----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 10:48:03]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) Number of symmetry operations in supercell: 144 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 1.923307889117069 1.110422327516268 9.977473383333322 b -1.923307889117065 1.110422327516268 9.977473383333322 c 0.000000000000002 -2.220844655032540 9.977473383333322 Atomic positions (fractional): *1 O 0.69469359905913 0.69469359905913 0.69469359905913 15.999 2 O 0.30530640094088 0.30530640094088 0.30530640094088 15.999 *3 Zn 0.80408782305716 0.80408782305716 0.80408782305716 65.380 4 Zn 0.19591217694284 0.19591217694284 0.19591217694284 65.380 *5 P 0.88836925580820 0.88836925580820 0.88836925580820 30.974 6 P 0.11163074419180 0.11163074419180 0.11163074419180 30.974 *7 Dy 0.62010188168312 0.62010188168312 0.62010188168312 162.500 8 Dy 0.37989811831688 0.37989811831688 0.37989811831688 162.500 -------------------------------- unit cell --------------------------------- Lattice vectors: a 3.846615778234134 0.000000000000000 0.000000000000000 b -1.923307889117067 3.331266982548808 0.000000000000000 c 0.000000000000000 0.000000000000000 29.932420149999999 Atomic positions (fractional): *1 O 0.66666666666667 0.33333333333333 0.02802693239246 15.999 > 1 2 O 0.00000000000000 0.00000000000000 0.30530640094088 15.999 > 2 3 O 0.33333333333333 0.66666666666667 0.36136026572579 15.999 > 1 4 O 0.66666666666667 0.33333333333333 0.63863973427421 15.999 > 2 5 O 0.00000000000000 0.00000000000000 0.69469359905912 15.999 > 1 6 O 0.33333333333333 0.66666666666667 0.97197306760754 15.999 > 2 *7 Zn 0.66666666666667 0.33333333333333 0.13742115639049 65.380 > 3 8 Zn 0.00000000000000 0.00000000000000 0.19591217694284 65.380 > 4 9 Zn 0.33333333333333 0.66666666666667 0.47075448972383 65.380 > 3 10 Zn 0.66666666666667 0.33333333333333 0.52924551027617 65.380 > 4 11 Zn 0.00000000000000 0.00000000000000 0.80408782305716 65.380 > 3 12 Zn 0.33333333333333 0.66666666666667 0.86257884360951 65.380 > 4 *13 P 0.66666666666667 0.33333333333333 0.22170258914153 30.974 > 5 14 P 0.00000000000000 0.00000000000000 0.11163074419180 30.974 > 6 15 P 0.33333333333333 0.66666666666667 0.55503592247486 30.974 > 5 16 P 0.66666666666667 0.33333333333333 0.44496407752514 30.974 > 6 17 P 0.00000000000000 0.00000000000000 0.88836925580820 30.974 > 5 18 P 0.33333333333333 0.66666666666667 0.77829741085847 30.974 > 6 *19 Dy 0.33333333333333 0.66666666666667 0.28676854834979 162.500 > 7 20 Dy 0.33333333333333 0.66666666666667 0.04656478498354 162.500 > 8 21 Dy 0.00000000000000 0.00000000000000 0.62010188168312 162.500 > 7 22 Dy 0.00000000000000 0.00000000000000 0.37989811831688 162.500 > 8 23 Dy 0.66666666666667 0.33333333333333 0.95343521501646 162.500 > 7 24 Dy 0.66666666666667 0.33333333333333 0.71323145165021 162.500 > 8 -------------------------------- super cell -------------------------------- Lattice vectors: a 7.693231556468268 0.000000000000000 0.000000000000000 b -3.846615778234134 6.662533965097616 0.000000000000000 c 0.000000000000000 0.000000000000000 29.932420149999999 Atomic positions (fractional): *1 O 0.33333333333333 0.16666666666667 0.02802693239246 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02802693239246 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02802693239246 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02802693239246 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30530640094088 15.999 > 2 6 O 0.50000000000000 0.00000000000000 0.30530640094088 15.999 > 2 7 O 0.00000000000000 0.50000000000000 0.30530640094088 15.999 > 2 8 O 0.50000000000000 0.50000000000000 0.30530640094088 15.999 > 2 9 O 0.16666666666667 0.33333333333333 0.36136026572579 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36136026572579 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36136026572579 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36136026572579 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63863973427421 15.999 > 2 14 O 0.83333333333333 0.16666666666667 0.63863973427421 15.999 > 2 15 O 0.33333333333333 0.66666666666667 0.63863973427421 15.999 > 2 16 O 0.83333333333333 0.66666666666667 0.63863973427421 15.999 > 2 17 O 0.00000000000000 0.00000000000000 0.69469359905912 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69469359905912 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69469359905912 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69469359905912 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97197306760754 15.999 > 2 22 O 0.66666666666667 0.33333333333333 0.97197306760754 15.999 > 2 23 O 0.16666666666667 0.83333333333333 0.97197306760754 15.999 > 2 24 O 0.66666666666667 0.83333333333333 0.97197306760754 15.999 > 2 *25 Zn 0.33333333333333 0.16666666666667 0.13742115639049 65.380 > 3 26 Zn 0.83333333333333 0.16666666666667 0.13742115639049 65.380 > 3 27 Zn 0.33333333333333 0.66666666666667 0.13742115639049 65.380 > 3 28 Zn 0.83333333333333 0.66666666666667 0.13742115639049 65.380 > 3 29 Zn 0.00000000000000 0.00000000000000 0.19591217694284 65.380 > 4 30 Zn 0.50000000000000 0.00000000000000 0.19591217694284 65.380 > 4 31 Zn 0.00000000000000 0.50000000000000 0.19591217694284 65.380 > 4 32 Zn 0.50000000000000 0.50000000000000 0.19591217694284 65.380 > 4 