 8.990) 17.709 2.473 ( -5.057 -4.250 -2.715) 7.141 3.008 ( -8.089 -2.470 26.625) 27.936 3.239 ( -2.797 0.869 1.187) 3.160 3.329 ( -3.920 0.182 -6.651) 7.722 3.838 ( 3.709 -0.331 4.922) 6.172 3.962 ( 4.391 -4.467 9.245) 11.168 4.236 ( -1.820 3.403 6.211) 7.313 4.751 ( 3.592 -2.377 1.780) 4.661 5.110 ( -2.733 5.770 5.767) 8.603 5.640 ( -1.359 2.560 -14.763) 15.045 5.775 ( 0.267 -7.464 3.154) 8.107 6.097 ( 4.066 -0.061 -10.144) 10.929 6.891 ( -2.743 5.860 -0.241) 6.475 6.988 ( 13.715 1.139 -21.380) 25.426 7.355 ( 2.337 -6.404 -2.613) 7.301 7.742 ( 0.718 -0.193 1.247) 1.452 8.082 ( -3.050 -0.616 -4.117) 5.160 8.260 ( 5.972 2.739 -0.440) 6.585 8.392 ( 8.603 -3.303 -7.081) 11.622 10.355 ( -3.654 3.497 -0.217) 5.062 10.666 ( -1.289 -4.280 -2.315) 5.034 11.706 ( -8.451 2.800 11.825) 14.802 12.929 ( -32.845 11.954 0.996) 34.967 13.582 ( 14.845 -2.757 -0.965) 15.130 14.386 ( 5.815 -6.600 1.614) 8.943 15.598 ( 2.938 1.344 -1.106) 3.415 15.717 ( 5.708 -2.368 -0.287) 6.186 ======================= Grid point 314 (145/306) ======================= q-point: ( 0.30 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( -3.466 -2.720 3.620) 5.702 1.935 ( 5.780 -3.795 0.126) 6.916 2.284 ( -4.528 -2.883 5.732) 7.853 2.523 ( 12.787 -10.050 -2.723) 16.491 3.052 ( -6.608 3.689 5.855) 9.569 3.205 ( -8.481 -0.030 -0.262) 8.485 3.335 ( -5.315 -5.400 20.554) 21.906 3.843 ( -0.528 3.042 -8.705) 9.237 4.052 ( 6.989 -3.296 -4.595) 8.990 4.277 ( -4.753 -1.257 7.419) 8.900 4.908 ( 4.863 -3.451 9.186) 10.952 5.096 ( -3.768 4.153 7.601) 9.445 5.491 ( 3.920 4.159 -6.800) 8.882 5.892 ( 3.537 -4.702 -1.186) 6.002 6.075 ( 2.711 -1.674 -3.978) 5.097 6.757 ( -2.592 5.628 -3.984) 7.367 6.975 ( 12.975 0.147 -17.960) 22.158 7.415 ( 2.716 -5.529 -5.345) 8.156 7.792 ( 0.767 -0.749 3.299) 3.469 7.981 ( -3.542 -1.078 -4.877) 6.123 8.279 ( 4.594 2.455 -3.853) 6.479 8.505 ( 12.513 0.026 -5.909) 13.838 10.292 ( -4.428 1.794 4.419) 6.507 10.670 ( -0.850 -3.291 -1.419) 3.684 11.671 ( -6.566 4.399 9.418) 12.294 12.397 ( -26.926 9.942 0.933) 28.718 13.783 ( 8.581 -4.483 0.798) 9.715 14.575 ( 6.618 -6.203 4.259) 10.021 15.613 ( 3.387 1.930 -1.645) 4.232 15.810 ( 5.234 -1.216 -0.802) 5.433 ======================= Grid point 315 (146/306) ======================= q-point: (-0.60 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( -5.922 -2.670 4.829) 8.094 2.036 ( 4.239 -2.559 0.210) 4.956 2.229 ( -6.946 -4.971 -2.906) 9.023 2.714 ( -1.805 -0.503 1.175) 2.211 2.991 ( -8.229 1.547 6.684) 10.714 3.109 ( -2.959 -2.858 1.867) 4.518 3.474 ( -3.745 2.578 7.933) 9.143 3.713 ( -1.316 -1.299 -1.021) 2.112 4.189 ( 10.689 -6.117 -4.947) 13.272 4.236 ( -10.502 -3.170 3.952) 11.660 5.041 ( -7.553 2.512 5.717) 9.800 5.096 ( 0.414 -3.100 8.989) 9.517 5.507 ( 5.307 5.000 2.046) 7.573 5.969 ( 10.871 -1.200 -6.153) 12.549 6.111 ( 1.154 -1.623 0.235) 2.005 6.651 ( 0.465 2.986 -3.860) 4.902 6.976 ( 12.080 -0.774 -16.742) 20.660 7.432 ( 1.362 -4.567 -6.822) 8.322 7.748 ( -1.426 4.251 -6.095) 7.567 7.994 ( 1.803 -3.431 2.134) 4.424 8.276 ( 3.589 -0.754 -5.010) 6.209 8.605 ( 13.001 4.565 -5.688) 14.908 10.281 ( -6.346 -0.209 9.575) 11.489 10.684 ( -0.148 -1.738 0.780) 1.910 11.615 ( -4.987 7.067 5.674) 10.345 11.988 ( -18.173 6.595 0.651) 19.344 13.943 ( 3.552 -6.192 2.901) 7.706 14.781 ( 5.246 -6.373 6.180) 10.311 15.620 ( 3.538 2.457 -2.204) 4.839 15.869 ( 3.864 -0.032 -1.725) 4.231 ======================= Grid point 316 (147/306) ======================= q-point: (-0.50 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -8.316 -0.943 5.936) 10.260 2.094 ( -3.684 -0.821 -3.664) 5.260 2.167 ( -0.660 -6.313 -0.144) 6.349 2.579 ( -11.915 4.321 2.649) 12.948 2.864 ( -14.500 2.022 7.138) 16.288 3.119 ( -3.642 3.585 -2.078) 5.517 3.438 ( 8.881 2.795 -5.703) 10.918 3.800 ( -10.039 -6.016 16.598) 20.309 4.129 ( -9.259 -0.298 3.121) 9.775 4.393 ( 8.716 -12.265 -4.593) 15.732 4.939 ( -10.950 2.501 5.656) 12.576 5.130 ( -10.428 0.135 7.331) 12.748 5.561 ( 7.813 5.055 2.020) 9.522 6.116 ( 13.826 -0.141 -4.844) 14.650 6.150 ( 4.642 -3.161 -1.749) 5.882 6.624 ( 3.357 2.291 -2.555) 4.801 6.997 ( 12.547 -2.029 -15.243) 19.847 7.413 ( 0.273 -4.193 -7.592) 8.677 7.613 ( 0.389 5.155 -7.475) 9.088 8.027 ( 2.802 0.947 -6.162) 6.835 8.329 ( 3.364 -4.213 0.795) 5.450 8.657 ( 11.165 7.631 -5.593) 14.635 10.309 ( -8.310 -2.219 13.334) 15.867 10.725 ( 0.741 0.142 5.012) 5.069 11.463 ( -9.222 6.312 -0.670) 11.196 11.790 ( -4.143 6.557 3.423) 8.478 14.072 ( -0.171 -6.705 4.060) 7.840 14.984 ( 3.501 -7.537 6.968) 10.845 15.617 ( 3.349 2.775 -2.662) 5.099 15.884 ( 1.815 0.216 -3.111) 3.609 ======================= Grid point 317 (148/306) ======================= q-point: (-0.40 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -11.130 3.879 7.358) 13.895 1.896 ( -14.379 1.374 -4.018) 14.993 2.300 ( 2.652 -3.964 6.472) 8.040 2.395 ( -7.388 2.142 -3.225) 8.341 2.703 ( -15.098 3.732 8.840) 17.889 2.974 ( -2.115 7.184 -1.728) 7.686 3.486 ( -0.699 -0.946 0.870) 1.463 3.798 ( -14.381 0.418 11.644) 18.508 4.056 ( -9.439 -2.234 3.003) 10.154 4.515 ( -2.004 -6.420 -3.532) 7.596 4.893 ( -0.149 -2.628 6.597) 7.103 4.985 ( -17.067 0.176 6.027) 18.101 5.657 ( 9.828 5.145 0.562) 11.108 6.203 ( 6.887 -4.572 -5.855) 10.129 6.314 ( 13.739 -1.502 -3.704) 14.308 6.624 ( 3.730 2.724 -2.280) 5.151 7.053 ( 13.556 -1.355 -14.404) 19.826 7.371 ( 0.515 -3.620 -9.266) 9.961 7.512 ( 2.238 5.065 -5.026) 7.478 7.953 ( 3.219 3.246 -10.408) 11.368 8.439 ( 2.229 -3.690 3.057) 5.285 8.648 ( 7.377 8.474 -5.415) 12.472 10.370 ( -7.512 -4.572 13.670) 16.255 10.815 ( 1.476 1.695 11.375) 11.595 11.274 ( -8.470 1.465 -1.949) 8.814 11.736 ( 2.994 10.905 3.208) 11.755 14.157 ( -2.852 -5.888 3.726) 7.529 15.184 ( 2.749 -8.888 6.387) 11.285 15.602 ( 2.803 2.832 -3.198) 5.109 15.853 ( -1.298 -1.522 -4.767) 5.169 ======================= Grid point 318 (149/306) ======================= q-point: (-0.30 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -15.654 9.936 8.206) 20.276 1.606 ( -16.361 9.526 1.371) 18.982 2.187 ( -10.556 -1.720 -4.421) 11.573 2.498 ( 6.688 2.565 6.607) 9.744 2.587 ( -9.201 -0.333 11.493) 14.726 2.891 ( -4.372 4.319 4.774) 7.782 3.388 ( -21.336 3.266 11.093) 24.268 3.707 ( -5.718 -0.246 0.912) 5.795 3.899 ( -9.234 2.876 -3.890) 10.425 4.507 ( -5.476 -4.077 4.609) 8.237 4.747 ( -19.701 2.066 7.364) 21.134 5.110 ( 6.918 -10.599 2.639) 12.930 5.726 ( 8.791 6.322 -1.696) 10.960 6.281 ( 7.114 -5.601 -9.670) 13.248 6.470 ( 11.814 -1.860 -5.189) 13.037 6.626 ( 4.386 2.483 -4.186) 6.552 7.084 ( 11.264 1.370 -14.029) 18.043 7.324 ( 2.881 -1.045 -7.750) 8.334 7.461 ( 2.758 3.863 -3.651) 5.988 7.870 ( 3.374 2.832 -6.855) 8.148 8.512 ( 0.280 -1.591 1.744) 2.377 8.593 ( 3.941 6.509 -5.001) 9.105 10.473 ( -3.742 -7.104 9.133) 12.161 10.969 ( 2.473 1.117 12.941) 13.222 11.171 ( -5.755 -2.055 4.079) 7.347 11.715 ( 8.367 14.657 4.112) 17.371 14.190 ( -4.342 -4.843 2.148) 6.850 15.364 ( 2.532 -7.111 3.699) 8.406 15.564 ( 1.197 2.314 -5.361) 5.960 15.782 ( -6.061 -5.874 -5.792) 10.236 ======================= Grid point 319 (150/306) ======================= q-point: (-0.20 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.168 ( -13.991 11.176 12.282) 21.714 1.253 ( -17.353 18.724 6.718) 26.398 2.046 ( -5.744 -2.023 -5.089) 7.936 2.523 ( -6.003 5.090 14.727) 16.698 2.700 ( -1.997 -1.534 3.933) 4.670 2.868 ( 0.718 2.408 9.503) 9.830 3.111 ( -30.374 6.082 24.154) 39.281 3.627 ( -7.891 1.009 3.131) 8.549 3.764 ( 2.830 -0.004 -9.708) 10.112 4.417 ( -20.566 -0.766 8.089) 22.113 4.657 ( -0.746 -1.284 4.909) 5.129 5.303 ( 2.233 -9.328 -0.009) 9.592 5.745 ( 6.498 6.272 -2.720) 9.432 6.311 ( 7.107 -5.044 -14.901) 17.262 6.513 ( 1.877 0.077 -12.563) 12.703 6.639 ( 10.571 2.035 -4.557) 11.690 7.090 ( 7.445 0.070 -7.059) 10.260 7.311 ( 7.059 4.272 -7.122) 10.900 7.441 ( 2.346 0.411 -0.355) 2.408 7.863 ( 3.780 0.627 -1.708) 4.195 8.505 ( -2.693 0.741 -0.955) 2.951 8.533 ( 2.546 3.313 -5.544) 6.942 10.575 ( -1.831 -7.216 2.975) 8.017 10.976 ( -4.964 1.374 -2.475) 5.715 11.345 ( 3.284 -5.865 15.445) 16.845 11.833 ( 21.258 13.503 11.711) 27.774 14.186 ( -4.413 -4.481 0.211) 6.292 15.416 ( -8.709 -2.158 -11.031) 14.219 15.476 ( 1.077 -1.640 -1.074) 2.237 15.687 ( -7.955 -5.011 -3.371) 9.987 ======================= Grid point 320 (151/306) ======================= q-point: (-0.10 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -11.408 17.312 14.006) 25.021 1.124 ( -0.576 4.925 16.466) 17.196 1.915 ( -4.113 2.010 -6.943) 8.316 2.523 ( -13.651 1.273 19.797) 24.081 2.653 ( 1.252 3.742 -1.653) 4.278 3.017 ( -22.296 0.603 43.580) 48.956 3.074 ( 6.029 0.560 11.019) 12.573 3.567 ( -6.852 0.311 7.440) 10.119 3.714 ( 5.779 -1.013 -14.634) 15.767 4.233 ( -15.936 0.983 9.544) 18.601 4.727 ( 2.239 -2.077 0.797) 3.156 5.352 ( -3.122 -3.951 -1.842) 5.362 5.726 ( 1.745 3.329 -3.296) 4.999 6.265 ( 6.736 -1.731 -20.604) 21.746 6.354 ( -0.331 0.664 -14.250) 14.270 6.740 ( 10.042 0.303 -3.388) 10.602 7.148 ( 5.071 -4.148 -4.345) 7.861 7.273 ( 6.151 6.955 -6.391) 11.271 7.535 ( 7.252 -1.976 1.997) 7.778 7.904 ( 2.992 0.051 0.361) 3.014 8.406 ( -4.449 2.289 -4.314) 6.606 8.480 ( 0.945 0.735 -5.452) 5.582 10.631 ( -1.910 -6.452 -0.368) 6.739 10.824 ( -5.963 4.661 -4.508) 8.809 11.547 ( -0.092 -2.429 11.597) 11.849 12.307 ( 36.345 2.975 9.500) 37.684 14.172 ( -2.901 -4.538 -1.276) 5.535 14.992 ( -32.514 -1.662 -14.501) 35.640 15.504 ( 1.955 0.631 0.054) 2.055 15.610 ( -2.689 0.040 -1.182) 2.938 ======================= Grid point 322 (152/306) ======================= q-point: ( 0.10 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.608 ( 15.439 0.000 4.660) 16.127 1.712 ( 3.621 0.000 3.498) 5.035 1.944 ( 12.530 0.000 2.777) 12.834 2.425 ( -7.894 -0.000 0.686) 7.924 2.978 ( -7.120 -0.000 29.214) 30.069 3.248 ( -4.348 -0.000 -0.957) 4.452 3.337 ( -2.039 -0.000 -9.105) 9.330 3.829 ( 3.053 0.000 4.879) 5.755 3.918 ( 3.962 0.000 13.094) 13.681 4.277 ( -2.628 -0.000 7.099) 7.570 4.726 ( 3.861 0.000 -0.857) 3.955 5.179 ( -3.147 -0.000 5.366) 6.221 5.675 ( 1.943 0.000 5.617) 5.943 5.680 ( -1.335 -0.000 -16.497) 16.551 6.096 ( 3.397 0.000 -10.106) 10.662 6.961 ( 2.704 0.000 -1.914) 3.313 7.013 ( 9.698 0.000 -22.717) 24.700 7.267 ( 0.763 0.000 1.036) 1.287 7.737 ( -0.737 -0.000 -0.117) 0.747 8.074 ( -3.728 -0.000 -5.257) 6.444 8.291 ( 12.800 0.000 2.502) 13.042 8.357 ( 5.091 0.000 -7.851) 9.357 10.400 ( -4.512 -0.000 -2.012) 4.941 10.614 ( -0.367 -0.000 -0.816) 0.894 11.736 ( -8.490 -0.000 11.868) 14.592 13.054 ( -39.514 -0.000 3.392) 39.659 13.570 ( 20.739 0.000 -7.823) 22.165 14.301 ( 4.947 0.000 5.078) 7.089 15.624 ( 3.601 0.000 -1.426) 3.873 15.679 ( 5.969 0.000 0.456) 5.987 ======================= Grid point 323 (153/306) ======================= q-point: ( 0.20 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( -2.802 -0.471 3.005) 4.135 1.940 ( 13.932 5.438 1.433) 15.024 2.187 ( 8.733 -9.193 4.679) 13.516 2.318 ( -3.311 -4.953 -5.360) 8.014 3.126 ( -6.640 3.874 8.663) 11.581 3.212 ( -7.499 -2.822 11.617) 14.112 3.245 ( -2.213 -0.712 4.793) 5.327 3.876 ( -0.813 -0.123 -0.206) 0.848 3.997 ( 3.208 -0.830 -6.698) 7.473 4.276 ( -4.136 0.334 3.756) 5.597 4.852 ( 4.772 -1.511 9.684) 10.901 5.171 ( -6.485 2.265 6.426) 9.406 5.568 ( 6.094 2.432 -6.734) 9.402 5.799 ( 5.813 -2.948 2.282) 6.905 6.052 ( 2.326 -0.764 -5.500) 6.020 6.867 ( -1.470 3.708 -8.855) 9.712 6.984 ( 11.765 0.558 -15.948) 19.826 7.309 ( 2.108 -3.729 -2.508) 4.964 7.755 ( 0.016 -1.566 4.235) 4.515 7.963 ( -4.175 -0.569 -5.551) 6.969 8.337 ( 6.861 2.069 -10.043) 12.337 8.506 ( 14.283 -0.039 -0.185) 14.284 10.322 ( -4.974 0.877 1.455) 5.256 10.621 ( -0.017 -1.303 0.927) 1.599 11.735 ( -5.564 1.661 9.773) 11.367 12.543 ( -32.632 3.737 1.581) 32.883 13.737 ( 12.132 -0.511 -4.625) 12.993 14.465 ( 5.105 -3.433 7.980) 10.076 15.653 ( 4.034 1.569 -1.778) 4.679 15.778 ( 5.897 -1.405 -0.190) 6.065 ======================= Grid point 324 (154/306) ======================= q-point: ( 0.30 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -5.168 -1.709 3.167) 6.297 2.036 ( 7.953 4.475 0.254) 9.129 2.162 ( -7.270 -1.825 -2.098) 7.784 2.559 ( 9.653 -13.658 -2.103) 16.856 3.043 ( -3.645 2.882 1.945) 5.037 3.128 ( -8.017 4.064 4.123) 9.889 3.420 ( -7.500 -4.664 22.567) 24.234 3.785 ( -0.049 4.758 -9.370) 10.509 3.996 ( 0.140 -8.243 -4.619) 9.450 4.236 ( -3.853 0.077 0.229) 3.860 5.027 ( -0.717 -2.231 10.076) 10.345 5.096 ( -8.336 1.635 7.166) 11.114 5.622 ( 7.976 5.698 1.243) 9.881 5.918 ( 9.893 -2.938 -5.080) 11.503 6.096 ( 4.374 -0.723 2.110) 4.910 6.718 ( -1.434 3.134 -7.313) 8.084 6.975 ( 11.572 0.567 -16.455) 20.124 7.330 ( 1.025 -4.638 -6.135) 7.758 7.802 ( -1.579 1.585 -2.622) 3.446 7.911 ( 1.249 -4.213 3.226) 5.452 8.295 ( 6.574 1.785 -12.368) 14.120 8.688 ( 14.772 3.104 -2.124) 15.243 10.276 ( -6.220 -0.222 5.818) 8.520 10.657 ( 0.318 -0.962 3.245) 3.400 11.748 ( -1.270 5.130 7.374) 9.072 12.093 ( -24.643 3.418 -0.429) 24.883 13.849 ( 5.320 -2.841 -0.621) 6.063 14.664 ( 3.860 -4.582 9.161) 10.946 15.669 ( 3.834 2.123 -2.297) 4.948 15.857 ( 4.206 -0.918 -1.357) 4.514 ======================= Grid point 326 (155/306) ======================= q-point: (-0.60 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -7.425 -3.352 3.444) 8.844 2.057 ( -6.492 -1.320 -2.621) 7.124 2.117 ( 6.630 1.364 1.598) 6.955 2.633 ( -5.199 -0.910 -2.801) 5.975 2.979 ( -9.109 8.118 8.726) 15.000 3.083 ( 0.086 -3.862 0.708) 3.927 3.541 ( 2.256 2.089 0.914) 3.208 3.673 ( -7.053 -2.270 7.036) 10.218 4.042 ( -10.184 -9.833 4.123) 14.744 4.211 ( 4.852 -3.333 -4.940) 7.685 4.993 ( -9.611 2.509 7.330) 12.345 5.106 ( -9.782 -1.915 8.229) 12.926 5.675 ( 6.668 6.141 2.367) 9.369 6.077 ( 13.495 -3.663 -4.093) 14.570 6.165 ( 4.493 3.666 0.105) 5.800 6.648 ( 2.380 -0.190 -3.924) 4.593 6.969 ( 11.946 -0.539 -16.066) 20.028 7.313 ( -0.309 -4.964 -7.260) 8.801 7.695 ( -0.691 2.962 -6.589) 7.257 8.038 ( 5.718 -0.811 -0.159) 5.778 8.257 ( 5.187 -1.828 -8.037) 9.738 8.807 ( 13.046 6.358 -4.318) 15.141 10.270 ( -7.455 -1.509 9.873) 12.463 10.721 ( 0.724 -0.527 6.370) 6.433 11.609 ( -14.558 7.037 -1.497) 16.239 11.898 ( 0.344 3.764 4.440) 5.831 13.941 ( 0.250 -5.352 2.649) 5.977 14.853 ( 2.307 -5.110 9.105) 10.692 15.671 ( 3.310 2.315 -2.789) 4.908 15.880 ( 1.228 -0.350 -3.146) 3.395 ======================= Grid point 327 (156/306) ======================= q-point: (-0.50 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -8.805 -4.015 5.290) 11.029 1.918 ( -8.542 1.901 -3.450) 9.407 2.247 ( 6.631 -0.992 4.747) 8.215 2.479 ( -9.146 5.294 0.923) 10.608 2.857 ( -9.281 10.386 11.925) 18.336 3.068 ( -0.343 0.384 -6.682) 6.702 3.502 ( 1.889 3.728 -3.635) 5.539 3.744 ( -11.630 -6.654 15.099) 20.187 3.977 ( -12.123 -4.580 3.507) 13.425 4.332 ( 3.809 -9.694 -2.185) 10.642 4.909 ( -7.312 3.174 7.522) 10.960 4.991 ( -16.595 0.032 5.830) 17.589 5.747 ( 7.448 4.279 1.621) 8.741 6.179 ( 5.571 2.431 -2.807) 6.696 6.262 ( 12.193 -3.800 -4.212) 13.448 6.664 ( 2.865 0.651 -2.293) 3.727 7.012 ( 14.203 -2.550 -14.472) 20.437 7.279 ( -0.692 -4.732 -7.083) 8.546 7.604 ( 2.558 3.748 -6.606) 8.015 8.033 ( 7.090 4.082 -12.350) 14.814 8.346 ( 4.332 -4.835 2.055) 6.810 8.830 ( 8.440 8.404 -6.363) 13.504 10.299 ( -7.102 -2.324 11.941) 14.086 10.825 ( 0.999 -0.499 10.488) 10.547 11.323 ( -12.808 2.948 -3.066) 13.496 11.947 ( 8.267 9.116 3.214) 12.719 14.018 ( -3.837 -6.830 4.557) 9.063 15.030 ( 2.043 -5.980 8.293) 10.427 15.657 ( 2.598 2.378 -3.398) 4.894 15.829 ( -2.966 -0.593 -5.291) 6.095 ======================= Grid point 328 (157/306) ======================= q-point: (-0.40 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( -9.637 1.251 8.698) 13.042 1.715 ( -9.666 3.591 -1.950) 10.495 2.259 ( -9.831 8.524 3.945) 13.596 2.460 ( 7.181 -3.073 4.459) 8.994 2.753 ( -5.782 13.160 13.662) 19.831 2.983 ( 0.086 2.867 -4.177) 5.067 3.424 ( -11.769 0.997 4.734) 12.724 3.717 ( -12.588 0.586 8.617) 15.266 3.892 ( -8.655 -3.590 -1.129) 9.437 4.408 ( -4.805 -5.872 3.044) 8.176 4.791 ( -17.445 2.099 6.673) 18.795 4.940 ( 1.619 -4.635 5.009) 7.014 5.819 ( 8.027 3.045 -2.029) 8.821 6.214 ( 5.380 -0.242 -4.674) 7.131 6.409 ( 9.273 -4.124 -5.366) 11.480 6.663 ( 2.592 1.063 -2.661) 3.864 7.094 ( 14.642 -1.373 -15.367) 21.270 7.257 ( 0.540 -4.226 -4.908) 6.499 7.551 ( 4.282 4.166 -5.576) 8.172 7.951 ( 6.467 4.579 -11.965) 14.351 8.468 ( 4.005 -2.286 1.661) 4.901 8.751 ( 3.072 8.095 -6.996) 11.132 10.362 ( -4.780 -3.460 10.387) 11.946 10.975 ( 0.896 -0.613 13.177) 13.222 11.141 ( -7.869 -0.818 0.068) 7.912 12.002 ( 12.173 12.416 1.387) 17.443 14.060 ( -7.397 -7.149 4.762) 11.336 15.213 ( 3.222 -6.707 6.817) 10.091 15.606 ( -1.173 1.567 -7.645) 7.892 15.711 ( -5.754 -1.005 -4.046) 7.106 ======================= Grid point 329 (158/306) ======================= q-point: (-0.30 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( -10.750 11.385 6.811) 17.076 1.604 ( -6.036 7.628 7.820) 12.482 2.063 ( -5.716 7.960 -0.133) 9.801 2.602 ( -6.941 -0.567 13.646) 15.321 2.761 ( 10.187 10.159 5.535) 15.415 2.936 ( -1.705 3.333 5.045) 6.283 3.226 ( -25.194 4.075 15.985) 30.114 3.621 ( -7.156 -0.377 1.424) 7.306 3.779 ( -4.421 0.477 -3.540) 5.684 4.388 ( -12.716 -2.102 7.536) 14.930 4.644 ( -7.879 0.355 5.445) 9.583 5.097 ( 2.450 -9.614 2.284) 10.181 5.860 ( 6.791 4.237 -4.041) 8.967 6.225 ( 4.659 -2.061 -9.066) 10.400 6.472 ( 2.441 -3.681 -8.660) 9.721 6.678 ( 6.898 1.014 -4.447) 8.270 7.122 ( 10.988 1.342 -13.990) 17.840 7.292 ( 3.955 -4.134 -2.832) 6.383 7.513 ( 3.965 4.694 -4.490) 7.610 7.899 ( 5.632 3.035 -6.218) 8.922 8.522 ( 1.552 1.132 -0.839) 2.096 8.630 ( 0.842 5.580 -6.866) 8.887 10.437 ( -2.924 -5.198 5.179) 7.898 11.000 ( -4.436 0.965 0.633) 4.584 11.237 ( 1.358 -4.855 15.646) 16.438 12.103 ( 18.681 11.701 2.571) 22.192 14.054 ( -10.331 -7.564 4.016) 13.419 15.366 ( -8.180 -2.572 -8.776) 12.270 15.400 ( -1.931 -4.039 -0.680) 4.528 15.648 ( -1.198 0.796 -0.785) 1.639 ======================= Grid point 330 (159/306) ======================= q-point: (-0.20 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.267 ( -3.213 10.618 10.832) 15.505 1.452 ( -4.211 23.641 11.102) 26.455 1.961 ( 0.241 2.460 -5.248) 5.801 2.576 ( -14.462 3.724 17.831) 23.259 2.792 ( 5.381 8.577 -3.410) 10.684 3.044 ( -1.276 1.553 20.498) 20.596 3.096 ( -14.675 2.093 26.805) 30.631 3.560 ( -3.779 -0.998 1.531) 4.198 3.698 ( 0.081 0.005 -6.548) 6.549 4.270 ( -13.721 2.503 9.893) 17.100 4.659 ( -0.106 -3.948 1.622) 4.270 5.215 ( -1.528 -8.528 -0.058) 8.664 5.832 ( 2.343 6.058 -3.517) 7.387 6.205 ( 5.492 -3.094 -14.153) 15.493 6.365 ( -1.106 -0.352 -15.213) 15.257 6.746 ( 8.843 0.046 -4.079) 9.739 7.108 ( 5.197 -0.348 -8.934) 10.342 7.376 ( 8.915 0.264 -6.931) 11.295 7.497 ( 2.975 1.059 1.581) 3.531 7.915 ( 4.586 1.264 -1.350) 4.945 8.471 ( -2.560 2.827 -2.563) 4.595 8.524 ( 1.558 4.116 -7.850) 9.000 10.484 ( -2.793 -6.541 0.035) 7.112 10.915 ( -4.112 3.733 -1.058) 5.653 11.465 ( 0.310 -5.017 13.772) 14.660 12.396 ( 29.068 4.418 4.049) 29.679 14.011 ( -13.859 -9.572 3.817) 17.270 14.971 ( -22.455 0.608 -13.759) 26.342 15.504 ( 3.463 -1.199 1.166) 3.846 15.620 ( -0.368 1.209 -0.776) 1.483 ======================= Grid point 331 (160/306) ======================= q-point: (-0.10 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.224 ( 3.127 20.722 11.577) 23.942 1.433 ( 9.977 7.525 12.412) 17.614 1.843 ( -1.994 4.561 -6.263) 8.001 2.576 ( -7.726 1.453 14.912) 16.858 2.719 ( -6.468 7.345 11.892) 15.402 3.226 ( 2.353 -1.868 7.958) 8.506 3.278 ( -5.507 1.158 36.114) 36.550 3.576 ( 2.966 -0.785 -0.713) 3.150 3.630 ( -0.419 0.653 -3.705) 3.785 4.192 ( -7.653 2.502 10.129) 12.939 4.715 ( 1.948 -3.817 -2.271) 4.850 5.227 ( -5.224 -5.396 -1.255) 7.614 5.738 ( -2.089 6.507 -1.162) 6.932 6.107 ( 2.508 -0.708 -21.562) 21.719 6.220 ( 2.427 -1.034 -12.386) 12.664 6.831 ( 7.412 -0.875 -3.044) 8.061 7.100 ( 4.412 -3.827 -10.203) 11.756 7.353 ( 4.720 6.376 -6.148) 10.036 7.626 ( 6.514 -4.312 1.758) 8.007 7.967 ( 4.338 0.691 1.521) 4.648 8.350 ( -3.114 5.378 -4.376) 7.600 8.432 ( 0.853 1.182 -7.093) 7.241 10.496 ( -3.311 -6.880 -2.652) 8.083 10.787 ( -3.260 6.218 -2.655) 7.506 11.626 ( -3.616 -3.275 13.565) 14.415 12.863 ( 33.601 -1.617 -1.860) 33.691 13.915 ( -25.984 -14.340 5.189) 30.128 14.490 ( -16.900 9.011 -9.355) 21.315 15.551 ( 2.484 0.929 0.131) 2.655 15.601 ( 1.588 1.638 -1.000) 2.491 ======================= Grid point 334 (161/306) ======================= q-point: ( 0.20 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -5.703 -0.000 2.242) 6.128 2.143 ( -7.450 -0.000 -0.791) 7.492 2.244 ( 7.356 0.000 -0.588) 7.379 2.246 ( 15.565 0.000 -2.799) 15.815 3.084 ( -1.415 -0.000 -3.301) 3.592 3.182 ( -7.259 -0.000 6.730) 9.899 3.366 ( -8.343 -0.000 25.295) 26.635 3.823 ( -6.412 -0.000 0.795) 6.461 3.915 ( 3.062 0.000 -14.751) 15.065 4.235 ( -3.395 -0.000 -0.267) 3.405 5.003 ( 0.103 0.000 11.472) 11.473 5.114 ( -10.369 -0.000 6.670) 12.329 5.699 ( 10.998 0.000 1.441) 11.092 5.875 ( 8.490 0.000 -6.757) 10.851 6.084 ( 5.234 0.000 4.599) 6.968 6.756 ( -1.741 -0.000 -10.739) 10.879 6.986 ( 10.439 0.000 -15.050) 18.316 7.274 ( 0.991 0.000 -5.181) 5.275 7.833 ( 3.364 0.000 7.795) 8.490 7.845 ( -3.511 -0.000 -5.761) 6.746 8.318 ( 7.682 0.000 -15.210) 17.040 8.722 ( 15.210 0.000 -0.498) 15.218 10.274 ( -6.270 -0.000 4.494) 7.714 10.646 ( 0.346 0.000 4.081) 4.096 11.805 ( 1.214 0.000 8.224) 8.313 12.128 ( -28.079 -0.000 -0.878) 28.093 13.821 ( 6.119 0.000 -3.035) 6.830 14.612 ( 3.376 0.000 11.113) 11.615 15.695 ( 3.644 0.000 -2.581) 4.465 15.844 ( 4.639 0.000 -0.903) 4.726 ======================= Grid point 335 (162/306) ======================= q-point: (-0.70 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( -8.311 -2.278 0.810) 8.655 2.051 ( -5.463 -0.061 0.929) 5.542 2.237 ( 8.531 10.281 -1.199) 13.414 2.490 ( 5.826 -11.807 -4.591) 13.944 3.061 ( 1.499 1.462 -0.058) 2.094 3.130 ( -8.753 4.148 9.484) 13.557 3.485 ( -8.381 -1.747 18.523) 20.406 3.729 ( -3.614 1.663 -3.475) 5.282 3.832 ( -3.986 -6.725 -3.925) 8.747 4.183 ( -1.278 -0.493 -3.067) 3.359 5.037 ( -8.839 1.635 8.601) 12.441 5.068 ( -9.066 -1.609 8.943) 12.835 5.815 ( 7.370 7.008 1.547) 10.287 5.973 ( 10.272 -6.074 -3.865) 12.544 6.245 ( 8.973 2.867 4.433) 10.411 6.627 ( -1.020 -1.162 -8.540) 8.679 6.972 ( 10.512 0.423 -15.606) 18.821 7.230 ( -0.339 -2.440 -6.209) 6.680 7.740 ( -1.182 1.243 -6.099) 6.335 8.000 ( 6.957 -1.722 6.496) 9.673 8.251 ( 7.417 0.351 -17.032) 18.580 8.903 ( 13.684 2.485 -3.205) 14.272 10.249 ( -7.005 -0.512 8.793) 11.254 10.709 ( 0.441 -0.403 6.495) 6.522 11.723 ( -21.694 3.239 -2.838) 22.118 11.947 ( 6.798 1.064 6.165) 9.239 13.865 ( 1.040 -1.911 0.197) 2.184 14.777 ( 1.583 -2.026 11.233) 11.524 15.706 ( 2.923 0.906 -3.228) 4.448 15.874 ( 1.397 -0.157 -2.397) 2.779 ======================= Grid point 336 (163/306) ======================= q-point: (-0.60 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.473 ( -9.420 -5.459 1.461) 10.985 1.979 ( -5.288 2.983 1.189) 6.187 2.275 ( 8.521 4.324 0.435) 9.565 2.549 ( -1.456 -0.826 -0.948) 1.924 3.018 ( -7.205 2.014 4.356) 8.657 3.101 ( -0.609 7.014 6.184) 9.370 3.571 ( -5.991 -6.703 10.528) 13.845 3.614 ( -0.222 4.851 -6.048) 7.756 3.841 ( -13.610 -9.186 9.639) 19.040 4.174 ( 2.754 -4.728 -4.243) 6.924 4.971 ( -11.220 0.963 6.340) 12.924 4.998 ( -11.228 1.852 9.102) 14.572 5.855 ( 5.542 6.286 2.280) 8.684 6.151 ( 9.055 -6.487 -2.636) 11.446 6.291 ( 4.976 7.624 -2.389) 9.412 6.627 ( 3.374 -4.667 -3.106) 6.543 6.967 ( 10.459 -1.318 -13.800) 17.365 7.190 ( -0.750 -3.502 -5.693) 6.726 7.666 ( 3.083 2.139 -7.162) 8.086 8.111 ( 9.156 3.418 -12.441) 15.821 8.252 ( 7.877 -4.025 -0.775) 8.879 8.974 ( 8.634 5.080 -6.827) 12.123 10.270 ( -6.214 -0.602 12.243) 13.743 10.805 ( 0.617 -1.143 9.107) 9.199 11.380 ( -16.913 2.176 -3.532) 17.414 12.099 ( 11.245 5.293 3.245) 12.845 13.900 ( -2.917 -4.128 3.148) 5.955 14.933 ( 1.069 -3.427 9.895) 10.526 15.695 ( 2.226 1.194 -3.854) 4.608 15.828 ( -3.130 0.282 -4.267) 5.300 ======================= Grid point 337 (164/306) ======================= q-point: (-0.50 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( -7.881 -7.757 5.247) 12.239 1.846 ( -6.432 7.078 -0.392) 9.572 2.396 ( 7.866 0.116 3.478) 8.601 2.483 ( -4.735 8.281 5.747) 11.137 2.963 ( -3.567 -2.134 -0.137) 4.159 3.051 ( -1.526 12.649 8.760) 15.462 3.476 ( -11.738 2.954 4.074) 12.771 3.673 ( 0.497 -4.654 1.456) 4.902 3.795 ( -13.690 -4.535 6.954) 16.011 4.256 ( -0.086 -8.208 0.667) 8.235 4.819 ( -15.103 0.444 5.176) 15.972 4.946 ( -5.476 4.264 9.342) 11.638 5.886 ( 5.487 4.124 -0.773) 6.907 6.260 ( 4.293 4.116 -3.016) 6.669 6.300 ( 7.181 -6.056 -4.604) 10.462 6.664 ( 1.519 -1.360 -2.903) 3.547 7.023 ( 10.547 -4.727 -11.411) 16.242 7.170 ( -0.272 -3.948 -3.815) 5.497 7.631 ( 6.863 3.430 -8.060) 11.128 8.040 ( 8.401 3.678 -15.321) 17.856 8.427 ( 9.728 -1.610 1.032) 9.914 8.904 ( 1.953 6.193 -8.933) 11.044 10.328 ( -4.287 -0.120 11.615) 12.381 10.943 ( 0.677 -2.241 12.308) 12.529 11.138 ( -11.080 0.416 -1.169) 11.149 12.212 ( 12.281 7.674 -0.862) 14.507 13.925 ( -6.696 -5.271 4.947) 9.853 15.094 ( 2.646 -4.825 8.100) 9.792 15.637 ( -3.237 1.741 -8.003) 8.806 15.715 ( -3.438 0.513 -2.616) 4.351 ======================= Grid point 338 (165/306) ======================= q-point: (-0.40 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( -5.364 -5.753 10.232) 12.906 1.666 ( -4.547 8.425 -0.351) 9.581 2.355 ( -3.515 15.985 6.441) 17.589 2.560 ( 3.272 -2.430 7.444) 8.486 2.939 ( 2.352 -2.135 -7.533) 8.175 3.026 ( -2.121 11.187 15.646) 19.351 3.295 ( -19.320 3.645 11.609) 22.832 3.651 ( -6.688 3.495 4.362) 8.716 3.750 ( -3.508 -3.706 -1.474) 5.312 4.321 ( -5.113 -4.801 5.728) 9.056 4.668 ( -12.464 1.176 5.974) 13.872 4.961 ( -1.630 -1.773 5.872) 6.346 5.920 ( 7.370 2.208 -4.389) 8.857 6.240 ( 3.646 2.880 -5.581) 7.262 6.375 ( 1.608 -5.308 -5.796) 8.022 6.674 ( 3.835 -1.365 -3.630) 5.454 7.091 ( 7.543 -4.461 -11.067) 14.117 7.194 ( 1.889 -4.795 -1.716) 5.432 7.613 ( 7.922 4.946 -7.815) 12.178 7.976 ( 7.866 3.831 -11.267) 14.265 8.552 ( 7.551 1.594 -2.187) 8.021 8.745 ( -1.938 5.131 -8.337) 9.979 10.376 ( -3.102 -0.765 6.302) 7.065 11.019 ( -5.556 0.841 3.519) 6.631 11.139 ( 0.689 -4.640 14.133) 14.891 12.293 ( 13.473 6.293 -3.345) 15.242 13.912 ( -10.665 -5.294 5.687) 13.195 15.268 ( 3.064 -5.581 3.586) 7.307 15.398 ( -10.608 2.637 -8.782) 14.021 15.674 ( 0.192 1.061 -1.633) 1.956 ======================= Grid point 339 (166/306) ======================= q-point: (-0.30 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -3.403 9.976 8.175) 13.339 1.687 ( 2.120 -1.496 6.793) 7.272 2.178 ( -1.099 19.054 0.808) 19.103 2.652 ( -7.102 2.768 13.076) 15.136 2.914 ( 1.326 0.932 -4.503) 4.785 3.051 ( 0.262 -0.281 4.246) 4.263 3.188 ( -16.757 5.668 30.666) 35.402 3.589 ( 0.751 5.792 3.188) 6.654 3.704 ( -2.570 0.077 -2.072) 3.302 4.323 ( -8.656 1.805 10.180) 13.484 4.588 ( -4.831 -2.411 2.354) 5.890 5.036 ( -1.750 -7.354 2.464) 7.951 5.940 ( 5.358 3.489 -4.631) 7.894 6.182 ( 2.632 1.512 -9.904) 10.359 6.328 ( -1.874 -2.854 -10.147) 10.706 6.732 ( 7.387 -1.656 -4.410) 8.761 7.083 ( 1.912 -3.033 -10.092) 10.710 7.299 ( 7.170 -5.313 -1.372) 9.029 7.587 ( 6.086 5.916 -5.426) 10.073 7.960 ( 7.113 2.916 -5.527) 9.468 8.519 ( -2.872 2.056 -6.194) 7.131 8.629 ( 3.565 5.132 -6.063) 8.706 10.385 ( -2.909 -2.736 0.773) 4.067 10.981 ( -3.402 2.902 3.571) 5.722 11.354 ( 0.339 -5.475 14.098) 15.128 12.444 ( 17.279 -0.490 -2.150) 17.419 13.847 ( -14.885 -4.900 6.740) 17.059 15.021 ( -15.326 3.641 -12.402) 20.049 15.454 ( 5.067 -3.149 3.322) 6.828 15.652 ( 0.769 1.467 -1.436) 2.192 ======================= Grid point 340 (167/306) ======================= q-point: (-0.20 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.514 ( 5.955 8.571 12.323) 16.148 1.741 ( 2.192 12.701 7.083) 14.707 1.961 ( -1.010 11.538 -6.892) 13.477 2.629 ( -8.125 3.824 14.210) 16.810 2.866 ( -5.034 4.464 7.493) 10.071 3.164 ( 1.661 -3.999 4.174) 6.015 3.296 ( -6.834 -0.247 27.922) 28.747 3.617 ( 6.198 5.148 -3.461) 8.769 3.660 ( -0.171 3.630 8.324) 9.083 4.265 ( -7.662 4.368 8.540) 12.277 4.621 ( 1.017 -4.780 0.745) 4.943 5.085 ( -4.580 -7.600 0.115) 8.875 5.893 ( -0.198 7.329 -0.672) 7.362 6.069 ( 0.497 -2.688 -18.058) 18.264 6.212 ( 2.162 0.692 -11.830) 12.046 6.808 ( 6.360 -1.218 -3.449) 7.337 7.029 ( 2.053 -3.573 -10.823) 11.581 7.434 ( 9.804 -1.001 -6.818) 11.984 7.573 ( 2.477 2.037 2.316) 3.955 7.996 ( 5.917 2.057 -1.029) 6.349 8.387 ( -4.603 -0.642 -6.028) 7.611 8.543 ( 3.052 7.637 -7.227) 10.948 10.375 ( -2.868 -4.475 -1.652) 5.566 10.908 ( -3.137 5.705 -0.308) 6.518 11.535 ( -2.923 -5.223 13.219) 14.511 12.749 ( 19.176 -10.182 -2.411) 21.846 13.721 ( -20.617 -2.931 9.314) 22.812 14.649 ( -10.167 6.691 -10.664) 16.183 15.555 ( 2.950 -0.650 0.665) 3.093 15.640 ( 2.503 1.789 -1.346) 3.359 ======================= Grid point 341 (168/306) ======================= q-point: (-0.10 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 6.351 18.945 7.976) 21.515 1.764 ( 11.280 4.139 9.473) 15.301 1.816 ( -0.178 4.806 -2.701) 5.516 2.595 ( -4.841 3.349 1.634) 6.109 2.889 ( -7.521 5.308 24.300) 25.985 3.230 ( -1.992 -3.901 2.290) 4.942 3.434 ( -2.207 -0.796 -1.367) 2.716 3.666 ( 3.610 -0.622 13.696) 14.177 3.795 ( 7.228 7.925 14.635) 18.145 4.213 ( -4.344 0.234 3.492) 5.578 4.702 ( 3.370 -1.463 0.938) 3.792 5.076 ( -5.911 -6.490 0.556) 8.796 5.782 ( -3.202 5.475 -2.360) 6.768 5.892 ( -0.610 1.160 -14.951) 15.009 6.144 ( 4.855 -0.202 -11.520) 12.503 6.860 ( 1.117 -2.750 -0.621) 3.032 7.001 ( 8.417 -3.613 -16.461) 18.838 7.421 ( 4.674 6.249 -6.182) 9.956 7.677 ( 3.587 -3.243 2.602) 5.491 8.064 ( 5.114 0.620 1.480) 5.360 8.276 ( -3.795 -0.756 -5.222) 6.499 8.432 ( 4.165 6.674 -7.737) 11.034 10.366 ( -2.965 -4.942 -1.519) 5.960 10.782 ( -2.599 6.246 -3.038) 7.416 11.652 ( -6.820 -4.196 13.199) 15.439 13.054 ( 2.105 -19.680 -6.309) 20.774 13.532 ( -13.988 5.679 10.661) 18.481 14.422 ( 1.249 7.728 -5.560) 9.602 15.575 ( 1.146 0.237 -0.777) 1.405 15.668 ( 5.083 2.108 -0.710) 5.548 ======================= Grid point 346 (169/306) ======================= q-point: ( 0.30 -0.70 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( -9.870 -0.000 0.567) 9.886 2.010 ( -4.428 -0.000 3.393) 5.579 2.405 ( 6.041 0.000 -6.164) 8.631 2.446 ( 6.937 0.000 -0.091) 6.937 3.102 ( -14.589 -0.000 14.050) 20.255 3.124 ( 5.611 0.000 -1.525) 5.815 3.565 ( -2.546 -0.000 13.050) 13.296 3.635 ( -13.495 -0.000 9.282) 16.379 3.700 ( -1.581 -0.000 -6.990) 7.167 4.129 ( 0.077 0.000 -4.595) 4.595 4.972 ( -13.294 -0.000 6.017) 14.593 5.028 ( -7.702 -0.000 10.569) 13.078 5.988 ( 3.601 0.000 2.557) 4.416 6.016 ( 9.266 0.000 -2.098) 9.500 6.448 ( 8.681 0.000 2.918) 9.158 6.501 ( -0.585 -0.000 -9.069) 9.088 6.957 ( 8.397 0.000 -13.381) 15.798 7.150 ( -0.725 -0.000 -5.010) 5.062 7.689 ( 3.339 0.000 -7.398) 8.117 8.171 ( 7.934 0.000 -18.610) 20.231 8.185 ( 11.404 0.000 4.368) 12.212 9.028 ( 8.635 0.000 -7.108) 11.184 10.266 ( -5.744 -0.000 12.824) 14.051 10.791 ( 0.462 0.000 8.403) 8.415 11.403 ( -18.536 -0.000 -3.637) 18.889 12.155 ( 11.990 0.000 3.269) 12.428 13.857 ( -2.074 -0.000 2.148) 2.986 14.895 ( 0.574 0.000 10.584) 10.599 15.707 ( 2.094 0.000 -3.993) 4.509 15.832 ( -3.098 -0.000 -3.697) 4.824 ======================= Grid point 348 (170/306) ======================= q-point: (-0.60 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( -8.060 -3.702 4.338) 9.873 1.960 ( -5.156 3.148 2.043) 6.377 2.421 ( 6.660 2.698 -1.101) 7.270 2.559 ( 5.889 -2.015 -1.736) 6.461 2.990 ( -12.146 6.146 10.760) 17.352 3.207 ( -0.037 -1.486 4.684) 4.914 3.491 ( -15.348 3.289 10.994) 19.164 3.628 ( -3.426 -3.117 -2.598) 5.311 3.714 ( 0.599 -1.307 8.988) 9.102 4.113 ( 1.359 -4.408 -3.538) 5.814 4.823 ( -14.575 0.036 4.542) 15.266 5.037 ( -5.745 3.016 11.928) 13.578 5.990 ( 2.386 5.155 -0.377) 5.693 6.167 ( 6.508 -5.821 -1.288) 8.826 6.377 ( 2.629 6.209 -6.015) 9.036 6.587 ( 2.473 -5.623 -2.365) 6.583 6.948 ( 5.855 -1.736 -8.580) 10.532 7.107 ( -0.597 -1.774 -3.264) 3.762 7.682 ( 8.821 1.344 -9.498) 13.031 8.094 ( 8.557 1.378 -16.810) 18.913 8.404 ( 13.880 -0.559 0.836) 13.916 8.994 ( 1.383 2.236 -10.405) 10.732 10.339 ( -3.457 0.684 13.107) 13.572 10.901 ( 0.385 -1.369 10.372) 10.469 11.148 ( -12.995 0.335 -0.509) 13.009 12.316 ( 10.770 2.432 -2.225) 11.263 13.854 ( -4.117 -1.601 4.079) 6.013 15.020 ( 1.750 -1.987 8.633) 9.030 15.678 ( -1.306 1.860 -5.550) 5.997 15.714 ( -4.996 -0.682 -3.785) 6.305 ======================= Grid point 349 (171/306) ======================= q-point: (-0.50 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.361 ( -3.510 -6.668 9.212) 11.901 1.843 ( -4.481 7.078 0.307) 8.383 2.519 ( 5.691 -0.962 4.012) 7.029 2.613 ( 4.401 5.049 0.399) 6.710 2.888 ( -6.734 2.492 5.132) 8.826 3.213 ( -9.153 5.224 12.212) 16.131 3.338 ( -15.947 0.438 7.003) 17.422 3.624 ( -5.397 -7.876 2.337) 9.829 3.785 ( 7.199 8.966 2.540) 11.776 4.189 ( 0.424 -7.370 2.726) 7.869 4.668 ( -13.100 -0.599 4.104) 13.741 5.032 ( -6.111 6.268 11.877) 14.754 5.970 ( 5.109 2.473 -5.222) 7.712 6.269 ( 2.575 -4.127 -3.297) 5.876 6.317 ( 3.756 3.967 -4.450) 7.046 6.615 ( 1.112 -4.558 -4.524) 6.518 6.983 ( 3.255 -4.315 -4.494) 7.030 7.105 ( 0.405 -3.544 -1.520) 3.877 7.703 ( 11.759 3.308 -10.863) 16.347 8.041 ( 8.809 2.265 -13.406) 16.201 8.581 ( 11.733 1.132 -3.169) 12.206 8.830 ( -3.865 2.877 -10.345) 11.412 10.391 ( -2.764 1.657 6.627) 7.369 11.031 ( -5.840 -0.324 6.375) 8.651 11.055 ( -0.423 -2.544 12.921) 13.175 12.368 ( 7.334 1.477 -7.607) 10.669 13.849 ( -5.978 -1.139 5.517) 8.214 15.164 ( 3.016 -4.021 4.710) 6.888 15.471 ( -10.035 3.712 -5.982) 12.258 15.681 ( 0.870 -0.418 -3.042) 3.191 ======================= Grid point 350 (172/306) ======================= q-point: (-0.40 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -0.517 -6.581 11.125) 12.936 1.734 ( 0.945 8.065 1.477) 8.254 2.562 ( 0.386 15.089 2.978) 15.385 2.665 ( 4.257 -1.542 4.948) 6.707 2.864 ( -2.003 -2.636 1.605) 3.679 3.080 ( -11.959 4.028 5.262) 13.672 3.241 ( -16.105 -1.137 18.333) 24.429 3.659 ( -3.329 -4.325 3.006) 6.231 3.814 ( 9.510 12.632 2.617) 16.026 4.306 ( -0.197 -3.367 7.628) 8.341 4.553 ( -10.007 -1.870 2.956) 10.601 4.989 ( -6.335 3.849 8.380) 11.188 5.972 ( 6.623 0.052 -9.056) 11.220 6.227 ( -3.309 0.196 -6.703) 7.478 6.300 ( 4.053 2.455 -4.678) 6.658 6.666 ( 6.127 -5.096 -4.808) 9.308 6.998 ( -1.598 -3.784 -3.821) 5.610 7.182 ( 4.430 -5.844 0.409) 7.345 7.712 ( 11.008 5.579 -10.139) 15.972 8.022 ( 8.571 2.764 -8.873) 12.642 8.554 ( -4.705 1.223 -10.190) 11.290 8.719 ( 5.287 3.435 -4.721) 7.877 10.369 ( -2.971 0.726 0.341) 3.078 11.041 ( -3.097 2.925 9.497) 10.409 11.245 ( 0.415 -4.795 13.543) 14.373 12.378 ( 5.034 -5.078 -8.686) 11.251 13.819 ( -7.000 1.432 7.008) 10.008 15.092 ( -12.289 2.399 -9.553) 15.749 15.400 ( 4.641 -1.435 4.166) 6.399 15.670 ( 1.337 0.133 -2.453) 2.797 ======================= Grid point 351 (173/306) ======================= q-point: (-0.30 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.648 ( 0.431 1.926 10.969) 11.145 1.791 ( 8.480 0.955 2.219) 8.818 2.361 ( -3.042 20.329 -1.881) 20.641 2.715 ( -3.164 3.117 4.475) 6.305 2.872 ( -6.208 -1.385 8.540) 10.649 3.075 ( 2.109 -4.569 4.803) 6.956 3.268 ( -10.683 -2.211 21.983) 24.541 3.655 ( -3.489 -0.337 0.607) 3.557 3.881 ( 11.268 13.606 8.506) 19.607 4.347 ( -7.573 2.219 5.502) 9.620 4.531 ( 0.942 -3.661 3.803) 5.362 4.963 ( -5.790 -2.279 4.484) 7.670 5.957 ( 5.155 -2.151 -12.245) 13.459 6.054 ( -6.781 1.902 -8.860) 11.318 6.270 ( 4.484 5.158 -5.821) 8.977 6.774 ( 8.894 -2.722 -4.704) 10.424 6.948 ( -2.622 -3.514 -5.971) 7.408 7.338 ( 6.997 -6.486 0.337) 9.547 7.686 ( 6.523 6.891 -6.233) 11.353 8.045 ( 7.783 2.509 -4.091) 9.144 8.361 ( -7.021 -1.781 -8.867) 11.449 8.687 ( 4.054 5.835 -6.360) 9.536 10.318 ( -2.891 -1.026 -1.528) 3.428 11.032 ( -3.067 6.347 4.837) 8.549 11.422 ( -1.870 -5.336 11.718) 13.011 12.469 ( 2.342 -15.349 -4.501) 16.166 13.770 ( -6.048 5.944 9.016) 12.378 14.772 ( -10.035 5.063 -9.828) 14.931 15.527 ( 4.595 -1.840 1.620) 5.208 15.667 ( 2.348 0.662 -2.024) 3.170 ======================= Grid point 352 (174/306) ======================= q-point: (-0.20 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 2.736 -1.008 6.856) 7.451 1.918 ( 10.207 5.851 5.528) 12.999 2.075 ( -3.486 20.258 0.229) 20.557 2.657 ( -3.333 2.819 0.073) 4.366 2.926 ( -3.461 -2.598 10.280) 11.153 3.176 ( -4.907 -0.719 12.971) 13.887 3.431 ( -1.609 -0.256 11.812) 11.923 3.631 ( 1.644 -1.928 3.845) 4.605 4.016 ( 10.335 12.259 12.062) 20.065 4.221 ( -7.619 0.158 -3.045) 8.206 4.679 ( 5.463 -0.886 8.293) 9.970 4.946 ( -6.622 -4.848 2.140) 8.482 5.803 ( -5.463 -1.561 -16.972) 17.898 5.949 ( 3.275 1.414 -5.423) 6.491 6.200 ( 3.048 6.533 -5.815) 9.262 6.820 ( -2.217 -0.654 -0.578) 2.383 6.925 ( 9.973 -3.962 -13.945) 17.596 7.484 ( 8.565 -2.365 -5.867) 10.648 7.654 ( 1.116 3.236 2.728) 4.377 8.098 ( 5.862 2.338 -0.596) 6.339 8.220 ( -4.719 -3.743 -7.108) 9.316 8.589 ( 2.966 7.240 -8.157) 11.303 10.285 ( -2.818 -2.633 -0.456) 3.883 10.923 ( -3.316 7.606 -1.790) 8.488 11.547 ( -5.621 -5.600 11.856) 14.266 12.612 ( -7.819 -21.693 -1.447) 23.104 13.717 ( -1.704 10.981 9.007) 14.304 14.552 ( -0.151 4.829 -6.846) 8.379 15.580 ( 1.297 0.017 -0.821) 1.535 15.695 ( 4.845 0.470 -1.271) 5.031 ======================= Grid point 353 (175/306) ======================= q-point: (-0.10 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -4.193 5.312 0.668) 6.800 1.927 ( 4.007 9.447 0.725) 10.288 2.141 ( 10.688 5.818 15.365) 19.600 2.567 ( 0.416 4.183 -5.724) 7.101 3.012 ( -4.607 -3.699 9.576) 11.252 3.246 ( -6.349 1.785 17.102) 18.329 3.364 ( -6.401 4.480 -0.565) 7.833 3.827 ( 6.495 -1.682 5.204) 8.491 4.054 ( 0.498 0.671 -7.414) 7.461 4.203 ( 2.288 3.803 12.868) 13.611 4.819 ( 4.017 3.982 5.722) 8.046 4.972 ( -2.419 -7.042 7.289) 10.419 5.584 ( -2.900 -2.321 -15.682) 16.116 5.921 ( 1.895 4.192 -1.858) 4.962 6.120 ( 2.489 3.848 -5.924) 7.489 6.779 ( -4.116 -4.174 -1.616) 6.080 6.965 ( 13.559 -1.057 -17.162) 21.898 7.481 ( 4.776 4.939 -6.902) 9.739 7.727 ( 1.571 -1.827 4.832) 5.399 8.088 ( -2.532 -0.555 -5.322) 5.920 8.204 ( 3.608 -1.575 0.490) 3.967 8.485 ( 6.027 5.319 -9.318) 12.306 10.283 ( -3.147 -3.148 2.133) 4.935 10.774 ( -2.475 6.096 -3.846) 7.621 11.624 ( -8.009 -4.933 11.323) 14.720 12.604 ( -21.947 -18.108 0.498) 28.457 13.711 ( 6.322 9.354 4.600) 12.191 14.517 ( 7.043 5.305 -1.355) 8.921 15.582 ( 1.511 -0.294 -1.492) 2.144 15.753 ( 5.394 0.861 -0.836) 5.526 ======================= Grid point 358 (176/306) ======================= q-point: ( 0.40 -0.60 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( -3.380 -0.000 9.260) 9.857 1.924 ( -4.522 -0.000 1.171) 4.671 2.521 ( 5.566 0.000 2.401) 6.062 2.602 ( 8.369 0.000 -8.013) 11.587 3.010 ( -18.112 -0.000 25.709) 31.448 3.189 ( -0.434 -0.000 -2.732) 2.766 3.427 ( -11.236 -0.000 7.341) 13.421 3.468 ( -11.827 -0.000 3.909) 12.457 3.934 ( 12.444 0.000 7.128) 14.341 4.066 ( 1.029 0.000 -2.134) 2.369 4.661 ( -13.648 -0.000 3.411) 14.068 5.114 ( -6.063 -0.000 13.981) 15.240 6.001 ( 2.284 0.000 -6.832) 7.204 6.220 ( 4.524 0.000 -0.073) 4.525 6.385 ( 4.327 0.000 -6.495) 7.805 6.531 ( -0.984 -0.000 -4.126) 4.242 6.942 ( 2.603 0.000 -1.772) 3.149 7.064 ( -0.731 -0.000 -1.555) 1.719 7.738 ( 13.023 0.000 -11.763) 17.549 8.065 ( 9.029 0.000 -13.860) 16.541 8.594 ( 13.097 0.000 -3.479) 13.552 8.860 ( -4.504 -0.000 -11.253) 12.121 10.414 ( -2.586 -0.000 6.545) 7.038 11.006 ( -0.311 -0.000 11.390) 11.394 11.047 ( -6.461 -0.000 8.924) 11.018 12.379 ( 4.659 0.000 -9.371) 10.465 13.842 ( -3.350 -0.000 5.231) 6.211 15.119 ( 2.785 0.000 5.044) 5.762 15.518 ( -10.874 -0.000 -3.992) 11.583 15.671 ( 2.009 0.000 -4.364) 4.804 ======================= Grid point 360 (177/306) ======================= q-point: (-0.50 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( 1.283 -3.507 10.843) 11.468 1.872 ( -0.846 4.042 1.760) 4.489 2.621 ( 6.393 -1.390 -5.811) 8.751 2.660 ( 5.184 -2.076 3.129) 6.401 2.974 ( -10.373 9.933 16.896) 22.175 3.159 ( -12.607 -5.821 10.675) 17.516 3.238 ( -10.629 10.797 3.257) 15.498 3.490 ( -3.570 -11.420 2.645) 12.254 4.043 ( 6.696 8.003 3.291) 10.941 4.221 ( 7.984 -4.116 6.238) 10.936 4.514 ( -11.706 -1.250 2.569) 12.050 5.116 ( -10.289 5.101 13.294) 17.567 5.959 ( 5.303 -0.776 -12.208) 13.333 6.224 ( -1.743 0.335 -4.798) 5.116 6.385 ( 6.598 4.603 -3.852) 8.919 6.527 ( 3.377 -7.143 -4.205) 8.950 6.969 ( -0.396 0.937 2.168) 2.395 7.069 ( 0.873 -4.395 0.326) 4.492 7.797 ( 13.940 2.221 -12.308) 18.728 8.064 ( 9.124 1.120 -10.110) 13.664 8.569 ( -6.358 0.302 -12.943) 14.423 8.767 ( 6.006 1.163 -4.009) 7.314 10.392 ( -3.085 0.942 -0.675) 3.295 11.099 ( -2.115 2.505 13.450) 13.844 11.163 ( -0.152 -3.032 14.821) 15.129 12.282 ( -1.312 -2.983 -14.279) 14.646 13.861 ( -1.513 1.636 6.692) 7.053 15.109 ( -8.548 -0.185 -5.551) 10.194 15.401 ( 0.325 0.804 3.022) 3.144 15.663 ( 2.344 -0.484 -3.683) 4.393 ======================= Grid point 361 (178/306) ======================= q-point: (-0.40 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.580 ( 2.283 -4.832 8.075) 9.683 1.888 ( 6.242 5.441 4.789) 9.566 2.618 ( 1.914 0.653 -8.805) 9.034 2.762 ( -0.919 3.853 5.020) 6.394 2.927 ( -7.550 5.403 14.288) 17.039 3.035 ( 0.067 4.657 -1.173) 4.803 3.203 ( -11.134 -3.321 21.211) 24.185 3.579 ( -3.734 -7.878 3.312) 9.326 4.126 ( 9.396 8.782 7.181) 14.731 4.330 ( -6.372 -2.494 -0.398) 6.854 4.479 ( 2.469 -1.242 6.744) 7.288 5.018 ( -11.262 5.567 10.483) 16.362 5.901 ( 4.434 -2.094 -15.804) 16.547 6.086 ( -4.216 1.127 -9.471) 10.428 6.391 ( 5.120 5.602 -1.868) 7.816 6.669 ( 11.048 -6.915 -4.838) 13.902 6.934 ( -3.603 2.574 0.874) 4.513 7.190 ( 3.338 -7.588 3.211) 8.890 7.821 ( 10.879 5.436 -10.361) 15.976 8.091 ( 8.626 1.776 -6.152) 10.743 8.316 ( -10.171 -2.308 -11.245) 15.337 8.778 ( 4.232 2.869 -5.577) 7.566 10.321 ( -3.129 0.764 -1.992) 3.787 11.163 ( -3.243 5.503 12.111) 13.692 11.334 ( -0.443 -2.463 11.107) 11.386 12.169 ( -4.796 -12.430 -11.464) 17.577 13.904 ( 1.627 5.792 8.664) 10.548 14.850 ( -11.983 2.383 -8.160) 14.692 15.493 ( 5.107 -1.159 2.085) 5.636 15.669 ( 2.717 -0.309 -2.881) 3.972 ======================= Grid point 362 (179/306) ======================= q-point: (-0.30 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( 1.469 -4.296 3.772) 5.903 2.036 ( 11.513 5.350 8.647) 15.361 2.438 ( -5.213 12.445 -4.698) 14.288 2.725 ( 0.772 4.107 -2.954) 5.118 2.853 ( -9.685 -1.763 9.331) 13.563 3.168 ( 0.898 -0.074 12.998) 13.029 3.384 ( 2.406 -3.966 18.742) 19.307 3.601 ( -4.623 -2.232 3.513) 6.221 4.188 ( -7.897 -2.473 -7.307) 11.040 4.265 ( 8.056 10.132 10.319) 16.555 4.640 ( 5.366 -2.527 8.076) 10.020 4.929 ( -8.694 2.431 7.958) 12.035 5.773 ( -1.165 -0.559 -16.835) 16.884 5.949 ( 2.194 -0.551 -10.915) 11.147 6.361 ( 2.033 7.385 -1.309) 7.771 6.830 ( 4.799 -3.869 -8.489) 10.491 6.851 ( 3.723 2.582 -1.147) 4.674 7.361 ( 4.908 -8.009 1.863) 9.576 7.770 ( 2.512 6.528 -5.004) 8.601 8.133 ( -4.833 -4.670 -8.850) 11.112 8.146 ( 7.244 2.079 -2.373) 7.901 8.712 ( 1.934 4.473 -7.832) 9.224 10.258 ( -3.329 -0.154 -0.053) 3.333 11.104 ( -4.421 9.772 2.143) 10.938 11.437 ( -3.855 -4.493 9.042) 10.807 12.179 ( -8.622 -19.870 -2.638) 21.820 13.954 ( 3.461 11.221 9.387) 15.034 14.621 ( -4.192 1.710 -6.547) 7.960 15.572 ( 2.792 -0.751 -0.609) 2.954 15.692 ( 3.997 -0.527 -2.105) 4.548 ======================= Grid point 363 (180/306) ======================= q-point: (-0.20 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( -0.314 -2.656 0.281) 2.689 2.178 ( -2.457 12.674 0.459) 12.919 2.269 ( 6.556 6.367 12.527) 15.506 2.655 ( 3.139 4.972 -4.596) 7.463 2.887 ( -3.449 -7.173 3.903) 8.865 3.265 ( -9.170 -0.035 16.492) 18.870 3.497 ( -8.217 6.433 11.393) 15.450 3.760 ( 12.457 -4.617 6.830) 14.938 4.000 ( -5.814 -3.687 -12.265) 14.065 4.362 ( 4.161 8.734 8.166) 12.660 4.841 ( 0.039 -4.790 11.229) 12.208 4.899 ( 1.388 2.686 6.245) 6.938 5.568 ( -1.916 1.395 -14.917) 15.104 5.918 ( 5.381 -2.686 -10.171) 11.816 6.268 ( -1.621 8.409 -0.610) 8.586 6.733 ( -4.290 -0.018 -2.894) 5.175 6.946 ( 13.525 -0.638 -12.851) 18.668 7.504 ( 6.417 -4.068 -4.598) 8.880 7.700 ( -3.312 0.397 2.675) 4.276 8.055 ( 0.021 -1.792 -6.577) 6.817 8.215 ( 5.298 1.849 1.181) 5.735 8.592 ( 2.282 4.584 -10.661) 11.827 10.235 ( -3.671 -1.349 3.863) 5.497 10.924 ( -4.065 8.519 -4.394) 10.412 11.512 ( -6.703 -5.523 9.783) 13.082 12.216 ( -14.706 -18.875 1.081) 23.952 13.947 ( 2.611 12.866 5.925) 14.403 14.591 ( 6.948 1.670 -1.110) 7.231 15.581 ( 0.974 0.105 -2.055) 2.276 15.749 ( 4.900 -1.089 -1.384) 5.207 ======================= Grid point 364 (181/306) ======================= q-point: (-0.10 -0.60 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -4.461 2.304 2.443) 5.583 2.045 ( 1.206 7.011 -0.873) 7.167 2.360 ( -5.256 4.860 7.764) 10.560 2.668 ( 9.618 4.370 -1.242) 10.637 2.959 ( -2.171 -5.004 4.884) 7.322 3.222 ( -11.776 0.306 4.776) 12.712 3.449 ( -9.264 5.201 17.015) 20.059 3.792 ( -1.041 -1.190 -11.379) 11.488 4.071 ( 12.184 -1.496 0.092) 12.276 4.353 ( -4.820 5.571 5.254) 9.048 4.936 ( 1.042 -1.967 8.697) 8.977 5.060 ( 2.771 1.533 9.018) 9.557 5.429 ( 1.541 -0.980 -7.195) 7.423 5.927 ( 6.362 -1.699 -8.773) 10.969 6.157 ( -2.056 6.326 0.525) 6.673 6.668 ( -2.014 -2.520 -3.450) 4.724 6.980 ( 12.715 0.640 -16.071) 20.502 7.508 ( 3.376 2.758 -6.841) 8.112 7.738 ( -0.978 -6.052 0.745) 6.176 8.013 ( 0.604 2.206 -2.328) 3.263 8.270 ( 2.530 1.579 1.075) 3.170 8.510 ( 8.057 0.535 -10.942) 13.599 10.256 ( -4.545 -1.530 7.924) 9.262 10.757 ( -2.357 5.173 -4.003) 6.953 11.564 ( -7.100 -5.609 8.432) 12.368 12.152 ( -19.112 -13.218 1.275) 23.272 13.927 ( 4.210 9.089 3.620) 10.651 14.693 ( 8.787 4.850 2.904) 10.448 15.581 ( 2.020 -1.045 -2.103) 3.098 15.816 ( 4.773 -0.737 -1.158) 4.966 ======================= Grid point 370 (182/306) ======================= q-point: ( 0.50 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.523 ( 3.387 0.000 7.899) 8.595 1.952 ( 4.891 0.000 4.806) 6.857 2.599 ( 3.155 0.000 -6.502) 7.227 2.773 ( 0.522 0.000 4.870) 4.898 3.029 ( 2.023 0.000 -0.590) 2.107 3.073 ( -16.751 -0.000 20.909) 26.792 3.322 ( -4.246 0.000 10.967) 11.761 3.349 ( -4.163 -0.000 2.798) 5.016 4.217 ( 7.148 -0.000 8.083) 10.791 4.300 ( -5.914 0.000 -3.681) 6.966 4.472 ( 4.470 0.000 8.136) 9.283 5.090 ( -15.320 0.000 12.012) 19.468 5.882 ( 6.196 0.000 -16.566) 17.687 6.099 ( -3.720 0.000 -10.580) 11.215 6.477 ( 1.379 0.000 -0.088) 1.382 6.556 ( 14.812 0.000 -4.291) 15.421 7.030 ( 0.113 -0.000 -1.075) 1.081 7.044 ( -0.700 0.000 8.137) 8.167 7.883 ( 13.631 0.000 -11.610) 17.905 8.112 ( 8.901 0.000 -6.761) 11.178 8.286 ( -12.666 0.000 -12.331) 17.677 8.807 ( 4.168 0.000 -5.237) 6.693 10.331 ( -3.268 0.000 -2.243) 3.964 11.215 ( -3.103 0.000 12.449) 12.830 11.328 ( 0.316 0.000 17.189) 17.191 12.022 ( -6.851 0.000 -18.309) 19.549 13.970 ( 4.022 0.000 8.637) 9.528 14.873 ( -12.969 0.000 -7.233) 14.850 15.482 ( 4.722 0.000 2.136) 5.182 15.663 ( 3.211 0.000 -3.371) 4.656 ======================= Grid point 372 (183/306) ======================= q-point: (-0.40 0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( 2.583 -2.339 3.138) 4.689 2.123 ( 10.859 2.448 8.664) 14.106 2.560 ( -0.285 1.815 -5.713) 6.001 2.725 ( -7.064 -2.292 -0.113) 7.427 2.980 ( -11.013 8.455 9.723) 16.950 3.191 ( 11.911 1.772 0.120) 12.042 3.318 ( -1.772 -0.504 19.195) 19.283 3.488 ( -5.643 -7.984 12.593) 15.943 4.127 ( -9.719 -1.957 -7.498) 12.431 4.433 ( 10.083 4.703 11.917) 16.303 4.612 ( 4.959 -0.123 4.284) 6.554 4.967 ( -15.872 0.490 10.143) 18.843 5.789 ( 6.326 1.401 -17.807) 18.949 5.939 ( -1.425 -0.374 -11.685) 11.778 6.472 ( 0.620 3.109 -0.388) 3.194 6.738 ( 13.778 -3.324 -7.284) 15.935 6.968 ( -0.333 7.180 0.463) 7.202 7.182 ( 0.606 -8.460 6.232) 10.525 7.904 ( 2.510 6.173 -8.358) 10.689 8.028 ( -4.319 -5.428 -9.529) 11.787 8.177 ( 8.030 0.772 -3.445) 8.772 8.773 ( 1.287 1.431 -7.331) 7.579 10.265 ( -3.910 0.409 0.149) 3.934 11.271 ( -5.508 3.036 10.888) 12.574 11.428 ( -2.167 6.219 6.838) 9.494 11.807 ( -8.222 -14.674 -10.409) 19.781 14.141 ( 8.459 5.531 10.617) 14.658 14.628 ( -9.679 -0.445 -6.486) 11.660 15.557 ( 3.870 -0.486 -0.569) 3.942 15.681 ( 3.549 -0.362 -2.837) 4.557 ======================= Grid point 373 (184/306) ======================= q-point: (-0.30 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( 1.000 -3.592 -0.203) 3.734 2.363 ( 9.520 4.847 11.248) 15.513 2.414 ( -4.057 7.156 -2.607) 8.629 2.700 ( -1.096 -5.867 -3.176) 6.760 2.845 ( -4.455 8.642 6.108) 11.482 3.246 ( -8.857 -2.109 10.042) 13.555 3.568 ( -9.454 -0.070 17.635) 20.009 3.662 ( 16.616 -4.137 8.505) 19.119 3.924 ( -6.966 -3.035 -11.424) 13.720 4.539 ( 2.287 8.571 3.738) 9.627 4.786 ( 3.193 -0.893 14.070) 14.455 4.892 ( -4.992 -3.554 5.773) 8.419 5.648 ( 2.393 5.562 -13.992) 15.246 5.852 ( 3.970 -3.447 -12.245) 13.326 6.409 ( -2.220 4.620 -1.994) 5.500 6.773 ( 0.423 2.984 -6.158) 6.856 6.955 ( 10.483 2.302 -6.492) 12.544 7.347 ( 2.456 -9.488 2.669) 10.157 7.719 ( -8.393 0.639 -3.632) 9.167 8.036 ( 6.942 -0.089 -5.931) 9.131 8.252 ( 6.460 1.385 -0.142) 6.608 8.665 ( -0.030 2.398 -10.744) 11.008 10.224 ( -4.832 0.098 5.029) 6.975 11.128 ( -6.675 10.776 -4.036) 13.302 11.416 ( -4.769 -2.965 6.781) 8.804 11.836 ( -9.614 -17.430 1.799) 19.987 14.218 ( 1.612 12.716 5.102) 13.796 14.577 ( 5.759 -3.279 1.496) 6.794 15.583 ( 1.659 0.012 -2.426) 2.939 15.718 ( 4.080 -1.541 -2.239) 4.902 ======================= Grid point 374 (185/306) ======================= q-point: (-0.20 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( -1.391 -3.536 -0.394) 3.820 2.221 ( -3.448 8.886 -2.220) 9.787 2.495 ( -5.096 7.961 13.317) 16.330 2.693 ( 0.677 -2.956 -6.307) 6.998 2.891 ( 6.300 0.266 7.674) 9.932 3.200 ( -14.001 -2.050 9.621) 17.111 3.501 ( -13.198 -1.521 0.733) 13.306 3.804 ( -0.602 2.320 1.518) 2.837 4.019 ( 13.841 -2.822 4.251) 14.751 4.477 ( -3.247 6.311 3.219) 7.793 4.879 ( -1.489 -3.206 7.599) 8.381 5.081 ( 7.280 -0.181 9.601) 12.050 5.472 ( -2.600 4.493 -7.728) 9.310 5.858 ( 8.189 -4.177 -10.976) 14.317 6.294 ( -2.415 5.797 -1.731) 6.515 6.666 ( -1.835 2.526 -4.587) 5.549 7.003 ( 12.037 1.608 -12.589) 17.491 7.486 ( 4.909 -6.756 -4.003) 9.261 7.607 ( -6.487 -3.572 -0.097) 7.406 8.070 ( 5.471 2.986 -2.227) 6.619 8.318 ( 3.412 2.385 1.932) 4.589 8.524 ( 2.466 0.735 -13.724) 13.963 10.234 ( -5.776 -0.589 10.742) 12.210 10.887 ( -4.818 7.288 -6.283) 10.761 11.453 ( -6.079 -4.683 6.803) 10.255 11.868 ( -12.407 -13.747 2.667) 18.709 14.133 ( 0.593 9.993 2.154) 10.239 14.770 ( 11.270 2.471 5.837) 12.931 15.569 ( 1.024 -0.146 -2.849) 3.031 15.780 ( 4.274 -2.540 -1.657) 5.240 ======================= Grid point 375 (186/306) ======================= q-point: (-0.10 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -5.652 -0.936 2.909) 6.425 2.110 ( 0.716 5.059 -0.668) 5.153 2.374 ( -7.367 9.098 -0.180) 11.708 2.653 ( -8.978 -4.808 2.072) 10.393 2.987 ( -10.235 0.194 9.017) 13.641 3.153 ( -5.807 -0.212 6.163) 8.471 3.364 ( 2.817 -4.922 -11.043) 12.414 3.811 ( -4.679 5.655 12.823) 14.775 4.170 ( -0.215 -2.619 0.753) 2.733 4.425 ( 4.945 9.804 0.675) 11.002 4.986 ( -2.739 -2.581 6.965) 7.917 5.150 ( -3.683 1.713 3.234) 5.192 5.420 ( 1.738 -3.473 2.036) 4.384 5.952 ( 13.658 -2.021 -7.031) 15.493 6.198 ( -0.349 6.317 -0.940) 6.396 6.603 ( 0.715 -1.391 -3.962) 4.260 7.007 ( 11.600 2.140 -14.811) 18.934 7.498 ( 1.853 1.530 -6.036) 6.497 7.614 ( -0.527 -8.412 -4.883) 9.741 8.064 ( 1.018 3.878 -1.448) 4.263 8.322 ( 2.438 2.770 -1.478) 3.975 8.512 ( 9.120 -4.089 -7.912) 12.747 10.283 ( -7.111 -0.046 14.608) 16.247 10.733 ( -1.854 3.136 -2.702) 4.535 11.478 ( -5.973 -5.753 4.135) 9.266 11.825 ( -12.762 -8.991 2.070) 15.747 14.091 ( 1.710 7.456 3.184) 8.286 14.919 ( 7.628 6.902 5.863) 11.840 15.574 ( 2.487 -1.790 -2.562) 3.994 15.850 ( 3.993 -2.028 -1.583) 4.750 ======================= Grid point 382 (187/306) ======================= q-point: (-0.40 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 1.371 0.000 -0.659) 1.521 2.412 ( 11.744 0.000 10.804) 15.958 2.529 ( -0.441 -0.000 -2.476) 2.515 2.582 ( -7.586 -0.000 -1.045) 7.658 3.003 ( -5.708 -0.000 8.349) 10.114 3.189 ( -7.027 -0.000 -0.379) 7.037 3.546 ( -12.530 -0.000 21.205) 24.630 3.614 ( 19.287 0.000 9.897) 21.678 3.894 ( -6.245 -0.000 -9.212) 11.129 4.678 ( 4.319 0.000 -1.999) 4.759 4.769 ( 11.621 0.000 15.172) 19.112 4.814 ( -17.947 -0.000 9.890) 20.492 5.743 ( 11.034 0.000 -17.541) 20.723 5.788 ( -4.138 -0.000 -9.477) 10.341 6.456 ( -2.735 -0.000 -2.612) 3.782 6.807 ( 9.244 0.000 -9.997) 13.616 7.027 ( 4.756 0.000 -4.480) 6.534 7.197 ( -0.948 -0.000 7.775) 7.832 7.724 ( -10.721 -0.000 -4.949) 11.808 8.038 ( 10.230 0.000 -5.809) 11.764 8.266 ( 6.899 0.000 -0.742) 6.939 8.690 ( -0.785 -0.000 -10.608) 10.637 10.228 ( -5.478 -0.000 5.518) 7.775 11.273 ( -8.756 -0.000 1.208) 8.839 11.444 ( -6.091 -0.000 -7.877) 9.957 11.560 ( -4.590 -0.000 10.222) 11.205 14.435 ( -6.888 -0.000 -5.124) 8.585 14.462 ( 13.472 0.000 12.648) 18.479 15.582 ( 2.334 0.000 -2.507) 3.425 15.700 ( 3.485 0.000 -2.809) 4.476 ======================= Grid point 383 (188/306) ======================= q-point: (-0.30 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -0.579 -2.283 -2.004) 3.092 2.388 ( -3.958 7.342 -2.425) 8.686 2.541 ( -4.608 -6.192 0.908) 7.772 2.678 ( 1.749 3.730 13.058) 13.692 2.977 ( 1.381 7.454 2.518) 7.988 3.132 ( -8.159 -5.368 7.179) 12.121 3.410 ( -17.423 -4.597 -5.194) 18.753 3.858 ( -1.633 1.946 10.717) 11.014 3.972 ( 14.872 -1.460 5.582) 15.952 4.623 ( -4.386 7.710 4.775) 10.073 4.782 ( -1.193 -6.377 3.232) 7.248 5.077 ( 9.184 0.075 12.571) 15.569 5.564 ( -9.785 3.232 -9.022) 13.696 5.779 ( 12.484 -2.735 -12.238) 17.695 6.371 ( -1.256 1.636 -4.378) 4.839 6.753 ( 0.949 4.087 -9.271) 10.176 7.049 ( 9.052 2.763 -6.910) 11.718 7.298 ( 0.973 -8.163 1.596) 8.375 7.577 ( -5.710 -0.513 -1.692) 5.978 8.119 ( 8.379 1.384 -3.260) 9.096 8.354 ( 5.024 0.905 1.533) 5.330 8.536 ( -1.428 0.296 -14.699) 14.771 10.229 ( -7.210 -0.011 12.367) 14.316 11.034 ( -8.160 5.437 -9.147) 13.409 11.388 ( -4.511 -1.198 5.014) 6.850 11.619 ( -7.400 -8.582 5.704) 12.687 14.298 ( -2.367 4.745 -2.136) 5.717 14.798 ( 14.002 0.500 11.660) 18.228 15.572 ( 0.928 0.283 -3.308) 3.448 15.729 ( 3.492 -1.779 -2.581) 4.693 ======================= Grid point 384 (189/306) ======================= q-point: (-0.20 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( -3.720 -4.172 -0.392) 5.603 2.240 ( -3.870 6.801 -0.506) 7.841 2.536 ( -7.250 -6.233 0.176) 9.563 2.606 ( -8.729 12.847 4.076) 16.058 2.948 ( -13.134 -3.539 10.649) 17.275 3.122 ( -13.427 -3.488 -2.686) 14.131 3.289 ( 11.383 -2.441 -4.327) 12.420 3.914 ( -6.516 4.394 15.046) 16.975 4.115 ( -2.236 -2.581 2.593) 4.288 4.616 ( 7.869 8.642 4.054) 12.371 4.919 ( 3.576 -4.504 6.228) 8.477 5.183 ( -8.924 2.259 -2.475) 9.532 5.348 ( -2.558 -3.828 0.117) 4.605 5.916 ( 15.674 -1.185 -4.841) 16.448 6.320 ( 2.980 4.026 -3.077) 5.879 6.613 ( -1.130 2.665 -7.535) 8.072 7.063 ( 9.958 3.329 -10.917) 15.147 7.407 ( 2.383 -9.748 -3.796) 10.729 7.517 ( -1.688 -0.356 -1.664) 2.397 8.155 ( 3.104 4.440 -3.786) 6.609 8.354 ( 2.071 -0.358 -9.579) 9.806 8.451 ( 4.276 -1.407 -2.168) 4.997 10.280 ( -8.437 -0.163 18.502) 20.336 10.811 ( -4.683 3.889 -5.800) 8.407 11.390 ( -4.601 -2.582 3.326) 6.237 11.636 ( -9.004 -8.406 3.581) 12.828 14.225 ( 0.210 4.917 0.399) 4.938 15.059 ( 11.055 6.044 8.884) 15.416 15.550 ( 1.102 -0.545 -3.105) 3.340 15.788 ( 3.928 -3.552 -1.676) 5.555 ======================= Grid point 385 (190/306) ======================= q-point: (-0.10 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -8.503 -4.334 3.603) 10.201 2.119 ( -8.319 1.862 -1.121) 8.598 2.328 ( -5.242 8.378 -3.729) 10.563 2.506 ( -10.757 -1.697 6.179) 12.521 2.881 ( -16.392 1.843 4.394) 17.071 2.952 ( -6.561 -9.601 -2.054) 11.808 3.438 ( 8.741 1.134 -0.457) 8.826 3.878 ( -12.800 2.144 12.536) 18.044 4.117 ( -6.465 -1.365 6.673) 9.391 4.649 ( 8.447 11.806 -5.846) 15.649 4.897 ( -11.252 -1.419 3.142) 11.768 5.097 ( -8.350 -2.747 7.877) 11.803 5.454 ( 7.851 -5.481 0.375) 9.582 6.117 ( 15.795 -0.056 -2.677) 16.021 6.268 ( 4.211 7.527 -4.749) 9.846 6.568 ( 3.122 -2.686 -3.862) 5.646 7.048 ( 10.666 2.885 -13.110) 17.146 7.466 ( 4.084 -2.873 -10.741) 11.845 7.485 ( -1.170 -3.379 -1.480) 3.870 8.033 ( -1.144 1.757 -9.513) 9.742 8.387 ( 6.119 -0.139 -0.985) 6.199 8.523 ( 5.452 -3.888 -2.238) 7.060 10.355 ( -9.075 1.990 19.728) 21.806 10.721 ( -0.668 -0.009 1.161) 1.339 11.366 ( -5.800 -2.860 0.054) 6.467 11.635 ( -6.350 -8.023 3.191) 10.718 14.196 ( 0.080 4.842 2.390) 5.401 15.166 ( 5.342 9.803 6.302) 12.820 15.563 ( 2.774 -2.282 -2.814) 4.563 15.861 ( 3.452 -2.118 -1.780) 4.424 ======================= Grid point 393 (191/306) ======================= q-point: (-0.30 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -3.486 -0.000 -1.492) 3.792 2.352 ( -9.525 -0.000 0.680) 9.549 2.428 ( -1.307 -0.000 -1.394) 1.911 2.828 ( -7.903 -0.000 17.441) 19.148 2.884 ( -14.383 -0.000 1.932) 14.512 3.017 ( -16.726 -0.000 -13.068) 21.226 3.272 ( 14.042 0.000 2.744) 14.307 3.975 ( -5.810 -0.000 17.261) 18.213 4.077 ( -4.413 -0.000 1.469) 4.651 4.764 ( 3.243 0.000 14.055) 14.424 4.813 ( 10.816 0.000 -2.232) 11.043 5.242 ( -19.456 -0.000 -10.964) 22.332 5.273 ( 4.631 0.000 4.574) 6.509 5.904 ( 16.131 0.000 -3.291) 16.463 6.355 ( 4.085 0.000 -3.595) 5.442 6.661 ( -0.371 -0.000 -12.298) 12.304 7.127 ( 8.044 0.000 -6.053) 10.067 7.263 ( 1.582 0.000 -2.371) 2.850 7.512 ( -1.436 -0.000 -1.261) 1.911 8.215 ( 7.784 0.000 -2.296) 8.116 8.331 ( -2.671 -0.000 -17.991) 18.188 8.444 ( 3.436 0.000 2.729) 4.388 10.278 ( -9.180 -0.000 19.836) 21.857 10.860 ( -6.443 -0.000 -7.368) 9.788 11.369 ( -3.518 -0.000 3.305) 4.827 11.532 ( -7.379 -0.000 4.472) 8.628 14.278 ( -0.417 -0.000 -1.377) 1.438 15.131 ( 13.323 0.000 11.252) 17.439 15.547 ( 0.259 0.000 -3.240) 3.251 15.739 ( 3.530 0.000 -2.297) 4.212 ======================= Grid point 394 (192/306) ======================= q-point: (-0.20 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -8.433 -3.227 1.284) 9.120 2.154 ( -17.959 1.051 0.671) 18.002 2.415 ( -0.030 0.241 -2.315) 2.327 2.597 ( -11.615 9.299 -0.806) 14.900 2.768 ( -10.393 -7.344 -7.112) 14.579 2.886 ( -12.005 -2.010 14.947) 19.276 3.460 ( 8.439 0.802 1.455) 8.601 3.933 ( -13.074 3.374 5.864) 14.720 4.063 ( -9.613 -3.532 12.816) 16.405 4.823 ( -9.011 2.512 -14.139) 16.953 4.916 ( 2.522 5.015 9.086) 10.680 5.031 ( 1.600 -3.463 7.925) 8.796 5.347 ( 3.988 -3.835 -1.377) 5.701 6.117 ( 14.640 0.026 0.035) 14.640 6.396 ( 7.016 3.166 -3.674) 8.529 6.537 ( 2.989 0.007 -11.186) 11.579 7.125 ( 6.891 4.572 -8.787) 12.067 7.303 ( 2.517 -7.674 -5.313) 9.667 7.493 ( 1.517 0.275 -3.197) 3.550 8.085 ( -2.744 2.394 -15.776) 16.191 8.323 ( 7.946 -3.388 -3.214) 9.217 8.507 ( 1.403 0.454 3.178) 3.504 10.383 ( -8.921 0.676 25.462) 26.988 10.728 ( -3.249 0.457 -2.947) 4.410 11.347 ( -3.138 0.719 1.314) 3.477 11.485 ( -7.699 -5.341 2.755) 9.767 14.263 ( 0.367 1.601 0.006) 1.643 15.353 ( 8.250 6.610 5.922) 12.117 15.526 ( 1.062 -1.226 -2.674) 3.127 15.803 ( 5.165 -2.667 -0.136) 5.814 ======================= Grid point 395 (193/306) ======================= q-point: (-0.10 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -14.114 -6.825 5.368) 16.571 1.844 ( -22.533 -2.926 -2.711) 22.883 2.387 ( 2.305 1.861 -4.590) 5.463 2.406 ( -8.942 4.834 5.173) 11.405 2.645 ( -9.807 -4.140 -0.302) 10.650 2.877 ( -9.446 -0.728 11.669) 15.031 3.502 ( -5.876 0.909 4.276) 7.324 3.788 ( -10.559 0.238 4.353) 11.424 4.035 ( -12.708 -4.190 3.693) 13.881 4.580 ( -5.714 0.866 -3.914) 6.980 4.945 ( -16.270 0.073 9.637) 18.910 5.071 ( 7.589 9.463 2.776) 12.444 5.519 ( 10.156 -8.097 -0.293) 12.992 6.297 ( 12.087 1.508 -4.072) 12.844 6.372 ( 9.906 5.965 -8.385) 14.283 6.562 ( 5.865 -3.099 -3.724) 7.607 7.084 ( 8.011 2.255 -11.461) 14.164 7.349 ( 3.270 -6.711 -9.006) 11.698 7.462 ( 1.257 1.401 -4.491) 4.869 7.911 ( -0.438 -0.858 -10.238) 10.283 8.449 ( 7.596 -3.792 -2.350) 8.809 8.541 ( 0.144 -0.198 1.913) 1.929 10.486 ( -6.250 6.328 17.993) 20.071 10.754 ( 0.899 -4.133 10.385) 11.213 11.273 ( -6.048 1.566 -0.243) 6.252 11.514 ( -2.327 -9.935 2.805) 10.583 14.246 ( -0.860 2.678 1.046) 3.001 15.378 ( 2.711 8.746 3.064) 9.656 15.548 ( 2.721 -2.187 -3.124) 4.685 15.883 ( 3.265 1.184 -1.755) 3.891 ======================= Grid point 404 (194/306) ======================= q-point: (-0.20 -0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( -15.605 -0.000 4.386) 16.209 1.809 ( -26.220 -0.000 -3.096) 26.403 2.407 ( -3.086 -0.000 -3.315) 4.529 2.497 ( -6.571 -0.000 -2.409) 6.999 2.562 ( -4.383 -0.000 3.567) 5.651 2.883 ( -12.681 -0.000 16.631) 20.914 3.525 ( -4.112 -0.000 1.599) 4.412 3.803 ( -12.892 -0.000 4.032) 13.508 3.956 ( -14.448 -0.000 3.062) 14.769 4.586 ( -4.705 -0.000 -3.336) 5.767 4.942 ( -19.211 -0.000 10.558) 21.922 5.241 ( 15.594 0.000 3.034) 15.886 5.371 ( 6.473 0.000 -1.947) 6.760 6.303 ( 12.310 0.000 -1.585) 12.411 6.478 ( 9.617 0.000 -15.471) 18.217 6.501 ( 7.735 0.000 -2.211) 8.045 7.144 ( 3.774 0.000 -8.722) 9.504 7.229 ( 2.898 0.000 -6.220) 6.862 7.482 ( 2.617 0.000 -6.110) 6.646 7.905 ( -1.701 -0.000 -11.321) 11.448 8.395 ( 8.041 0.000 -2.582) 8.445 8.549 ( -0.987 -0.000 3.554) 3.688 10.592 ( -3.192 -0.000 30.547) 30.713 10.672 ( -1.801 -0.000 -0.355) 1.836 11.345 ( -9.537 -0.000 1.487) 9.652 11.350 ( -0.484 -0.000 1.476) 1.554 14.272 ( 0.026 0.000 -0.319) 0.320 15.497 ( 0.045 0.000 -1.681) 1.681 15.508 ( 4.370 0.000 -1.273) 4.552 15.896 ( 7.228 0.000 0.915) 7.286 ======================= Grid point 405 (195/306) ======================= q-point: (-0.10 -0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( -20.647 -6.811 8.726) 23.428 1.425 ( -25.454 -5.272 -0.775) 26.006 2.244 ( -8.792 2.016 -5.929) 10.795 2.440 ( -5.469 -1.494 7.807) 9.648 2.640 ( 4.702 1.945 6.830) 8.517 2.848 ( -12.454 -0.105 11.767) 17.134 3.328 ( -28.633 -1.389 10.229) 30.437 3.695 ( -8.879 -1.984 3.333) 9.689 3.825 ( -0.638 -2.166 -8.596) 8.888 4.578 ( -1.145 2.362 5.659) 6.239 4.709 ( -23.963 -1.408 8.064) 25.323 5.339 ( 7.400 10.834 0.393) 13.126 5.562 ( 9.794 -9.167 -0.368) 13.420 6.391 ( 9.892 3.511 -12.928) 16.653 6.495 ( 12.916 0.978 -6.676) 14.572 6.570 ( 4.768 -2.309 -6.246) 8.190 7.087 ( 4.876 2.181 -8.304) 9.873 7.249 ( 3.981 -6.013 -6.964) 10.025 7.441 ( 1.544 0.680 -4.776) 5.065 7.837 ( 2.053 -0.591 -3.747) 4.313 8.481 ( 6.752 -2.525 -4.718) 8.616 8.549 ( -3.222 0.511 2.636) 4.195 10.627 ( -1.320 6.060 4.054) 7.409 10.935 ( 6.012 -1.804 18.340) 19.384 11.226 ( -5.968 3.182 7.794) 10.320 11.439 ( 2.152 -10.174 4.811) 11.458 14.254 ( -1.210 1.409 -0.566) 1.942 15.470 ( 0.669 2.747 -0.280) 2.841 15.524 ( 1.669 -1.209 -4.677) 5.111 15.915 ( -0.557 4.929 -5.971) 7.763 ======================= Grid point 415 (196/306) ======================= q-point: (-0.10 -0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.955 ( -22.949 -0.000 13.010) 26.380 1.097 ( -18.857 -0.000 9.349) 21.047 2.069 ( -7.233 -0.000 -7.370) 10.326 2.469 ( -3.888 -0.000 12.343) 12.940 2.726 ( -13.908 -0.000 3.091) 14.247 2.845 ( 8.919 0.000 8.846) 12.562 3.033 ( -34.612 -0.000 31.444) 46.762 3.602 ( -9.541 -0.000 7.540) 12.161 3.772 ( 7.248 0.000 -13.533) 15.352 4.424 ( -23.499 -0.000 8.155) 24.874 4.675 ( 2.331 0.000 4.603) 5.160 5.427 ( -0.462 -0.000 -2.300) 2.346 5.653 ( 8.787 0.000 -0.771) 8.821 6.378 ( 9.857 0.000 -20.407) 22.662 6.492 ( -0.406 -0.000 -11.306) 11.313 6.620 ( 11.611 0.000 -4.048) 12.297 7.128 ( 6.014 0.000 -2.354) 6.459 7.206 ( 5.271 0.000 -6.785) 8.592 7.452 ( 3.737 0.000 -0.316) 3.750 7.859 ( 3.475 0.000 -0.618) 3.529 8.486 ( 2.450 0.000 -6.502) 6.948 8.509 ( -3.467 -0.000 0.175) 3.472 10.669 ( -0.631 -0.000 1.615) 1.734 10.955 ( -6.545 -0.000 -4.713) 8.065 11.453 ( 1.552 0.000 7.113) 7.280 11.633 ( 25.350 0.000 25.322) 35.830 14.232 ( -1.156 -0.000 -1.847) 2.179 15.439 ( -5.359 -0.000 -10.651) 11.923 15.485 ( 0.698 0.000 -0.338) 0.775 15.766 ( -11.557 -0.000 -8.609) 14.411 ======================= Grid point 416 (197/306) ======================= q-point: ( 0.00 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( 1.517 0.000 12.908) 12.996 1.572 ( 8.780 0.000 5.921) 10.590 1.795 ( -4.897 -0.000 5.584) 7.427 2.557 ( 0.332 0.000 -5.506) 5.516 3.107 ( -3.035 -0.000 22.912) 23.112 3.316 ( 3.627 0.000 -11.618) 12.171 3.319 ( 0.621 0.000 0.247) 0.668 3.715 ( 2.309 0.000 3.566) 4.249 4.076 ( -15.272 -0.000 35.869) 38.985 4.390 ( -6.156 -0.000 9.462) 11.289 4.661 ( -0.474 -0.000 -4.705) 4.729 5.288 ( -4.058 -0.000 1.974) 4.513 5.668 ( 4.234 0.000 -20.409) 20.844 5.677 ( -0.168 -0.000 3.896) 3.900 5.973 ( 3.728 0.000 -13.373) 13.883 6.624 ( 11.752 0.000 -19.456) 22.730 6.998 ( -0.365 -0.000 -1.042) 1.104 7.244 ( 2.399 0.000 -1.513) 2.836 7.693 ( 3.718 0.000 2.398) 4.424 8.027 ( 5.367 0.000 3.838) 6.599 8.140 ( -1.023 -0.000 -7.825) 7.892 8.323 ( -1.855 -0.000 -5.078) 5.406 10.547 ( -5.872 -0.000 -2.544) 6.400 10.622 ( -0.037 -0.000 -2.677) 2.677 11.980 ( -7.063 -0.000 17.326) 18.710 12.805 ( 27.999 0.000 -5.592) 28.552 14.139 ( 5.798 0.000 -2.188) 6.197 14.189 ( -34.221 -0.000 -5.204) 34.615 15.545 ( 2.847 0.000 0.518) 2.894 15.568 ( -0.089 -0.000 -0.567) 0.574 ======================= Grid point 417 (198/306) ======================= q-point: ( 0.10 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 10.597 -6.896 7.946) 14.933 1.782 ( 12.370 -4.375 1.028) 13.161 1.814 ( -3.141 -2.042 7.954) 8.792 2.472 ( -2.268 -0.371 -8.571) 8.874 3.242 ( -1.061 3.224 -2.518) 4.227 3.289 ( -1.496 -2.213 -1.401) 3.016 3.336 ( -0.948 -2.993 18.735) 18.996 3.793 ( 4.735 -0.603 -0.549) 4.805 4.140 ( -15.336 -0.238 14.887) 21.374 4.407 ( -3.703 2.507 9.933) 10.893 4.705 ( 4.363 -2.244 6.759) 8.352 5.250 ( -2.235 3.491 4.760) 6.313 5.516 ( 1.123 1.423 -15.076) 15.184 5.737 ( -0.821 -4.075 2.030) 4.626 5.927 ( 6.767 -0.142 -7.770) 10.304 6.560 ( 12.563 -0.406 -24.900) 27.893 6.978 ( -1.938 2.823 2.028) 3.980 7.256 ( 2.095 -1.789 -3.671) 4.589 7.753 ( 0.706 -0.450 4.007) 4.093 8.057 ( -1.178 -1.657 -6.640) 6.944 8.170 ( 8.176 -0.750 2.407) 8.555 8.242 ( -0.021 0.957 -6.865) 6.931 10.450 ( -4.261 1.908 1.149) 4.808 10.616 ( 0.255 -2.431 -2.261) 3.329 12.000 ( -11.448 1.560 13.995) 18.148 13.026 ( 16.007 4.117 -16.249) 23.178 13.711 ( -26.308 0.460 7.236) 27.289 14.262 ( 8.497 -2.627 2.077) 9.133 15.567 ( 1.499 0.687 -0.784) 1.826 15.613 ( 4.779 -1.816 -0.230) 5.117 ======================= Grid point 418 (199/306) ======================= q-point: ( 0.20 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 5.686 -3.109 2.476) 6.937 1.865 ( -2.408 -2.346 7.787) 8.481 2.122 ( 18.155 -13.765 0.091) 22.784 2.337 ( -3.224 -0.752 -9.622) 10.176 3.151 ( -3.668 2.249 -2.161) 4.815 3.260 ( -2.335 -1.285 -1.019) 2.853 3.582 ( 0.815 -3.476 18.685) 19.023 3.841 ( 4.294 -2.375 -5.103) 7.080 3.977 ( -14.794 3.029 2.172) 15.256 4.438 ( -6.356 -0.908 8.837) 10.923 4.910 ( 5.230 -1.680 13.130) 14.233 5.269 ( -2.167 4.859 8.833) 10.312 5.386 ( 5.475 2.739 -8.595) 10.552 5.747 ( 3.910 -2.325 -9.018) 10.101 6.006 ( 2.877 -3.078 3.133) 5.250 6.495 ( 13.352 -1.248 -24.501) 27.931 6.917 ( -3.985 4.717 2.123) 6.529 7.267 ( 3.214 -3.072 -6.390) 7.785 7.825 ( -0.341 -1.720 6.370) 6.607 7.973 ( -3.435 -1.744 -6.448) 7.511 8.167 ( 2.401 0.301 -8.900) 9.224 8.322 ( 10.211 1.120 1.320) 10.357 10.415 ( -3.894 0.196 5.259) 6.546 10.631 ( 1.285 -1.569 -0.773) 2.171 11.931 ( -11.541 2.761 9.724) 15.342 12.753 ( -13.503 9.708 -15.578) 22.787 13.681 ( 0.120 -5.358 8.605) 10.137 14.469 ( 9.763 -2.748 6.459) 12.024 15.573 ( 2.277 1.303 -1.378) 2.963 15.705 ( 5.696 -1.853 -0.955) 6.065 ======================= Grid point 419 (200/306) ======================= q-point: ( 0.30 0.00 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -2.438 -2.889 4.332) 5.749 1.944 ( 2.284 -1.940 2.592) 3.962 2.218 ( -3.009 -2.562 -7.337) 8.334 2.503 ( 14.052 -14.004 -3.605) 20.164 3.074 ( -2.182 0.424 0.401) 2.259 3.208 ( -4.873 1.113 0.025) 4.999 3.636 ( -5.593 5.667 -8.790) 11.860 3.880 ( -8.418 -3.745 20.278) 22.273 3.922 ( 6.382 -5.608 -0.257) 8.500 4.406 ( -9.445 -1.411 4.857) 10.714 5.130 ( 4.575 -0.996 11.163) 12.105 5.201 ( -3.460 5.135 2.622) 6.724 5.501 ( 8.010 1.956 7.004) 10.819 5.742 ( 7.982 -1.305 -9.841) 12.738 6.084 ( 0.959 -1.965 0.125) 2.190 6.460 ( 11.776 -1.900 -19.355) 22.735 6.825 ( -3.451 3.988 -0.034) 5.274 7.274 ( 3.263 -3.739 -8.197) 9.582 7.801 ( -5.323 3.349 -2.586) 6.800 7.943 ( 1.365 -2.740 -2.685) 4.072 8.140 ( 3.391 -3.359 -4.594) 6.625 8.460 ( 10.372 3.282 0.939) 10.920 10.436 ( -4.457 -2.091 7.786) 9.212 10.674 ( 2.321 -0.364 2.580) 3.490 11.828 ( -8.549 4.979 5.569) 11.353 12.285 ( -17.262 8.070 -10.603) 21.806 13.857 ( 3.675 -6.530 6.002) 9.600 14.713 ( 8.222 -3.153 8.996) 12.588 15.574 ( 2.816 1.994 -2.078) 4.028 15.782 ( 4.946 -0.849 -1.957) 5.386 ======================= Grid point 420 (201/306) ======================= q-point: (-0.60 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.813 ( -6.546 -3.777 5.625) 9.421 2.022 ( 5.774 0.408 -0.532) 5.813 2.143 ( -4.790 -4.728 -3.776) 7.717 2.653 ( 0.076 -5.844 -6.640) 8.846 3.091 ( -6.650 2.290 -1.477) 7.187 3.127 ( 2.426 -3.101 0.632) 3.988 3.393 ( -5.286 7.740 -1.919) 9.567 4.022 ( 4.500 -8.234 1.059) 9.443 4.127 ( -2.493 -5.904 17.891) 19.004 4.316 ( -10.395 -1.321 3.285) 10.981 5.132 ( -4.926 3.069 3.850) 6.964 5.294 ( 2.285 0.906 8.775) 9.113 5.562 ( -0.709 4.362 1.292) 4.605 5.871 ( 15.014 -1.510 -1.435) 15.158 6.071 ( 1.052 0.039 -6.037) 6.128 6.481 ( 10.776 -1.898 -11.190) 15.651 6.752 ( 0.249 1.060 -4.189) 4.328 7.263 ( 2.370 -3.580 -9.065) 10.030 7.650 ( -4.681 4.644 -3.073) 7.275 7.903 ( 2.451 -0.335 -11.566) 11.828 8.247 ( 3.310 -5.583 4.072) 7.662 8.562 ( 8.932 5.338 0.359) 10.412 10.479 ( -5.032 -3.418 7.433) 9.605 10.766 ( 2.645 -0.155 7.957) 8.386 11.661 ( -9.517 8.371 -2.065) 12.842 11.946 ( -8.930 4.238 -3.203) 10.390 14.028 ( 2.208 -6.657 5.037) 8.635 14.944 ( 5.152 -4.126 9.490) 11.559 15.568 ( 3.186 2.559 -2.790) 4.948 15.817 ( 3.087 0.012 -3.288) 4.510 ======================= Grid point 421 (202/306) ======================= q-point: (-0.50 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.807 ( -8.247 -2.891 6.795) 11.070 1.997 ( -5.896 0.832 -3.702) 7.011 2.180 ( 6.716 -3.009 0.715) 7.394 2.563 ( -8.394 -0.171 -2.854) 8.867 2.902 ( -4.550 6.999 -6.862) 10.806 3.126 ( -8.021 -0.679 6.320) 10.234 3.378 ( 5.878 0.575 -0.832) 5.964 4.128 ( -4.779 0.892 3.661) 6.086 4.229 ( -11.937 -9.917 8.623) 17.753 4.349 ( 2.427 -6.389 8.994) 11.296 5.045 ( -7.881 3.876 4.568) 9.900 5.306 ( -14.358 -0.390 9.455) 17.196 5.546 ( 11.489 7.783 -4.389) 14.554 6.015 ( 7.381 -0.477 -9.374) 11.941 6.105 ( 9.631 -2.382 1.779) 10.080 6.545 ( 8.427 0.889 -6.084) 10.432 6.731 ( 5.736 -2.410 -8.943) 10.894 7.229 ( 1.931 -2.444 -8.770) 9.307 7.524 ( -2.402 4.103 -2.213) 5.244 7.816 ( 3.035 0.453 -11.489) 11.892 8.392 ( 2.710 -4.633 4.228) 6.833 8.605 ( 5.980 6.568 -0.969) 8.935 10.514 ( -4.864 -3.456 6.157) 8.574 10.916 ( 2.313 -0.886 12.480) 12.724 11.396 ( -9.412 5.055 -5.252) 11.904 11.830 ( -0.524 6.411 0.716) 6.472 14.153 ( 0.091 -5.296 3.654) 6.434 15.143 ( 2.597 -5.676 8.359) 10.432 15.553 ( 3.156 2.876 -3.621) 5.598 15.802 ( 0.403 -0.407 -4.475) 4.511 ======================= Grid point 422 (203/306) ======================= q-point: (-0.40 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -11.190 4.244 8.798) 14.854 1.829 ( -10.041 -0.087 -1.722) 10.188 2.300 ( 3.388 6.077 -2.701) 7.464 2.418 ( -4.515 -3.766 2.583) 6.422 2.743 ( -0.371 5.627 -2.303) 6.092 3.105 ( -8.858 -0.504 10.955) 14.097 3.417 ( 4.400 0.231 -5.658) 7.171 4.005 ( -9.278 3.494 1.218) 9.989 4.194 ( -22.398 -3.409 13.207) 26.224 4.524 ( 0.517 -5.278 7.089) 8.853 5.002 ( -0.012 -1.274 4.074) 4.269 5.149 ( -20.615 -0.392 9.255) 22.600 5.585 ( 12.301 5.947 -7.913) 15.789 6.057 ( 9.850 -0.897 -8.907) 13.310 6.262 ( 7.721 -1.877 -0.723) 7.979 6.552 ( 4.423 3.225 -6.342) 8.378 6.778 ( 10.031 -3.701 -10.168) 14.755 7.198 ( 3.169 -0.669 -6.974) 7.690 7.453 ( -0.168 2.981 -1.048) 3.165 7.760 ( 3.901 0.223 -7.456) 8.418 8.489 ( 2.134 -0.791 0.990) 2.482 8.584 ( 1.724 4.335 -1.471) 4.892 10.545 ( -3.930 -3.753 4.814) 7.260 11.077 ( -0.017 1.022 9.627) 9.681 11.237 ( -3.153 -1.690 0.869) 3.682 11.785 ( 3.740 9.182 2.054) 10.125 14.210 ( -1.763 -3.000 1.236) 3.692 15.310 ( 1.657 -6.172 5.860) 8.671 15.514 ( 1.454 2.531 -5.774) 6.469 15.752 ( -2.684 -2.430 -4.168) 5.520 ======================= Grid point 423 (204/306) ======================= q-point: (-0.30 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( -14.746 6.799 5.331) 17.091 1.703 ( -10.261 10.721 9.624) 17.687 2.119 ( -10.156 2.607 -1.640) 10.613 2.529 ( 9.633 1.442 -3.562) 10.371 2.761 ( 3.224 -0.604 7.914) 8.567 3.077 ( -11.027 2.314 11.054) 15.784 3.401 ( 4.356 -0.561 -7.795) 8.948 3.846 ( -7.692 3.064 -0.807) 8.319 3.995 ( -27.764 3.332 22.589) 35.947 4.617 ( -5.160 -5.163 6.857) 10.015 4.909 ( -20.188 1.902 7.518) 21.627 5.148 ( 4.884 -7.169 1.073) 8.741 5.619 ( 11.867 4.238 -8.415) 15.152 6.075 ( 5.337 0.260 -10.498) 11.779 6.348 ( 5.308 -1.714 -7.341) 9.219 6.484 ( 5.477 3.856 -9.100) 11.299 6.883 ( 9.919 -3.546 -4.624) 11.504 7.182 ( 4.877 1.764 -6.731) 8.497 7.438 ( 0.852 1.503 2.047) 2.678 7.774 ( 5.036 -0.883 -2.928) 5.892 8.467 ( 2.519 5.408 -5.314) 7.989 8.559 ( -3.105 -1.293 0.173) 3.368 10.577 ( -3.086 -4.669 2.224) 6.022 11.035 ( -3.947 2.275 -2.084) 5.010 11.391 ( 3.653 -4.606 12.501) 13.814 11.821 ( 10.086 8.975 6.167) 14.843 14.198 ( -2.488 -1.413 -1.579) 3.268 15.398 ( -4.881 -0.002 -10.062) 11.184 15.430 ( 1.541 -3.572 2.481) 4.614 15.701 ( -4.354 -3.513 -1.870) 5.899 ======================= Grid point 424 (205/306) ======================= q-point: (-0.20 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( -10.657 6.879 9.028) 15.569 1.494 ( -13.903 17.632 15.202) 27.116 1.963 ( -7.478 0.390 -2.253) 7.820 2.580 ( 8.373 3.458 -4.979) 10.337 2.906 ( -8.202 -0.779 14.600) 16.764 3.041 ( 2.658 1.901 9.079) 9.649 3.408 ( 7.417 -1.160 -10.096) 12.581 3.730 ( -5.319 1.747 1.657) 5.839 3.864 ( -26.193 1.869 32.823) 42.034 4.579 ( -16.483 -1.750 6.826) 17.926 4.753 ( -7.143 -0.048 5.230) 8.853 5.273 ( 3.445 -5.710 -2.771) 7.222 5.654 ( 8.635 3.214 -6.106) 11.053 5.989 ( 3.601 1.674 -15.763) 16.255 6.235 ( -1.917 0.147 -13.869) 14.002 6.529 ( 11.909 0.614 -6.778) 13.717 7.004 ( 5.085 -3.149 -2.043) 6.320 7.167 ( 7.071 2.982 -6.175) 9.850 7.489 ( 2.335 0.028 4.593) 5.153 7.846 ( 4.895 -1.211 0.033) 5.042 8.375 ( 1.448 4.174 -7.820) 8.982 8.499 ( -5.018 -0.186 -1.751) 5.318 10.596 ( -2.872 -5.552 -0.579) 6.278 10.904 ( -4.714 4.172 -4.669) 7.838 11.627 ( 3.113 -3.668 14.505) 15.282 12.043 ( 20.119 4.515 7.822) 22.053 14.150 ( -1.570 -1.115 -3.797) 4.257 15.147 ( -15.508 -2.805 -13.588) 20.809 15.486 ( 1.184 -0.651 1.055) 1.714 15.650 ( -4.388 -0.989 -0.635) 4.543 ======================= Grid point 425 (206/306) ======================= q-point: (-0.10 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.222 ( -11.357 11.892 13.878) 21.517 1.425 ( -0.229 4.386 12.576) 13.321 1.846 ( -5.975 1.268 0.750) 6.153 2.589 ( 4.314 1.959 -5.414) 7.194 2.950 ( -7.335 1.265 21.483) 22.736 3.222 ( 6.864 -1.396 5.398) 8.843 3.389 ( 6.755 0.391 -14.131) 15.668 3.686 ( -2.782 0.619 3.213) 4.295 3.911 ( -20.044 -0.384 40.191) 44.914 4.434 ( -13.238 0.668 8.688) 15.849 4.724 ( -3.223 -1.135 -0.944) 3.546 5.308 ( -0.816 -2.893 -1.750) 3.478 5.666 ( 3.529 2.618 -2.258) 4.940 5.831 ( 4.093 1.612 -20.498) 20.965 6.080 ( 0.023 -0.803 -13.202) 13.227 6.611 ( 12.024 0.007 -10.964) 16.272 7.023 ( 0.384 -1.445 -4.337) 4.587 7.208 ( 6.100 1.355 -1.869) 6.522 7.591 ( 4.690 -0.647 3.972) 6.180 7.929 ( 3.919 -0.557 2.237) 4.547 8.258 ( -0.561 2.898 -8.610) 9.102 8.405 ( -3.764 -0.060 -3.455) 5.109 10.598 ( -3.349 -6.229 -2.300) 7.437 10.733 ( -4.053 6.077 -4.630) 8.648 11.843 ( -1.007 -1.968 17.375) 17.515 12.420 ( 27.348 0.797 2.140) 27.443 14.114 ( 1.184 -1.523 -4.373) 4.779 14.727 ( -27.057 -1.380 -11.983) 29.624 15.512 ( 1.438 0.519 0.764) 1.709 15.594 ( -2.520 0.575 -0.369) 2.611 ======================= Grid point 427 (207/306) ======================= q-point: ( 0.10 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 12.923 0.000 4.611) 13.721 1.838 ( -2.779 -0.000 9.549) 9.946 1.924 ( 14.052 0.000 -4.410) 14.728 2.330 ( -3.967 -0.000 -8.926) 9.768 3.173 ( -3.946 -0.000 -5.092) 6.443 3.251 ( 0.029 0.000 -0.068) 0.074 3.546 ( -0.248 -0.000 22.805) 22.806 3.813 ( 3.951 0.000 -6.794) 7.859 4.011 ( -13.410 -0.000 1.847) 13.537 4.429 ( -6.929 -0.000 7.227) 10.012 4.892 ( 5.010 0.000 14.959) 15.775 5.328 ( -1.028 -0.000 8.613) 8.674 5.422 ( 3.781 0.000 -8.779) 9.558 5.702 ( 2.742 0.000 -6.382) 6.946 5.983 ( 4.141 0.000 2.417) 4.795 6.480 ( 14.528 0.000 -26.688) 30.386 6.978 ( -3.530 -0.000 1.462) 3.821 7.227 ( 1.889 0.000 -4.912) 5.263 7.801 ( -0.284 -0.000 6.398) 6.404 7.950 ( -2.100 -0.000 -7.064) 7.370 8.175 ( 1.753 0.000 -9.435) 9.596 8.336 ( 10.929 0.000 2.230) 11.154 10.418 ( -4.175 -0.000 3.270) 5.303 10.615 ( 1.651 0.000 0.963) 1.912 11.959 ( -11.415 -0.000 9.547) 14.881 12.859 ( -14.118 -0.000 -18.173) 23.013 13.624 ( -0.050 -0.000 9.062) 9.062 14.438 ( 8.907 0.000 8.466) 12.288 15.593 ( 2.969 0.000 -1.608) 3.377 15.677 ( 6.017 0.000 -0.576) 6.044 ======================= Grid point 428 (208/306) ======================= q-point: ( 0.20 0.10 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( -5.414 1.157 7.004) 8.928 1.941 ( 8.978 4.233 0.217) 9.928 2.161 ( 8.665 -9.843 -7.609) 15.161 2.216 ( 2.895 -5.353 -2.912) 6.746 3.075 ( -2.734 -0.086 -3.267) 4.261 3.248 ( -0.726 1.643 1.027) 2.069 3.726 ( 1.936 3.286 -3.753) 5.351 3.810 ( 4.209 -4.741 -2.634) 6.865 3.845 ( -15.901 -0.120 17.296) 23.494 4.383 ( -9.234 -0.674 5.833) 10.943 5.111 ( 3.005 -0.544 14.100) 14.427 5.292 ( -7.208 2.828 5.128) 9.287 5.540 ( 12.565 1.349 2.512) 12.884 5.694 ( 6.814 -2.257 -9.706) 12.072 6.072 ( 2.825 0.221 4.510) 5.326 6.423 ( 14.216 -1.220 -24.816) 28.625 6.905 ( -4.966 2.729 -0.234) 5.671 7.208 ( 1.979 -2.086 -6.542) 7.146 7.840 ( -3.608 0.842 -3.954) 5.419 7.894 ( 1.312 -1.837 5.341) 5.799 8.097 ( 3.007 -0.727 -11.679) 12.082 8.514 ( 12.335 1.538 1.052) 12.475 10.408 ( -4.408 -0.633 6.110) 7.561 10.669 ( 2.287 -0.113 3.744) 4.389 11.899 ( -6.474 1.767 5.924) 8.952 12.407 ( -20.834 3.236 -13.358) 24.959 13.760 ( 4.325 -2.518 5.805) 7.665 14.666 ( 6.749 -1.281 11.514) 13.408 15.612 ( 3.349 1.265 -2.271) 4.240 15.760 ( 5.741 -0.879 -1.421) 5.979 ======================= Grid point 429 (209/306) ======================= q-point: ( 0.30 0.10 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.753 ( -8.648 -1.868 5.336) 10.332 2.020 ( 7.699 1.824 -0.648) 7.939 2.110 ( -2.821 0.181 -2.156) 3.555 2.453 ( 8.783 -12.691 -7.490) 17.155 3.048 ( -0.178 -1.804 0.009) 1.812 3.206 ( -0.777 5.533 0.317) 5.596 3.541 ( -4.618 6.064 -7.120) 10.430 3.846 ( 2.798 -7.998 -3.188) 9.054 4.012 ( -7.532 -4.530 23.551) 25.138 4.303 ( -10.563 -0.350 4.849) 11.628 5.196 ( -6.076 2.942 6.287) 9.225 5.286 ( -3.460 -1.315 10.772) 11.390 5.648 ( 6.575 3.934 -2.099) 7.944 5.825 ( 14.228 -2.889 -0.447) 14.526 6.124 ( 5.191 4.213 -3.280) 7.447 6.414 ( 12.174 -4.065 -16.519) 20.919 6.798 ( -2.971 2.596 -3.108) 5.022 7.187 ( 1.336 -3.163 -7.133) 7.917 7.723 ( -4.509 2.223 -3.342) 6.037 7.922 ( 4.319 2.256 -9.971) 11.098 8.114 ( 2.593 -6.589 1.613) 7.262 8.665 ( 11.649 3.953 -0.216) 12.303 10.429 ( -4.702 -1.477 7.943) 9.348 10.759 ( 2.385 -0.444 6.570) 7.004 11.828 ( -6.848 7.273 -1.331) 10.078 11.999 ( -11.955 0.756 -6.086) 13.437 13.903 ( 2.093 -4.764 5.305) 7.432 14.881 ( 3.590 -2.130 11.719) 12.440 15.616 ( 3.233 1.815 -2.911) 4.714 15.814 ( 3.515 -0.186 -2.620) 4.388 ======================= Grid point 430 (210/306) ======================= q-point: (-0.60 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( -9.441 -5.085 4.733) 11.722 2.033 ( -5.238 2.422 0.077) 5.771 2.132 ( 8.780 -0.956 0.887) 8.876 2.536 ( 1.381 -4.109 -5.634) 7.109 3.023 ( -2.116 2.698 -5.733) 6.680 3.152 ( -1.146 5.572 4.729) 7.397 3.416 ( 1.769 2.634 -2.089) 3.799 3.966 ( -3.114 -10.701 5.386) 12.379 4.170 ( -4.632 -2.544 4.326) 6.829 4.210 ( -11.024 -4.737 15.244) 19.399 5.125 ( -6.937 3.679 5.096) 9.361 5.282 ( -14.121 -1.661 8.943) 16.797 5.699 ( 10.345 6.596 -1.473) 12.357 6.051 ( 10.857 -2.531 2.230) 11.369 6.071 ( 7.109 5.215 -10.567) 13.762 6.510 ( 12.028 -4.090 -9.069) 15.609 6.719 ( 1.966 0.798 -6.623) 6.955 7.164 ( 0.933 -3.298 -6.530) 7.375 7.606 ( -3.159 3.397 -2.400) 5.223 7.838 ( 5.582 1.762 -13.751) 14.945 8.262 ( 2.648 -6.976 4.020) 8.476 8.746 ( 8.355 6.117 -2.219) 10.590 10.463 ( -4.662 -1.454 8.150) 9.502 10.887 ( 2.556 -1.676 9.336) 9.824 11.511 ( -13.812 5.391 -6.997) 16.394 11.945 ( 4.338 4.594 -0.026) 6.318 14.026 ( -0.692 -6.256 5.175) 8.148 15.055 ( 1.145 -3.096 10.232) 10.751 15.605 ( 2.725 2.004 -3.691) 5.007 15.803 ( 0.003 0.516 -3.967) 4.001 ======================= Grid point 431 (211/306) ======================= q-point: (-0.50 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( -7.896 -6.749 5.470) 11.739 1.900 ( -8.951 5.293 1.620) 10.524 2.306 ( 10.021 -3.189 1.559) 10.631 2.489 ( -2.827 5.451 0.532) 6.164 2.871 ( 0.324 5.968 -8.074) 10.045 3.141 ( -3.958 5.279 11.126) 12.935 3.432 ( 3.666 1.055 -2.831) 4.750 4.013 ( -14.527 -6.211 4.918) 16.547 4.080 ( -10.429 -2.821 8.138) 13.526 4.376 ( -2.077 -8.957 9.647) 13.327 5.040 ( -5.960 3.726 5.484) 8.915 5.143 ( -17.913 0.101 8.666) 19.899 5.717 ( 7.723 7.279 -6.055) 12.219 6.071 ( 10.878 1.851 -7.752) 13.485 6.216 ( 6.567 -2.431 0.371) 7.012 6.589 ( 6.376 -0.169 -7.337) 9.722 6.719 ( 10.331 -1.839 -10.410) 14.781 7.156 ( 1.784 -2.880 -4.629) 5.736 7.523 ( -0.267 3.413 -1.849) 3.891 7.775 ( 5.963 1.246 -10.809) 12.407 8.398 ( 2.445 -5.591 2.204) 6.488 8.728 ( 3.678 7.038 -4.421) 9.089 10.491 ( -4.407 -1.306 6.753) 8.169 11.058 ( 2.834 -2.566 11.109) 11.748 11.248 ( -9.058 2.245 -3.357) 9.918 11.963 ( 8.118 7.721 -1.577) 11.313 14.111 ( -3.476 -6.078 4.154) 8.142 15.200 ( 0.858 -4.331 8.098) 9.223 15.561 ( 0.234 2.041 -6.480) 6.798 15.732 ( -2.978 0.306 -3.339) 4.484 ======================= Grid point 432 (212/306) ======================= q-point: (-0.40 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -8.386 3.637 0.815) 9.177 1.747 ( -7.604 -1.015 10.032) 12.628 2.319 ( -7.508 11.979 2.858) 14.424 2.522 ( 11.920 -0.804 -0.336) 11.952 2.797 ( 3.524 2.666 -1.383) 4.630 3.154 ( -5.160 6.298 13.857) 16.072 3.411 ( 1.385 1.743 -4.240) 4.789 3.877 ( -9.498 -0.555 -0.762) 9.545 4.014 ( -22.767 -2.251 17.490) 28.797 4.495 ( -4.308 -6.916 5.912) 10.067 4.960 ( -19.027 1.987 9.739) 21.467 5.037 ( 0.131 -1.317 4.210) 4.413 5.699 ( 10.352 3.696 -9.951) 14.828 6.103 ( 5.123 2.430 -6.334) 8.502 6.303 ( 5.010 -2.634 -5.163) 7.661 6.555 ( 4.481 2.400 -9.643) 10.901 6.819 ( 12.747 -2.662 -7.665) 15.110 7.175 ( 3.071 -2.038 -4.021) 5.455 7.489 ( 1.502 3.027 -0.008) 3.379 7.766 ( 6.219 0.201 -6.035) 8.668 8.481 ( 1.618 -2.646 -0.690) 3.178 8.628 ( -0.049 6.202 -5.643) 8.385 10.501 ( -4.477 -2.226 3.867) 6.321 11.089 ( -4.484 2.922 0.172) 5.355 11.287 ( 3.356 -5.255 11.432) 13.022 12.001 ( 11.605 7.841 -1.126) 14.051 14.133 ( -5.744 -4.716 2.168) 7.741 15.337 ( 0.914 -4.788 4.678) 6.756 15.405 ( -6.376 1.167 -10.428) 12.278 15.673 ( -2.171 0.207 -0.409) 2.218 ======================= Grid point 433 (213/306) ======================= q-point: (-0.30 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -7.636 8.316 6.888) 13.226 1.782 ( -4.393 2.868 9.259) 10.642 2.079 ( -8.704 15.294 2.806) 17.820 2.635 ( 10.437 0.717 -9.183) 13.920 2.894 ( 1.982 -0.287 11.540) 11.712 3.123 ( -6.368 6.220 11.188) 14.297 3.402 ( 6.063 1.515 -4.030) 7.436 3.764 ( -5.126 1.112 0.146) 5.247 3.887 ( -26.012 -0.398 26.066) 36.827 4.527 ( -7.028 -3.262 5.648) 9.589 4.775 ( -14.957 2.438 7.876) 17.079 5.131 ( 1.518 -6.723 0.905) 6.951 5.721 ( 10.942 2.504 -9.786) 14.891 6.037 ( 1.476 3.355 -8.778) 9.512 6.243 ( -1.591 0.301 -13.416) 13.513 6.545 ( 10.139 0.727 -8.181) 13.048 6.947 ( 7.718 -2.428 -3.125) 8.673 7.191 ( 5.441 -0.757 -6.656) 8.630 7.508 ( 1.732 1.892 4.160) 4.888 7.820 ( 6.279 -1.017 -2.069) 6.689 8.471 ( 1.352 3.370 -5.688) 6.748 8.504 ( -2.970 1.897 -4.277) 5.542 10.492 ( -4.674 -3.871 1.162) 6.179 10.993 ( -2.994 4.493 -2.124) 5.802 11.526 ( 3.073 -5.833 13.682) 15.188 12.144 ( 17.820 4.322 1.240) 18.379 14.099 ( -6.499 -3.811 0.284) 7.539 15.104 ( -15.482 -0.382 -12.857) 20.128 15.457 ( 2.863 -2.328 2.420) 4.412 15.644 ( -1.884 0.401 0.426) 1.973 ======================= Grid point 434 (214/306) ======================= q-point: (-0.20 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( -0.252 9.024 10.010) 13.479 1.686 ( -7.292 19.346 11.523) 23.669 1.888 ( -4.592 3.591 -0.308) 5.837 2.638 ( 5.576 1.590 -9.396) 11.042 3.003 ( -5.642 3.558 20.024) 21.105 3.185 ( 4.465 -1.627 5.044) 6.929 3.414 ( 6.566 2.950 -8.234) 10.937 3.709 ( -2.342 1.394 2.065) 3.419 3.890 ( -19.552 -1.769 35.990) 40.996 4.467 ( -11.591 2.653 8.883) 14.842 4.684 ( -4.798 -2.352 1.322) 5.505 5.204 ( -1.444 -6.476 -0.673) 6.669 5.738 ( 8.933 2.662 -9.842) 13.555 5.898 ( -0.577 5.256 -10.565) 11.814 6.061 ( -0.604 -0.474 -14.529) 14.549 6.608 ( 11.144 -0.374 -10.509) 15.322 6.986 ( -0.743 -1.686 -2.404) 3.029 7.230 ( 8.502 0.068 -6.367) 10.621 7.582 ( 2.407 0.300 6.229) 6.685 7.911 ( 5.463 -1.063 0.904) 5.639 8.358 ( 1.510 5.965 -8.427) 10.434 8.404 ( -4.500 0.002 -4.185) 6.145 10.478 ( -4.507 -4.997 0.007) 6.729 10.858 ( -2.672 6.127 -4.882) 8.277 11.764 ( -0.508 -5.414 16.390) 17.268 12.436 ( 24.104 -0.092 -0.307) 24.106 14.048 ( -6.372 -4.477 0.032) 7.787 14.710 ( -20.389 0.835 -12.014) 23.680 15.524 ( 2.840 0.144 0.793) 2.952 15.612 ( -1.789 1.082 0.024) 2.091 ======================= Grid point 435 (215/306) ======================= q-point: (-0.10 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.446 ( 0.693 18.615 10.262) 21.268 1.635 ( 7.386 5.935 6.952) 11.752 1.823 ( -4.023 2.201 4.362) 6.329 2.576 ( 0.938 1.368 -7.986) 8.157 3.133 ( -2.825 1.326 20.519) 20.755 3.270 ( 1.531 -0.705 -0.863) 1.894 3.370 ( 2.200 2.656 -5.824) 6.768 3.725 ( 2.443 0.870 3.176) 4.100 4.069 ( -12.813 -0.896 35.304) 37.568 4.377 ( -9.304 -0.487 7.040) 11.677 4.671 ( 0.924 0.615 -1.223) 1.652 5.221 ( -4.196 -5.403 1.392) 6.981 5.667 ( 3.921 -0.134 -20.814) 21.181 5.767 ( -0.843 7.066 3.910) 8.120 5.956 ( 4.588 -1.085 -13.601) 14.395 6.625 ( 11.279 0.002 -18.270) 21.471 6.963 ( -2.256 -2.659 -0.112) 3.489 7.267 ( 4.896 1.475 -4.184) 6.607 7.684 ( 2.826 -0.424 4.730) 5.526 8.015 ( 5.029 -0.794 3.028) 5.924 8.217 ( 0.437 6.387 -8.289) 10.473 8.308 ( -2.454 -1.345 -5.382) 6.066 10.467 ( -4.203 -4.648 0.212) 6.270 10.709 ( -1.690 5.637 -4.863) 7.634 11.941 ( -6.543 -3.713 17.039) 18.626 12.782 ( 25.531 -2.837 -6.460) 26.488 13.990 ( -16.758 -7.573 2.932) 18.622 14.312 ( -9.900 6.247 -8.182) 14.282 15.557 ( 1.385 0.892 0.413) 1.698 15.585 ( 1.430 1.491 -0.630) 2.160 ======================= Grid point 438 (216/306) ======================= q-point: ( 0.20 0.20 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -11.680 -0.000 6.527) 13.380 2.090 ( 1.437 0.000 -3.640) 3.914 2.150 ( 11.629 0.000 -5.015) 12.664 2.220 ( 7.346 0.000 -1.874) 7.581 3.032 ( 0.292 0.000 -1.050) 1.090 3.277 ( 2.349 0.000 0.068) 2.350 3.624 ( -7.531 -0.000 -6.183) 9.744 3.734 ( 4.794 0.000 -8.304) 9.588 3.962 ( -11.096 -0.000 27.348) 29.513 4.299 ( -10.211 -0.000 5.134) 11.429 5.247 ( -4.031 -0.000 12.262) 12.908 5.251 ( -8.054 -0.000 6.078) 10.090 5.706 ( 10.942 0.000 -8.659) 13.953 5.777 ( 12.574 0.000 4.912) 13.499 6.188 ( 6.116 0.000 4.590) 7.647 6.354 ( 13.008 0.000 -24.404) 27.655 6.830 ( -4.296 -0.000 -3.323) 5.431 7.151 ( 0.980 0.000 -6.117) 6.195 7.745 ( -3.513 -0.000 -4.155) 5.441 7.995 ( 3.997 0.000 -15.171) 15.688 7.995 ( 2.685 0.000 7.219) 7.702 8.708 ( 12.464 0.000 -0.462) 12.473 10.414 ( -4.579 -0.000 8.230) 9.418 10.753 ( 2.060 0.000 6.113) 6.451 11.925 ( 1.952 0.000 3.236) 3.779 11.989 ( -20.657 -0.000 -11.498) 23.641 13.850 ( 2.080 0.000 5.060) 5.470 14.858 ( 2.980 0.000 12.684) 13.029 15.636 ( 2.956 0.000 -3.142) 4.314 15.812 ( 3.998 0.000 -1.974) 4.459 ======================= Grid point 439 (217/306) ======================= q-point: ( 0.30 0.20 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -12.380 -2.209 5.830) 13.861 2.085 ( -1.831 1.128 2.180) 3.063 2.175 ( 9.180 6.516 -3.247) 11.716 2.377 ( 7.089 -9.954 -6.010) 13.618 3.048 ( 1.687 0.739 -0.489) 1.906 3.303 ( 6.704 5.726 -1.734) 8.986 3.464 ( -6.889 1.768 0.042) 7.112 3.781 ( 2.584 -6.167 -0.595) 6.713 4.059 ( -13.322 -3.867 22.138) 26.125 4.192 ( -11.255 -0.080 3.652) 11.832 5.191 ( -6.730 2.460 5.626) 9.110 5.246 ( -12.416 -1.634 8.835) 15.326 5.804 ( 12.975 3.115 -3.119) 13.703 5.996 ( 7.081 -2.067 6.224) 9.651 6.218 ( 9.795 7.861 -14.440) 19.138 6.393 ( 11.090 -6.768 -6.665) 14.602 6.739 ( 0.252 0.683 -6.795) 6.834 7.111 ( 0.519 -1.509 -4.989) 5.238 7.654 ( -3.473 1.152 -2.365) 4.357 7.883 ( 5.952 1.967 -15.760) 16.961 8.137 ( 4.472 -4.074 4.467) 7.520 8.836 ( 9.075 2.314 -3.165) 9.885 10.448 ( -4.042 -0.180 9.551) 10.372 10.857 ( 2.040 -0.921 7.721) 8.039 11.594 ( -17.171 2.262 -8.444) 19.268 12.013 ( 7.998 1.775 -0.054) 8.193 13.927 ( -0.825 -2.707 5.270) 5.982 15.010 ( 0.113 -1.161 11.243) 11.303 15.633 ( 2.294 0.676 -3.800) 4.490 15.817 ( 0.166 0.511 -2.859) 2.909 ======================= Grid point 440 (218/306) ======================= q-point: (-0.60 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -10.308 -4.810 7.908) 13.854 2.014 ( -5.833 5.483 2.137) 8.286 2.267 ( 10.263 -0.035 -0.954) 10.308 2.483 ( 4.711 -5.621 -4.219) 8.461 2.994 ( -1.407 6.613 -2.699) 7.280 3.330 ( 5.982 10.582 5.783) 13.461 3.429 ( 0.955 -1.952 -0.048) 2.173 3.846 ( -12.148 -6.136 10.799) 17.374 4.062 ( -9.981 -0.618 0.791) 10.031 4.168 ( -6.820 -10.334 13.044) 17.984 5.098 ( -13.778 1.184 6.543) 15.298 5.169 ( -6.896 2.288 7.020) 10.102 5.880 ( 5.358 7.683 -2.005) 9.579 6.095 ( 7.109 -1.075 -7.114) 10.114 6.194 ( 7.772 1.854 -2.056) 8.250 6.535 ( 8.384 -4.581 -6.830) 11.744 6.702 ( 7.585 -0.112 -9.359) 12.047 7.098 ( 0.885 -2.316 -3.030) 3.915 7.581 ( -1.407 1.941 -1.535) 2.847 7.807 ( 7.470 1.589 -13.538) 15.544 8.291 ( 6.276 -4.202 1.744) 7.752 8.845 ( 3.457 3.950 -6.077) 8.030 10.487 ( -3.653 0.644 8.134) 8.940 10.998 ( 2.664 -2.707 9.264) 10.013 11.299 ( -11.838 2.140 -3.166) 12.439 12.091 ( 10.104 4.433 -4.190) 11.802 13.991 ( -3.439 -4.672 5.327) 7.876 15.128 ( -0.572 -2.603 8.965) 9.353 15.602 ( 0.745 1.786 -5.288) 5.631 15.747 ( -3.700 0.785 -3.078) 4.876 ======================= Grid point 441 (219/306) ======================= q-point: (-0.50 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.601 ( -6.000 -6.031 9.146) 12.491 1.872 ( -8.140 7.019 3.361) 11.262 2.404 ( 9.336 -1.449 -4.424) 10.432 2.566 ( 3.310 0.196 4.970) 5.974 2.864 ( -0.847 6.623 -3.489) 7.534 3.367 ( -0.804 12.869 15.421) 20.101 3.456 ( 4.922 1.684 -4.602) 6.946 3.803 ( -14.850 -6.264 8.764) 18.346 3.942 ( -15.000 -2.886 6.591) 16.636 4.318 ( -2.171 -10.103 6.017) 11.958 4.947 ( -15.935 -0.965 7.148) 17.491 5.135 ( -4.162 7.030 9.185) 12.293 5.791 ( 5.115 5.549 -10.142) 12.642 6.155 ( 7.210 1.668 -5.324) 9.116 6.250 ( 2.625 -1.753 -1.609) 3.543 6.563 ( 3.168 -1.859 -8.725) 9.466 6.773 ( 13.632 -1.735 -9.166) 16.518 7.119 ( 1.181 -2.900 -1.535) 3.487 7.547 ( 1.202 2.277 -0.549) 2.633 7.783 ( 7.883 1.261 -9.315) 12.268 8.426 ( 6.733 -2.346 -1.194) 7.230 8.741 ( -1.337 4.291 -7.549) 8.785 10.487 ( -4.536 0.668 4.354) 6.323 11.151 ( -5.533 2.845 2.806) 6.825 11.181 ( 3.295 -4.626 10.254) 11.721 12.128 ( 10.367 4.199 -7.153) 13.277 14.027 ( -6.084 -4.795 4.716) 9.069 15.240 ( -0.019 -4.268 5.581) 7.026 15.465 ( -5.345 4.404 -7.948) 10.542 15.678 ( -2.154 -0.285 -1.022) 2.401 ======================= Grid point 442 (220/306) ======================= q-point: (-0.40 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( -1.171 0.515 3.315) 3.553 1.757 ( -7.528 2.166 11.432) 13.858 2.403 ( 0.664 10.049 -2.077) 10.283 2.644 ( 4.169 3.281 -0.678) 5.349 2.852 ( 4.707 -3.688 2.743) 6.579 3.284 ( -11.980 7.669 9.724) 17.231 3.508 ( 10.617 8.820 2.410) 14.012 3.767 ( -4.006 -0.974 2.067) 4.612 3.829 ( -22.531 -4.802 17.483) 28.920 4.432 ( -1.395 -6.287 4.981) 8.142 4.812 ( -16.407 -0.713 8.034) 18.283 5.090 ( -3.689 5.078 6.806) 9.258 5.749 ( 9.450 0.458 -13.024) 16.098 6.128 ( 2.288 4.937 -4.373) 6.981 6.236 ( -1.297 -0.903 -9.043) 9.180 6.542 ( 6.751 -1.467 -9.156) 11.470 6.901 ( 10.497 -2.022 -5.086) 11.838 7.149 ( 2.438 -2.869 -3.292) 5.001 7.556 ( 2.251 2.459 2.468) 4.148 7.812 ( 7.936 0.397 -5.028) 9.404 8.486 ( 2.780 -0.059 -4.276) 5.100 8.588 ( -1.609 4.050 -7.409) 8.596 10.446 ( -5.351 -0.660 1.983) 5.744 11.095 ( -2.069 5.392 2.373) 6.244 11.398 ( 3.072 -6.211 11.497) 13.423 12.191 ( 12.529 -0.136 -5.987) 13.887 14.013 ( -8.097 -3.652 4.086) 9.778 15.137 ( -12.508 2.852 -10.756) 16.742 15.405 ( 3.062 -1.839 3.928) 5.309 15.653 ( -1.068 -0.009 -0.358) 1.127 ======================= Grid point 443 (221/306) ======================= q-point: (-0.30 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( 1.495 7.831 7.838) 11.180 1.819 ( -2.609 -2.031 7.286) 8.001 2.198 ( -5.701 19.591 1.552) 20.462 2.637 ( 5.708 -0.874 -10.924) 12.356 3.039 ( 1.719 -1.978 12.528) 12.799 3.171 ( -6.515 1.056 7.353) 9.881 3.551 ( 7.377 9.647 -2.808) 12.465 3.722 ( -6.642 -0.937 5.293) 8.544 3.853 ( -10.316 -0.574 26.593) 28.529 4.514 ( -3.533 -0.059 8.167) 8.898 4.652 ( -12.820 -0.106 4.710) 13.658 5.088 ( -2.703 -2.673 2.840) 4.745 5.741 ( 8.592 -1.880 -16.226) 18.456 6.030 ( -4.918 4.639 -6.542) 9.408 6.082 ( 3.045 4.078 -10.538) 11.703 6.589 ( 9.619 -1.700 -9.675) 13.749 6.958 ( -0.576 -0.958 -1.440) 1.823 7.204 ( 9.244 -2.346 -6.837) 11.735 7.609 ( 1.617 2.062 6.513) 7.020 7.893 ( 7.727 -0.455 -1.379) 7.862 8.394 ( -5.836 -0.665 -5.893) 8.320 8.490 ( 3.835 5.939 -8.028) 10.697 10.403 ( -5.166 -2.084 1.937) 5.898 10.996 ( -1.765 7.533 -3.267) 8.399 11.629 ( 0.277 -7.374 14.031) 15.853 12.380 ( 16.297 -5.921 -4.207) 17.842 13.966 ( -9.152 -2.419 4.900) 10.659 14.776 ( -14.224 5.099 -11.669) 19.091 15.508 ( 3.619 -1.523 2.011) 4.411 15.633 ( -0.768 0.684 -0.395) 1.102 ======================= Grid point 444 (222/306) ======================= q-point: (-0.20 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 9.903 8.035 9.704) 16.025 1.848 ( -2.048 1.734 5.043) 5.712 1.921 ( -5.476 19.506 2.345) 20.396 2.589 ( 2.933 -0.364 -11.799) 12.163 3.120 ( -6.141 -1.586 11.225) 12.893 3.277 ( 4.231 -1.252 7.462) 8.669 3.483 ( 0.822 8.947 -1.302) 9.079 3.737 ( 0.168 -0.516 4.716) 4.747 4.053 ( -4.265 0.595 29.302) 29.617 4.394 ( -15.998 1.843 5.639) 17.062 4.678 ( 4.020 0.023 4.390) 5.953 5.101 ( -4.650 -5.225 2.068) 7.294 5.655 ( 3.078 -1.295 -21.201) 21.463 5.851 ( -0.964 -0.546 -9.219) 9.285 6.018 ( 4.748 8.454 -2.257) 9.955 6.619 ( 10.394 -0.658 -15.381) 18.575 6.915 ( -4.789 -1.591 0.710) 5.096 7.282 ( 8.943 -0.149 -7.232) 11.503 7.690 ( 1.121 1.144 8.169) 8.324 8.003 ( 6.467 -0.306 1.589) 6.667 8.266 ( -5.479 -2.472 -5.728) 8.303 8.371 ( 2.979 7.577 -9.921) 12.834 10.387 ( -4.322 -2.843 3.185) 6.075 10.839 ( -1.782 7.097 -6.287) 9.648 11.829 ( -5.127 -6.901 15.755) 17.948 12.650 ( 16.225 -10.496 -7.450) 20.710 13.897 ( -13.461 -0.554 8.202) 15.772 14.440 ( -5.750 6.295 -9.998) 13.140 15.569 ( 0.933 0.081 0.732) 1.189 15.617 ( 2.252 1.296 -0.993) 2.781 ======================= Grid point 445 (223/306) ======================= q-point: (-0.10 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 0.732 14.891 3.284) 15.266 1.850 ( -1.980 2.214 5.830) 6.543 1.950 ( 16.011 9.168 6.984) 19.727 2.483 ( -0.574 0.577 -11.174) 11.203 3.160 ( -3.469 -4.369 2.709) 6.202 3.351 ( -1.394 2.828 -3.192) 4.487 3.437 ( 0.159 7.280 16.674) 18.195 3.810 ( 5.311 0.526 -0.111) 5.338 4.147 ( -17.736 0.306 9.928) 20.328 4.346 ( -1.325 -2.063 15.876) 16.064 4.772 ( 4.478 3.737 6.051) 8.404 5.142 ( -2.379 -6.079 6.048) 8.900 5.475 ( -0.433 -2.198 -16.715) 16.865 5.797 ( 4.276 -0.629 -10.015) 10.908 5.991 ( 3.541 7.289 1.481) 8.238 6.574 ( 11.320 0.811 -21.864) 24.634 6.899 ( -4.159 -3.892 2.853) 6.371 7.302 ( 5.476 2.137 -6.563) 8.810 7.772 ( 0.570 1.278 6.966) 7.105 8.085 ( -0.135 0.333 -1.103) 1.160 8.183 ( 0.472 -1.821 -2.582) 3.195 8.250 ( 4.900 4.429 -9.622) 11.671 10.400 ( -3.598 -2.273 4.734) 6.366 10.693 ( -0.723 4.826 -5.190) 7.124 11.934 ( -10.549 -4.796 13.953) 18.138 12.843 ( 6.036 -13.404 -13.677) 20.079 13.746 ( -14.920 4.841 9.884) 18.540 14.343 ( 8.104 4.494 -2.051) 9.491 15.561 ( -0.051 0.142 -0.617) 0.635 15.654 ( 5.132 1.688 -0.687) 5.446 ======================= Grid point 449 (224/306) ======================= q-point: ( 0.30 0.30 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( -11.609 -0.000 9.570) 15.045 2.084 ( -5.189 -0.000 3.745) 6.399 2.330 ( 7.754 0.000 -0.866) 7.803 2.337 ( 9.582 0.000 -9.151) 13.250 3.093 ( 3.401 0.000 -0.838) 3.502 3.366 ( 2.316 0.000 -6.310) 6.722 3.481 ( -0.239 -0.000 13.703) 13.705 3.794 ( -1.132 -0.000 5.021) 5.147 4.026 ( -17.392 -0.000 19.662) 26.250 4.055 ( -8.355 -0.000 -1.769) 8.540 5.107 ( -16.623 -0.000 7.600) 18.277 5.199 ( -2.213 -0.000 5.463) 5.894 5.986 ( 12.291 0.000 -1.072) 12.338 6.053 ( -3.481 -0.000 -0.017) 3.481 6.248 ( 11.046 0.000 -13.007) 17.064 6.458 ( 6.527 0.000 -1.719) 6.750 6.702 ( 7.148 0.000 -9.823) 12.149 7.072 ( 0.532 0.000 -2.381) 2.440 7.601 ( -1.844 -0.000 -1.432) 2.335 7.826 ( 7.569 0.000 -14.543) 16.395 8.244 ( 8.522 0.000 1.617) 8.674 8.886 ( 3.308 0.000 -6.814) 7.575 10.498 ( -3.095 -0.000 8.710) 9.244 10.966 ( 2.284 0.000 8.515) 8.816 11.323 ( -12.696 -0.000 -2.918) 13.027 12.138 ( 10.426 0.000 -5.243) 11.670 13.940 ( -2.976 -0.000 5.525) 6.276 15.100 ( -1.209 -0.000 9.136) 9.215 15.623 ( 1.681 0.000 -4.131) 4.460 15.756 ( -4.670 -0.000 -3.374) 5.761 ======================= Grid point 450 (225/306) ======================= q-point: (-0.60 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( -8.340 -2.454 13.392) 15.966 1.996 ( -6.821 4.106 1.543) 8.110 2.380 ( 10.094 -0.101 -6.944) 12.253 2.481 ( 7.099 -5.035 0.953) 8.756 3.063 ( 0.305 9.532 -0.589) 9.555 3.400 ( 1.166 -5.888 0.683) 6.041 3.601 ( 0.692 5.131 13.284) 14.257 3.733 ( -17.615 2.198 12.040) 21.449 3.926 ( -7.374 2.531 1.494) 7.938 4.091 ( -1.070 -11.169 6.177) 12.808 4.937 ( -17.218 -0.136 6.921) 18.558 5.248 ( 0.432 3.021 8.185) 8.735 5.912 ( -1.373 4.691 -10.297) 11.398 6.144 ( 8.099 -1.625 -0.991) 8.320 6.260 ( 3.059 1.719 -3.333) 4.840 6.492 ( 1.825 -3.610 -7.176) 8.238 6.751 ( 12.702 -0.435 -8.814) 15.466 7.072 ( 0.088 -1.294 -0.180) 1.310 7.579 ( 1.061 0.805 -0.701) 1.505 7.806 ( 8.749 0.730 -10.988) 14.064 8.392 ( 10.625 -0.856 -1.925) 10.832 8.800 ( -2.113 1.418 -8.830) 9.189 10.510 ( -4.254 0.958 3.943) 5.879 11.105 ( 2.447 -2.119 9.358) 9.902 11.201 ( -5.263 1.386 5.785) 7.943 12.178 ( 7.984 0.954 -11.299) 13.868 13.957 ( -4.208 -1.693 5.688) 7.275 15.174 ( -0.865 -1.798 5.997) 6.320 15.565 ( -3.119 4.691 -4.994) 7.528 15.648 ( -4.009 -2.657 -2.531) 5.434 ======================= Grid point 451 (226/306) ======================= q-point: (-0.50 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -3.927 -4.016 12.818) 13.994 1.878 ( -5.151 5.751 3.508) 8.480 2.444 ( 8.796 -1.594 -9.256) 12.868 2.670 ( 6.229 -4.847 6.708) 10.358 2.927 ( -1.937 11.980 -0.781) 12.161 3.399 ( -9.641 3.126 3.308) 10.661 3.640 ( -2.463 -1.157 2.867) 3.952 3.676 ( -17.622 -5.294 22.868) 29.352 3.848 ( 5.079 8.894 1.241) 10.317 4.271 ( 2.596 -8.800 4.647) 10.285 4.779 ( -15.976 -1.309 7.173) 17.561 5.269 ( -4.721 8.894 10.923) 14.856 5.759 ( 4.558 0.883 -15.753) 16.423 6.204 ( 0.940 0.399 -3.148) 3.309 6.232 ( 2.004 2.442 -4.832) 5.774 6.475 ( 3.759 -4.766 -8.731) 10.634 6.869 ( 12.052 -0.925 -5.386) 13.233 7.091 ( 0.013 -2.371 -0.037) 2.372 7.600 ( 3.113 1.583 1.259) 3.713 7.830 ( 9.169 1.014 -7.349) 11.794 8.483 ( 4.724 -0.181 -6.197) 7.795 8.652 ( -1.388 2.036 -7.714) 8.098 10.453 ( -5.494 0.958 1.730) 5.840 11.206 ( -1.049 4.540 9.128) 10.249 11.287 ( 3.124 -3.726 9.135) 10.349 12.145 ( 5.680 -3.532 -13.514) 15.078 13.967 ( -4.841 -0.876 5.922) 7.699 15.172 ( -7.555 -0.065 -4.504) 8.796 15.419 ( -1.411 3.321 1.330) 3.846 15.631 ( -0.426 -2.126 -1.691) 2.750 ======================= Grid point 452 (227/306) ======================= q-point: (-0.40 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 0.165 -3.618 7.648) 8.462 1.829 ( -1.711 5.780 8.728) 10.607 2.451 ( 5.047 2.571 -9.273) 10.866 2.720 ( -2.434 11.253 -1.441) 11.603 2.931 ( 7.497 -6.793 6.215) 11.874 3.226 ( -14.150 3.672 7.093) 16.248 3.642 ( -7.496 -3.421 7.018) 10.823 3.703 ( -7.778 -0.612 10.755) 13.287 3.937 ( 10.090 9.133 10.656) 17.285 4.438 ( 2.457 -6.262 5.165) 8.481 4.647 ( -14.790 -0.698 6.964) 16.362 5.168 ( -7.866 9.532 8.767) 15.153 5.685 ( 6.763 -3.109 -18.326) 19.780 6.059 ( -6.396 0.155 -12.328) 13.889 6.215 ( 5.849 6.185 -2.211) 8.795 6.531 ( 8.167 -3.971 -7.727) 11.924 6.951 ( 1.401 0.505 -0.219) 1.505 7.143 ( 7.439 -3.358 -4.262) 9.208 7.656 ( 2.802 2.285 4.928) 6.112 7.895 ( 9.342 0.569 -3.905) 10.141 8.370 ( -7.579 -1.490 -7.747) 