33 Zn 0.16666666666667 0.33333333333333 0.47075448972383 65.380 > 3 34 Zn 0.66666666666667 0.33333333333333 0.47075448972383 65.380 > 3 35 Zn 0.16666666666667 0.83333333333333 0.47075448972383 65.380 > 3 36 Zn 0.66666666666667 0.83333333333333 0.47075448972383 65.380 > 3 37 Zn 0.33333333333333 0.16666666666667 0.52924551027617 65.380 > 4 38 Zn 0.83333333333333 0.16666666666667 0.52924551027617 65.380 > 4 39 Zn 0.33333333333333 0.66666666666667 0.52924551027617 65.380 > 4 40 Zn 0.83333333333333 0.66666666666667 0.52924551027617 65.380 > 4 41 Zn 0.00000000000000 0.00000000000000 0.80408782305716 65.380 > 3 42 Zn 0.50000000000000 0.00000000000000 0.80408782305716 65.380 > 3 43 Zn 0.00000000000000 0.50000000000000 0.80408782305716 65.380 > 3 44 Zn 0.50000000000000 0.50000000000000 0.80408782305716 65.380 > 3 45 Zn 0.16666666666667 0.33333333333333 0.86257884360951 65.380 > 4 46 Zn 0.66666666666667 0.33333333333333 0.86257884360951 65.380 > 4 47 Zn 0.16666666666667 0.83333333333333 0.86257884360951 65.380 > 4 48 Zn 0.66666666666667 0.83333333333333 0.86257884360951 65.380 > 4 *49 P 0.33333333333333 0.16666666666667 0.22170258914153 30.974 > 5 50 P 0.83333333333333 0.16666666666667 0.22170258914153 30.974 > 5 51 P 0.33333333333333 0.66666666666667 0.22170258914153 30.974 > 5 52 P 0.83333333333333 0.66666666666667 0.22170258914153 30.974 > 5 53 P 0.00000000000000 0.00000000000000 0.11163074419180 30.974 > 6 54 P 0.50000000000000 0.00000000000000 0.11163074419180 30.974 > 6 55 P 0.00000000000000 0.50000000000000 0.11163074419180 30.974 > 6 56 P 0.50000000000000 0.50000000000000 0.11163074419180 30.974 > 6 57 P 0.16666666666667 0.33333333333333 0.55503592247486 30.974 > 5 58 P 0.66666666666667 0.33333333333333 0.55503592247486 30.974 > 5 59 P 0.16666666666667 0.83333333333333 0.55503592247486 30.974 > 5 60 P 0.66666666666667 0.83333333333333 0.55503592247486 30.974 > 5 61 P 0.33333333333333 0.16666666666667 0.44496407752514 30.974 > 6 62 P 0.83333333333333 0.16666666666667 0.44496407752514 30.974 > 6 63 P 0.33333333333333 0.66666666666667 0.44496407752514 30.974 > 6 64 P 0.83333333333333 0.66666666666667 0.44496407752514 30.974 > 6 65 P 0.00000000000000 0.00000000000000 0.88836925580820 30.974 > 5 66 P 0.50000000000000 0.00000000000000 0.88836925580820 30.974 > 5 67 P 0.00000000000000 0.50000000000000 0.88836925580820 30.974 > 5 68 P 0.50000000000000 0.50000000000000 0.88836925580820 30.974 > 5 69 P 0.16666666666667 0.33333333333333 0.77829741085847 30.974 > 6 70 P 0.66666666666667 0.33333333333333 0.77829741085847 30.974 > 6 71 P 0.16666666666667 0.83333333333333 0.77829741085847 30.974 > 6 72 P 0.66666666666667 0.83333333333333 0.77829741085847 30.974 > 6 *73 Dy 0.16666666666667 0.33333333333333 0.28676854834979 162.500 > 7 74 Dy 0.66666666666667 0.33333333333333 0.28676854834979 162.500 > 7 75 Dy 0.16666666666667 0.83333333333333 0.28676854834979 162.500 > 7 76 Dy 0.66666666666667 0.83333333333333 0.28676854834979 162.500 > 7 77 Dy 0.16666666666667 0.33333333333333 0.04656478498354 162.500 > 8 78 Dy 0.66666666666667 0.33333333333333 0.04656478498354 162.500 > 8 79 Dy 0.16666666666667 0.83333333333333 0.04656478498354 162.500 > 8 80 Dy 0.66666666666667 0.83333333333333 0.04656478498354 162.500 > 8 81 Dy 0.00000000000000 0.00000000000000 0.62010188168312 162.500 > 7 82 Dy 0.50000000000000 0.00000000000000 0.62010188168312 162.500 > 7 83 Dy 0.00000000000000 0.50000000000000 0.62010188168312 162.500 > 7 84 Dy 0.50000000000000 0.50000000000000 0.62010188168312 162.500 > 7 85 Dy 0.00000000000000 0.00000000000000 0.37989811831688 162.500 > 8 86 Dy 0.50000000000000 0.00000000000000 0.37989811831688 162.500 > 8 87 Dy 0.00000000000000 0.50000000000000 0.37989811831688 162.500 > 8 88 Dy 0.50000000000000 0.50000000000000 0.37989811831688 162.500 > 8 89 Dy 0.33333333333333 0.16666666666667 0.95343521501646 162.500 > 7 90 Dy 0.83333333333333 0.16666666666667 0.95343521501646 162.500 > 7 91 Dy 0.33333333333333 0.66666666666667 0.95343521501646 162.500 > 7 92 Dy 0.83333333333333 0.66666666666667 0.95343521501646 162.500 > 7 93 Dy 0.33333333333333 0.16666666666667 0.71323145165021 162.500 > 8 94 Dy 0.83333333333333 0.16666666666667 0.71323145165021 162.500 > 8 95 Dy 0.33333333333333 0.66666666666667 0.71323145165021 162.500 > 8 96 Dy 0.83333333333333 0.66666666666667 0.71323145165021 162.500 > 8 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 10.0559265 0.0000000 0.0000000 0.0000000 10.0559265 0.0000000 0.0000000 0.0000000 7.9951567 -------------------------- Born effective charges -------------------------- 1 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 2 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 3 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 4 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 5 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 6 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 7 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 8 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 288/288 Permutation basis: 4128/4128 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 376 Number of blocks in projector: 320 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 168 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 112 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 96 Use standard eigh solver. Tree of FC basis block matrices: - (376, 368), data: False |-- (96, 96), data: True |-- (112, 108), data: True |-- (168, 164), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 80 / 80 - Time: 0.206 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.212 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 4128/4128 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 376 Number of blocks in projector: 320 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 3 --- Eigsh_solver_block: 1 / 3 --- Block_size: 168 Use standard eigh solver. --- Eigsh_solver_block: 2 / 3 --- Block_size: 112 Use standard eigh solver. --- Eigsh_solver_block: 3 / 3 --- Block_size: 96 Use standard eigh solver. Tree of FC basis block matrices: - (376, 368), data: False |-- (96, 96), data: True |-- (112, 108), data: True |-- (168, 164), 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 10:48:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:48:07]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 1.923307889117069 1.110422327516268 9.977473383333322 b -1.923307889117065 1.110422327516268 9.977473383333322 c 0.000000000000002 -2.220844655032540 9.977473383333322 Atomic positions (fractional): 1 O 0.69469359905913 0.69469359905913 0.69469359905913 15.999 2 O 0.30530640094088 0.30530640094088 0.30530640094088 15.999 3 Zn 0.80408782305716 0.80408782305716 0.80408782305716 65.380 4 Zn 0.19591217694284 0.19591217694284 0.19591217694284 65.380 5 P 0.88836925580820 0.88836925580820 0.88836925580820 30.974 6 P 0.11163074419180 0.11163074419180 0.11163074419180 30.974 7 Dy 0.62010188168312 0.62010188168312 0.62010188168312 162.500 8 Dy 0.37989811831688 0.37989811831688 0.37989811831688 162.500 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.693231556468268 0.000000000000000 0.000000000000000 b -3.846615778234134 6.662533965097616 0.000000000000000 c 0.000000000000000 0.000000000000000 29.932420149999999 Atomic positions (fractional): 1 O 0.33333333333333 0.16666666666667 0.02802693239246 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02802693239246 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02802693239246 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02802693239246 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30530640094088 15.999 > 5 6 O 0.50000000000000 0.00000000000000 0.30530640094088 15.999 > 5 7 O 0.00000000000000 0.50000000000000 0.30530640094088 15.999 > 5 8 O 0.50000000000000 0.50000000000000 0.30530640094088 15.999 > 5 9 O 0.16666666666667 0.33333333333333 0.36136026572579 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36136026572579 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36136026572579 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36136026572579 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63863973427421 15.999 > 5 14 O 0.83333333333333 0.16666666666667 0.63863973427421 15.999 > 5 15 O 0.33333333333333 0.66666666666667 0.63863973427421 15.999 > 5 16 O 0.83333333333333 0.66666666666667 0.63863973427421 15.999 > 5 17 O 0.00000000000000 0.00000000000000 0.69469359905912 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69469359905912 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69469359905912 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69469359905912 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97197306760754 15.999 > 5 22 O 0.66666666666667 0.33333333333333 0.97197306760754 15.999 > 5 23 O 0.16666666666667 0.83333333333333 0.97197306760754 15.999 > 5 24 O 0.66666666666667 0.83333333333333 0.97197306760754 15.999 > 5 25 Zn 0.33333333333333 0.16666666666667 0.13742115639049 65.380 > 25 26 Zn 0.83333333333333 0.16666666666667 0.13742115639049 65.380 > 25 27 Zn 0.33333333333333 0.66666666666667 0.13742115639049 65.380 > 25 28 Zn 0.83333333333333 0.66666666666667 0.13742115639049 65.380 > 25 29 Zn 0.00000000000000 0.00000000000000 0.19591217694284 65.380 > 29 30 Zn 0.50000000000000 0.00000000000000 0.19591217694284 65.380 > 29 31 Zn 0.00000000000000 0.50000000000000 0.19591217694284 65.380 > 29 32 Zn 0.50000000000000 0.50000000000000 0.19591217694284 65.380 > 29 33 Zn 0.16666666666667 0.33333333333333 0.47075448972383 65.380 > 25 34 Zn 0.66666666666667 0.33333333333333 0.47075448972383 65.380 > 25 35 Zn 0.16666666666667 0.83333333333333 0.47075448972383 65.380 > 25 36 Zn 0.66666666666667 0.83333333333333 0.47075448972383 65.380 > 25 37 Zn 0.33333333333333 0.16666666666667 0.52924551027617 65.380 > 29 38 Zn 0.83333333333333 0.16666666666667 0.52924551027617 65.380 > 29 39 Zn 0.33333333333333 0.66666666666667 0.52924551027617 65.380 > 29 40 Zn 0.83333333333333 0.66666666666667 0.52924551027617 65.380 > 29 41 Zn 0.00000000000000 0.00000000000000 0.80408782305716 65.380 > 25 42 Zn 0.50000000000000 0.00000000000000 0.80408782305716 65.380 > 25 43 Zn 0.00000000000000 0.50000000000000 0.80408782305716 65.380 > 25 44 Zn 0.50000000000000 0.50000000000000 0.80408782305716 65.380 > 25 45 Zn 0.16666666666667 0.33333333333333 0.86257884360951 65.380 > 29 46 Zn 0.66666666666667 0.33333333333333 0.86257884360951 65.380 > 29 47 Zn 0.16666666666667 0.83333333333333 0.86257884360951 65.380 > 29 48 Zn 0.66666666666667 0.83333333333333 0.86257884360951 65.380 > 29 49 P 0.33333333333333 