10.939 8.595 ( 5.729 4.044 -7.879) 10.547 10.389 ( -5.553 0.490 3.070) 6.365 11.178 ( -0.855 9.964 1.023) 10.052 11.477 ( 1.087 -6.722 10.696) 12.680 12.189 ( 6.440 -11.907 -8.990) 16.251 13.964 ( -4.127 1.835 7.156) 8.462 14.892 ( -12.574 5.328 -9.989) 16.920 15.475 ( 3.415 -1.207 3.082) 4.756 15.631 ( 0.151 -0.978 -1.281) 1.619 ======================= Grid point 453 (228/306) ======================= q-point: (-0.30 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -1.512 -3.077 4.830) 5.923 1.902 ( 7.835 6.511 10.122) 14.361 2.302 ( -3.037 13.883 -4.037) 14.774 2.593 ( 3.194 2.741 -9.799) 10.664 3.102 ( -11.186 0.068 8.710) 14.177 3.195 ( 8.314 -6.041 7.020) 12.446 3.650 ( -0.655 2.126 0.404) 2.261 3.705 ( -6.360 0.912 13.985) 15.390 4.127 ( 6.330 5.982 16.763) 18.890 4.421 ( -18.381 0.136 5.684) 19.240 4.658 ( 6.025 -2.341 6.527) 9.186 5.071 ( -6.794 3.838 6.046) 9.871 5.605 ( 3.957 -3.502 -20.109) 20.792 5.833 ( -2.746 -0.281 -14.314) 14.578 6.207 ( 5.103 8.439 -0.419) 9.871 6.593 ( 9.757 -1.942 -11.895) 15.507 6.908 ( -5.717 1.037 1.679) 6.048 7.258 ( 10.802 -2.274 -6.766) 12.947 7.728 ( 0.543 2.349 8.614) 8.945 8.001 ( 8.800 0.143 -0.397) 8.811 8.204 ( -8.085 -3.460 -6.521) 10.948 8.516 ( 3.922 6.038 -10.738) 12.929 10.356 ( -4.956 -0.097 5.735) 7.581 11.014 ( -1.858 10.120 -6.619) 12.235 11.668 ( -3.289 -8.225 13.122) 15.832 12.357 ( 5.568 -17.069 -6.883) 19.228 13.962 ( -3.601 5.856 9.745) 11.926 14.571 ( -7.015 6.110 -9.990) 13.650 15.557 ( 1.969 -1.190 1.343) 2.664 15.631 ( 1.834 -0.009 -1.511) 2.376 ======================= Grid point 454 (229/306) ======================= q-point: (-0.20 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.855 ( -2.846 -1.276 4.830) 5.749 2.037 ( 0.983 12.280 -1.105) 12.369 2.144 ( 12.128 9.824 9.127) 18.080 2.504 ( 2.539 2.020 -11.665) 12.108 3.070 ( -7.164 -4.103 5.596) 9.973 3.382 ( 2.637 -0.183 2.325) 3.520 3.610 ( 0.077 7.635 8.043) 11.090 3.797 ( 3.259 -1.369 4.905) 6.046 4.146 ( -21.735 -0.524 5.854) 22.516 4.361 ( 2.422 3.606 16.416) 16.981 4.842 ( 7.023 1.964 6.275) 9.621 5.036 ( -4.493 -2.634 7.702) 9.297 5.435 ( -1.050 -1.523 -17.859) 17.955 5.747 ( 6.770 -2.935 -13.295) 15.205 6.173 ( 2.035 8.939 1.562) 9.300 6.587 ( 9.912 0.293 -17.743) 20.325 6.844 ( -5.680 -1.021 2.891) 6.454 7.331 ( 8.587 0.387 -8.022) 11.757 7.799 ( -1.547 1.193 9.383) 9.584 8.067 ( -3.734 -2.387 -3.967) 5.948 8.139 ( 5.254 -1.133 0.805) 5.435 8.372 ( 3.143 6.245 -12.812) 14.596 10.370 ( -4.002 -0.434 8.485) 9.392 10.817 ( -1.500 7.319 -7.782) 10.788 11.804 ( -8.644 -7.520 12.923) 17.270 12.503 ( -0.976 -18.485 -8.920) 20.548 13.909 ( -5.917 10.274 9.291) 15.062 14.434 ( 6.882 4.115 -4.422) 9.157 15.566 ( -0.797 0.088 -0.636) 1.023 15.672 ( 4.928 -0.044 -0.988) 5.026 ======================= Grid point 455 (230/306) ======================= q-point: (-0.10 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( -4.575 5.856 5.526) 9.261 1.923 ( 2.438 4.625 -0.199) 5.232 2.366 ( 2.653 4.761 -1.635) 5.690 2.387 ( 14.848 8.513 -3.122) 17.398 3.079 ( -4.062 -4.505 2.091) 6.416 3.315 ( -5.216 3.800 -1.791) 6.697 3.678 ( 2.825 5.103 7.771) 9.716 3.890 ( 8.505 0.123 -6.453) 10.676 3.910 ( -22.056 -0.845 12.885) 25.558 4.467 ( -5.112 1.819 9.553) 10.987 4.951 ( 5.260 1.904 8.289) 10.000 5.168 ( -1.641 -4.265 8.800) 9.916 5.329 ( 5.715 -2.182 -6.331) 8.804 5.750 ( 7.455 -1.641 -11.758) 14.018 6.119 ( -0.378 6.952 2.250) 7.317 6.522 ( 10.462 1.182 -19.941) 22.550 6.826 ( -3.880 -3.263 1.926) 5.424 7.331 ( 5.729 2.662 -8.291) 10.423 7.836 ( -3.642 -1.436 3.847) 5.488 7.998 ( -2.380 0.775 -1.979) 3.191 8.192 ( 2.822 2.840 -6.619) 7.736 8.304 ( 8.296 -0.277 -2.572) 8.690 10.416 ( -3.691 0.456 9.772) 10.456 10.682 ( 0.272 3.577 -4.464) 5.727 11.844 ( -11.282 -5.656 9.671) 15.900 12.490 ( -11.281 -14.897 -10.602) 21.484 13.837 ( -0.087 9.377 7.107) 11.766 14.538 ( 11.391 3.620 3.483) 12.450 15.552 ( 0.663 -0.649 -1.410) 1.688 15.732 ( 5.256 0.550 -1.245) 5.429 ======================= Grid point 460 (231/306) ======================= q-point: ( 0.40 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.552 ( -5.718 -0.000 15.688) 16.698 1.945 ( -4.084 -0.000 0.846) 4.171 2.423 ( 8.524 0.000 -8.269) 11.875 2.601 ( 7.319 0.000 5.203) 8.980 3.105 ( -0.882 -0.000 -4.214) 4.305 3.396 ( 0.421 0.000 2.807) 2.838 3.603 ( -15.496 -0.000 8.239) 17.551 3.618 ( -19.764 -0.000 20.418) 28.416 4.027 ( 6.939 0.000 -0.919) 7.000 4.111 ( 7.647 0.000 7.587) 10.773 4.766 ( -16.606 -0.000 7.670) 18.292 5.369 ( -1.045 -0.000 10.162) 10.215 5.777 ( -0.354 -0.000 -15.294) 15.298 6.199 ( 0.023 0.000 -3.177) 3.177 6.276 ( 4.382 0.000 -4.115) 6.011 6.400 ( 2.191 0.000 -7.615) 7.924 6.861 ( 13.045 0.000 -5.518) 14.164 7.064 ( -1.409 -0.000 1.536) 2.084 7.617 ( 3.652 0.000 0.701) 3.719 7.842 ( 9.560 0.000 -8.033) 12.487 8.481 ( 5.251 0.000 -7.174) 8.891 8.673 ( -1.178 -0.000 -7.785) 7.874 10.467 ( -5.516 -0.000 1.401) 5.691 11.227 ( 1.921 0.000 9.911) 10.095 11.281 ( 0.981 0.000 11.827) 11.868 12.097 ( 2.307 0.000 -17.930) 18.077 13.962 ( -2.743 -0.000 6.331) 6.899 15.163 ( -5.093 -0.000 -1.225) 5.238 15.481 ( -6.340 -0.000 0.712) 6.380 15.589 ( 2.019 0.000 -3.419) 3.970 ======================= Grid point 462 (232/306) ======================= q-point: (-0.50 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -3.680 -2.138 12.966) 13.647 1.928 ( 1.348 2.783 3.474) 4.651 2.454 ( 6.709 -0.180 -7.605) 10.143 2.787 ( 7.004 -4.007 6.658) 10.462 2.964 ( -3.611 7.005 -6.315) 10.099 3.322 ( -10.336 5.414 2.068) 11.850 3.551 ( -9.028 -5.046 7.644) 12.861 3.632 ( -10.116 -3.677 21.289) 23.855 4.123 ( 10.297 6.871 5.092) 13.386 4.306 ( 4.701 -5.357 2.143) 7.442 4.644 ( -13.045 0.258 10.681) 16.862 5.366 ( -10.205 6.668 10.552) 16.123 5.631 ( 4.962 -1.610 -19.564) 20.248 6.054 ( -5.984 -0.380 -12.400) 13.773 6.313 ( 8.291 3.280 -3.197) 9.472 6.438 ( 6.302 -4.023 -4.086) 8.520 6.981 ( 7.336 2.044 -1.164) 7.704 7.073 ( 1.584 -2.999 -0.132) 3.394 7.693 ( 4.482 1.028 3.391) 5.713 7.909 ( 9.964 0.546 -5.395) 11.344 8.342 ( -9.009 -0.936 -9.288) 12.973 8.652 ( 6.609 1.406 -7.691) 10.237 10.406 ( -5.676 0.697 3.684) 6.802 11.356 ( -0.310 0.369 11.675) 11.685 11.402 ( 3.099 5.084 6.415) 8.752 11.942 ( -0.772 -9.543 -17.558) 19.998 14.008 ( 0.239 1.572 7.604) 7.769 14.970 ( -12.249 1.907 -7.741) 14.615 15.471 ( 1.207 0.549 3.311) 3.566 15.599 ( 1.960 -1.504 -2.404) 3.447 ======================= Grid point 463 (233/306) ======================= q-point: (-0.40 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.742 ( -3.400 -3.456 8.111) 9.450 2.014 ( 8.515 3.940 6.671) 11.512 2.442 ( 3.529 2.455 -7.537) 8.677 2.743 ( -3.647 8.056 -6.169) 10.781 3.042 ( 7.733 -6.131 3.932) 10.623 3.151 ( -8.556 3.593 6.527) 11.345 3.583 ( -5.441 -4.724 8.355) 11.033 3.749 ( -4.403 0.076 15.304) 15.925 4.230 ( 0.249 2.130 4.218) 4.732 4.407 ( -2.362 -0.317 10.472) 10.740 4.626 ( -0.044 0.349 6.891) 6.900 5.220 ( -11.491 7.861 8.513) 16.319 5.528 ( 5.528 -3.263 -20.271) 21.263 5.838 ( -3.219 0.460 -14.369) 14.732 6.350 ( 6.447 5.505 -2.176) 8.752 6.535 ( 9.142 -3.631 -7.793) 12.550 6.960 ( -4.184 3.758 1.881) 5.930 7.190 ( 9.522 -3.999 -3.673) 10.962 7.781 ( 2.336 2.524 6.758) 7.583 8.006 ( 9.985 0.321 -2.312) 10.254 8.129 ( -10.598 -3.450 -7.094) 13.211 8.612 ( 4.376 3.196 -10.972) 12.237 10.374 ( -5.623 1.340 7.851) 9.749 11.265 ( -2.132 14.125 -5.981) 15.486 11.513 ( -1.598 -6.006 9.793) 11.598 11.978 ( 0.132 -18.876 -6.572) 19.987 14.092 ( 3.649 5.659 9.717) 11.822 14.677 ( -10.324 3.771 -8.900) 14.143 15.530 ( 2.138 -1.065 1.600) 2.875 15.619 ( 2.245 -0.962 -2.048) 3.188 ======================= Grid point 464 (234/306) ======================= q-point: (-0.30 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -3.401 -3.795 5.027) 7.158 2.203 ( 11.855 4.725 2.502) 13.005 2.342 ( 1.068 7.915 0.057) 7.987 2.591 ( 3.003 5.791 -8.814) 10.966 3.005 ( -10.308 -1.339 5.669) 11.840 3.334 ( 7.815 -4.308 3.930) 9.751 3.660 ( 1.489 -2.500 5.431) 6.161 3.822 ( -0.363 3.431 9.418) 10.030 4.119 ( -23.266 -2.260 9.006) 25.050 4.473 ( 2.449 6.530 9.107) 11.471 4.812 ( 9.743 -3.387 7.936) 13.015 5.078 ( -9.617 4.690 6.960) 12.765 5.414 ( 3.214 -0.574 -17.696) 17.995 5.706 ( 4.514 -0.668 -11.555) 12.424 6.332 ( 2.166 6.137 -1.697) 6.726 6.582 ( 9.089 -0.897 -13.579) 16.365 6.867 ( -5.149 3.155 1.681) 6.268 7.309 ( 8.717 -2.513 -5.896) 10.819 7.823 ( -5.237 1.103 7.151) 8.932 8.000 ( -3.713 -3.463 -2.975) 5.884 8.135 ( 8.819 0.206 1.019) 8.880 8.486 ( 2.129 4.393 -14.144) 14.962 10.384 ( -5.201 1.633 12.062) 13.236 11.003 ( -2.648 10.639 -10.385) 15.101 11.640 ( -6.144 -7.757 10.463) 14.401 12.108 ( -2.652 -19.008 -4.961) 19.823 14.142 ( -0.558 11.466 8.155) 14.081 14.501 ( 3.636 2.016 -4.427) 6.073 15.560 ( -0.198 -0.593 -0.574) 0.849 15.655 ( 4.138 -1.353 -1.506) 4.606 ======================= Grid point 465 (235/306) ======================= q-point: (-0.20 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( -3.383 -3.644 5.186) 7.184 2.102 ( -0.513 9.520 -5.867) 11.194 2.478 ( 1.743 7.000 -7.518) 10.419 2.535 ( 16.033 4.789 7.312) 18.261 2.976 ( -5.368 -4.869 4.409) 8.482 3.381 ( -4.796 1.369 -0.550) 5.017 3.741 ( -6.168 0.026 -6.430) 8.910 3.848 ( 4.049 -1.339 3.713) 5.654 3.972 ( -10.683 4.464 20.665) 23.688 4.510 ( -3.357 2.351 5.756) 7.066 4.966 ( 2.428 -0.856 0.354) 2.599 5.105 ( 0.563 -1.686 10.772) 10.917 5.330 ( 7.091 2.669 -4.288) 8.706 5.706 ( 6.815 -2.292 -9.375) 11.815 6.254 ( -1.722 5.477 -1.457) 5.923 6.539 ( 6.960 0.572 -15.279) 16.800 6.804 ( -1.612 1.332 -0.127) 2.095 7.361 ( 7.021 -0.089 -8.328) 10.893 7.770 ( -8.390 -4.141 0.759) 9.387 8.017 ( 1.072 1.015 4.065) 4.325 8.252 ( 4.618 2.055 0.087) 5.056 8.322 ( 4.016 2.134 -12.376) 13.185 10.439 ( -4.563 1.848 14.781) 15.580 10.785 ( -1.277 6.379 -8.208) 10.474 11.704 ( -9.697 -7.525 8.278) 14.804 12.163 ( -7.933 -16.154 -5.844) 18.922 14.050 ( -1.038 10.595 3.753) 11.288 14.614 ( 12.533 3.663 3.628) 13.552 15.543 ( -0.360 -0.303 -1.722) 1.785 15.722 ( 4.712 -1.566 -1.393) 5.157 ======================= Grid point 466 (236/306) ======================= q-point: (-0.10 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -6.181 0.453 7.756) 9.928 1.986 ( 4.047 4.298 -4.948) 7.703 2.320 ( -1.968 7.293 -7.279) 10.490 2.709 ( 6.868 5.166 0.808) 8.632 3.051 ( 4.733 -1.618 3.160) 5.916 3.230 ( -9.203 2.857 -1.638) 9.775 3.509 ( -15.003 -5.842 -5.298) 16.949 3.981 ( 4.361 4.851 8.282) 10.543 4.034 ( 1.346 5.410 11.198) 12.509 4.440 ( -8.166 1.999 2.527) 8.779 5.078 ( 3.898 -5.303 3.422) 7.418 5.160 ( 1.664 0.400 2.156) 2.752 5.478 ( 3.340 -0.012 11.234) 11.720 5.739 ( 9.456 -1.245 -8.303) 12.646 6.153 ( -2.158 4.188 -2.627) 5.395 6.485 ( 8.100 0.343 -13.733) 15.947 6.777 ( -0.001 -0.092 -2.286) 2.287 7.341 ( 4.869 2.244 -9.500) 10.908 7.705 ( -6.206 -5.326 -2.467) 8.543 8.008 ( -0.548 3.370 -4.801) 5.891 8.206 ( 4.582 2.065 -2.473) 5.602 8.402 ( 6.954 -1.696 1.463) 7.306 10.496 ( -5.023 3.608 12.370) 13.830 10.690 ( 1.498 1.437 -0.721) 2.197 11.700 ( -9.941 -7.098 4.263) 12.938 12.091 ( -12.132 -10.372 -6.137) 17.100 14.012 ( 2.628 7.830 4.450) 9.382 14.795 ( 10.273 4.769 6.924) 13.275 15.538 ( 1.463 -1.491 -2.229) 3.054 15.784 ( 4.534 -0.798 -2.039) 5.035 ======================= Grid point 472 (237/306) ======================= q-point: ( 0.50 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -4.222 0.000 9.541) 10.433 2.056 ( 8.940 0.000 4.361) 9.947 2.472 ( 4.376 0.000 -4.694) 6.417 2.816 ( -8.071 0.000 -3.678) 8.870 2.977 ( 12.793 0.000 0.462) 12.802 3.225 ( -8.917 0.000 -0.196) 8.919 3.507 ( -5.937 0.000 10.232) 11.830 3.738 ( -4.658 0.000 20.954) 21.465 4.236 ( -9.688 0.000 0.189) 9.690 4.412 ( 12.603 -0.000 11.128) 16.813 4.643 ( -4.672 0.000 8.298) 9.523 5.310 ( -15.802 0.000 8.935) 18.153 5.493 ( 7.370 0.000 -21.297) 22.536 5.844 ( -2.254 0.000 -13.974) 14.155 6.449 ( 12.498 0.000 -5.755) 13.759 6.450 ( 3.426 -0.000 -2.545) 4.268 7.024 ( -3.408 -0.000 0.345) 3.425 7.125 ( 8.924 0.000 -0.798) 8.959 7.813 ( 4.425 0.000 5.724) 7.235 8.012 ( 10.333 0.000 -3.223) 10.824 8.085 ( -12.655 0.000 -7.337) 14.628 8.646 ( 4.465 0.000 -10.972) 11.846 10.391 ( -5.924 0.000 8.870) 10.667 11.445 ( -1.779 0.000 9.607) 9.770 11.590 ( 2.093 0.000 8.525) 8.779 11.603 ( -4.784 -0.000 -22.195) 22.705 14.157 ( 6.440 0.000 9.611) 11.569 14.717 ( -12.191 0.000 -8.158) 14.669 15.519 ( 1.587 0.000 1.542) 2.213 15.605 ( 3.024 0.000 -2.320) 3.811 ======================= Grid point 474 (238/306) ======================= q-point: (-0.40 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( -4.373 -1.994 5.799) 7.532 2.261 ( 14.278 1.214 1.295) 14.388 2.469 ( 2.076 4.205 0.430) 4.709 2.656 ( -4.351 -0.183 -6.401) 7.742 3.061 ( -5.104 6.461 0.946) 8.288 3.219 ( 7.820 -6.491 1.229) 10.238 3.594 ( 1.267 -2.571 10.967) 11.335 3.872 ( -0.173 1.123 7.172) 7.262 4.069 ( -22.461 -1.711 14.318) 26.691 4.602 ( -0.105 4.876 1.643) 5.146 4.747 ( 11.672 -2.627 10.099) 15.657 5.150 ( -15.950 1.699 7.706) 17.795 5.407 ( 9.972 -0.096 -18.523) 21.037 5.714 ( 1.445 0.772 -9.402) 9.543 6.428 ( 1.037 3.005 -3.781) 4.940 6.553 ( 10.149 -1.510 -9.989) 14.320 6.948 ( -2.847 3.437 -1.562) 4.729 7.242 ( 6.049 -2.959 -1.250) 6.849 7.841 ( -10.621 0.584 -1.389) 10.728 7.944 ( 1.856 -1.560 4.387) 5.012 8.138 ( 9.742 0.061 -0.233) 9.745 8.548 ( 1.677 1.526 -14.542) 14.717 10.421 ( -6.430 1.292 14.845) 16.230 11.239 ( -4.875 10.437 -15.701) 19.474 11.515 ( -3.901 -3.477 7.676) 9.286 11.752 ( -1.475 -13.519 0.974) 13.634 14.351 ( 6.086 7.705 8.538) 13.012 14.502 ( -2.929 -2.029 -4.613) 5.829 15.547 ( 0.819 -0.505 -0.433) 1.055 15.630 ( 3.272 -0.802 -2.230) 4.040 ======================= Grid point 475 (239/306) ======================= q-point: (-0.30 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.750 ( -3.917 -3.961 4.204) 6.979 2.276 ( 1.149 7.203 -7.480) 10.448 2.554 ( 4.983 -0.943 -6.801) 8.484 2.641 ( 10.478 4.631 9.094) 14.627 2.936 ( -5.637 3.125 2.361) 6.864 3.335 ( -2.970 -6.002 0.263) 6.702 3.712 ( -17.823 -1.682 -4.963) 18.577 3.827 ( 12.482 -0.843 7.406) 14.538 4.062 ( -9.225 3.416 23.162) 25.164 4.568 ( 0.070 3.024 0.225) 3.033 4.924 ( -0.322 -2.603 -4.030) 4.808 5.098 ( -0.504 0.710 12.711) 12.740 5.410 ( 11.284 3.934 -4.757) 12.862 5.662 ( 1.235 -1.879 -5.811) 6.230 6.336 ( -2.700 2.468 -4.806) 6.040 6.553 ( 6.488 0.742 -12.995) 14.544 6.870 ( 0.996 4.281 -2.587) 5.100 7.322 ( 4.664 -3.321 -4.616) 7.354 7.695 ( -9.574 -2.626 -0.295) 9.932 8.037 ( 2.464 0.835 5.681) 6.249 8.274 ( 7.471 0.416 2.250) 7.813 8.372 ( 0.189 2.035 -16.820) 16.944 10.487 ( -6.567 2.390 19.151) 20.386 10.938 ( -3.338 7.721 -12.083) 14.723 11.558 ( -6.901 -5.746 5.788) 10.684 11.846 ( -4.616 -13.480 -1.371) 14.314 14.245 ( -2.701 7.443 -1.828) 8.126 14.682 ( 13.671 2.654 8.032) 16.077 15.540 ( -0.263 -0.013 -1.846) 1.865 15.676 ( 3.849 -2.481 -1.962) 4.982 ======================= Grid point 476 (240/306) ======================= q-point: (-0.20 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( -3.928 -5.383 5.113) 8.400 2.132 ( 0.878 8.085 -5.730) 9.949 2.477 ( 0.897 5.478 -10.034) 11.466 2.751 ( -4.889 1.842 6.587) 8.407 3.017 ( 13.638 -1.571 2.143) 13.895 3.267 ( -9.613 -1.106 -3.222) 10.199 3.420 ( -21.059 -2.393 2.193) 21.307 4.047 ( 10.247 1.836 1.711) 10.549 4.143 ( -3.748 4.445 18.262) 19.165 4.507 ( -3.016 4.919 0.199) 5.774 4.965 ( 4.795 -5.750 0.984) 7.551 5.168 ( 2.737 0.900 -1.490) 3.244 5.487 ( -5.127 -0.053 7.802) 9.336 5.712 ( 11.242 -0.762 -0.880) 11.302 6.234 ( -1.091 3.075 -4.190) 5.310 6.484 ( 4.434 0.031 -11.945) 12.742 6.824 ( 3.399 4.257 -4.553) 7.099 7.347 ( 4.556 -2.009 -8.640) 9.973 7.607 ( -7.117 -3.592 -0.363) 7.980 8.076 ( -0.947 3.071 -3.568) 4.801 8.214 ( 3.530 -0.823 -7.408) 8.247 8.395 ( 5.355 0.536 3.033) 6.177 10.574 ( -6.488 3.551 19.962) 21.288 10.745 ( -0.732 3.903 -6.522) 7.636 11.554 ( -8.306 -6.405 2.289) 10.736 11.867 ( -7.712 -10.813 -1.781) 13.400 14.159 ( 1.296 5.912 0.404) 6.066 14.910 ( 12.266 6.105 7.727) 15.730 15.516 ( 0.268 -0.531 -2.522) 2.592 15.745 ( 4.301 -2.975 -1.863) 5.551 ======================= Grid point 477 (241/306) ======================= q-point: (-0.10 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -6.807 -3.425 7.975) 11.031 2.041 ( 4.692 4.561 -5.512) 8.556 2.281 ( -4.822 7.304 -6.483) 10.892 2.701 ( -7.114 -0.440 0.779) 7.170 3.040 ( -9.328 -2.889 -10.195) 14.117 3.214 ( -1.801 3.501 0.765) 4.010 3.265 ( -2.620 -3.025 8.692) 9.569 4.124 ( 2.724 0.884 -0.058) 2.864 4.242 ( -3.834 4.669 19.453) 20.369 4.403 ( -1.788 8.037 -1.191) 8.319 5.075 ( -3.955 -2.337 2.683) 5.320 5.237 ( 7.316 -4.569 3.199) 9.200 5.463 ( -6.604 -5.327 1.537) 8.623 5.908 ( 13.145 2.534 3.153) 13.753 6.123 ( -0.500 4.397 -6.947) 8.237 6.479 ( 7.413 -2.017 -7.412) 10.675 6.777 ( 3.928 3.520 -6.718) 8.540 7.312 ( 3.625 0.546 -10.638) 11.252 7.553 ( -4.769 -4.092 -1.482) 6.456 7.926 ( -0.486 1.580 -11.961) 12.074 8.303 ( 5.971 -1.022 2.943) 6.735 8.488 ( 4.079 -0.799 2.300) 4.751 10.570 ( -5.493 5.174 6.510) 9.966 10.766 ( 1.161 -0.074 10.785) 10.848 11.502 ( -8.439 -6.510 -2.170) 10.877 11.829 ( -7.621 -6.909 -0.547) 10.301 14.151 ( 2.325 4.808 2.569) 5.926 15.059 ( 7.086 7.036 7.754) 12.643 15.518 ( 2.302 -2.134 -3.044) 4.373 15.805 ( 3.626 -1.380 -2.779) 4.773 ======================= Grid point 484 (242/306) ======================= q-point: (-0.40 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( -4.488 -0.000 4.213) 6.156 2.375 ( 6.109 0.000 -8.022) 10.083 2.512 ( -4.305 -0.000 -5.623) 7.082 2.678 ( 13.251 0.000 10.548) 16.936 3.054 ( -1.700 -0.000 -3.237) 3.656 3.202 ( -4.711 -0.000 2.039) 5.133 3.694 ( -20.239 -0.000 -2.796) 20.431 3.817 ( 13.566 0.000 9.701) 16.677 4.098 ( -8.234 -0.000 23.141) 24.562 4.607 ( 3.252 0.000 -3.166) 4.538 4.890 ( -2.554 -0.000 -4.137) 4.862 5.111 ( -1.576 -0.000 13.868) 13.957 5.457 ( 15.675 0.000 -5.630) 16.655 5.638 ( -4.388 -0.000 -4.657) 6.398 6.361 ( -3.468 -0.000 -6.095) 7.013 6.563 ( 7.354 0.000 -12.483) 14.488 6.930 ( 3.064 0.000 -4.968) 5.837 7.271 ( 1.437 0.000 -0.582) 1.550 7.668 ( -9.038 -0.000 -0.974) 9.090 8.047 ( 2.917 0.000 5.684) 6.389 8.277 ( 8.136 0.000 1.999) 8.378 8.394 ( -0.669 -0.000 -17.304) 17.317 10.516 ( -7.853 -0.000 21.244) 22.649 11.040 ( -5.078 -0.000 -15.575) 16.382 11.497 ( -4.990 -0.000 4.647) 6.818 11.679 ( -2.759 -0.000 1.877) 3.337 14.327 ( -3.855 -0.000 -5.504) 6.720 14.712 ( 14.581 0.000 11.643) 18.659 15.541 ( 0.188 0.000 -1.517) 1.528 15.644 ( 3.140 0.000 -2.746) 4.171 ======================= Grid point 485 (243/306) ======================= q-point: (-0.30 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( -4.544 -2.708 4.662) 7.051 2.295 ( 1.046 7.343 -6.387) 9.788 2.459 ( 0.182 -5.396 -6.996) 8.838 2.891 ( -6.432 9.607 -0.551) 11.575 2.991 ( 14.847 -0.674 2.075) 15.007 3.163 ( -10.202 -7.759 0.038) 12.818 3.397 ( -21.066 -0.410 6.699) 22.110 4.073 ( 8.504 0.742 4.867) 9.826 4.203 ( -2.979 1.349 14.382) 14.749 4.634 ( 3.216 6.247 1.519) 7.188 4.837 ( 3.428 -6.011 -2.537) 7.370 5.206 ( 3.684 2.141 0.619) 4.306 5.455 ( -15.190 -2.145 -2.001) 15.470 5.715 ( 14.313 0.519 8.399) 16.604 6.271 ( 0.700 0.658 -4.789) 4.885 6.492 ( 3.065 0.470 -14.002) 14.342 6.923 ( 6.201 4.017 -6.217) 9.656 7.276 ( 0.110 -3.412 -3.660) 5.005 7.563 ( -6.094 -0.866 0.029) 6.155 8.127 ( 1.639 1.637 1.021) 2.531 8.193 ( -0.626 -0.904 -14.899) 14.939 8.405 ( 5.755 0.257 3.393) 6.686 10.630 ( -8.607 1.562 24.407) 25.927 10.826 ( -2.977 2.823 -10.107) 10.908 11.465 ( -5.471 -1.701 1.765) 5.995 11.675 ( -4.754 -6.374 0.290) 7.957 14.243 ( 0.193 2.115 -3.141) 3.792 15.018 ( 13.982 3.343 9.587) 17.280 15.518 ( -0.242 0.628 -2.023) 2.132 15.677 ( 3.745 -2.745 -2.493) 5.270 ======================= Grid point 486 (244/306) ======================= q-point: (-0.20 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( -5.797 -5.326 6.702) 10.338 2.173 ( 0.983 6.885 -5.444) 8.832 2.390 ( -3.122 1.563 -9.623) 10.237 2.684 ( -8.777 0.142 -1.253) 8.867 2.965 ( -13.727 -2.929 -4.727) 14.811 3.235 ( -8.659 -0.915 14.449) 16.870 3.280 ( 5.390 2.053 -0.795) 5.822 4.113 ( -4.457 -0.621 1.054) 4.622 4.306 ( -0.462 1.759 13.551) 13.673 4.611 ( 3.779 10.798 0.162) 11.441 5.014 ( 3.288 -4.903 0.779) 5.955 5.140 ( -3.077 -3.166 -0.125) 4.417 5.350 ( -4.599 -5.036 1.572) 6.999 5.970 ( 10.793 2.977 8.429) 14.014 6.223 ( 1.621 4.698 -7.706) 9.170 6.416 ( 4.397 -3.627 -8.597) 10.315 6.883 ( 5.611 6.086 -7.532) 11.192 7.270 ( 2.095 -4.160 -8.290) 9.509 7.500 ( -4.192 -1.116 -0.390) 4.356 7.960 ( -2.096 1.484 -13.703) 13.942 8.245 ( 4.999 -3.090 1.127) 5.985 8.502 ( 3.169 1.014 4.026) 5.223 10.675 ( -4.601 4.346 2.081) 6.663 10.767 ( -3.595 0.264 17.137) 17.512 11.410 ( -5.205 -2.008 -1.570) 5.795 11.673 ( -6.505 -7.535 1.067) 10.011 14.220 ( 2.128 1.958 -1.011) 3.063 15.217 ( 9.312 7.113 6.646) 13.471 15.490 ( 0.756 -0.212 -2.854) 2.961 15.754 ( 4.769 -3.425 -1.632) 6.094 ======================= Grid point 487 (245/306) ======================= q-point: (-0.10 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -9.206 -5.887 8.793) 14.026 2.027 ( -7.941 2.545 -6.083) 10.322 2.242 ( 3.441 3.479 -4.995) 6.992 2.581 ( -10.602 0.487 1.301) 10.693 2.770 ( -7.831 -4.753 -5.315) 10.590 3.160 ( -12.155 2.920 11.523) 17.002 3.383 ( 8.184 0.550 -4.148) 9.192 4.061 ( -8.068 -4.065 2.606) 9.403 4.399 ( -16.099 4.219 22.098) 27.665 4.484 ( 5.395 6.810 -8.334) 12.039 4.982 ( -4.081 -1.323 3.849) 5.763 5.295 ( -9.960 -1.361 10.386) 14.454 5.387 ( 12.232 -7.448 -5.904) 15.490 6.082 ( 5.352 5.238 -10.725) 13.081 6.151 ( 8.399 1.981 2.444) 8.969 6.488 ( 5.998 -4.148 -3.763) 8.206 6.815 ( 6.520 5.450 -9.619) 12.835 7.241 ( 3.012 -1.739 -10.035) 10.621 7.458 ( -2.610 -1.875 -0.921) 3.343 7.815 ( 0.598 0.233 -9.908) 9.929 8.381 ( 6.318 -5.067 0.461) 8.112 8.555 ( 0.796 1.581 3.285) 3.732 10.598 ( -3.608 4.236 3.114) 6.376 10.921 ( -0.592 -0.301 16.834) 16.847 11.326 ( -5.057 -1.228 -3.444) 6.241 11.683 ( -4.411 -7.602 2.353) 9.098 14.226 ( 1.268 1.797 0.396) 2.234 15.289 ( 3.620 7.935 5.913) 10.537 15.496 ( 2.849 -2.371 -3.875) 5.363 15.810 ( 2.683 0.032 -3.069) 4.077 ======================= Grid point 495 (246/306) ======================= q-point: (-0.30 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -6.375 -0.000 6.745) 9.281 2.278 ( -2.652 -0.000 -7.651) 8.098 2.362 ( 1.462 0.000 -4.591) 4.818 2.699 ( -10.673 -0.000 -13.380) 17.115 2.941 ( -15.567 -0.000 3.787) 16.021 3.213 ( -3.879 -0.000 15.107) 15.598 3.302 ( 2.883 0.000 0.864) 3.009 4.110 ( -6.543 -0.000 0.820) 6.594 4.323 ( 0.602 0.000 11.643) 11.659 4.786 ( -0.458 -0.000 3.808) 3.835 4.895 ( 16.618 0.000 -4.520) 17.221 5.118 ( -18.738 -0.000 -0.394) 18.742 5.288 ( 1.980 0.000 2.460) 3.158 6.006 ( 9.705 0.000 10.430) 14.247 6.290 ( 5.939 0.000 -2.399) 6.405 6.358 ( 0.533 0.000 -15.691) 15.700 6.972 ( 7.745 0.000 -9.271) 12.080 7.201 ( -1.323 -0.000 -4.101) 4.309 7.491 ( -3.459 -0.000 -0.645) 3.518 7.977 ( -2.456 -0.000 -15.194) 15.391 8.209 ( 3.936 0.000 1.130) 4.095 8.513 ( 3.444 0.000 4.235) 5.459 10.724 ( -1.420 -0.000 -5.626) 5.802 10.772 ( -8.896 -0.000 25.272) 26.792 11.405 ( -3.569 -0.000 0.117) 3.571 11.572 ( -5.796 -0.000 0.639) 5.831 14.239 ( 1.922 0.000 -2.597) 3.231 15.298 ( 10.559 0.000 4.881) 11.633 15.502 ( -0.404 -0.000 -1.122) 1.192 15.700 ( 5.591 0.000 -1.321) 5.745 ======================= Grid point 496 (247/306) ======================= q-point: (-0.20 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -10.295 -3.647 8.816) 14.036 2.057 ( -14.768 0.435 -8.369) 16.980 2.332 ( 3.214 4.305 -4.831) 7.225 2.522 ( -2.862 -4.492 -4.898) 7.236 2.750 ( -14.727 1.135 3.564) 15.194 3.221 ( -12.768 1.962 15.051) 19.834 3.390 ( 9.706 0.123 -6.995) 11.965 3.994 ( -9.318 -1.764 0.321) 9.489 4.440 ( -15.347 0.543 22.281) 27.060 4.565 ( -8.506 1.040 -10.175) 13.303 5.032 ( 9.515 6.035 0.695) 11.289 5.195 ( 11.423 -7.970 1.987) 14.069 5.303 ( -7.877 -0.731 5.551) 9.664 6.174 ( 6.658 1.380 -8.770) 11.097 6.203 ( 4.085 4.138 -1.521) 6.011 6.394 ( 6.618 -4.044 -2.520) 8.155 6.936 ( 6.104 5.091 -10.286) 13.000 7.169 ( 1.456 -3.958 -6.799) 8.001 7.442 ( -2.081 -0.128 -1.308) 2.461 7.821 ( -0.610 0.207 -9.382) 9.404 8.290 ( 5.519 -2.654 -1.008) 6.206 8.586 ( 0.772 0.844 4.438) 4.583 10.667 ( -0.744 1.986 -0.775) 2.257 10.911 ( -4.782 -0.389 20.194) 20.757 11.349 ( -2.096 2.835 -0.573) 3.572 11.531 ( -6.868 -6.136 3.529) 9.863 14.242 ( 1.962 0.151 -2.228) 2.972 15.415 ( 5.072 2.254 0.392) 5.564 15.478 ( 0.234 1.394 -1.618) 2.149 15.800 ( 6.474 -0.749 -0.478) 6.535 ======================= Grid point 497 (248/306) ======================= q-point: (-0.10 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -14.113 -7.083 10.274) 18.839 1.767 ( -17.073 -4.519 -2.991) 17.913 2.272 ( -1.669 2.809 -5.366) 6.283 2.478 ( -2.720 0.033 0.051) 2.720 2.666 ( -0.622 -0.965 4.051) 4.211 3.143 ( -13.036 2.768 11.622) 17.682 3.418 ( 6.682 0.161 -9.176) 11.352 3.914 ( -8.605 -4.552 1.724) 9.886 4.189 ( -30.623 -2.646 13.792) 33.689 4.601 ( 1.911 2.368 7.053) 7.681 5.094 ( 3.178 6.088 1.039) 6.945 5.159 ( -16.416 1.180 8.199) 18.387 5.452 ( 13.533 -6.961 -5.038) 16.031 6.102 ( 9.342 2.756 -13.745) 16.846 6.293 ( 7.024 1.122 -0.126) 7.114 6.476 ( 4.226 -3.517 -5.664) 7.893 6.870 ( 7.326 4.955 -8.775) 12.459 7.168 ( 3.522 -3.392 -7.643) 9.073 7.415 ( -0.842 -0.646 0.054) 1.062 7.762 ( 2.700 0.345 -4.808) 5.526 8.393 ( 5.417 -5.424 -3.150) 8.287 8.602 ( -2.074 1.996 3.116) 4.242 10.630 ( -1.620 3.891 2.146) 4.730 11.042 ( -1.106 -1.664 7.337) 7.604 11.303 ( -0.598 4.232 5.763) 7.175 11.595 ( -1.475 -8.793 6.578) 11.080 14.238 ( 0.368 0.147 -2.049) 2.087 15.432 ( 0.807 4.618 2.597) 5.360 15.464 ( 2.128 -1.878 -5.335) 6.043 15.822 ( 0.623 3.605 -3.662) 5.177 ======================= Grid point 506 (249/306) ======================= q-point: (-0.20 -0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -16.100 -0.000 10.551) 19.249 1.717 ( -20.580 -0.000 -3.741) 20.917 2.323 ( -5.115 -0.000 -4.399) 6.746 2.451 ( 2.093 0.000 -3.062) 3.709 2.672 ( -2.545 -0.000 7.378) 7.805 3.181 ( -14.734 -0.000 10.987) 18.379 3.420 ( 7.797 0.000 -10.245) 12.875 3.858 ( -8.173 -0.000 0.570) 8.193 4.150 ( -33.446 -0.000 15.469) 36.850 4.625 ( 2.722 0.000 7.432) 7.915 5.142 ( -21.434 -0.000 8.538) 23.072 5.241 ( 13.219 0.000 -9.834) 16.476 5.330 ( 10.693 0.000 5.181) 11.882 6.137 ( 9.404 0.000 -16.806) 19.258 6.306 ( 5.647 0.000 0.671) 5.687 6.433 ( 4.988 0.000 -4.964) 7.037 6.943 ( 6.665 0.000 -9.620) 11.704 7.108 ( 2.068 0.000 -5.416) 5.797 7.412 ( -0.703 -0.000 -0.139) 0.717 7.767 ( 2.362 0.000 -3.746) 4.429 8.332 ( 5.743 0.000 -3.652) 6.806 8.623 ( -2.283 -0.000 3.464) 4.148 10.676 ( 0.256 0.000 0.377) 0.456 11.023 ( -0.991 -0.000 7.376) 7.442 11.388 ( 1.973 0.000 2.958) 3.555 11.458 ( -6.759 -0.000 13.058) 14.703 14.236 ( 1.220 0.000 -3.414) 3.625 15.440 ( 2.461 0.000 -4.954) 5.532 15.485 ( -0.461 -0.000 0.503) 0.682 15.866 ( 3.355 0.000 -3.196) 4.634 ======================= Grid point 507 (250/306) ======================= q-point: (-0.10 -0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -18.251 -6.816 12.892) 23.362 1.458 ( -18.255 -4.856 4.852) 19.503 2.139 ( -10.558 1.546 -4.089) 11.427 2.485 ( 5.048 -1.699 -1.925) 5.663 2.800 ( 6.769 1.739 8.932) 11.341 3.044 ( -16.579 -0.814 8.805) 18.790 3.418 ( 7.309 0.723 -9.900) 12.327 3.779 ( -6.586 -2.364 1.371) 7.131 3.927 ( -29.215 -2.220 25.335) 38.734 4.704 ( -2.218 2.757 7.592) 8.376 4.875 ( -24.638 -1.266 7.503) 25.786 5.284 ( 9.016 4.759 -6.374) 12.023 5.532 ( 10.487 -3.395 -1.962) 11.196 6.078 ( 6.194 0.195 -15.848) 17.016 6.376 ( 2.646 1.057 -9.276) 9.703 6.419 ( 7.971 -2.015 -5.712) 10.012 6.963 ( 8.515 3.715 -3.555) 9.947 7.112 ( 3.811 -3.860 -5.893) 8.010 7.426 ( 0.960 -0.029 2.567) 2.741 7.792 ( 4.408 0.602 -1.056) 4.572 8.371 ( 4.297 -2.787 -6.077) 7.947 8.587 ( -5.144 0.814 0.886) 5.283 10.666 ( -0.542 2.966 0.285) 3.028 10.998 ( -4.463 -1.126 -3.989) 6.091 11.474 ( 3.956 3.119 10.503) 11.649 11.660 ( 7.541 -5.533 15.089) 17.753 14.206 ( 0.062 -0.084 -4.199) 4.200 15.390 ( -1.487 -0.470 -8.599) 8.740 15.480 ( -0.192 1.195 1.114) 1.645 15.788 ( -4.836 3.225 -5.251) 7.834 ======================= Grid point 517 (251/306) ======================= q-point: (-0.10 -0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( -20.459 -0.000 14.967) 25.349 1.332 ( -9.976 -0.000 12.771) 16.206 1.960 ( -9.228 -0.000 -2.777) 9.637 2.539 ( 6.593 0.000 -2.808) 7.166 2.912 ( -15.035 -0.000 14.718) 21.040 3.028 ( 9.255 0.000 8.835) 12.795 3.423 ( 9.027 0.000 -13.426) 16.179 3.710 ( -5.057 -0.000 2.805) 5.783 3.840 ( -26.088 -0.000 35.729) 44.239 4.597 ( -21.666 -0.000 7.677) 22.986 4.757 ( -2.748 -0.000 4.344) 5.140 5.335 ( 4.751 0.000 -6.080) 7.716 5.618 ( 6.327 0.000 -2.647) 6.859 5.968 ( 4.799 0.000 -19.366) 19.952 6.236 ( -1.787 -0.000 -13.106) 13.228 6.523 ( 12.262 0.000 -6.344) 13.806 7.067 ( 2.168 0.000 -5.589) 5.995 7.101 ( 8.932 0.000 -0.825) 8.970 7.492 ( 3.274 0.000 3.969) 5.145 7.860 ( 4.263 0.000 0.841) 4.345 8.328 ( 1.974 0.000 -8.328) 8.559 8.501 ( -6.113 -0.000 -1.424) 6.277 10.674 ( -0.082 -0.000 -1.405) 1.407 10.843 ( -7.459 -0.000 -5.752) 9.419 11.667 ( 3.122 0.000 14.163) 14.503 11.990 ( 20.700 0.000 11.209) 23.540 14.158 ( 0.546 0.000 -5.398) 5.426 15.181 ( -13.451 -0.000 -13.704) 19.202 15.493 ( 0.003 0.000 1.022) 1.022 15.665 ( -6.452 -0.000 -2.362) 6.871 ======================= Grid point 518 (252/306) ======================= q-point: ( 0.00 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( -1.819 -0.000 10.045) 10.209 1.600 ( 4.892 0.000 -3.019) 5.748 2.001 ( -5.716 -0.000 14.240) 15.345 2.327 ( 4.751 0.000 -15.931) 16.624 3.212 ( 3.166 0.000 0.853) 3.279 3.276 ( -2.047 -0.000 -3.772) 4.292 3.510 ( -0.641 -0.000 15.630) 15.643 3.714 ( 1.991 0.000 -4.466) 4.890 4.498 ( 2.863 0.000 1.564) 3.262 4.510 ( -15.468 -0.000 0.979) 15.499 4.789 ( -2.221 -0.000 23.517) 23.621 5.229 ( 2.128 0.000 -17.599) 17.727 5.450 ( 0.002 0.000 7.886) 7.886 5.693 ( 2.071 0.000 -13.559) 13.716 5.842 ( 1.316 0.000 12.450) 12.519 6.189 ( 5.455 0.000 -20.856) 21.557 7.052 ( -2.004 -0.000 4.923) 5.315 7.166 ( 3.237 0.000 -5.547) 6.423 7.797 ( 0.508 0.000 7.414) 7.432 7.968 ( 0.175 0.000 -8.870) 8.872 8.115 ( 4.816 0.000 4.753) 6.766 8.217 ( -3.510 -0.000 -5.257) 6.321 10.529 ( -4.054 -0.000 0.670) 4.109 10.565 ( 1.732 0.000 -2.593) 3.118 12.333 ( -12.360 -0.000 16.722) 20.793 12.629 ( 19.929 0.000 -11.865) 23.193 14.102 ( 13.250 0.000 -1.062) 13.293 14.111 ( -23.358 -0.000 -2.144) 23.456 15.554 ( 2.076 0.000 0.361) 2.108 15.560 ( -1.049 -0.000 -0.275) 1.084 ======================= Grid point 519 (253/306) ======================= q-point: ( 0.10 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 5.382 -2.625 1.334) 6.135 1.725 ( 13.798 -10.179 -5.302) 17.947 2.069 ( -7.396 -0.013 15.867) 17.506 2.214 ( 2.888 0.222 -14.645) 14.928 3.189 ( -4.301 -0.783 -3.388) 5.531 3.263 ( 0.178 -0.552 2.058) 2.138 3.651 ( 1.857 0.134 6.077) 6.356 3.675 ( 3.714 -1.025 -8.899) 9.697 4.328 ( -15.876 -0.229 8.864) 18.184 4.560 ( -1.354 -0.681 4.714) 4.951 5.012 ( 1.352 0.310 18.953) 19.004 5.146 ( 12.235 -0.198 -15.146) 19.472 5.472 ( -5.207 6.015 5.192) 9.500 5.587 ( 2.761 -0.629 -7.673) 8.179 6.006 ( 1.336 -1.012 6.300) 6.519 6.089 ( 8.027 -4.225 -15.123) 17.635 7.050 ( -4.318 2.092 4.594) 6.643 7.143 ( 2.676 -0.388 -6.502) 7.042 7.882 ( -0.337 -1.288 0.234) 1.352 7.894 ( -0.115 -2.358 -1.002) 2.565 8.108 ( -2.776 0.981 -5.979) 6.665 8.240 ( 6.624 0.480 4.005) 7.755 10.505 ( -2.846 -0.490 3.584) 4.603 10.586 ( 3.066 -0.226 -0.195) 3.080 12.251 ( -16.514 1.330 10.136) 19.422 12.653 ( 7.271 3.164 -19.952) 21.470 13.860 ( -14.246 -1.213 7.306) 16.056 14.343 ( 15.518 -0.109 6.010) 16.641 15.550 ( 0.447 0.270 -0.880) 1.023 15.605 ( 4.220 -1.318 -0.541) 4.454 ======================= Grid point 520 (254/306) ======================= q-point: ( 0.20 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( 7.095 -2.916 -4.376) 8.832 2.028 ( 15.267 -14.471 -8.433) 22.663 2.103 ( -5.917 0.866 9.484) 11.212 2.140 ( 1.823 -3.035 -4.483) 5.712 3.120 ( -4.604 -2.129 0.125) 5.074 3.248 ( -2.786 0.926 -1.727) 3.406 3.603 ( 3.468 -1.782 -12.813) 13.393 3.720 ( 1.788 0.375 -1.439) 2.326 4.293 ( -10.479 -1.041 20.612) 23.147 4.542 ( -5.894 -0.527 1.514) 6.108 5.187 ( 5.697 2.268 8.195) 10.235 5.258 ( 9.208 2.458 -2.921) 9.968 5.365 ( 6.556 2.743 -5.476) 8.972 5.616 ( -0.681 -2.628 3.912) 4.762 5.992 ( 5.419 -0.786 -10.979) 12.269 6.196 ( 1.729 -4.358 3.685) 5.963 6.978 ( -7.356 3.714 3.616) 8.999 7.124 ( 3.124 -1.447 -6.786) 7.609 7.812 ( -0.307 -2.364 -9.374) 9.672 7.921 ( -4.330 3.242 -0.847) 5.476 8.065 ( 0.970 -4.411 3.337) 5.616 8.375 ( 7.999 1.269 3.354) 8.766 10.520 ( -1.838 -0.944 3.743) 4.276 10.661 ( 3.767 -0.664 4.470) 5.883 12.079 ( -14.460 2.582 4.217) 15.282 12.384 ( -6.897 5.459 -19.256) 21.170 13.868 ( -2.643 -3.828 9.135) 10.251 14.643 ( 13.505 0.004 10.393) 17.041 15.543 ( 1.230 1.055 -1.514) 2.218 15.679 ( 5.053 -1.416 -1.410) 5.434 ======================= Grid point 521 (255/306) ======================= q-point: ( 0.30 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( 6.201 -3.562 -4.832) 8.631 2.063 ( 0.755 -0.578 -3.696) 3.816 2.133 ( -7.280 -1.383 9.586) 12.116 2.344 ( 13.249 -14.273 -10.487) 22.119 3.111 ( -2.625 -2.223 3.461) 4.879 3.127 ( -4.073 2.298 -7.843) 9.131 3.515 ( -2.191 0.637 -6.639) 7.020 3.764 ( 7.042 -3.954 -2.381) 8.420 4.433 ( -5.993 -1.430 17.103) 18.179 4.469 ( -6.648 -0.589 7.171) 9.796 5.205 ( 4.675 6.767 -4.089) 9.186 5.297 ( 3.874 4.051 4.142) 6.969 5.531 ( 18.561 -2.344 -11.483) 21.952 5.683 ( -4.448 -4.976 8.104) 10.498 5.985 ( 2.991 -0.346 -2.251) 3.759 6.276 ( 1.989 -2.867 0.507) 3.526 6.848 ( -8.428 3.801 1.492) 9.365 7.119 ( 2.590 -2.172 -5.945) 6.839 7.734 ( -1.085 -1.405 -7.222) 7.437 7.769 ( -3.980 4.351 -6.269) 8.606 8.205 ( 1.599 -6.121 6.732) 9.238 8.501 ( 7.774 2.785 2.509) 8.630 10.545 ( -0.846 -0.751 3.011) 3.216 10.794 ( 3.314 -2.040 8.285) 9.153 11.858 ( -11.269 6.812 -4.808) 14.018 12.050 ( -9.281 2.240 -9.331) 13.350 13.997 ( 1.250 -4.939 7.151) 8.780 14.925 ( 9.118 -0.694 11.527) 14.714 15.530 ( 1.800 1.929 -2.270) 3.480 15.736 ( 4.009 -0.280 -2.382) 4.671 ======================= Grid point 522 (256/306) ======================= q-point: ( 0.40 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( 2.961 -4.175 -1.995) 5.493 2.036 ( -0.117 1.275 -2.372) 2.696 2.153 ( -4.184 -2.163 7.529) 8.881 2.492 ( 4.329 -8.642 -8.075) 12.595 2.933 ( -3.505 4.919 -9.949) 11.639 3.159 ( -0.344 -3.089 2.793) 4.179 3.429 ( -3.135 1.374 0.381) 3.444 3.943 ( 11.438 -7.047 -1.500) 13.518 4.350 ( -7.820 1.562 0.671) 8.003 4.627 ( -8.325 -4.577 23.024) 24.907 5.171 ( 1.622 4.547 -2.279) 5.338 5.347 ( 10.531 5.086 -3.654) 12.253 5.580 ( 0.135 3.005 -2.434) 3.869 5.754 ( 3.339 -6.357 -6.812) 9.898 6.060 ( 2.050 -0.743 8.845) 9.110 6.343 ( 5.463 -1.888 -2.863) 6.450 6.714 ( -5.656 2.012 -0.953) 6.078 7.113 ( 1.327 -1.802 -4.668) 5.177 7.607 ( -4.585 4.234 -2.994) 6.922 7.672 ( 1.094 -1.289 -7.825) 8.006 8.356 ( 1.371 -5.898 5.544) 8.210 8.579 ( 5.725 4.498 0.723) 7.316 10.571 ( -0.650 -0.671 2.597) 2.760 10.962 ( 3.100 -3.396 9.288) 10.364 11.540 ( -10.627 6.847 -8.320) 15.134 11.892 ( -3.497 1.883 -2.469) 4.677 14.130 ( 1.359 -4.351 4.634) 6.500 15.150 ( 4.141 -2.226 10.392) 11.406 15.507 ( 2.377 2.786 -3.381) 4.985 15.748 ( 1.899 0.389 -3.116) 3.670 ======================= Grid point 523 (257/306) ======================= q-point: (-0.50 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( -2.607 -3.835 0.392) 4.654 1.976 ( -4.214 2.209 0.928) 4.847 2.223 ( 4.588 1.133 3.230) 5.724 2.495 ( -3.154 -2.434 -3.077) 5.034 2.762 ( -1.673 3.495 -4.639) 6.045 3.206 ( 0.592 -1.460 1.079) 1.909 3.396 ( -1.814 1.285 1.623) 2.752 4.123 ( 1.328 -0.397 -0.802) 1.602 4.244 ( -1.710 -3.533 -0.553) 3.964 4.774 ( -11.554 -6.287 20.992) 24.773 5.093 ( -2.235 4.501 -1.588) 5.270 5.385 ( 10.989 6.094 -9.162) 15.551 5.496 ( -13.764 -0.272 8.205) 16.026 5.783 ( 11.034 -0.605 -10.556) 15.282 6.201 ( 2.778 -1.500 6.370) 7.109 6.384 ( 5.566 -0.839 -8.112) 9.874 6.647 ( -0.430 -0.200 -1.107) 1.204 7.101 ( 1.408 -0.620 -3.392) 3.725 7.502 ( -2.374 2.528 -0.197) 3.473 7.639 ( 2.249 -1.024 -5.041) 5.614 8.465 ( 0.832 -2.821 2.377) 3.782 8.588 ( 2.100 3.524 -0.704) 4.162 10.591 ( -1.158 -0.980 1.904) 2.435 11.139 ( 3.281 -3.305 7.945) 9.210 11.286 ( -6.408 3.620 -4.852) 8.815 11.830 ( 0.262 3.106 -0.349) 3.136 14.208 ( 0.088 -1.984 1.452) 2.460 15.307 ( 0.815 -3.607 7.243) 8.132 15.465 ( 1.665 2.818 -5.053) 6.020 15.727 ( -0.301 -0.352 -2.250) 2.297 ======================= Grid point 524 (258/306) ======================= q-point: (-0.40 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -8.201 3.135 0.646) 8.803 1.940 ( -5.940 -0.854 6.851) 9.107 2.279 ( 7.437 9.827 -1.181) 12.380 2.405 ( -6.627 -1.205 -1.780) 6.967 2.765 ( 3.066 -1.266 5.482) 6.408 3.229 ( 2.645 0.447 -2.084) 3.397 3.365 ( -4.342 2.331 3.984) 6.338 3.971 ( -8.891 4.268 -2.796) 10.251 4.337 ( 0.315 -4.062 2.215) 4.637 4.841 ( -15.839 -6.999 15.102) 22.977 5.021 ( 1.722 4.571 -1.332) 5.063 5.343 ( -15.616 -1.540 5.973) 16.790 5.398 ( 5.289 2.835 -2.957) 6.690 5.861 ( 13.512 2.474 -9.626) 16.774 6.248 ( -0.296 -0.734 -3.994) 4.071 6.358 ( 3.375 1.107 -7.830) 8.598 6.697 ( 6.325 -2.738 0.118) 6.893 7.095 ( 2.104 0.941 -2.711) 3.558 7.487 ( -0.726 0.994 4.660) 4.819 7.658 ( 4.403 -1.652 -2.761) 5.454 8.454 ( 1.009 5.316 -3.834) 6.632 8.582 ( -2.754 -2.872 0.394) 3.999 10.596 ( -1.878 -1.726 0.413) 2.584 11.097 ( -4.279 3.746 -3.848) 6.866 11.370 ( 6.517 -5.121 8.301) 11.730 11.835 ( 3.560 3.157 2.943) 5.595 14.201 ( -1.208 0.742 -2.106) 2.539 15.349 ( -1.010 1.095 -8.167) 8.302 15.429 ( -1.437 -3.227 3.682) 5.102 15.710 ( -1.805 -1.418 0.125) 2.299 ======================= Grid point 525 (259/306) ======================= q-point: (-0.30 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( -9.636 4.942 5.306) 12.059 1.923 ( -6.854 4.647 9.592) 12.672 2.150 ( -11.035 10.700 5.696) 16.392 2.377 ( 8.900 -0.599 -10.646) 13.889 2.941 ( 5.986 -2.668 9.493) 11.535 3.225 ( 5.519 2.280 -7.337) 9.460 3.311 ( -9.062 3.740 11.332) 14.984 3.802 ( -4.439 2.274 -3.234) 5.945 4.372 ( -6.713 -1.013 10.365) 12.391 4.769 ( -13.159 -5.532 -0.850) 14.300 5.003 ( -4.896 2.895 7.563) 9.463 5.225 ( -12.199 -2.823 8.282) 15.013 5.451 ( 9.251 0.448 -5.944) 11.005 5.861 ( 5.532 4.875 -10.154) 12.549 6.139 ( -2.178 0.164 -12.108) 12.303 6.339 ( 5.407 1.034 -4.871) 7.350 6.858 ( 9.350 -3.917 0.466) 10.148 7.079 ( 1.396 1.861 -2.349) 3.306 7.542 ( -0.044 0.820 7.924) 7.967 7.741 ( 6.087 -2.782 -0.397) 6.705 8.344 ( 0.277 6.093 -6.598) 8.985 8.545 ( -5.518 -2.303 -1.594) 6.188 10.584 ( -2.196 -2.554 -1.039) 3.525 10.951 ( -3.620 3.860 -6.220) 8.166 11.641 ( 7.973 -5.581 12.774) 16.059 11.937 ( 9.194 2.277 4.755) 10.598 14.127 ( -1.221 2.018 -5.224) 5.731 15.167 ( -8.323 -0.623 -11.989) 14.608 15.482 ( -0.448 -2.142 2.461) 3.293 15.697 ( -3.303 -1.056 1.136) 3.649 ======================= Grid point 526 (260/306) ======================= q-point: (-0.20 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( -7.850 4.509 8.155) 12.184 1.798 ( -13.881 15.417 13.882) 24.961 1.981 ( -8.169 1.370 4.357) 9.359 2.401 ( 10.126 0.081 -12.395) 16.006 3.142 ( 5.558 -1.278 5.776) 8.117 3.204 ( 5.327 1.443 -4.916) 7.391 3.296 ( -6.450 3.841 15.095) 16.858 3.730 ( -1.221 0.247 -1.197) 1.727 4.419 ( -7.204 -1.974 15.508) 17.213 4.613 ( -5.712 -0.655 -6.180) 8.441 4.933 ( -19.920 0.861 15.625) 25.332 5.234 ( 1.721 -3.792 0.511) 4.195 5.495 ( 6.093 -1.879 -10.152) 11.988 5.739 ( 2.079 7.994 -7.219) 10.970 5.979 ( -3.911 -1.148 -9.970) 10.771 6.358 ( 7.726 0.968 -9.425) 12.226 7.008 ( 2.256 -1.913 2.306) 3.751 7.069 ( 5.712 0.039 -3.521) 6.710 7.622 ( 0.650 1.096 8.423) 8.518 7.868 ( 5.661 -2.746 2.209) 6.668 8.210 ( 0.048 4.917 -8.289) 9.637 8.446 ( -6.476 -0.760 -3.314) 7.314 10.568 ( -1.961 -3.080 -1.771) 4.058 10.787 ( -3.824 4.022 -6.649) 8.660 11.959 ( 5.765 -5.159 17.336) 18.984 12.142 ( 15.947 1.189 2.657) 16.211 14.036 ( 1.068 1.643 -7.187) 7.449 14.879 ( -15.675 -1.861 -12.634) 20.218 15.513 ( -0.034 -0.694 1.460) 1.617 15.654 ( -4.259 0.628 0.881) 4.394 ======================= Grid point 527 (261/306) ======================= q-point: (-0.10 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -9.296 6.324 10.888) 15.651 1.617 ( -5.663 7.382 6.291) 11.231 1.954 ( -5.536 0.373 9.724) 11.196 2.394 ( 7.779 -0.213 -14.136) 16.136 3.177 ( 4.585 1.316 -3.851) 6.131 3.293 ( 3.352 -0.138 0.418) 3.381 3.365 ( -3.893 1.310 18.193) 18.651 3.718 ( -0.071 -0.082 0.054) 0.122 4.476 ( -1.721 -2.580 -0.653) 3.170 4.584 ( 2.138 1.811 10.002) 10.387 4.753 ( -23.720 0.847 13.659) 27.385 5.337 ( 0.706 -4.142 5.970) 7.300 5.405 ( 1.993 -1.018 -18.975) 19.106 5.695 ( 7.525 5.285 -1.008) 9.251 5.848 ( -5.178 -1.063 -4.729) 7.093 6.315 ( 6.035 1.201 -16.044) 17.184 7.028 ( -1.959 -0.322 3.916) 4.390 7.146 ( 6.290 -1.132 -4.281) 7.692 7.711 ( 1.213 0.876 7.748) 7.891 7.994 ( 4.350 -1.599 3.637) 5.891 8.079 ( 0.094 3.227 -8.486) 9.080 8.325 ( -5.183 -0.368 -4.273) 6.728 10.557 ( -1.684 -3.103 -1.689) 3.914 10.635 ( -2.959 3.653 -4.601) 6.578 12.232 ( -2.559 -2.845 20.231) 20.590 12.401 ( 21.198 -0.018 -3.826) 21.540 14.002 ( 6.625 0.468 -6.447) 9.257 14.505 ( -21.779 -1.006 -9.744) 23.880 15.531 ( 0.585 0.149 0.979) 1.150 15.595 ( -3.268 0.945 0.397) 3.425 ======================= Grid point 529 (262/306) ======================= q-point: ( 0.10 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 11.251 0.000 -3.735) 11.855 1.778 ( 15.936 0.000 -9.714) 18.663 2.110 ( -9.872 -0.000 15.564) 18.431 2.124 ( 3.213 0.000 -9.895) 10.404 3.095 ( -3.970 -0.000 -1.290) 4.174 3.261 ( -1.745 -0.000 -0.820) 1.928 3.583 ( 4.707 0.000 -14.797) 15.528 3.726 ( 0.825 0.000 -0.048) 0.827 4.282 ( -11.354 -0.000 20.917) 23.800 4.536 ( -5.901 -0.000 2.355) 6.353 5.218 ( 1.299 0.000 14.912) 14.968 5.252 ( 20.704 0.000 -10.536) 23.231 5.499 ( 4.584 0.000 -9.634) 10.669 5.500 ( -7.807 -0.000 5.856) 9.759 6.012 ( 10.328 0.000 -14.835) 18.076 6.130 ( -0.753 -0.000 9.883) 9.912 7.023 ( -6.863 -0.000 2.731) 7.386 7.106 ( 2.080 0.000 -5.941) 6.295 7.786 ( 0.210 0.000 -8.895) 8.897 7.966 ( -0.191 -0.000 9.099) 9.101 8.004 ( -3.098 -0.000 -6.896) 7.560 8.390 ( 8.819 0.000 3.077) 9.340 10.510 ( -2.507 -0.000 5.300) 5.863 10.655 ( 4.390 0.000 3.006) 5.320 12.103 ( -14.186 -0.000 4.283) 14.818 12.443 ( -6.809 -0.000 -21.559) 22.609 13.827 ( -3.668 -0.000 10.064) 10.711 14.644 ( 12.531 0.000 11.718) 17.156 15.559 ( 2.032 0.000 -1.799) 2.714 15.660 ( 5.475 0.000 -1.000) 5.565 ======================= Grid point 530 (263/306) ======================= q-point: ( 0.20 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( 8.769 3.701 -7.136) 11.896 1.963 ( 8.943 -9.597 -9.324) 16.094 2.112 ( -2.924 0.477 4.467) 5.361 2.149 ( 3.610 -3.590 3.639) 6.258 3.059 ( -2.779 -1.314 2.193) 3.776 3.187 ( -1.198 1.766 -7.349) 7.653 3.522 ( 6.646 -0.048 -12.776) 14.401 3.706 ( -2.123 -1.409 0.826) 2.679 4.404 ( -9.082 -0.850 25.936) 27.494 4.464 ( -6.321 -0.070 1.383) 6.471 5.333 ( 6.784 3.430 -2.243) 7.926 5.376 ( -4.753 4.836 6.863) 9.648 5.485 ( 23.845 -1.527 -13.986) 27.686 5.561 ( -0.750 -6.143 2.339) 6.615 6.019 ( 5.777 2.302 -3.843) 7.310 6.213 ( 0.005 -2.569 4.756) 5.405 6.914 ( -9.021 1.952 0.831) 9.267 7.082 ( 1.694 -1.064 -4.969) 5.356 7.707 ( 0.920 -0.753 -8.564) 8.646 7.860 ( -4.138 3.488 -6.046) 8.114 8.083 ( 0.216 -4.508 7.532) 8.781 8.547 ( 9.871 1.305 1.995) 10.155 10.537 ( -2.263 -0.111 5.961) 6.377 10.767 ( 4.303 -0.635 5.721) 7.186 11.958 ( -7.656 2.560 -1.071) 8.143 12.080 ( -12.174 0.741 -16.662) 20.649 13.918 ( -0.016 -2.194 8.714) 8.986 14.919 ( 7.250 -0.118 13.038) 14.919 15.563 ( 2.382 1.001 -2.483) 3.584 15.729 ( 5.104 -0.221 -1.275) 5.266 ======================= Grid point 531 (264/306) ======================= q-point: ( 0.30 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( 2.258 -1.221 -2.406) 3.518 2.037 ( 4.159 -3.692 -3.550) 6.597 2.102 ( -3.466 1.260 4.390) 5.734 2.328 ( 7.997 -7.670 -1.955) 11.252 3.024 ( -1.252 3.512 -7.782) 8.629 3.111 ( 1.822 -1.183 -0.379) 2.205 3.483 ( 2.408 3.554 -3.694) 5.663 3.785 ( 4.844 -7.672 1.655) 9.223 4.375 ( -8.550 0.797 2.670) 8.993 4.539 ( -12.430 -3.416 23.866) 27.125 5.264 ( -2.596 3.926 -1.858) 5.060 5.434 ( 9.789 2.900 -1.803) 10.368 5.602 ( -5.514 -1.631 4.844) 7.519 5.669 ( 22.811 -0.929 -19.323) 29.909 6.066 ( 1.335 1.216 7.730) 7.938 6.296 ( 4.379 -2.371 0.311) 4.989 6.763 ( -8.064 2.263 -0.837) 8.417 7.072 ( 0.950 -1.801 -3.614) 4.148 7.649 ( 2.505 -0.716 -8.725) 9.106 7.700 ( -4.792 4.210 -3.807) 7.428 8.215 ( 0.339 -6.548 5.560) 8.597 8.667 ( 8.100 3.301 -0.032) 8.747 10.568 ( -1.852 0.188 5.373) 5.686 10.905 ( 3.548 -2.011 7.298) 8.360 11.667 ( -12.333 4.971 -11.204) 17.388 11.917 ( 0.077 0.592 -4.181) 4.224 14.034 ( -0.172 -4.104 6.936) 8.061 15.119 ( 2.315 -0.994 11.343) 11.619 15.554 ( 2.253 1.631 -3.167) 4.215 15.766 ( 2.436 1.165 -1.655) 3.167 ======================= Grid point 532 (265/306) ======================= q-point: ( 0.40 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( -4.401 -3.366 4.268) 6.994 2.046 ( -1.644 4.118 0.857) 4.516 2.146 ( 5.341 -5.226 -1.361) 7.596 2.462 ( 3.865 -4.162 0.269) 5.686 2.875 ( 1.142 7.497 -7.584) 10.725 3.177 ( 3.724 -1.468 0.702) 4.064 3.454 ( 1.022 4.379 1.347) 4.694 3.993 ( 7.252 -9.441 1.681) 12.023 4.245 ( -12.806 1.459 3.831) 13.446 4.628 ( -14.531 -7.162 20.014) 25.749 5.170 ( -2.118 3.115 -1.826) 4.186 5.454 ( -10.130 -0.862 4.817) 11.250 5.563 ( 9.754 7.514 -11.022) 16.525 5.784 ( 17.067 0.197 -10.824) 20.212 6.181 ( 1.665 -0.457 8.648) 8.819 6.366 ( 5.297 -0.706 -4.941) 7.278 6.652 ( -2.910 0.507 -1.045) 3.133 7.073 ( 1.047 -1.728 -2.065) 2.889 7.567 ( -0.605 3.362 -4.666) 5.783 7.625 ( 1.345 -0.270 -3.301) 3.575 8.336 ( 0.176 -7.183 3.015) 7.792 8.698 ( 4.250 4.906 -2.800) 7.069 10.586 ( -2.087 0.433 3.878) 4.426 11.063 ( 4.012 -3.489 7.215) 8.963 11.373 ( -9.280 4.058 -5.754) 11.649 11.891 ( 4.936 2.675 -5.158) 7.624 14.131 ( -1.520 -4.652 4.775) 6.837 15.250 ( -0.437 -2.178 8.694) 8.973 15.518 ( 0.877 2.364 -4.952) 5.557 15.743 ( -0.692 1.643 -1.397) 2.266 ======================= Grid point 533 (266/306) ======================= q-point: (-0.50 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -6.510 -2.307 5.156) 8.619 1.976 ( -5.350 4.287 5.378) 8.714 2.259 ( 7.150 -5.472 -6.754) 11.256 2.552 ( 3.585 4.659 5.780) 8.245 2.769 ( 1.151 4.686 -0.811) 4.893 3.247 ( 5.617 1.129 -0.788) 5.783 3.441 ( 0.407 5.075 3.114) 5.968 4.035 ( -11.951 1.856 -0.626) 12.111 4.206 ( -0.103 -7.973 5.718) 9.812 4.671 ( -16.944 -9.096 13.912) 23.736 5.113 ( -0.440 3.899 1.031) 4.057 5.332 ( -15.572 -0.097 8.369) 17.679 5.484 ( 8.956 5.801 -13.866) 17.496 5.920 ( 14.496 2.846 -5.893) 15.905 6.239 ( -1.085 -0.090 -1.053) 1.514 6.369 ( 5.588 0.185 -8.213) 9.936 6.657 ( 3.067 -1.365 0.752) 3.440 7.094 ( 1.902 -0.887 -1.186) 2.410 7.520 ( 0.757 2.193 1.255) 2.638 7.635 ( 3.704 -0.629 -2.490) 4.508 8.420 ( -0.229 -5.662 -0.244) 5.672 8.636 ( 0.349 5.183 -4.620) 6.952 10.577 ( -3.153 -0.040 2.018) 3.744 11.181 ( -3.456 3.927 -2.064) 5.624 11.262 ( 4.396 -4.693 6.918) 9.445 11.898 ( 7.157 2.647 -4.033) 8.631 14.174 ( -3.246 -3.155 1.919) 4.917 15.347 ( -0.378 -3.062 6.098) 6.834 15.403 ( -3.775 2.943 -8.544) 9.793 15.706 ( -1.884 0.552 0.597) 2.052 ======================= Grid point 534 (267/306) ======================= q-point: (-0.40 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( -6.801 2.721 4.077) 8.383 1.951 ( -5.171 1.668 9.602) 11.033 2.307 ( 3.357 -2.895 -7.718) 8.900 2.501 ( -0.595 16.148 4.015) 16.650 2.871 ( 5.962 -4.581 7.034) 10.297 3.287 ( 6.958 3.724 -4.594) 9.132 3.420 ( -3.351 6.982 9.318) 12.116 3.840 ( -8.716 1.241 -2.495) 9.150 4.309 ( -7.092 -5.220 10.226) 13.495 4.628 ( -13.150 -7.751 4.306) 15.860 5.094 ( 1.019 2.057 0.947) 2.484 5.174 ( -17.452 2.633 9.347) 19.971 5.469 ( 8.492 0.360 -8.326) 11.898 5.971 ( 6.848 5.674 -6.202) 10.842 6.151 ( -1.327 0.852 -10.884) 10.998 6.357 ( 4.838 0.508 -5.930) 7.671 6.779 ( 8.252 -3.522 0.830) 9.010 7.104 ( 0.932 0.555 -1.590) 1.924 7.564 ( 1.281 1.317 7.051) 7.287 7.693 ( 5.725 -1.669 -1.417) 6.130 8.425 ( -0.221 -0.301 -5.009) 5.023 8.528 ( -2.842 2.337 -3.956) 5.403 10.545 ( -4.049 -1.008 1.207) 4.344 11.048 ( -2.214 5.657 -5.283) 8.051 11.506 ( 7.162 -7.099 10.416) 14.498 11.975 ( 10.230 0.877 -0.990) 10.315 14.144 ( -4.086 -0.705 -1.077) 4.284 15.174 ( -10.138 1.906 -10.874) 14.988 15.431 ( 0.975 -2.546 3.496) 4.434 15.688 ( -2.424 -0.068 1.787) 3.012 ======================= Grid point 535 (268/306) ======================= q-point: (-0.30 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -4.155 5.906 6.957) 10.027 1.960 ( -4.841 1.831 8.461) 9.919 2.186 ( -11.530 13.177 5.684) 18.409 2.410 ( 8.032 3.210 -10.770) 13.814 3.094 ( 6.797 -4.072 7.616) 10.990 3.267 ( 3.525 4.628 -4.229) 7.193 3.410 ( -3.979 7.609 13.340) 15.864 3.736 ( -1.258 0.178 -2.717) 2.999 4.347 ( -11.921 -4.916 14.862) 19.676 4.586 ( -1.387 -2.379 -1.271) 3.033 4.983 ( -20.013 3.575 12.859) 24.055 5.135 ( 1.766 -4.082 -0.238) 4.454 5.477 ( 5.686 -0.714 -12.227) 13.503 5.892 ( 2.877 5.666 -9.453) 11.391 5.986 ( -3.850 3.051 -6.406) 8.072 6.376 ( 6.995 0.560 -7.605) 10.348 6.946 ( 7.346 -3.672 0.707) 8.243 7.080 ( 0.367 0.797 -2.277) 2.440 7.654 ( 0.797 1.886 9.781) 9.993 7.805 ( 6.981 -2.983 0.498) 7.608 8.322 ( 0.140 5.134 -8.136) 9.621 8.428 ( -5.093 -0.778 -3.924) 6.476 10.514 ( -4.075 -1.792 1.518) 4.704 10.888 ( -1.697 5.900 -8.192) 10.237 11.816 ( 6.109 -8.355 14.474) 17.794 12.150 ( 14.594 -1.021 -0.367) 14.634 14.067 ( -2.408 0.968 -3.262) 4.169 14.858 ( -15.777 0.709 -11.207) 19.365 15.496 ( 1.724 -1.055 1.549) 2.547 15.666 ( -3.201 0.357 1.605) 3.599 ======================= Grid point 536 (269/306) ======================= q-point: (-0.20 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 1.303 8.817 6.743) 11.176 1.893 ( -12.317 16.209 8.168) 21.935 1.973 ( -5.526 2.208 8.561) 10.426 2.382 ( 7.447 -0.772 -14.956) 16.725 3.232 ( 1.858 3.543 -1.035) 4.132 3.275 ( 5.436 -2.003 1.813) 6.071 3.429 ( -3.407 5.250 14.484) 15.778 3.720 ( 1.063 0.503 -0.772) 1.407 4.402 ( -4.102 -4.127 8.585) 10.370 4.626 ( 5.079 1.628 2.816) 6.031 4.784 ( -24.128 2.062 15.550) 28.779 5.221 ( 0.059 -5.599 3.856) 6.798 5.384 ( 4.408 -1.194 -19.243) 19.778 5.753 ( 0.475 -1.609 -15.782) 15.871 5.907 ( -0.064 8.105 6.961) 10.684 6.351 ( 5.527 1.929 -12.803) 14.077 7.018 ( -3.700 -0.599 4.840) 6.122 7.108 ( 8.002 -2.186 -5.989) 10.231 7.746 ( 