0.16666666666667 0.22170258914153 30.974 > 49 50 P 0.83333333333333 0.16666666666667 0.22170258914153 30.974 > 49 51 P 0.33333333333333 0.66666666666667 0.22170258914153 30.974 > 49 52 P 0.83333333333333 0.66666666666667 0.22170258914153 30.974 > 49 53 P 0.00000000000000 0.00000000000000 0.11163074419180 30.974 > 53 54 P 0.50000000000000 0.00000000000000 0.11163074419180 30.974 > 53 55 P 0.00000000000000 0.50000000000000 0.11163074419180 30.974 > 53 56 P 0.50000000000000 0.50000000000000 0.11163074419180 30.974 > 53 57 P 0.16666666666667 0.33333333333333 0.55503592247486 30.974 > 49 58 P 0.66666666666667 0.33333333333333 0.55503592247486 30.974 > 49 59 P 0.16666666666667 0.83333333333333 0.55503592247486 30.974 > 49 60 P 0.66666666666667 0.83333333333333 0.55503592247486 30.974 > 49 61 P 0.33333333333333 0.16666666666667 0.44496407752514 30.974 > 53 62 P 0.83333333333333 0.16666666666667 0.44496407752514 30.974 > 53 63 P 0.33333333333333 0.66666666666667 0.44496407752514 30.974 > 53 64 P 0.83333333333333 0.66666666666667 0.44496407752514 30.974 > 53 65 P 0.00000000000000 0.00000000000000 0.88836925580820 30.974 > 49 66 P 0.50000000000000 0.00000000000000 0.88836925580820 30.974 > 49 67 P 0.00000000000000 0.50000000000000 0.88836925580820 30.974 > 49 68 P 0.50000000000000 0.50000000000000 0.88836925580820 30.974 > 49 69 P 0.16666666666667 0.33333333333333 0.77829741085847 30.974 > 53 70 P 0.66666666666667 0.33333333333333 0.77829741085847 30.974 > 53 71 P 0.16666666666667 0.83333333333333 0.77829741085847 30.974 > 53 72 P 0.66666666666667 0.83333333333333 0.77829741085847 30.974 > 53 73 Dy 0.16666666666667 0.33333333333333 0.28676854834979 162.500 > 73 74 Dy 0.66666666666667 0.33333333333333 0.28676854834979 162.500 > 73 75 Dy 0.16666666666667 0.83333333333333 0.28676854834979 162.500 > 73 76 Dy 0.66666666666667 0.83333333333333 0.28676854834979 162.500 > 73 77 Dy 0.16666666666667 0.33333333333333 0.04656478498354 162.500 > 77 78 Dy 0.66666666666667 0.33333333333333 0.04656478498354 162.500 > 77 79 Dy 0.16666666666667 0.83333333333333 0.04656478498354 162.500 > 77 80 Dy 0.66666666666667 0.83333333333333 0.04656478498354 162.500 > 77 81 Dy 0.00000000000000 0.00000000000000 0.62010188168312 162.500 > 73 82 Dy 0.50000000000000 0.00000000000000 0.62010188168312 162.500 > 73 83 Dy 0.00000000000000 0.50000000000000 0.62010188168312 162.500 > 73 84 Dy 0.50000000000000 0.50000000000000 0.62010188168312 162.500 > 73 85 Dy 0.00000000000000 0.00000000000000 0.37989811831688 162.500 > 77 86 Dy 0.50000000000000 0.00000000000000 0.37989811831688 162.500 > 77 87 Dy 0.00000000000000 0.50000000000000 0.37989811831688 162.500 > 77 88 Dy 0.50000000000000 0.50000000000000 0.37989811831688 162.500 > 77 89 Dy 0.33333333333333 0.16666666666667 0.95343521501646 162.500 > 73 90 Dy 0.83333333333333 0.16666666666667 0.95343521501646 162.500 > 73 91 Dy 0.33333333333333 0.66666666666667 0.95343521501646 162.500 > 73 92 Dy 0.83333333333333 0.66666666666667 0.95343521501646 162.500 > 73 93 Dy 0.33333333333333 0.16666666666667 0.71323145165021 162.500 > 77 94 Dy 0.83333333333333 0.16666666666667 0.71323145165021 162.500 > 77 95 Dy 0.33333333333333 0.66666666666667 0.71323145165021 162.500 > 77 96 Dy 0.83333333333333 0.66666666666667 0.71323145165021 162.500 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 10.0559265 0.0000000 0.0000000 0.0000000 10.0559265 0.0000000 0.0000000 0.0000000 7.9951567 -------------------------- Born effective charges -------------------------- 1 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 2 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 3 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 4 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 5 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 6 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 7 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 8 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 ---------------------------------------------------------------------------- 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] 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 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000026 (zzz) 0.00000026 (zzz) 0.00000026 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) 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 10:48:14]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:48:14]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3m (166) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 1.923307889117069 1.110422327516268 9.977473383333322 b -1.923307889117065 1.110422327516268 9.977473383333322 c 0.000000000000002 -2.220844655032540 9.977473383333322 Atomic positions (fractional): 1 O 0.69469359905913 0.69469359905913 0.69469359905913 15.999 2 O 0.30530640094088 0.30530640094088 0.30530640094088 15.999 3 Zn 0.80408782305716 0.80408782305716 0.80408782305716 65.380 4 Zn 0.19591217694284 0.19591217694284 0.19591217694284 65.380 5 P 0.88836925580820 0.88836925580820 0.88836925580820 30.974 6 P 0.11163074419180 0.11163074419180 0.11163074419180 30.974 7 Dy 0.62010188168312 0.62010188168312 0.62010188168312 162.500 8 Dy 0.37989811831688 0.37989811831688 0.37989811831688 162.500 -------------------------------- supercell --------------------------------- Lattice vectors: a 7.693231556468268 0.000000000000000 0.000000000000000 b -3.846615778234134 6.662533965097616 0.000000000000000 c 0.000000000000000 0.000000000000000 29.932420149999999 Atomic positions (fractional): 1 O 0.33333333333333 0.16666666666667 0.02802693239246 15.999 > 1 2 O 0.83333333333333 0.16666666666667 0.02802693239246 15.999 > 1 3 O 0.33333333333333 0.66666666666667 0.02802693239246 15.999 > 1 4 O 0.83333333333333 0.66666666666667 0.02802693239246 15.999 > 1 5 O 0.00000000000000 0.00000000000000 0.30530640094088 15.999 > 5 6 O 0.50000000000000 0.00000000000000 0.30530640094088 15.999 > 5 7 O 0.00000000000000 0.50000000000000 0.30530640094088 15.999 > 5 8 O 0.50000000000000 0.50000000000000 0.30530640094088 15.999 > 5 9 O 0.16666666666667 0.33333333333333 0.36136026572579 15.999 > 1 10 O 0.66666666666667 0.33333333333333 0.36136026572579 15.999 > 1 11 O 0.16666666666667 0.83333333333333 0.36136026572579 15.999 > 1 12 O 0.66666666666667 0.83333333333333 0.36136026572579 15.999 > 1 13 O 0.33333333333333 0.16666666666667 0.63863973427421 15.999 > 5 14 O 0.83333333333333 0.16666666666667 0.63863973427421 15.999 > 5 15 O 0.33333333333333 0.66666666666667 0.63863973427421 15.999 > 5 16 O 0.83333333333333 0.66666666666667 0.63863973427421 15.999 > 5 17 O 0.00000000000000 0.00000000000000 0.69469359905912 15.999 > 1 18 O 0.50000000000000 0.00000000000000 0.69469359905912 15.999 > 1 19 O 0.00000000000000 0.50000000000000 0.69469359905912 15.999 > 1 20 O 0.50000000000000 0.50000000000000 0.69469359905912 15.999 > 1 21 O 0.16666666666667 0.33333333333333 0.97197306760754 15.999 > 5 22 O 0.66666666666667 0.33333333333333 0.97197306760754 15.999 > 5 23 O 0.16666666666667 0.83333333333333 0.97197306760754 15.999 > 5 24 O 0.66666666666667 0.83333333333333 0.97197306760754 15.999 > 5 25 Zn 0.33333333333333 0.16666666666667 0.13742115639049 65.380 > 25 26 Zn 0.83333333333333 0.16666666666667 0.13742115639049 65.380 > 25 27 Zn 0.33333333333333 0.66666666666667 0.13742115639049 65.380 > 25 28 Zn 0.83333333333333 0.66666666666667 0.13742115639049 65.380 > 25 29 Zn 0.00000000000000 0.00000000000000 0.19591217694284 65.380 > 29 30 Zn 0.50000000000000 0.00000000000000 0.19591217694284 65.380 > 29 31 Zn 0.00000000000000 0.50000000000000 0.19591217694284 65.380 > 29 32 Zn 0.50000000000000 0.50000000000000 0.19591217694284 65.380 > 29 33 Zn 0.16666666666667 0.33333333333333 0.47075448972383 65.380 > 25 34 Zn 0.66666666666667 0.33333333333333 0.47075448972383 65.380 > 25 35 Zn 0.16666666666667 0.83333333333333 0.47075448972383 65.380 > 25 36 Zn 0.66666666666667 0.83333333333333 0.47075448972383 65.380 > 25 37 Zn 0.33333333333333 0.16666666666667 0.52924551027617 65.380 > 29 38 Zn 0.83333333333333 0.16666666666667 0.52924551027617 65.380 > 29 39 Zn 0.33333333333333 0.66666666666667 0.52924551027617 65.380 > 29 40 Zn 0.83333333333333 0.66666666666667 0.52924551027617 65.380 > 29 41 Zn 0.00000000000000 0.00000000000000 0.80408782305716 65.380 > 25 42 Zn 0.50000000000000 0.00000000000000 0.80408782305716 65.380 > 25 43 Zn 0.00000000000000 0.50000000000000 0.80408782305716 65.380 > 25 44 Zn 0.50000000000000 0.50000000000000 0.80408782305716 65.380 > 25 45 Zn 0.16666666666667 0.33333333333333 0.86257884360951 65.380 > 29 46 Zn 0.66666666666667 0.33333333333333 0.86257884360951 65.380 > 29 47 Zn 0.16666666666667 0.83333333333333 0.86257884360951 65.380 > 29 48 Zn 0.66666666666667 0.83333333333333 0.86257884360951 65.380 > 29 49 P 0.33333333333333 0.16666666666667 0.22170258914153 30.974 > 49 50 P 0.83333333333333 0.16666666666667 0.22170258914153 30.974 > 49 51 P 0.33333333333333 0.66666666666667 0.22170258914153 30.974 > 49 52 P 0.83333333333333 0.66666666666667 0.22170258914153 30.974 > 49 53 P 0.00000000000000 0.00000000000000 0.11163074419180 30.974 > 53 54 P 0.50000000000000 0.00000000000000 0.11163074419180 30.974 > 53 55 P 0.00000000000000 0.50000000000000 0.11163074419180 30.974 > 53 56 P 0.50000000000000 0.50000000000000 0.11163074419180 30.974 > 53 57 P 0.16666666666667 0.33333333333333 0.55503592247486 30.974 > 49 58 P 0.66666666666667 0.33333333333333 0.55503592247486 30.974 > 49 59 P 0.16666666666667 0.83333333333333 0.55503592247486 30.974 > 49 60 P 0.66666666666667 0.83333333333333 0.55503592247486 30.974 > 49 61 P 0.33333333333333 0.16666666666667 0.44496407752514 30.974 > 53 62 P 0.83333333333333 0.16666666666667 0.44496407752514 30.974 > 53 63 P 0.33333333333333 0.66666666666667 0.44496407752514 30.974 > 53 64 P 0.83333333333333 0.66666666666667 0.44496407752514 30.974 > 53 65 P 0.00000000000000 0.00000000000000 0.88836925580820 30.974 > 49 66 P 0.50000000000000 0.00000000000000 0.88836925580820 30.974 > 49 67 P 0.00000000000000 0.50000000000000 0.88836925580820 30.974 > 49 68 P 0.50000000000000 0.50000000000000 0.88836925580820 30.974 > 49 69 P 0.16666666666667 0.33333333333333 0.77829741085847 30.974 > 53 70 P 0.66666666666667 0.33333333333333 0.77829741085847 30.974 > 53 71 P 0.16666666666667 0.83333333333333 0.77829741085847 30.974 > 53 72 P 0.66666666666667 0.83333333333333 0.77829741085847 30.974 > 53 73 Dy 0.16666666666667 0.33333333333333 0.28676854834979 162.500 > 73 74 Dy 0.66666666666667 0.33333333333333 0.28676854834979 162.500 > 73 75 Dy 0.16666666666667 0.83333333333333 0.28676854834979 