0.765 2.396 9.735) 10.055 7.949 ( 6.270 -2.563 2.630) 7.266 8.178 ( 0.545 5.781 -9.043) 10.747 8.311 ( -5.697 -0.960 -4.686) 7.439 10.501 ( -3.320 -1.964 2.413) 4.549 10.722 ( -1.280 4.861 -8.012) 9.458 12.122 ( -0.139 -7.616 17.851) 19.408 12.381 ( 17.897 -2.591 -4.695) 18.683 14.018 ( 2.616 0.972 -3.027) 4.117 14.490 ( -19.175 0.554 -9.307) 21.321 15.538 ( 2.253 0.362 0.620) 2.365 15.621 ( -3.404 1.244 0.763) 3.703 ======================= Grid point 537 (270/306) ======================= q-point: (-0.10 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -1.960 14.145 7.024) 15.914 1.705 ( 4.516 9.011 -0.227) 10.081 2.005 ( -5.269 0.404 13.144) 14.167 2.317 ( 4.875 -0.859 -15.993) 16.741 3.229 ( 0.658 1.309 1.619) 2.184 3.293 ( -0.337 1.484 -3.698) 3.999 3.528 ( -0.086 1.911 14.347) 14.474 3.717 ( 2.345 0.380 -4.442) 5.038 4.475 ( -2.693 -0.826 4.550) 5.352 4.542 ( -11.027 1.759 1.861) 11.320 4.800 ( -1.385 1.018 21.151) 21.221 5.209 ( 1.159 -1.873 -14.274) 14.443 5.383 ( 1.204 -5.101 4.718) 7.052 5.640 ( 2.472 -4.462 -15.508) 16.325 5.932 ( 1.249 7.301 10.873) 13.156 6.230 ( 4.852 3.425 -18.183) 19.128 7.029 ( -3.693 -1.859 5.440) 6.833 7.156 ( 5.038 -0.904 -6.427) 8.216 7.824 ( 0.199 2.525 8.748) 9.108 8.013 ( 1.010 3.657 -8.591) 9.391 8.107 ( 4.873 -0.356 3.172) 5.825 8.201 ( -4.148 -1.519 -5.182) 6.810 10.508 ( -2.739 -1.077 3.591) 4.643 10.602 ( 0.391 2.761 -5.334) 6.019 12.290 ( -11.130 -4.231 16.672) 20.488 12.591 ( 17.784 -4.016 -12.403) 22.051 14.057 ( -7.625 -1.620 4.048) 8.784 14.163 ( -1.579 2.984 -6.372) 7.211 15.566 ( 0.074 0.993 0.448) 1.092 15.575 ( 0.937 1.238 -0.424) 1.609 ======================= Grid point 540 (271/306) ======================= q-point: ( 0.20 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -0.737 -0.000 -3.286) 3.368 1.977 ( 11.703 0.000 -8.122) 14.245 2.165 ( -1.410 -0.000 7.596) 7.726 2.199 ( 4.346 0.000 0.559) 4.382 3.057 ( -1.339 -0.000 3.790) 4.020 3.108 ( 4.467 0.000 -12.671) 13.435 3.546 ( 11.942 0.000 -9.446) 15.226 3.675 ( -5.309 -0.000 7.406) 9.112 4.384 ( -7.920 -0.000 2.464) 8.295 4.501 ( -14.665 -0.000 24.578) 28.620 5.310 ( -5.293 -0.000 -2.980) 6.075 5.462 ( 4.489 0.000 2.686) 5.231 5.573 ( 3.626 0.000 1.932) 4.109 5.669 ( 24.815 0.000 -19.827) 31.763 6.087 ( 1.392 0.000 5.144) 5.329 6.265 ( 3.712 0.000 3.043) 4.799 6.790 ( -9.151 -0.000 -0.815) 9.187 7.051 ( 0.865 0.000 -3.283) 3.395 7.642 ( 2.610 0.000 -8.180) 8.586 7.752 ( -4.508 -0.000 -5.517) 7.125 8.135 ( 0.225 0.000 6.176) 6.180 8.702 ( 8.758 0.000 -0.429) 8.768 10.571 ( -2.206 -0.000 6.573) 6.933 10.883 ( 3.454 0.000 6.504) 7.365 11.724 ( -13.623 -0.000 -13.231) 18.990 11.921 ( 2.391 0.000 -3.929) 4.599 13.988 ( -0.789 -0.000 7.620) 7.660 15.108 ( 1.560 0.000 11.516) 11.622 15.571 ( 2.068 0.000 -3.141) 3.761 15.781 ( 2.761 0.000 -0.611) 2.827 ======================= Grid point 541 (272/306) ======================= q-point: ( 0.30 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( -4.971 -1.158 5.868) 7.777 2.072 ( 11.138 -1.493 -7.023) 13.252 2.154 ( -1.859 6.192 2.734) 7.019 2.316 ( 2.120 -8.409 2.124) 8.928 3.029 ( 4.235 6.485 -5.031) 9.236 3.131 ( 6.540 -3.305 -3.230) 8.008 3.583 ( 5.567 7.890 0.492) 9.668 3.788 ( 3.437 -9.705 5.441) 11.645 4.272 ( -12.871 0.982 4.777) 13.764 4.507 ( -18.247 -3.637 19.691) 27.091 5.218 ( -0.527 1.327 -3.997) 4.245 5.433 ( -14.488 -0.705 8.392) 16.758 5.702 ( 17.206 5.172 -15.163) 23.510 5.772 ( 18.873 -1.726 -12.477) 22.690 6.180 ( 0.242 0.152 9.697) 9.701 6.356 ( 5.640 -0.271 -1.027) 5.739 6.661 ( -6.046 0.270 -0.873) 6.115 7.044 ( 1.047 -0.871 -1.401) 1.954 7.607 ( 5.184 0.260 -9.970) 11.240 7.643 ( -4.370 1.586 0.287) 4.658 8.215 ( 1.446 -3.593 3.106) 4.965 8.768 ( 4.491 1.726 -3.767) 6.110 10.600 ( -2.197 0.618 4.982) 5.480 11.008 ( 3.461 -1.561 6.696) 7.697 11.435 ( -10.296 1.685 -6.134) 12.103 11.932 ( 7.566 1.101 -8.027) 11.085 14.051 ( -2.295 -2.316 6.437) 7.216 15.215 ( -1.456 -1.005 8.680) 8.859 15.557 ( 1.391 1.090 -3.611) 4.020 15.776 ( -1.750 1.054 -0.837) 2.208 ======================= Grid point 542 (273/306) ======================= q-point: ( 0.40 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.770 ( -6.888 -0.778 10.843) 12.869 2.068 ( -5.718 3.824 2.895) 7.463 2.171 ( 10.340 -2.214 -7.932) 13.218 2.478 ( 5.211 -7.368 4.023) 9.881 2.962 ( 1.796 10.003 -0.504) 10.176 3.245 ( 10.144 -1.996 -4.242) 11.175 3.589 ( 4.790 9.156 3.794) 11.008 3.991 ( 1.585 -7.927 2.302) 8.405 4.101 ( -16.368 0.411 8.971) 18.670 4.483 ( -18.527 -8.303 14.107) 24.722 5.185 ( -0.904 3.223 0.581) 3.397 5.312 ( -11.943 -1.845 7.557) 14.253 5.621 ( 10.590 6.265 -22.174) 25.359 5.964 ( 14.513 1.227 -1.900) 14.688 6.243 ( -1.422 0.390 2.027) 2.506 6.376 ( 3.741 0.651 -6.417) 7.456 6.630 ( 0.593 -1.392 1.283) 1.984 7.070 ( 1.691 -1.101 0.368) 2.051 7.567 ( 2.411 1.939 -2.992) 4.304 7.630 ( 2.259 0.035 -0.644) 2.349 8.307 ( 3.049 -4.500 -0.174) 5.439 8.720 ( -0.202 2.727 -6.182) 6.760 10.590 ( -3.520 0.995 2.465) 4.411 11.159 ( 4.896 -3.397 6.067) 8.504 11.277 ( -4.680 3.441 0.628) 5.843 11.935 ( 8.191 0.913 -10.485) 13.336 14.098 ( -3.788 -3.354 4.877) 7.028 15.282 ( -2.390 -2.584 5.796) 6.781 15.491 ( -1.103 4.503 -5.148) 6.928 15.713 ( -4.071 -0.154 -0.376) 4.091 ======================= Grid point 543 (274/306) ======================= q-point: (-0.50 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.777 ( -5.412 1.020 7.391) 9.217 2.006 ( -7.291 2.143 9.913) 12.491 2.239 ( 8.941 -2.242 -10.014) 13.610 2.696 ( 6.983 -4.538 6.852) 10.784 2.854 ( -2.835 9.938 2.193) 10.565 3.346 ( 9.027 0.919 -5.136) 10.426 3.610 ( 5.303 10.935 6.120) 13.607 3.855 ( -13.390 0.572 0.189) 13.404 4.177 ( -8.163 -6.608 14.463) 17.874 4.450 ( -11.521 -9.372 5.103) 15.704 5.082 ( -12.252 -0.112 5.104) 13.273 5.324 ( -2.466 6.365 8.702) 11.060 5.471 ( 7.899 1.480 -18.960) 20.592 6.082 ( 7.664 4.596 -2.020) 9.161 6.171 ( -1.687 1.174 -8.425) 8.673 6.351 ( 3.480 -1.258 -7.224) 8.117 6.717 ( 6.225 -2.456 1.417) 6.841 7.105 ( 0.571 -0.346 0.723) 0.984 7.594 ( 3.265 1.391 3.562) 5.028 7.674 ( 4.347 -0.256 -0.221) 4.360 8.377 ( 3.525 -2.878 -3.660) 5.840 8.595 ( -3.280 2.837 -6.656) 7.945 10.543 ( -4.719 0.649 2.334) 5.304 11.184 ( -0.231 7.143 -2.489) 7.568 11.364 ( 5.666 -6.101 8.391) 11.820 11.958 ( 8.464 -2.633 -8.090) 12.001 14.107 ( -4.938 -2.249 3.089) 6.244 15.233 ( -9.427 2.251 -6.761) 11.817 15.405 ( 1.207 1.272 2.486) 3.042 15.676 ( -2.960 -1.466 0.844) 3.409 ======================= Grid point 544 (275/306) ======================= q-point: (-0.40 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( -2.014 2.785 6.074) 6.979 2.006 ( -7.106 2.076 12.437) 14.474 2.261 ( 6.482 -0.893 -10.350) 12.245 2.641 ( -6.345 14.191 1.348) 15.603 2.970 ( 7.075 -7.569 6.058) 12.002 3.358 ( 0.730 3.217 -1.748) 3.733 3.617 ( -0.893 11.607 9.905) 15.285 3.735 ( 0.909 -0.012 -3.521) 3.636 4.232 ( -14.152 -5.665 17.591) 23.277 4.500 ( 2.237 -6.138 1.242) 6.650 4.973 ( -15.142 -2.727 6.969) 16.890 5.213 ( -1.842 9.979 0.839) 10.182 5.444 ( 3.426 -2.529 -10.980) 11.777 5.966 ( -2.323 2.614 -16.221) 16.594 6.095 ( 1.724 5.677 0.438) 5.949 6.374 ( 6.319 -0.971 -6.016) 8.779 6.869 ( 9.092 -3.491 -0.229) 9.742 7.098 ( -1.662 0.857 0.171) 1.878 7.693 ( 2.209 1.592 9.736) 10.109 7.757 ( 6.772 -1.404 -0.364) 6.926 8.378 ( 1.470 -0.497 -6.743) 6.919 8.443 ( -4.015 2.813 -6.471) 8.118 10.501 ( -4.901 0.425 4.056) 6.376 11.039 ( 0.050 8.880 -8.554) 12.330 11.630 ( 5.624 -9.138 11.364) 15.629 12.077 ( 10.738 -6.298 -4.707) 13.309 14.075 ( -4.307 0.066 1.940) 4.724 14.924 ( -13.797 5.206 -10.087) 17.867 15.470 ( 2.563 -1.166 2.406) 3.704 15.662 ( -2.685 -0.982 1.153) 3.082 ======================= Grid point 545 (276/306) ======================= q-point: (-0.30 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( 2.827 4.727 7.159) 9.033 2.006 ( -6.131 2.572 10.606) 12.517 2.195 ( -2.693 7.349 -4.079) 8.826 2.420 ( -0.832 7.590 -7.989) 11.051 3.196 ( 7.580 -5.586 2.748) 9.808 3.296 ( -5.162 2.090 3.099) 6.373 3.582 ( -0.229 8.499 6.720) 10.837 3.745 ( 2.666 2.161 -0.485) 3.467 4.320 ( -3.523 -3.343 15.186) 15.944 4.632 ( 6.614 -1.476 2.723) 7.303 4.815 ( -21.638 0.024 11.814) 24.653 5.167 ( -0.921 2.108 5.048) 5.548 5.348 ( 3.296 -2.434 -19.603) 20.027 5.725 ( -3.440 -0.206 -17.568) 17.903 6.082 ( 2.534 7.799 4.628) 9.416 6.383 ( 5.177 0.951 -9.115) 10.526 7.000 ( 0.237 -1.310 3.474) 3.721 7.074 ( 4.556 -0.682 -4.409) 6.377 7.802 ( 0.412 2.840 11.844) 12.186 7.895 ( 8.397 -2.480 1.383) 8.864 8.284 ( -6.917 -1.711 -5.030) 8.722 8.299 ( 2.069 5.531 -10.402) 11.961 10.484 ( -4.127 0.408 6.087) 7.365 10.847 ( -0.247 7.419 -10.757) 13.070 11.929 ( 1.599 -10.619 14.776) 18.266 12.269 ( 12.447 -8.520 -6.534) 16.438 14.045 ( -0.842 1.980 2.754) 3.495 14.553 ( -14.718 5.461 -9.914) 18.567 15.538 ( 3.170 -0.469 0.983) 3.352 15.636 ( -2.926 0.082 0.642) 2.996 ======================= Grid point 546 (277/306) ======================= q-point: (-0.20 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.889 ( 8.202 7.127 5.212) 12.051 1.946 ( -7.057 11.895 0.282) 13.834 2.038 ( -3.654 5.383 11.037) 12.812 2.305 ( 4.857 0.537 -14.597) 15.393 3.246 ( -5.592 -0.017 3.964) 6.854 3.319 ( 4.670 0.170 -2.899) 5.499 3.599 ( 1.119 4.991 9.231) 10.554 3.736 ( 2.043 1.603 -3.849) 4.642 4.475 ( 0.397 0.909 10.523) 10.570 4.573 ( -15.641 1.251 4.993) 16.467 4.822 ( 1.143 0.433 15.050) 15.100 5.161 ( -1.490 -2.116 -6.176) 6.696 5.285 ( 3.273 -3.825 -3.543) 6.156 5.546 ( 2.514 -3.683 -17.573) 18.130 6.096 ( 1.570 7.770 7.350) 10.811 6.306 ( 4.108 3.449 -13.522) 14.547 6.994 ( -6.428 -1.216 6.047) 8.908 7.135 ( 8.035 -0.994 -7.381) 10.955 7.890 ( -0.550 3.511 11.127) 11.681 8.049 ( 6.280 -0.816 1.646) 6.543 8.152 ( 0.474 3.662 -9.157) 9.873 8.159 ( -4.355 -1.196 -5.597) 7.192 10.501 ( -2.847 0.693 7.693) 8.233 10.677 ( 0.324 4.690 -8.985) 10.141 12.155 ( -8.043 -8.761 15.758) 19.742 12.446 ( 11.943 -10.105 -12.504) 20.027 14.064 ( -6.005 2.662 8.440) 10.695 14.244 ( -0.465 5.028 -9.292) 10.575 15.584 ( -0.577 0.532 0.742) 1.080 15.599 ( 1.631 0.889 -0.760) 2.007 ======================= Grid point 547 (278/306) ======================= q-point: (-0.10 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.745 ( -0.730 10.745 -1.798) 10.919 1.983 ( 12.090 9.714 0.891) 15.535 2.082 ( -2.344 3.769 11.260) 12.103 2.214 ( 3.855 0.795 -13.307) 13.877 3.203 ( -5.719 -0.148 1.747) 5.982 3.295 ( -0.421 2.742 -1.588) 3.196 3.665 ( 1.146 1.667 3.185) 3.773 3.702 ( 4.988 1.449 -7.905) 9.459 4.342 ( -17.089 1.266 10.123) 19.903 4.585 ( -1.638 1.627 4.790) 5.318 4.999 ( 1.726 -0.969 13.975) 14.115 5.147 ( 11.785 -0.460 -10.383) 15.713 5.334 ( -4.969 -6.070 2.748) 8.312 5.543 ( 8.168 -3.739 -6.263) 10.951 6.087 ( -1.474 5.928 0.525) 6.131 6.194 ( 6.404 5.190 -8.599) 11.911 6.987 ( -6.423 -3.326 5.519) 9.098 7.152 ( 5.258 0.534 -7.652) 9.300 7.933 ( -2.337 2.631 5.922) 6.888 7.961 ( -1.541 3.536 -8.747) 9.559 8.082 ( -0.971 -0.723 -3.587) 3.786 8.223 ( 6.645 -1.033 3.754) 7.702 10.529 ( -2.620 1.968 5.460) 6.368 10.599 ( 2.641 1.203 -1.951) 3.497 12.189 ( -15.296 -4.923 10.294) 19.084 12.522 ( 4.270 -9.431 -17.193) 20.069 13.919 ( -10.902 4.700 6.827) 13.695 14.354 ( 15.934 1.307 3.592) 16.386 15.550 ( -1.261 0.226 -0.563) 1.400 15.638 ( 4.575 1.439 -0.874) 4.875 ======================= Grid point 551 (279/306) ======================= q-point: ( 0.30 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -7.110 -0.000 13.891) 15.605 2.098 ( 1.737 0.000 -10.368) 10.513 2.178 ( 1.729 0.000 2.230) 2.821 2.370 ( 7.571 0.000 4.428) 8.771 3.110 ( -0.820 -0.000 2.703) 2.825 3.180 ( 13.992 0.000 -8.291) 16.264 3.767 ( 11.819 0.000 -7.207) 13.843 3.829 ( -0.322 -0.000 15.712) 15.716 4.121 ( -17.727 -0.000 7.628) 19.299 4.380 ( -21.118 -0.000 15.224) 26.033 5.236 ( 6.297 0.000 -1.599) 6.497 5.274 ( -18.066 -0.000 7.934) 19.731 5.694 ( 12.716 0.000 -26.260) 29.177 5.974 ( 14.166 0.000 0.608) 14.179 6.249 ( -1.315 -0.000 3.448) 3.690 6.388 ( 1.897 0.000 -5.213) 5.548 6.610 ( -0.721 -0.000 1.940) 2.070 7.057 ( 1.651 0.000 0.965) 1.913 7.588 ( 3.917 0.000 -5.673) 6.893 7.632 ( 0.607 0.000 1.173) 1.321 8.257 ( 4.845 0.000 -0.245) 4.851 8.748 ( -0.467 -0.000 -6.757) 6.773 10.603 ( -3.545 -0.000 2.320) 4.237 11.121 ( 4.353 0.000 6.089) 7.485 11.318 ( -4.217 -0.000 2.189) 4.752 11.942 ( 7.987 0.000 -13.594) 15.767 14.061 ( -3.600 -0.000 5.914) 6.924 15.253 ( -2.798 -0.000 5.788) 6.429 15.547 ( 1.225 0.000 -3.093) 3.327 15.706 ( -6.681 -0.000 -1.511) 6.850 ======================= Grid point 552 (280/306) ======================= q-point: ( 0.40 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -7.101 1.747 14.438) 16.185 2.002 ( -4.040 -1.623 -1.928) 4.762 2.239 ( 7.078 1.349 -3.121) 7.852 2.569 ( 8.161 -4.584 6.219) 11.238 3.061 ( -2.238 7.549 0.561) 7.893 3.313 ( 9.897 -3.271 -5.226) 11.660 3.783 ( 5.842 2.879 -7.938) 10.268 3.924 ( -10.099 7.841 11.626) 17.282 4.064 ( -5.721 -4.502 17.596) 19.043 4.260 ( -15.313 -7.589 7.402) 18.624 5.096 ( -16.608 0.874 7.827) 18.381 5.349 ( 6.903 -1.127 0.436) 7.008 5.566 ( 7.365 4.269 -20.136) 21.862 6.138 ( 7.131 0.878 0.418) 7.197 6.211 ( -2.035 2.383 -4.153) 5.202 6.311 ( -0.203 -2.097 -8.714) 8.965 6.678 ( 5.277 -1.086 2.144) 5.798 7.097 ( 0.444 -0.235 2.703) 2.750 7.616 ( 4.763 0.654 0.066) 4.808 7.675 ( 3.153 0.124 1.796) 3.631 8.331 ( 6.538 -1.271 -3.943) 7.740 8.633 ( -3.710 0.876 -7.541) 8.450 10.560 ( -4.750 0.625 2.579) 5.441 11.259 ( 5.715 -1.974 3.738) 7.109 11.330 ( 0.965 3.986 6.125) 7.371 11.886 ( 5.010 -3.031 -15.629) 16.690 14.072 ( -3.794 -0.910 5.359) 6.629 15.240 ( -5.902 -0.506 0.004) 5.924 15.494 ( -0.959 5.693 -1.715) 6.022 15.618 ( -4.673 -4.035 -0.330) 6.183 ======================= Grid point 553 (281/306) ======================= q-point: (-0.50 0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( -2.653 2.974 7.657) 8.632 1.998 ( -5.547 -3.007 7.574) 9.858 2.278 ( 6.753 2.541 -4.752) 8.639 2.807 ( 7.077 -7.146 6.202) 11.816 2.900 ( -6.150 10.292 -1.735) 12.115 3.380 ( 1.264 -1.021 -3.070) 3.474 3.710 ( -5.301 -0.630 0.438) 5.356 3.875 ( 2.993 10.739 3.971) 11.834 4.133 ( -12.625 -3.559 19.657) 23.632 4.346 ( 4.248 -7.825 3.999) 9.760 4.955 ( -14.502 0.836 9.005) 17.091 5.354 ( 6.853 -1.980 -22.308) 23.421 5.462 ( -3.367 8.776 7.185) 11.832 6.008 ( -5.604 1.159 -15.675) 16.687 6.186 ( 3.217 2.857 -0.135) 4.304 6.336 ( 6.026 -2.279 -3.387) 7.279 6.810 ( 9.418 -2.049 -0.433) 9.648 7.114 ( -2.163 0.680 2.807) 3.608 7.711 ( 6.934 0.253 2.605) 7.412 7.752 ( 2.850 0.616 5.425) 6.159 8.350 ( 0.424 -1.485 -6.605) 6.783 8.496 ( -1.046 1.872 -7.805) 8.094 10.523 ( -4.846 1.408 5.872) 7.743 11.250 ( 2.907 10.717 -7.946) 13.655 11.466 ( 4.357 -5.591 9.130) 11.559 11.893 ( 4.826 -10.940 -8.923) 14.919 14.082 ( -2.642 0.607 5.270) 5.926 15.035 ( -12.474 4.473 -7.992) 15.475 15.467 ( 1.749 1.408 2.329) 3.235 15.617 ( -2.065 -3.336 0.353) 3.939 ======================= Grid point 554 (282/306) ======================= q-point: (-0.40 0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( 1.302 1.811 6.822) 7.178 2.027 ( -4.726 -1.268 7.664) 9.093 2.278 ( 5.204 4.211 -4.909) 8.301 2.645 ( -7.426 10.854 -5.434) 14.230 3.053 ( 8.173 -7.602 4.530) 12.046 3.316 ( -8.187 -0.026 1.906) 8.406 3.692 ( -1.017 1.204 3.277) 3.636 3.831 ( 0.406 5.536 0.245) 5.556 4.279 ( 1.829 -0.416 17.306) 17.408 4.548 ( 5.666 -6.343 6.784) 10.879 4.821 ( -16.460 2.067 8.906) 18.829 5.258 ( 8.897 -1.730 -19.534) 21.534 5.332 ( -9.957 7.667 4.107) 13.221 5.739 ( -5.197 0.891 -17.616) 18.388 6.212 ( 4.002 4.589 2.020) 6.415 6.389 ( 4.897 -0.350 -5.389) 7.290 6.964 ( 8.620 -1.849 -0.617) 8.838 7.082 ( -2.698 1.130 0.805) 3.034 7.851 ( 6.935 -0.716 1.833) 7.209 7.858 ( 3.162 1.477 11.058) 11.595 8.239 ( -8.189 -2.520 -5.349) 10.100 8.398 ( 3.548 3.841 -11.276) 12.429 10.517 ( -4.380 2.527 9.442) 10.710 11.037 ( 0.772 10.957 -13.626) 17.502 11.707 ( 2.381 -10.017 11.172) 15.193 12.032 ( 6.111 -13.929 -6.598) 16.580 14.104 ( 0.601 3.418 6.470) 7.342 14.689 ( -13.097 6.829 -9.821) 17.737 15.523 ( 2.896 -0.685 1.644) 3.400 15.619 ( -1.921 -1.746 0.109) 2.598 ======================= Grid point 555 (283/306) ======================= q-point: (-0.30 0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -1.323 -0.611 7.289) 7.433 2.057 ( 2.466 1.735 0.024) 3.015 2.240 ( 1.883 8.947 2.533) 9.487 2.396 ( -0.595 8.392 -9.359) 12.585 3.222 ( -9.032 -2.387 4.322) 10.293 3.277 ( 8.307 -3.992 -0.136) 9.218 3.699 ( -0.183 3.243 4.452) 5.511 3.787 ( 1.260 3.340 -2.690) 4.469 4.499 ( 3.632 0.705 15.105) 15.552 4.613 ( -19.698 3.411 7.299) 21.282 4.780 ( 5.778 -4.525 9.836) 12.272 5.138 ( 1.074 -1.457 -15.426) 15.532 5.259 ( -0.997 2.819 3.584) 4.667 5.513 ( 1.614 0.566 -15.955) 16.046 6.235 ( 2.319 5.511 3.424) 6.890 6.363 ( 3.681 2.023 -9.372) 10.270 6.987 ( -7.750 0.599 5.573) 9.564 7.116 ( 9.883 -0.882 -6.861) 12.064 7.956 ( -1.526 2.372 12.013) 12.340 8.023 ( 8.444 -1.138 2.420) 8.857 8.099 ( -7.392 -3.027 -3.268) 8.631 8.262 ( 2.199 4.878 -13.628) 14.641 10.543 ( -3.362 3.336 11.942) 12.847 10.804 ( 0.412 7.732 -12.783) 14.946 11.940 ( -4.678 -11.435 13.124) 18.024 12.182 ( 5.852 -14.853 -10.388) 19.046 14.162 ( 0.132 6.303 10.012) 11.832 14.367 ( -3.799 6.497 -10.095) 12.591 15.582 ( 0.287 -0.785 1.138) 1.412 15.604 ( 0.911 -0.453 -1.149) 1.535 ======================= Grid point 556 (284/306) ======================= q-point: (-0.20 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( -2.004 4.299 -4.727) 6.697 2.023 ( -3.226 1.586 8.092) 8.855 2.236 ( 6.365 5.509 -9.076) 12.379 2.320 ( 10.920 9.824 2.560) 14.910 3.168 ( -8.200 -3.230 3.960) 9.662 3.355 ( 2.215 2.039 -2.915) 4.191 3.717 ( 1.695 2.971 1.205) 3.627 3.738 ( 2.483 2.216 -5.564) 6.483 4.382 ( -17.695 2.508 9.420) 20.202 4.617 ( -2.878 1.066 5.613) 6.397 4.959 ( 2.027 -3.273 7.191) 8.156 5.115 ( 9.191 -2.079 -10.643) 14.215 5.262 ( -1.166 -0.543 8.583) 8.678 5.493 ( 10.215 -0.124 -6.044) 11.869 6.210 ( -1.670 5.274 -1.512) 5.735 6.290 ( 4.672 3.931 -6.563) 8.964 6.932 ( -8.392 -1.806 5.390) 10.136 7.165 ( 7.584 0.639 -8.043) 11.073 7.930 ( -8.605 -2.576 -0.500) 8.996 8.042 ( -1.371 4.015 -3.007) 5.201 8.112 ( 2.122 3.033 -1.988) 4.202 8.201 ( 7.442 -0.926 2.989) 8.073 10.592 ( -2.512 4.255 10.871) 11.941 10.645 ( 1.753 3.566 -6.930) 7.988 12.040 ( -12.621 -9.377 8.734) 17.986 12.277 ( 1.708 -13.668 -11.701) 18.073 14.051 ( -7.515 7.568 3.357) 11.182 14.408 ( 15.125 4.013 3.058) 15.945 15.553 ( -2.318 -0.032 -0.633) 2.403 15.653 ( 4.371 -0.165 -0.920) 4.470 ======================= Grid point 557 (285/306) ======================= q-point: (-0.10 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 2.640 7.066 -5.684) 9.445 2.071 ( -5.746 -2.015 9.855) 11.585 2.157 ( 3.940 3.547 -8.351) 9.892 2.393 ( 14.570 14.834 -3.981) 21.171 3.133 ( -5.815 -2.398 2.948) 6.947 3.264 ( -4.431 3.471 -3.624) 6.694 3.645 ( -4.620 1.839 -5.010) 7.059 3.728 ( 7.852 1.793 -6.705) 10.480 4.324 ( -7.293 1.733 17.613) 19.142 4.552 ( -6.358 0.282 -0.194) 6.367 5.115 ( 2.237 -5.287 5.195) 7.742 5.151 ( 4.278 -4.593 -2.787) 6.868 5.402 ( 15.526 3.899 -3.445) 16.374 5.617 ( 2.060 -0.996 9.041) 9.326 6.070 ( 0.213 5.513 -9.195) 10.724 6.277 ( 2.025 3.212 0.172) 3.802 6.895 ( -8.129 -3.770 4.167) 9.882 7.158 ( 5.043 1.717 -7.843) 9.481 7.833 ( -7.315 -3.633 -2.139) 8.443 7.885 ( -0.294 3.072 -11.645) 12.047 8.158 ( 1.937 3.947 6.952) 8.226 8.348 ( 6.556 -1.083 3.751) 7.630 10.553 ( 0.004 2.383 -0.947) 2.565 10.690 ( 1.534 2.435 9.192) 9.632 11.982 ( -13.954 -7.012 2.083) 15.755 12.235 ( -6.606 -8.518 -11.917) 16.069 13.973 ( -0.740 5.860 5.901) 8.349 14.658 ( 14.688 1.957 8.193) 16.932 15.524 ( -0.490 -0.778 -1.369) 1.649 15.701 ( 4.476 0.458 -1.760) 4.831 ======================= Grid point 562 (286/306) ======================= q-point: ( 0.40 0.40 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.881 ( -7.997 -0.000 15.880) 17.780 1.932 ( 1.015 0.000 -3.167) 3.326 2.317 ( 5.465 0.000 -0.927) 5.543 2.721 ( 6.575 0.000 6.439) 9.203 3.025 ( -6.033 -0.000 -3.979) 7.227 3.352 ( 3.884 0.000 -3.992) 5.569 3.701 ( -5.609 -0.000 0.851) 5.673 4.025 ( -18.056 -0.000 10.620) 20.947 4.086 ( 6.486 0.000 7.420) 9.855 4.237 ( 4.549 0.000 11.059) 11.958 4.973 ( -14.687 -0.000 11.506) 18.657 5.317 ( 5.938 0.000 -21.066) 21.887 5.578 ( 1.162 0.000 1.701) 2.060 6.016 ( -8.289 -0.000 -14.866) 17.021 6.213 ( 3.092 0.000 -1.536) 3.453 6.307 ( 6.285 0.000 -0.824) 6.339 6.788 ( 9.442 0.000 -0.459) 9.453 7.122 ( -2.193 -0.000 4.004) 4.565 7.713 ( 8.218 0.000 -0.412) 8.228 7.761 ( 1.898 0.000 7.781) 8.010 8.333 ( 0.145 0.000 -6.968) 6.969 8.516 ( -0.112 -0.000 -8.011) 8.012 10.541 ( -4.660 -0.000 6.712) 8.171 11.355 ( 6.604 0.000 -1.705) 6.820 11.473 ( 4.597 0.000 6.626) 8.065 11.715 ( -1.147 -0.000 -14.911) 14.955 14.090 ( -1.328 -0.000 6.225) 6.365 15.082 ( -11.647 -0.000 -6.167) 13.179 15.527 ( -2.882 -0.000 3.012) 4.168 15.538 ( 1.743 0.000 -1.622) 2.381 ======================= Grid point 563 (287/306) ======================= q-point: (-0.50 0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( -4.319 1.883 9.684) 10.769 1.976 ( 2.084 -2.682 1.193) 3.599 2.370 ( 4.269 3.336 0.943) 5.500 2.804 ( -4.187 3.108 -8.227) 9.741 2.929 ( 3.852 -2.711 5.994) 7.623 3.306 ( -5.692 -0.603 -2.774) 6.361 3.682 ( -3.515 -0.962 6.282) 7.262 3.911 ( -4.736 1.777 1.257) 5.212 4.303 ( 9.229 2.375 12.729) 15.901 4.417 ( 1.120 -5.105 12.032) 13.118 4.891 ( -13.590 3.309 11.535) 18.130 5.179 ( 6.735 -3.330 -23.584) 24.751 5.519 ( -8.181 6.800 3.571) 11.221 5.739 ( -5.139 -0.940 -17.446) 18.211 6.274 ( 5.928 1.509 0.306) 6.125 6.375 ( 4.079 -0.681 -1.813) 4.515 6.934 ( 11.739 -0.845 -1.999) 11.938 7.105 ( -4.974 0.747 3.023) 5.869 7.834 ( 10.379 -0.356 -2.202) 10.616 7.890 ( 0.468 0.886 14.153) 14.188 8.193 ( -9.322 -1.449 -5.440) 10.890 8.452 ( 4.460 1.370 -11.723) 12.618 10.568 ( -4.297 1.767 12.218) 13.072 11.275 ( 3.318 9.971 -19.119) 21.817 11.564 ( 1.480 -1.609 8.256) 8.540 11.726 ( 1.495 -14.303 -2.491) 14.595 14.165 ( 2.937 1.829 7.687) 8.430 14.800 ( -13.341 3.068 -9.017) 16.392 15.524 ( 1.175 1.044 1.711) 2.324 15.570 ( 0.074 -2.579 -0.236) 2.591 ======================= Grid point 564 (288/306) ======================= q-point: (-0.40 0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -7.109 -1.281 8.624) 11.250 2.062 ( 9.166 -0.399 -4.160) 10.074 2.400 ( 3.529 6.565 5.229) 9.105 2.573 ( -3.662 7.206 -9.622) 12.567 3.133 ( 3.106 -5.700 4.453) 7.872 3.200 ( -2.922 -2.732 -1.347) 4.221 3.722 ( -2.295 -0.317 7.120) 7.487 3.852 ( 0.769 2.284 -4.169) 4.815 4.499 ( -3.023 -0.400 18.368) 18.619 4.677 ( 7.041 -3.530 13.049) 15.242 4.712 ( -13.620 4.484 1.746) 14.445 5.080 ( 8.081 -3.285 -21.962) 23.631 5.371 ( -8.861 5.845 6.038) 12.212 5.550 ( 2.771 2.255 -12.388) 12.893 6.324 ( 3.441 3.191 0.499) 4.720 6.389 ( 3.097 0.474 -5.740) 6.539 7.013 ( -6.962 1.662 3.339) 7.898 7.095 ( 9.880 -1.190 -4.704) 11.007 7.969 ( 4.689 -0.561 3.586) 5.929 8.011 ( -4.467 -1.200 0.116) 4.627 8.052 ( -1.316 -0.410 8.110) 8.226 8.343 ( 2.634 2.772 -14.963) 15.444 10.629 ( -3.960 4.338 16.390) 17.411 10.991 ( 0.488 9.620 -17.813) 20.250 11.716 ( -2.489 -9.132 9.106) 13.134 11.867 ( 2.483 -14.434 -5.787) 15.748 14.292 ( 6.188 5.385 9.883) 12.844 14.490 ( -8.494 4.777 -9.521) 13.624 15.559 ( 0.194 -1.148 1.260) 1.715 15.585 ( 1.197 -1.209 -1.382) 2.192 ======================= Grid point 565 (289/306) ======================= q-point: (-0.30 -0.60 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.912 ( -5.668 -3.088 4.657) 7.959 2.100 ( 4.449 3.144 -6.030) 8.127 2.369 ( 2.217 6.746 -8.943) 11.419 2.506 ( 9.976 7.714 7.293) 14.568 3.084 ( -9.183 -4.138 1.665) 10.209 3.345 ( 6.321 -3.247 -1.426) 7.247 3.771 ( 2.370 2.038 2.968) 4.310 3.785 ( -1.560 1.798 -3.098) 3.907 4.439 ( -17.881 2.775 6.324) 19.169 4.622 ( -3.663 -0.193 6.264) 7.259 4.865 ( 2.876 -5.314 0.667) 6.079 5.100 ( 11.114 0.783 -11.015) 15.668 5.296 ( -1.156 3.167 13.290) 13.711 5.534 ( 8.401 3.267 -3.677) 9.735 6.295 ( -1.567 3.016 -3.356) 4.777 6.356 ( 3.541 2.446 -5.284) 6.815 6.915 ( -8.622 0.045 2.920) 9.103 7.176 ( 8.166 0.316 -6.557) 10.478 7.865 ( -10.383 -3.136 -1.371) 10.932 8.101 ( 0.425 1.139 6.414) 6.528 8.175 ( 1.081 2.753 -12.267) 12.619 8.193 ( 6.969 0.453 4.915) 8.540 10.701 ( -3.328 6.006 17.576) 18.869 10.753 ( 0.878 6.574 -12.891) 14.497 11.819 ( -9.174 -11.106 4.984) 15.242 11.981 ( 1.045 -14.176 -5.570) 15.267 14.209 ( -6.064 7.025 -2.578) 9.631 14.512 ( 13.780 5.504 6.352) 16.141 15.547 ( -2.169 -0.508 -0.844) 2.382 15.631 ( 3.600 -1.853 -0.925) 4.153 ======================= Grid point 566 (290/306) ======================= q-point: (-0.20 0.40 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 0.827 -0.114 -4.678) 4.752 2.056 ( -5.028 1.837 6.799) 8.654 2.257 ( 5.510 5.679 -11.764) 14.177 2.650 ( 12.714 9.982 1.868) 16.272 3.036 ( -6.317 -6.143 0.370) 8.819 3.342 ( -4.423 2.449 -1.504) 5.274 3.671 ( -10.106 0.802 0.798) 10.170 3.806 ( 9.798 5.469 -6.613) 13.025 4.349 ( -2.913 0.119 10.059) 10.473 4.549 ( -5.977 -0.242 -3.544) 6.953 5.001 ( 0.058 -5.468 8.156) 9.819 5.090 ( 4.835 -0.796 -4.592) 6.715 5.492 ( 15.206 4.475 -1.770) 15.950 5.616 ( 1.544 0.984 12.483) 12.616 6.176 ( -1.814 4.176 -6.597) 8.016 6.326 ( 1.284 1.641 -2.563) 3.303 6.838 ( -7.219 -1.563 2.402) 7.767 7.189 ( 5.610 