162.500 > 73 76 Dy 0.66666666666667 0.83333333333333 0.28676854834979 162.500 > 73 77 Dy 0.16666666666667 0.33333333333333 0.04656478498354 162.500 > 77 78 Dy 0.66666666666667 0.33333333333333 0.04656478498354 162.500 > 77 79 Dy 0.16666666666667 0.83333333333333 0.04656478498354 162.500 > 77 80 Dy 0.66666666666667 0.83333333333333 0.04656478498354 162.500 > 77 81 Dy 0.00000000000000 0.00000000000000 0.62010188168312 162.500 > 73 82 Dy 0.50000000000000 0.00000000000000 0.62010188168312 162.500 > 73 83 Dy 0.00000000000000 0.50000000000000 0.62010188168312 162.500 > 73 84 Dy 0.50000000000000 0.50000000000000 0.62010188168312 162.500 > 73 85 Dy 0.00000000000000 0.00000000000000 0.37989811831688 162.500 > 77 86 Dy 0.50000000000000 0.00000000000000 0.37989811831688 162.500 > 77 87 Dy 0.00000000000000 0.50000000000000 0.37989811831688 162.500 > 77 88 Dy 0.50000000000000 0.50000000000000 0.37989811831688 162.500 > 77 89 Dy 0.33333333333333 0.16666666666667 0.95343521501646 162.500 > 73 90 Dy 0.83333333333333 0.16666666666667 0.95343521501646 162.500 > 73 91 Dy 0.33333333333333 0.66666666666667 0.95343521501646 162.500 > 73 92 Dy 0.83333333333333 0.66666666666667 0.95343521501646 162.500 > 73 93 Dy 0.33333333333333 0.16666666666667 0.71323145165021 162.500 > 77 94 Dy 0.83333333333333 0.16666666666667 0.71323145165021 162.500 > 77 95 Dy 0.33333333333333 0.66666666666667 0.71323145165021 162.500 > 77 96 Dy 0.83333333333333 0.66666666666667 0.71323145165021 162.500 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 10.0559265 0.0000000 0.0000000 0.0000000 10.0559265 0.0000000 0.0000000 0.0000000 7.9951567 -------------------------- Born effective charges -------------------------- 1 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 2 O -2.6897043 -0.0000000 0.0000000 0.0000000 -2.6897043 0.0000000 0.0000000 0.0000000 -4.0586133 3 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 4 Zn 1.8643281 0.0000000 0.0000000 0.0000000 1.8643281 0.0000000 0.0000000 0.0000000 1.2015691 5 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 6 P -3.0515397 -0.0000000 0.0000000 0.0000000 -3.0515397 0.0000000 0.0000000 0.0000000 -2.4619423 7 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 8 Dy 3.8769160 0.0000000 0.0000000 0.0000000 3.8769160 0.0000000 0.0000000 0.0000000 5.3189865 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000026 (zzz) 0.00000026 (zzz) 0.00000026 (zzz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 15 15 15 ] 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: 0.82, Number of G-points: 299, Lambda: 0.26 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/344) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 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 2.375 ( 0.000 0.000 0.000) 0.000 2.375 ( 0.000 0.000 0.000) 0.000 2.693 ( 0.000 0.000 0.000) 0.000 2.693 ( 0.000 0.000 0.000) 0.000 3.371 ( 0.000 0.000 0.000) 0.000 3.371 ( 0.000 0.000 0.000) 0.000 4.040 ( 0.000 0.000 0.000) 0.000 4.280 ( 0.000 0.000 0.000) 0.000 5.422 ( 0.000 0.000 0.000) 0.000 7.251 ( 0.000 0.000 0.000) 0.000 8.913 ( 0.000 0.000 0.000) 0.000 8.913 ( 0.000 0.000 0.000) 0.000 9.260 ( 0.000 0.000 0.000) 0.000 9.260 ( 0.000 0.000 0.000) 0.000 9.683 ( 0.000 0.000 0.000) 0.000 10.098 ( 0.000 0.000 0.000) 0.000 10.098 ( 0.000 0.000 0.000) 0.000 12.134 ( 0.000 0.000 0.000) 0.000 12.134 ( 0.000 0.000 0.000) 0.000 13.797 ( 0.000 0.000 0.000) 0.000 13.886 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/344) ======================= q-point: ( 0.07 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.569 ( 23.725 13.698 3.920) 27.674 0.600 ( 25.225 14.563 3.415) 29.326 1.052 ( 44.127 25.477 3.834) 51.097 2.446 ( 5.853 3.379 -0.120) 6.759 2.478 ( 8.527 4.923 -5.411) 11.235 2.679 ( -1.163 -0.671 -0.547) 1.450 2.902 ( 6.851 3.955 4.144) 8.930 3.369 ( -0.167 -0.096 0.031) 0.195 3.462 ( 7.593 4.384 0.124) 8.769 4.089 ( 4.592 2.651 -4.547) 6.985 4.239 ( -3.598 -2.077 3.799) 5.629 5.389 ( -2.828 -1.633 0.169) 3.270 7.308 ( 2.613 1.509 11.955) 12.330 8.938 ( 2.037 1.176 0.951) 2.537 9.274 ( 0.872 0.503 0.995) 1.416 9.277 ( 1.504 0.868 -0.826) 1.923 9.309 ( -14.153 -8.171 -1.655) 16.426 9.889 ( 8.679 5.011 0.061) 10.021 10.043 ( -4.545 -2.624 -0.189) 5.252 11.809 ( -15.570 -8.989 -31.528) 36.294 12.154 ( 1.647 0.951 0.186) 1.910 12.284 ( -3.559 -2.055 6.875) 8.009 13.908 ( 1.662 0.959 32.729) 32.785 13.988 ( 7.773 4.488 0.520) 8.990 ======================= Grid point 2 (3/344) ======================= q-point: ( 0.13 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( 21.465 12.393 3.411) 25.019 1.171 ( 23.354 13.484 2.728) 27.105 2.022 ( 38.171 22.038 0.186) 44.076 2.613 ( 3.251 1.877 11.810) 12.392 2.655 ( 4.245 2.451 -13.124) 14.009 2.698 ( 10.909 6.298 -4.496) 13.375 3.124 ( 10.766 6.216 6.305) 13.939 3.367 ( 0.018 0.010 0.392) 0.392 3.703 ( 12.590 7.269 0.005) 14.538 4.116 ( -4.372 -2.524 -4.084) 6.493 4.278 ( 9.964 5.753 1.664) 11.626 5.294 ( -5.356 -3.093 0.009) 6.185 7.430 ( 5.896 3.404 6.469) 9.391 8.984 ( -12.884 -7.439 0.551) 14.888 9.008 ( 3.620 2.090 1.893) 4.589 9.320 ( 2.953 1.705 -2.364) 4.148 9.322 ( 2.418 1.396 -1.740) 3.290 9.898 ( -7.637 -4.409 0.086) 8.819 10.052 ( 5.544 3.201 0.869) 6.461 11.370 ( -16.965 -9.795 -14.147) 24.164 12.111 ( -11.370 -6.564 9.151) 16.004 12.206 ( 2.718 1.569 0.039) 3.138 14.017 ( 3.259 1.881 9.196) 9.936 14.234 ( 12.456 7.191 -0.722) 14.401 ======================= Grid point 3 (4/344) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( 17.934 10.354 2.334) 20.840 1.684 ( 20.533 11.855 1.749) 23.774 2.581 ( -2.771 -1.600 4.554) 5.566 2.669 ( 15.151 8.747 -12.762) 21.655 2.867 ( 10.906 6.296 -6.378) 14.116 3.022 ( 17.990 10.386 11.546) 23.766 3.376 ( 0.684 0.395 1.295) 1.517 3.430 ( 15.556 8.981 1.688) 18.042 3.980 ( 3.304 1.908 0.317) 3.828 4.037 ( 6.901 3.984 -1.242) 8.065 4.579 ( 14.746 8.514 -1.320) 17.079 5.154 ( -6.185 -3.571 -0.489) 7.159 7.593 ( 6.724 3.882 5.242) 9.368 8.738 ( -8.107 -4.681 -0.762) 9.392 9.107 ( 4.252 2.455 3.003) 5.756 9.365 ( 1.024 0.591 -3.014) 3.238 9.409 ( 5.567 3.214 -2.869) 7.039 9.718 ( -7.050 -4.071 0.922) 8.193 10.158 ( 3.547 2.048 2.101) 4.603 11.001 ( -12.415 -7.168 -6.329) 15.671 11.853 ( -11.534 -6.659 3.538) 13.780 12.274 ( 3.092 1.785 -0.441) 3.598 14.101 ( 3.042 1.756 2.193) 4.141 14.513 ( 11.052 6.381 1.341) 12.832 ======================= Grid point 4 (5/344) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.935 ( 13.578 7.839 0.561) 15.689 2.124 ( 17.297 9.986 0.436) 19.977 2.530 ( -2.372 -1.370 4.334) 5.127 2.821 ( 3.647 2.106 -8.986) 9.923 3.095 ( 9.719 5.611 -6.223) 12.832 3.388 ( 10.104 5.834 10.593) 15.759 3.407 ( 1.583 0.914 2.615) 3.190 3.696 ( 1.606 0.927 -1.691) 2.510 4.139 ( 18.672 10.780 -0.700) 21.572 4.300 ( 10.770 6.218 -0.604) 12.451 4.858 ( 5.327 3.076 1.723) 6.388 5.073 ( 3.279 1.893 -2.551) 4.566 7.752 ( 5.851 3.378 5.277) 8.572 8.606 ( -3.106 -1.793 -2.993) 4.672 9.194 ( 0.704 0.406 5.542) 5.601 9.322 ( -2.489 -1.437 -4.785) 5.582 9.572 ( 9.086 5.246 -3.018) 10.918 9.636 ( 0.085 0.049 0.866) 0.871 10.232 ( 2.352 1.358 3.852) 4.713 10.776 ( -6.216 -3.589 -3.541) 8.003 11.608 ( -10.011 -5.780 0.389) 11.566 12.343 ( 2.930 1.692 -0.976) 3.521 14.172 ( 2.947 1.702 -0.067) 3.404 14.738 ( 7.990 4.613 2.095) 9.461 ======================= Grid point 5 (6/344) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 8.975 5.182 -1.752) 10.510 2.481 ( 13.465 7.774 -1.433) 15.614 2.495 ( -1.469 -0.848 4.930) 5.214 2.860 ( 1.561 0.901 -3.116) 3.600 3.280 ( 7.385 4.263 -5.871) 10.352 3.458 ( 2.124 1.226 3.593) 4.351 3.557 ( 3.046 1.759 5.890) 6.860 3.645 ( -3.163 -1.826 -0.777) 3.734 4.462 ( 6.577 3.797 -4.566) 8.861 4.654 ( 19.510 11.264 0.013) 22.528 4.865 ( -0.658 -0.380 4.221) 4.289 5.260 ( 8.764 5.060 -1.756) 10.271 7.890 ( 5.174 2.987 5.005) 7.794 8.567 ( 0.047 0.027 -4.442) 4.443 9.086 ( -7.717 -4.455 2.834) 9.350 9.354 ( 3.565 2.058 -0.975) 4.230 9.680 ( 2.691 1.553 0.088) 3.108 9.801 ( 10.741 6.201 -3.380) 12.855 10.285 ( 1.270 0.733 5.802) 5.985 10.688 ( -0.967 -0.558 -3.020) 3.220 11.392 ( -8.654 -4.996 -0.672) 10.016 12.403 ( 2.390 1.380 -1.236) 3.024 14.238 ( 2.748 1.586 -0.681) 3.245 14.892 ( 5.053 2.917 1.975) 6.160 ======================= Grid point 6 (7/344) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( 4.277 2.469 -3.452) 6.026 2.488 ( 0.011 0.006 5.141) 5.141 2.715 ( 6.467 3.734 -3.917) 8.433 2.911 ( 3.852 2.224 2.265) 4.992 3.407 ( 4.540 2.621 -4.275) 6.764 3.513 ( 1.814 1.047 3.147) 3.780 3.560 ( -1.864 -1.076 -1.166) 2.448 3.588 ( -2.525 -1.458 2.753) 4.010 4.571 ( 4.308 2.487 -1.590) 5.223 4.843 ( -0.104 -0.060 0.741) 0.751 5.067 ( 13.493 7.790 -0.192) 15.581 5.410 ( 4.184 2.415 0.373) 4.845 8.010 ( 4.204 2.427 3.557) 6.017 8.573 ( 0.983 0.568 -3.765) 3.932 8.928 ( -5.814 -3.357 1.741) 6.935 9.427 ( 2.569 1.483 -0.055) 2.967 9.739 ( 2.222 1.283 -0.086) 2.567 10.023 ( 8.521 4.919 -4.060) 10.644 10.313 ( -0.147 -0.085 6.363) 6.366 10.714 ( 3.609 2.084 -2.226) 4.725 11.201 ( -7.889 -4.555 -0.694) 9.136 12.446 ( 1.567 0.905 -1.030) 2.082 14.293 ( 2.056 1.187 -0.611) 2.452 14.984 ( 2.673 1.543 1.367) 3.375 ======================= Grid point 7 (8/344) ======================= q-point: ( 0.47 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( 0.835 0.482 -1.464) 1.753 2.509 ( 0.565 0.326 1.980) 2.085 2.777 ( 0.812 0.469 -1.605) 1.859 3.023 ( 3.525 2.035 1.486) 4.333 3.471 ( 1.523 0.879 -1.531) 2.331 3.520 ( -1.318 -0.761 -2.803) 3.189 3.531 ( -1.663 -0.960 2.734) 3.341 3.548 ( 0.707 0.408 1.208) 1.458 4.655 ( 2.563 1.479 0.051) 2.959 4.825 ( -1.050 -0.606 0.144) 1.221 5.292 ( 5.701 3.291 -1.446) 6.740 5.459 ( 0.297 0.172 1.263) 1.309 8.086 ( 1.684 0.972 1.273) 2.324 8.586 ( 0.486 0.281 -1.441) 1.547 8.838 ( -2.098 -1.211 0.640) 2.506 9.467 ( 0.897 0.518 0.019) 1.036 9.775 ( 0.828 0.478 -0.041) 0.957 10.157 ( 3.470 2.004 -2.780) 4.877 10.310 ( -0.758 -0.438 3.526) 3.633 10.831 ( 6.048 3.492 -0.667) 7.015 11.025 ( -6.946 -4.010 -0.269) 8.025 12.469 ( 0.547 0.316 -0.400) 0.747 14.326 ( 0.774 0.447 -0.235) 0.924 15.026 ( 0.818 0.473 0.487) 1.063 ======================= Grid point 16 (9/344) ======================= q-point: ( 0.07 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( 0.000 26.990 5.184) 27.483 0.615 ( 0.000 28.586 7.599) 29.579 1.073 ( 0.000 50.321 9.888) 51.283 2.410 ( -0.000 4.790 -9.575) 10.707 2.489 ( -0.000 10.627 -2.553) 10.930 2.714 ( 0.000 0.697 8.786) 8.813 2.881 ( -0.000 7.429 -1.585) 7.597 3.365 ( -0.000 -0.358 -1.230) 1.281 3.459 ( -0.000 8.625 -0.717) 8.655 4.068 ( -0.000 4.052 -9.313) 10.157 4.252 ( 0.000 -3.383 6.237) 7.095 5.390 ( 0.000 -3.283 0.581) 3.334 