1.177 -7.767) 9.654 7.751 ( -8.569 -3.579 -1.096) 9.351 7.959 ( -0.787 3.452 -13.949) 14.392 8.209 ( -0.007 0.893 8.587) 8.633 8.339 ( 6.659 0.330 4.058) 7.805 10.616 ( 1.742 3.593 -6.961) 8.025 10.775 ( -1.920 5.941 15.884) 17.067 11.795 ( -11.206 -10.280 -1.752) 15.308 12.040 ( -5.341 -10.371 -3.109) 12.073 14.091 ( 0.239 5.190 0.428) 5.214 14.736 ( 14.437 5.523 8.047) 17.427 15.509 ( -1.565 -0.629 -1.683) 2.383 15.691 ( 3.977 -1.532 -1.586) 4.548 ======================= Grid point 567 (291/306) ======================= q-point: (-0.10 0.40 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.860 ( 5.432 3.866 -6.363) 9.216 2.056 ( -6.574 -1.010 7.584) 10.087 2.169 ( 1.702 2.887 -4.814) 5.865 2.637 ( 5.875 12.742 -6.882) 15.628 3.019 ( -2.687 -5.924 -6.186) 8.977 3.209 ( -5.865 4.366 1.713) 7.510 3.514 ( -10.227 0.989 1.552) 10.391 3.856 ( 13.588 4.661 -5.831) 15.503 4.437 ( -4.972 -0.960 -2.918) 5.845 4.493 ( -0.631 1.081 18.344) 18.387 5.094 ( 3.184 -3.309 -0.188) 4.596 5.202 ( 5.282 -4.724 1.972) 7.355 5.555 ( 8.168 -0.438 -9.271) 12.364 5.780 ( 1.263 4.981 14.013) 14.925 6.040 ( -1.246 4.167 -4.232) 6.068 6.319 ( 3.031 1.093 -1.882) 3.732 6.780 ( -6.517 -2.301 0.940) 6.975 7.160 ( 3.283 1.538 -6.999) 7.882 7.669 ( -6.958 -4.032 -1.271) 8.141 7.786 ( -0.019 2.381 -11.767) 12.006 8.296 ( 2.330 1.643 7.013) 7.571 8.458 ( 4.861 -0.529 3.219) 5.854 10.571 ( 1.163 1.736 -1.296) 2.459 10.859 ( 0.743 4.476 12.478) 13.278 11.691 ( -11.175 -8.821 -6.039) 15.465 11.982 ( -8.227 -4.538 -2.657) 9.764 14.095 ( 2.808 3.930 3.512) 5.972 14.965 ( 10.758 3.584 9.594) 14.854 15.490 ( 0.401 -1.813 -2.494) 3.109 15.735 ( 3.573 -0.488 -2.625) 4.461 ======================= Grid point 573 (292/306) ======================= q-point: (-0.50 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -9.363 -0.000 9.407) 13.272 2.057 ( 11.499 0.000 -5.027) 12.550 2.479 ( 3.556 0.000 5.964) 6.944 2.654 ( -4.821 -0.000 -9.743) 10.871 3.058 ( 7.910 0.000 5.527) 9.650 3.168 ( -6.430 -0.000 -4.731) 7.984 3.714 ( -2.982 -0.000 9.597) 10.050 3.875 ( 0.358 0.000 -4.960) 4.973 4.493 ( -7.499 -0.000 21.421) 22.696 4.636 ( 14.027 0.000 8.660) 16.484 4.774 ( -18.907 -0.000 3.797) 19.284 5.037 ( 12.533 0.000 -22.837) 26.050 5.440 ( -12.624 -0.000 4.558) 13.422 5.578 ( 4.997 0.000 -10.635) 11.751 6.365 ( 5.452 0.000 -1.574) 5.675 6.387 ( 1.414 0.000 -2.973) 3.292 7.039 ( -7.774 -0.000 1.119) 7.854 7.075 ( 11.100 0.000 -2.589) 11.398 7.963 ( 9.326 0.000 0.309) 9.331 7.986 ( -11.780 -0.000 -2.683) 12.082 8.057 ( 1.106 0.000 14.163) 14.207 8.372 ( 2.774 0.000 -15.349) 15.597 10.683 ( -4.338 -0.000 19.033) 19.521 11.124 ( 0.763 0.000 -23.408) 23.421 11.615 ( -3.198 -0.000 5.974) 6.776 11.677 ( 2.832 0.000 0.269) 2.845 14.353 ( 8.999 0.000 9.597) 13.156 14.543 ( -10.990 -0.000 -8.995) 14.202 15.545 ( -0.638 -0.000 1.100) 1.272 15.569 ( 2.134 0.000 -1.349) 2.525 ======================= Grid point 574 (293/306) ======================= q-point: (-0.40 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -7.848 -1.428 6.605) 10.356 2.143 ( 10.456 1.074 -9.526) 14.186 2.481 ( -2.654 3.425 -7.782) 8.907 2.619 ( 7.405 2.543 8.905) 11.857 3.037 ( -5.208 0.171 -3.803) 6.451 3.245 ( 6.270 -4.812 2.358) 8.248 3.799 ( 0.936 0.749 3.654) 3.846 3.805 ( -1.101 0.221 -0.270) 1.155 4.483 ( -19.148 1.151 1.185) 19.219 4.632 ( -3.182 1.212 14.683) 15.072 4.764 ( 4.404 -3.719 -8.982) 10.672 5.124 ( 15.488 0.893 -9.084) 17.977 5.360 ( -4.136 2.134 15.104) 15.805 5.592 ( 5.481 1.650 -2.620) 6.295 6.337 ( -1.864 1.043 -4.844) 5.294 6.391 ( 3.090 0.899 -4.401) 5.452 6.923 ( -7.375 0.391 -0.641) 7.413 7.178 ( 7.523 0.007 -3.909) 8.478 7.815 ( -10.873 -1.411 -0.289) 10.968 8.100 ( 4.558 -0.470 5.320) 7.022 8.210 ( 3.355 0.716 8.516) 9.181 8.218 ( 0.612 1.087 -15.688) 15.737 10.818 ( -5.037 4.119 22.200) 23.134 10.881 ( 0.162 4.341 -16.992) 17.539 11.634 ( -5.580 -5.224 2.757) 8.125 11.733 ( 0.903 -8.075 -2.530) 8.510 14.316 ( -6.016 2.880 -7.044) 9.701 14.606 ( 13.249 2.768 9.846) 16.737 15.539 ( -1.210 -0.055 -0.301) 1.249 15.590 ( 2.401 -1.552 -1.686) 3.319 ======================= Grid point 575 (294/306) ======================= q-point: (-0.30 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.852 ( -4.256 -2.682 4.224) 6.569 2.125 ( 3.271 3.618 -6.590) 8.199 2.356 ( 2.362 3.097 -10.048) 10.777 2.815 ( 12.228 4.913 6.017) 14.487 2.924 ( -6.958 -2.429 -3.414) 8.122 3.330 ( -3.499 -3.398 1.002) 4.980 3.682 ( -9.970 0.248 1.190) 10.044 3.928 ( 8.761 5.455 1.348) 10.409 4.311 ( -2.806 -3.244 -0.468) 4.315 4.572 ( -1.055 2.542 -10.243) 10.606 4.887 ( -1.070 -5.146 14.593) 15.511 5.123 ( 3.948 3.021 -4.451) 6.673 5.571 ( 6.936 2.731 -1.917) 7.697 5.643 ( 4.135 1.305 17.049) 17.591 6.233 ( -2.613 1.364 -4.690) 5.539 6.351 ( 0.194 0.848 -5.294) 5.365 6.828 ( -3.689 0.295 -1.664) 4.058 7.206 ( 4.165 0.510 -5.835) 7.187 7.693 ( -8.945 -1.958 0.458) 9.168 8.018 ( -0.999 2.077 -15.744) 15.911 8.205 ( -0.982 -0.832 7.858) 7.963 8.353 ( 6.153 0.679 5.578) 8.333 10.696 ( 1.357 3.764 -10.785) 11.503 10.921 ( -5.102 7.155 21.419) 23.151 11.602 ( -7.515 -6.991 -2.599) 10.588 11.812 ( -2.744 -10.991 -0.178) 11.330 14.179 ( -0.357 3.115 -4.228) 5.264 14.861 ( 14.154 5.534 8.985) 17.655 15.505 ( -1.508 0.482 -1.630) 2.272 15.639 ( 3.201 -3.272 -1.581) 4.842 ======================= Grid point 576 (295/306) ======================= q-point: (-0.20 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.880 ( 1.897 -1.833 -0.466) 2.679 2.064 ( -4.005 2.423 2.951) 5.534 2.248 ( 3.288 3.862 -11.968) 12.999 2.802 ( -7.077 -0.668 -2.022) 7.391 2.938 ( 6.419 2.538 -5.986) 9.137 3.264 ( -7.677 0.374 2.618) 8.120 3.554 ( -13.201 2.239 8.034) 15.615 3.961 ( 12.945 5.901 -7.497) 16.082 4.385 ( -4.321 -4.411 -1.324) 6.315 4.504 ( 11.230 0.431 -0.830) 11.269 5.061 ( -2.326 -1.603 13.861) 14.146 5.140 ( 5.113 0.504 -0.881) 5.213 5.515 ( -3.404 -3.245 -5.440) 7.191 5.891 ( 6.929 5.395 14.389) 16.857 6.128 ( -2.967 3.962 -4.788) 6.887 6.316 ( 2.609 -1.348 -2.990) 4.191 6.763 ( -2.221 0.592 -2.443) 3.354 7.179 ( 2.219 0.334 -6.724) 7.088 7.604 ( -7.230 -2.181 0.267) 7.556 7.832 ( -0.854 1.921 -12.634) 12.808 8.277 ( -0.183 -2.242 5.880) 6.296 8.477 ( 4.657 1.433 4.899) 6.910 10.613 ( 2.199 2.185 -4.775) 5.693 10.982 ( -3.234 7.039 16.678) 18.389 11.518 ( -8.177 -7.053 -5.696) 12.209 11.854 ( -6.439 -7.784 1.741) 10.251 14.151 ( 3.206 1.559 -1.232) 3.772 15.073 ( 11.432 6.204 8.179) 15.365 15.463 ( -0.725 -0.401 -2.722) 2.845 15.706 ( 3.847 -2.554 -1.871) 4.983 ======================= Grid point 577 (296/306) ======================= q-point: (-0.10 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( 6.458 1.745 -5.901) 8.920 2.021 ( -8.172 0.130 7.019) 10.773 2.156 ( 0.770 -0.160 -3.622) 3.706 2.666 ( -5.780 4.577 -4.217) 8.493 2.841 ( -4.341 -1.187 -7.451) 8.704 3.216 ( -0.660 1.883 0.848) 2.169 3.437 ( -8.140 2.238 4.962) 9.793 4.052 ( 12.011 2.920 -3.100) 12.743 4.316 ( -2.617 -1.369 -4.523) 5.402 4.699 ( 1.217 1.674 15.437) 15.575 5.099 ( -1.865 -1.832 -0.266) 2.627 5.250 ( 5.006 -3.634 2.272) 6.590 5.500 ( 0.340 -4.548 -1.050) 4.680 5.899 ( -4.071 7.113 -5.352) 9.788 6.093 ( 3.415 2.281 8.071) 9.056 6.366 ( 6.152 0.094 -3.562) 7.109 6.695 ( -2.592 0.438 -2.588) 3.689 7.134 ( 1.348 0.188 -5.715) 5.875 7.536 ( -5.339 -2.401 -0.322) 5.863 7.701 ( 0.540 1.477 -8.459) 8.604 8.382 ( 3.145 -3.887 3.460) 6.081 8.549 ( 1.924 2.316 3.686) 4.759 10.595 ( 1.025 1.506 -0.317) 1.849 11.047 ( 0.591 4.801 11.656) 12.620 11.403 ( -7.915 -5.827 -6.629) 11.855 11.835 ( -5.986 -3.728 1.630) 7.238 14.186 ( 2.920 0.873 0.698) 3.127 15.227 ( 5.831 5.239 8.605) 11.640 15.448 ( 1.627 -2.533 -4.019) 5.021 15.745 ( 2.523 -0.238 -2.834) 3.802 ======================= Grid point 584 (297/306) ======================= q-point: (-0.40 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( -5.889 -0.000 6.582) 8.832 2.170 ( 8.219 0.000 -12.263) 14.762 2.383 ( -2.510 -0.000 -6.084) 6.581 2.823 ( 6.104 0.000 0.393) 6.117 2.961 ( 1.486 0.000 -1.021) 1.803 3.267 ( -4.559 -0.000 4.040) 6.091 3.684 ( -9.941 -0.000 1.164) 10.009 3.994 ( 10.629 0.000 7.178) 12.826 4.265 ( -4.919 -0.000 -7.112) 8.648 4.614 ( 3.566 0.000 -19.655) 19.975 4.821 ( -4.179 -0.000 24.168) 24.527 5.164 ( 5.451 0.000 -5.771) 7.939 5.598 ( -5.423 -0.000 -0.207) 5.427 5.660 ( 12.134 0.000 18.464) 22.094 6.244 ( -3.117 -0.000 -4.465) 5.445 6.361 ( -0.155 -0.000 -6.422) 6.424 6.834 ( -1.297 -0.000 -4.141) 4.339 7.211 ( 2.944 0.000 -4.330) 5.236 7.673 ( -8.965 -0.000 1.299) 9.059 8.040 ( -1.030 -0.000 -16.570) 16.602 8.193 ( -0.730 -0.000 7.255) 7.291 8.361 ( 5.418 0.000 6.412) 8.395 10.743 ( 0.682 0.000 -12.851) 12.869 11.009 ( -7.597 -0.000 25.135) 26.258 11.544 ( -5.599 -0.000 -0.386) 5.613 11.659 ( -0.354 -0.000 -2.793) 2.815 14.212 ( -0.963 -0.000 -5.813) 5.893 14.925 ( 14.253 0.000 9.219) 16.975 15.523 ( -1.098 -0.000 -0.161) 1.110 15.587 ( 2.569 0.000 -2.865) 3.848 ======================= Grid point 585 (298/306) ======================= q-point: (-0.30 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -3.847 -1.503 7.757) 8.788 2.125 ( 4.524 2.362 -10.814) 11.958 2.298 ( 0.373 0.784 -7.283) 7.335 2.724 ( -7.545 -2.884 -9.157) 12.210 3.061 ( 6.184 6.256 1.498) 8.923 3.219 ( -8.636 -4.094 3.909) 10.326 3.582 ( -12.021 0.459 10.531) 15.988 4.103 ( 6.254 7.266 -4.031) 10.400 4.265 ( 3.137 -6.569 -3.301) 7.993 4.517 ( 15.528 0.570 -16.409) 22.598 5.019 ( -4.360 -1.417 22.763) 23.220 5.205 ( 6.650 3.550 -1.578) 7.702 5.436 ( -15.419 -3.423 -0.599) 15.805 5.983 ( 9.289 2.837 14.426) 17.391 6.195 ( -0.171 2.314 -2.997) 3.791 6.273 ( -1.077 -2.304 -5.422) 5.989 6.787 ( 2.694 1.015 -6.946) 7.519 7.179 ( -0.163 -0.111 -5.025) 5.028 7.576 ( -7.190 -0.592 1.404) 7.350 7.860 ( -1.246 0.730 -13.228) 13.306 8.237 ( -2.268 -1.208 5.102) 5.712 8.497 ( 4.951 0.480 5.712) 7.575 10.652 ( 1.898 1.214 -6.703) 7.071 11.107 ( -8.070 3.487 19.157) 21.078 11.443 ( -4.629 0.424 -3.970) 6.113 11.682 ( -3.107 -7.296 2.806) 8.412 14.169 ( 2.471 0.406 -4.211) 4.899 15.176 ( 11.439 2.786 5.793) 13.121 15.489 ( -0.849 2.677 -0.825) 2.927 15.633 ( 4.311 -3.827 -1.640) 5.993 ======================= Grid point 586 (299/306) ======================= q-point: (-0.20 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.890 ( -2.348 -2.655 6.024) 6.990 2.041 ( -1.787 1.030 -5.135) 5.534 2.200 ( 0.850 4.025 -7.810) 8.827 2.590 ( -5.898 -7.101 -6.046) 11.035 2.950 ( -10.112 6.970 1.011) 12.323 3.224 ( 1.649 -1.121 -2.015) 2.835 3.508 ( -11.676 3.788 10.134) 15.918 4.068 ( 1.461 -0.472 -4.501) 4.756 4.303 ( 8.994 -0.167 -8.707) 12.519 4.692 ( 17.097 -1.639 -3.954) 17.624 5.096 ( -18.484 0.913 11.773) 21.933 5.206 ( 0.508 -0.789 9.562) 9.608 5.406 ( 4.163 -4.011 0.571) 5.809 6.024 ( -7.064 4.232 -8.315) 11.702 6.156 ( 4.763 4.015 8.315) 10.390 6.338 ( 5.161 -2.798 -0.636) 5.905 6.730 ( 2.281 2.408 -7.360) 8.073 7.124 ( -0.242 -0.929 -5.200) 5.288 7.506 ( -5.543 -0.705 1.419) 5.765 7.728 ( 0.125 1.033 -8.446) 8.510 8.285 ( 0.659 -4.149 1.903) 4.612 8.599 ( 2.281 1.750 5.522) 6.226 10.626 ( 2.143 1.312 -2.040) 3.236 11.134 ( -5.086 2.267 11.267) 12.568 11.335 ( -2.815 0.462 -4.919) 5.687 11.737 ( -6.285 -5.512 6.768) 10.757 14.180 ( 3.427 -0.913 -3.024) 4.660 15.324 ( 7.018 1.975 2.976) 7.874 15.438 ( -0.253 3.045 -1.358) 3.344 15.724 ( 4.799 -1.875 -1.207) 5.292 ======================= Grid point 587 (300/306) ======================= q-point: (-0.10 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( -3.700 -1.820 -3.898) 5.675 1.975 ( -9.250 -1.856 7.464) 12.030 2.147 ( 5.219 -0.404 -3.544) 6.321 2.538 ( -4.304 -2.807 -4.916) 7.111 2.754 ( -7.341 4.616 3.535) 9.365 3.227 ( 2.445 0.174 -3.621) 4.373 3.405 ( -7.999 2.376 5.413) 9.946 4.048 ( -4.892 -5.668 -2.682) 7.953 4.338 ( 8.124 3.717 -5.748) 10.624 4.865 ( -1.803 1.952 12.942) 13.212 4.989 ( -5.876 -4.587 1.739) 7.654 5.311 ( 3.842 -0.841 1.931) 4.381 5.490 ( -7.283 -0.902 7.699) 10.636 5.818 ( 3.088 2.447 -11.997) 12.627 6.240 ( 2.381 2.187 4.249) 5.339 6.388 ( 3.901 -0.829 -6.730) 7.823 6.674 ( 2.882 2.519 -3.732) 5.346 7.093 ( 1.235 -1.289 -4.197) 4.561 7.469 ( -3.319 -0.753 2.610) 4.289 7.665 ( 2.292 1.413 -4.869) 5.564 8.378 ( 2.900 -6.900 -1.057) 7.559 8.630 ( -1.135 3.617 3.790) 5.361 10.622 ( 0.450 1.785 -0.016) 1.841 11.147 ( -4.141 -2.457 1.523) 5.050 11.283 ( 2.415 3.457 2.034) 4.682 11.764 ( -4.334 -3.169 5.983) 8.039 14.206 ( 1.798 -1.643 -2.427) 3.438 15.396 ( 0.807 0.876 -3.563) 3.757 15.411 ( 2.756 1.484 3.404) 4.624 15.753 ( 1.272 1.693 -2.084) 2.971 ======================= Grid point 595 (301/306) ======================= q-point: (-0.30 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( -6.773 -0.000 11.441) 13.295 2.052 ( 0.962 0.000 -13.656) 13.690 2.263 ( 2.909 0.000 -4.841) 5.648 2.492 ( -7.675 -0.000 -7.580) 10.787 3.038 ( -15.863 -0.000 5.792) 16.887 3.197 ( 6.749 0.000 -5.218) 8.530 3.553 ( -11.639 -0.000 13.312) 17.683 4.062 ( -6.123 -0.000 -6.624) 9.021 4.300 ( 14.763 0.000 -8.600) 17.086 4.669 ( 23.477 0.000 -13.849) 27.257 5.109 ( -27.703 -0.000 18.706) 33.427 5.202 ( -2.200 -0.000 11.572) 11.779 5.359 ( 9.552 0.000 0.882) 9.593 6.065 ( -6.751 -0.000 -8.942) 11.204 6.242 ( 3.065 0.000 8.752) 9.273 6.268 ( 5.316 0.000 0.030) 5.316 6.762 ( 5.503 0.000 -10.598) 11.942 7.111 ( -1.824 -0.000 -4.081) 4.470 7.500 ( -5.572 -0.000 2.022) 5.928 7.740 ( 0.022 0.000 -8.315) 8.315 8.239 ( -0.616 -0.000 1.420) 1.548 8.617 ( 2.567 0.000 5.956) 6.485 10.641 ( 2.400 0.000 -2.498) 3.463 11.144 ( -7.100 -0.000 7.407) 10.260 11.376 ( -1.503 -0.000 -2.696) 3.087 11.657 ( -5.530 -0.000 10.792) 12.126 14.168 ( 3.329 0.000 -4.473) 5.575 15.329 ( 5.677 0.000 -1.499) 5.872 15.503 ( -0.858 -0.000 1.171) 1.452 15.690 ( 7.523 0.000 0.200) 7.525 ======================= Grid point 596 (302/306) ======================= q-point: (-0.20 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -9.507 -1.380 6.733) 11.731 1.893 ( -9.507 -2.699 -2.880) 10.294 2.235 ( 4.059 5.985 -4.585) 8.563 2.415 ( 0.254 -6.738 -5.771) 8.876 2.865 ( -13.420 3.665 7.598) 15.851 3.215 ( 5.198 -0.777 -7.757) 9.370 3.476 ( -13.209 3.077 8.971) 16.261 3.936 ( -4.207 -3.877 -6.057) 8.332 4.384 ( 7.296 0.911 -6.726) 9.965 4.850 ( 19.382 -1.705 -12.991) 23.395 4.946 ( -20.581 -0.332 21.948) 30.090 5.324 ( -0.549 1.060 11.314) 11.376 5.468 ( -3.788 -0.915 6.442) 7.529 5.862 ( -0.308 1.334 -13.641) 13.710 6.291 ( 1.070 2.717 2.166) 3.635 6.350 ( 1.857 -2.570 -2.528) 4.055 6.732 ( 6.665 2.176 -8.114) 10.724 7.062 ( -0.193 -1.190 -3.291) 3.505 7.463 ( -3.735 -0.048 3.814) 5.339 7.690 ( 2.427 0.794 -4.074) 4.808 8.264 ( 2.012 -3.292 -1.735) 4.230 8.681 ( -1.026 1.227 4.702) 4.967 10.653 ( 1.714 0.947 -0.895) 2.153 11.100 ( -4.371 -1.392 -0.800) 4.657 11.359 ( 3.108 2.673 1.842) 4.494 11.706 ( -6.962 -2.012 12.702) 14.624 14.170 ( 2.692 -1.240 -4.892) 5.720 15.357 ( 2.944 -1.235 -5.277) 6.167 15.493 ( -0.526 2.577 2.423) 3.576 15.781 ( 4.409 0.833 -1.019) 4.601 ======================= Grid point 597 (303/306) ======================= q-point: (-0.10 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -10.908 -3.028 1.224) 11.386 1.870 ( -11.277 -7.599 10.855) 17.399 2.182 ( 0.536 2.323 -3.606) 4.322 2.405 ( -0.996 -2.802 -6.098) 6.785 2.815 ( -0.037 3.414 9.778) 10.357 3.214 ( 4.997 -1.161 -7.941) 9.454 3.350 ( -12.045 0.677 7.842) 14.388 3.870 ( -4.536 -4.761 -4.504) 7.970 4.376 ( -3.109 0.269 3.058) 4.369 4.944 ( -7.479 2.452 9.681) 12.477 4.952 ( 3.193 -1.498 -0.622) 3.582 5.346 ( -16.624 -1.283 8.782) 18.845 5.399 ( 1.165 2.524 1.568) 3.191 5.824 ( 11.606 -1.190 -13.027) 17.488 6.266 ( 0.078 0.915 -6.684) 6.747 6.328 ( 0.554 -1.512 -4.884) 5.142 6.765 ( 8.948 3.373 -1.709) 9.714 7.060 ( 1.456 -2.078 -2.590) 3.626 7.476 ( -1.723 -0.164 6.052) 6.295 7.699 ( 4.678 1.972 -1.684) 5.348 8.317 ( 2.333 -6.104 -4.405) 7.881 8.652 ( -4.698 2.666 1.593) 5.632 10.639 ( 0.022 2.042 -1.485) 2.525 11.032 ( -3.893 -2.395 -4.643) 6.515 11.461 ( 7.099 3.368 8.659) 11.693 11.778 ( -0.821 -2.095 9.353) 9.620 14.162 ( 0.870 -2.267 -5.287) 5.818 15.324 ( 0.039 -1.221 -8.555) 8.642 15.490 ( -0.876 2.283 3.084) 3.936 15.763 ( -1.428 3.005 -1.562) 3.675 ======================= Grid point 606 (304/306) ======================= q-point: (-0.20 -0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -11.783 -0.000 2.256) 11.997 1.771 ( -15.166 -0.000 11.473) 19.016 2.242 ( -5.185 -0.000 -3.362) 6.179 2.345 ( 6.021 0.000 -7.720) 9.790 2.861 ( -2.505 -0.000 11.039) 11.320 3.197 ( 5.971 0.000 -9.898) 11.560 3.365 ( -15.957 -0.000 8.378) 18.023 3.812 ( -1.759 -0.000 -4.994) 5.294 4.375 ( -5.035 -0.000 4.374) 6.670 4.938 ( 15.783 0.000 -18.180) 24.075 4.966 ( -13.638 -0.000 24.606) 28.132 5.334 ( -20.806 -0.000 8.606) 22.516 5.431 ( 2.054 0.000 4.985) 5.392 5.811 ( 10.217 0.000 -14.925) 18.087 6.279 ( 0.055 0.000 -10.055) 10.055 6.308 ( -0.135 -0.000 -1.009) 1.018 6.808 ( 10.225 0.000 -3.284) 10.739 7.032 ( 0.393 0.000 -1.582) 1.630 7.475 ( -2.004 -0.000 6.227) 6.541 7.723 ( 4.668 0.000 -0.770) 4.731 8.246 ( 2.735 0.000 -4.821) 5.542 8.680 ( -5.093 -0.000 1.932) 5.447 10.663 ( 1.043 0.000 -2.319) 2.543 11.005 ( -3.763 -0.000 -5.005) 6.262 11.498 ( 7.208 0.000 8.333) 11.018 11.755 ( -2.811 -0.000 12.479) 12.792 14.135 ( 1.682 0.000 -6.425) 6.642 15.309 ( 0.620 0.000 -8.106) 8.129 15.514 ( -1.211 -0.000 2.287) 2.588 15.800 ( -0.682 -0.000 -2.528) 2.618 ======================= Grid point 607 (305/306) ======================= q-point: (-0.10 -0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( -11.836 -0.200 8.439) 14.538 1.720 ( -15.085 -9.335 13.477) 22.278 2.091 ( -10.110 0.501 -0.350) 10.129 2.371 ( 8.729 -0.690 -9.385) 12.835 2.995 ( 5.543 2.030 9.916) 11.540 3.186 ( 6.095 -1.277 -9.691) 11.519 3.259 ( -12.946 -1.370 12.203) 17.843 3.762 ( -1.334 -1.184 -2.729) 3.260 4.374 ( -7.373 -0.255 12.599) 14.600 4.839 ( -5.749 1.295 -13.014) 14.286 4.995 ( -14.788 1.093 20.084) 24.965 5.228 ( -5.164 -1.452 6.157) 8.166 5.482 ( 6.264 2.374 -3.380) 7.503 5.774 ( 3.671 -2.919 -13.959) 14.725 6.144 ( -2.364 0.381 -11.324) 11.574 6.321 ( 6.029 -0.513 -5.177) 7.963 6.929 ( 10.228 2.454 -0.604) 10.536 7.037 ( 0.715 -1.745 -0.956) 2.114 7.531 ( -0.475 -0.256 7.518) 7.538 7.793 ( 5.520 1.668 1.276) 5.906 8.236 ( 1.794 -3.333 -7.162) 8.100 8.583 ( -7.501 1.025 -1.215) 7.668 10.634 ( 0.316 1.693 -3.363) 3.779 10.890 ( -5.172 -1.758 -6.027) 8.134 11.724 ( 8.102 2.198 14.807) 17.021 11.898 ( 7.506 -1.153 7.775) 10.869 14.086 ( 0.814 -1.304 -7.423) 7.581 15.177 ( -5.580 0.214 -12.010) 13.244 15.515 ( -1.303 0.855 2.191) 2.689 15.724 ( -4.848 1.057 -1.145) 5.092 ======================= Grid point 617 (306/306) ======================= q-point: (-0.10 -0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.64e-04 1.64e-04 0.00e+00 0.00e+00 5.98e-04 5.98e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -18.351 -0.000 13.477) 22.768 1.577 ( -8.083 -0.000 10.510) 13.259 1.974 ( -8.128 -0.000 4.250) 9.172 2.397 ( 9.690 0.000 -11.207) 14.815 3.166 ( 5.843 0.000 -8.887) 10.636 3.186 ( 6.557 0.000 6.264) 9.069 3.250 ( -8.237 -0.000 17.323) 19.182 3.728 ( -1.040 -0.000 -0.341) 1.095 4.437 ( -4.970 -0.000 16.689) 17.413 4.620 ( -7.379 -0.000 -8.681) 11.393 4.928 ( -20.975 -0.000 15.592) 26.135 5.272 ( 3.698 0.000 2.550) 4.492 5.560 ( 7.386 0.000 -2.425) 7.774 5.607 ( -1.129 -0.000 -15.994) 16.034 5.996 ( -3.645 -0.000 -9.098) 9.801 6.346 ( 8.144 0.000 -10.580) 13.351 7.023 ( -1.169 -0.000 1.473) 1.881 7.074 ( 9.208 0.000 -2.023) 9.427 7.611 ( 0.779 0.000 7.665) 7.705 7.901 ( 4.631 0.000 3.401) 5.745 8.152 ( 0.733 0.000 -9.004) 9.034 8.454 ( -7.296 -0.000 -3.017) 7.895 10.613 ( 0.907 0.000 -4.379) 4.472 10.735 ( -6.555 -0.000 -4.774) 8.109 12.017 ( 4.651 0.000 19.765) 20.305 12.124 ( 16.898 0.000 2.457) 17.076 14.017 ( 2.469 0.000 -8.386) 8.742 14.903 ( -14.544 -0.000 -13.466) 19.821 15.522 ( -0.989 -0.000 1.742) 2.003 15.646 ( -5.090 -0.000 0.114) 5.092 =================== 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 3/33000 10.0 225.615 169.837 169.901 0.000 48.910 0.000 3/33000 20.0 49.892 28.449 38.186 0.000 -3.453 0.000 3/33000 30.0 23.976 12.984 18.574 0.000 -3.065 0.000 3/33000 40.0 15.364 8.214 12.194 0.000 -2.412 0.000 3/33000 50.0 11.322 5.975 9.230 0.000 -2.013 0.000 3/33000 60.0 9.029 4.700 7.542 0.000 -1.752 0.000 3/33000 70.0 7.554 3.885 6.445 0.000 -1.563 0.000 3/33000 80.0 6.521 3.320 5.663 0.000 -1.415 0.000 3/33000 90.0 5.752 2.906 5.070 0.000 -1.294 0.000 3/33000 100.0 5.155 2.588 4.600 0.000 -1.191 0.000 3/33000 110.0 4.676 2.335 4.215 0.000 -1.103 0.000 3/33000 120.0 4.283 2.130 3.892 0.000 -1.026 0.000 3/33000 130.0 3.954 1.959 3.617 0.000 -0.959 0.000 3/33000 140.0 3.674 1.814 3.379 0.000 -0.899 0.000 3/33000 150.0 3.432 1.690 3.171 0.000 -0.846 0.000 3/33000 160.0 3.222 1.582 2.987 0.000 -0.799 0.000 3/33000 170.0 3.036 1.488 2.824 0.000 -0.756 0.000 3/33000 180.0 2.871 1.404 2.677 0.000 -0.718 0.000 3/33000 190.0 2.724 1.330 2.545 0.000 -0.683 0.000 3/33000 200.0 2.591 1.263 2.425 0.000 -0.651 0.000 3/33000 210.0 2.471 1.202 2.316 0.000 -0.622 0.000 3/33000 220.0 2.362 1.148 2.217 0.000 -0.595 0.000 3/33000 230.0 2.262 1.098 2.125 0.000 -0.570 0.000 3/33000 240.0 2.171 1.052 2.041 0.000 -0.548 0.000 3/33000 250.0 2.086 1.010 1.963 0.000 -0.527 0.000 3/33000 260.0 2.008 0.971 1.891 0.000 -0.507 0.000 3/33000 270.0 1.936 0.936 1.824 0.000 -0.489 0.000 3/33000 280.0 1.868 0.902 1.761 0.000 -0.472 0.000 3/33000 290.0 1.806 0.871 1.703 0.000 -0.456 0.000 3/33000 300.0 1.747 0.842 1.648 0.000 -0.441 0.000 3/33000 310.0 1.692 0.815 1.597 0.000 -0.428 0.000 3/33000 320.0 1.640 0.790 1.548 0.000 -0.415 0.000 3/33000 330.0 1.592 0.766 1.503 0.000 -0.402 0.000 3/33000 340.0 1.546 0.744 1.460 0.000 -0.391 0.000 3/33000 350.0 1.503 0.723 1.419 0.000 -0.380 0.000 3/33000 360.0 1.462 0.703 1.381 0.000 -0.369 0.000 3/33000 370.0 1.423 0.684 1.345 0.000 -0.360 0.000 3/33000 380.0 1.386 0.666 1.310 0.000 -0.350 0.000 3/33000 390.0 1.351 0.649 1.277 0.000 -0.341 0.000 3/33000 400.0 1.318 0.633 1.246 0.000 -0.333 0.000 3/33000 410.0 1.287 0.617 1.217 0.000 -0.325 0.000 3/33000 420.0 1.257 0.603 1.188 0.000 -0.317 0.000 3/33000 430.0 1.228 0.589 1.161 0.000 -0.310 0.000 3/33000 440.0 1.200 0.575 1.135 0.000 -0.303 0.000 3/33000 450.0 1.174 0.563 1.111 0.000 -0.297 0.000 3/33000 460.0 1.149 0.551 1.087 0.000 -0.290 0.000 3/33000 470.0 1.125 0.539 1.064 0.000 -0.284 0.000 3/33000 480.0 1.102 0.528 1.042 0.000 -0.278 0.000 3/33000 490.0 1.080 0.517 1.021 0.000 -0.273 0.000 3/33000 500.0 1.058 0.507 1.001 0.000 -0.267 0.000 3/33000 510.0 1.038 0.497 0.982 0.000 -0.262 0.000 3/33000 520.0 1.018 0.487 0.963 0.000 -0.257 0.000 3/33000 530.0 0.999 0.478 0.945 0.000 -0.252 0.000 3/33000 540.0 0.981 0.469 0.928 0.000 -0.248 0.000 3/33000 550.0 0.963 0.461 0.912 0.000 -0.243 0.000 3/33000 560.0 0.946 0.453 0.896 0.000 -0.239 0.000 3/33000 570.0 0.930 0.445 0.880 0.000 -0.235 0.000 3/33000 580.0 0.914 0.437 0.865 0.000 -0.231 0.000 3/33000 590.0 0.899 0.430 0.851 0.000 -0.227 0.000 3/33000 600.0 0.884 0.423 0.837 0.000 -0.223 0.000 3/33000 610.0 0.870 0.416 0.823 0.000 -0.219 0.000 3/33000 620.0 0.856 0.409 0.810 0.000 -0.216 0.000 3/33000 630.0 0.842 0.402 0.797 0.000 -0.212 0.000 3/33000 640.0 0.829 0.396 0.785 0.000 -0.209 0.000 3/33000 650.0 0.817 0.390 0.773 0.000 -0.206 0.000 3/33000 660.0 0.804 0.384 0.761 0.000 -0.203 0.000 3/33000 670.0 0.792 0.379 0.750 0.000 -0.200 0.000 3/33000 680.0 0.781 0.373 0.739 0.000 -0.197 0.000 3/33000 690.0 0.770 0.368 0.729 0.000 -0.194 0.000 3/33000 700.0 0.759 0.362 0.718 0.000 -0.191 0.000 3/33000 710.0 0.748 0.357 0.708 0.000 -0.189 0.000 3/33000 720.0 0.738 0.352 0.698 0.000 -0.186 0.000 3/33000 730.0 0.728 0.348 0.689 0.000 -0.184 0.000 3/33000 740.0 0.718 0.343 0.680 0.000 -0.181 0.000 3/33000 750.0 0.708 0.338 0.671 0.000 -0.179 0.000 3/33000 760.0 0.699 0.334 0.662 0.000 -0.176 0.000 3/33000 770.0 0.690 0.329 0.653 0.000 -0.174 0.000 3/33000 780.0 0.681 0.325 0.645 0.000 -0.172 0.000 3/33000 790.0 0.673 0.321 0.637 0.000 -0.170 0.000 3/33000 800.0 0.664 0.317 0.629 0.000 -0.168 0.000 3/33000 810.0 0.656 0.313 0.621 0.000 -0.165 0.000 3/33000 820.0 0.648 0.309 0.614 0.000 -0.163 0.000 3/33000 830.0 0.641 0.306 0.607 0.000 -0.161 0.000 3/33000 840.0 0.633 0.302 0.599 0.000 -0.160 0.000 3/33000 850.0 0.626 0.299 0.592 0.000 -0.158 0.000 3/33000 860.0 0.618 0.295 0.586 0.000 -0.156 0.000 3/33000 870.0 0.611 0.292 0.579 0.000 -0.154 0.000 3/33000 880.0 0.604 0.288 0.572 0.000 -0.152 0.000 3/33000 890.0 0.598 0.285 0.566 0.000 -0.151 0.000 3/33000 900.0 0.591 0.282 0.560 0.000 -0.149 0.000 3/33000 910.0 0.585 0.279 0.554 0.000 -0.147 0.000 3/33000 920.0 0.578 0.276 0.548 0.000 -0.146 0.000 3/33000 930.0 0.572 0.273 0.542 0.000 -0.144 0.000 3/33000 940.0 0.566 0.270 0.536 0.000 -0.143 0.000 3/33000 950.0 0.560 0.267 0.530 0.000 -0.141 0.000 3/33000 960.0 0.554 0.264 0.525 0.000 -0.140 0.000 3/33000 970.0 0.549 0.262 0.520 0.000 -0.138 0.000 3/33000 980.0 0.543 0.259 0.514 0.000 -0.137 0.000 3/33000 990.0 0.538 0.256 0.509 0.000 -0.135 0.000 3/33000 1000.0 0.532 0.254 0.504 0.000 -0.134 0.000 3/33000 Thermal conductivity related properties were written into "kappa-m101011.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:19:54]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|