7.337 ( 0.000 -1.012 19.807) 19.833 8.933 ( -0.000 2.061 -0.671) 2.168 9.233 ( -0.000 -7.137 -8.032) 10.745 9.282 ( 0.000 2.012 0.630) 2.108 9.350 ( 0.000 -7.771 7.095) 10.523 9.878 ( -0.000 9.464 -2.993) 9.926 10.047 ( 0.000 -5.131 0.982) 5.224 11.949 ( 0.000 -19.297 11.649) 22.540 12.039 ( -0.000 7.027 -59.263) 59.678 12.151 ( -0.000 1.785 -0.884) 1.992 13.957 ( 0.000 3.765 9.450) 10.173 14.091 ( 0.000 -4.751 59.366) 59.556 ======================= Grid point 17 (10/344) ======================= q-point: ( 0.13 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( 13.901 23.191 5.057) 27.507 1.040 ( 13.403 24.089 5.833) 28.177 1.785 ( 21.686 39.588 5.940) 45.528 2.511 ( 8.242 4.147 -12.631) 15.642 2.624 ( 3.011 10.255 -1.695) 10.821 2.729 ( -1.945 5.452 7.092) 9.154 3.047 ( 7.669 8.372 4.679) 12.280 3.374 ( 0.881 0.477 -1.244) 1.597 3.611 ( 6.461 10.554 -0.614) 12.390 4.102 ( 1.064 0.236 -11.362) 11.414 4.245 ( 1.433 3.262 6.007) 6.984 5.326 ( -2.829 -4.768 0.558) 5.572 7.403 ( 3.037 3.074 8.890) 9.885 8.985 ( 2.818 3.139 0.180) 4.222 9.044 ( -6.080 -13.756 -4.035) 15.571 9.309 ( -0.012 2.248 2.120) 3.090 9.330 ( -0.328 3.425 1.560) 3.778 9.952 ( -2.642 -3.821 -2.222) 5.149 10.006 ( 3.576 3.315 0.081) 4.877 11.601 ( -21.370 -5.871 -14.874) 26.691 11.856 ( 4.599 -19.680 6.094) 21.110 12.344 ( 4.666 2.513 -5.554) 7.677 14.070 ( 3.551 2.393 19.266) 19.736 14.154 ( 0.648 9.675 6.435) 11.637 ======================= Grid point 18 (11/344) ======================= q-point: ( 0.20 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 13.737 20.158 4.505) 24.806 1.528 ( 15.476 20.093 3.619) 25.619 2.466 ( 17.114 17.856 -7.968) 25.985 2.628 ( 1.959 3.252 -0.539) 3.835 2.785 ( 5.530 8.587 -1.960) 10.400 2.906 ( 11.759 15.955 6.484) 20.854 3.294 ( 9.498 7.546 3.904) 12.744 3.404 ( 1.137 4.283 -0.033) 4.432 3.870 ( 11.110 9.419 -0.628) 14.579 4.031 ( -2.838 -4.137 -2.062) 5.424 4.443 ( 10.677 10.773 -2.758) 15.416 5.205 ( -4.954 -5.685 0.200) 7.544 7.533 ( 5.684 3.870 4.716) 8.339 8.800 ( -6.972 -9.379 -0.969) 11.726 9.086 ( 3.786 4.825 1.348) 6.279 9.347 ( 1.518 2.553 1.049) 3.150 9.386 ( 1.692 4.751 -1.569) 5.282 9.823 ( -6.771 -2.707 -0.309) 7.299 10.108 ( 4.340 1.684 -0.437) 4.675 11.167 ( -17.298 -7.418 -5.792) 19.692 11.726 ( 2.785 -21.779 3.618) 22.253 12.385 ( -2.502 7.195 -1.604) 7.784 14.146 ( -1.631 6.115 7.691) 9.960 14.370 ( 11.179 5.956 1.005) 12.706 ======================= Grid point 19 (12/344) ======================= q-point: ( 0.27 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 10.209 17.582 3.188) 20.579 1.979 ( 14.195 16.937 1.580) 22.155 2.596 ( -1.595 2.205 0.177) 2.727 2.758 ( 3.889 5.737 -10.565) 12.635 2.991 ( 8.741 8.109 -1.472) 12.014 3.322 ( 9.911 11.717 10.168) 18.409 3.424 ( 1.837 4.682 0.978) 5.124 3.626 ( 9.495 8.086 -1.175) 12.526 4.001 ( 6.105 4.224 0.653) 7.453 4.159 ( 12.003 6.668 -0.662) 13.747 4.753 ( 12.065 9.233 -2.308) 15.367 5.064 ( -3.653 -4.968 -0.444) 6.182 7.683 ( 6.367 2.690 3.763) 7.870 8.628 ( -4.107 -5.148 -0.674) 6.620 9.208 ( 3.101 6.137 2.409) 7.286 9.391 ( -2.380 4.045 -0.667) 4.740 9.489 ( 5.742 5.359 -2.412) 8.216 9.691 ( -5.871 0.776 0.270) 5.928 10.189 ( 3.989 0.030 1.108) 4.140 10.852 ( -9.776 -6.522 -2.070) 11.933 11.544 ( -0.016 -19.296 0.467) 19.301 12.423 ( -2.390 9.552 -1.128) 9.911 14.190 ( -0.990 5.488 1.496) 5.773 14.610 ( 10.679 2.474 2.036) 11.149 ======================= Grid point 20 (13/344) ======================= q-point: ( 0.33 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 5.557 15.235 1.077) 16.253 2.360 ( 11.702 13.841 -0.425) 18.130 2.586 ( -3.867 5.110 3.209) 7.167 2.819 ( 2.306 1.276 -6.225) 6.760 3.209 ( 7.635 7.403 -4.435) 11.523 3.455 ( 0.438 3.889 4.762) 6.164 3.583 ( 3.307 8.682 5.434) 10.763 3.665 ( -2.216 -2.519 -1.586) 3.711 4.336 ( 12.780 7.170 -5.810) 15.764 4.448 ( 16.192 10.259 3.696) 19.521 4.878 ( -1.540 -1.542 2.633) 3.418 5.121 ( 10.948 3.233 -2.566) 11.700 7.820 ( 6.155 1.345 4.147) 7.543 8.549 ( -0.669 -2.198 -1.832) 2.938 9.275 ( -9.542 5.693 4.264) 11.902 9.346 ( 0.083 5.046 -3.144) 5.946 9.659 ( 3.652 2.997 -0.830) 4.797 9.697 ( 6.482 6.975 -1.505) 9.640 10.255 ( 3.495 -0.635 3.384) 4.906 10.685 ( -2.863 -4.741 -1.474) 5.731 11.354 ( -1.023 -16.351 -1.031) 16.415 12.482 ( -2.525 10.828 -1.187) 11.181 14.231 ( 0.285 3.534 -0.250) 3.555 14.791 ( 8.332 -0.190 1.977) 8.566 ======================= Grid point 21 (14/344) ======================= q-point: ( 0.40 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( 0.779 12.874 -1.300) 12.963 2.583 ( -4.203 7.198 4.788) 9.613 2.648 ( 7.188 9.748 -3.254) 12.541 2.863 ( 3.318 0.933 -0.749) 3.527 3.373 ( 5.498 4.220 -5.252) 8.696 3.503 ( -1.345 5.152 4.873) 7.218 3.593 ( -1.874 -2.827 -0.428) 3.418 3.678 ( -2.671 7.487 2.522) 8.339 4.503 ( 5.761 2.356 -3.270) 7.031 4.818 ( 5.023 2.828 -1.607) 5.984 4.899 ( 11.652 4.228 4.357) 13.139 5.316 ( 8.330 0.788 -0.071) 8.367 7.942 ( 5.732 0.410 3.993) 6.998 8.541 ( 1.447 -0.519 -2.452) 2.894 9.117 ( -12.877 5.839 0.933) 14.170 9.426 ( 1.402 5.110 -0.101) 5.299 9.723 ( 1.868 2.643 -0.060) 3.237 9.921 ( 8.932 6.994 -3.328) 11.823 10.307 ( 1.938 -1.014 5.781) 6.181 10.643 ( 2.945 -2.933 -2.090) 4.653 11.179 ( -1.455 -13.893 -1.266) 14.026 12.540 ( -3.638 11.760 -1.090) 12.358 14.269 ( 1.381 1.359 -0.474) 1.994 14.906 ( 6.030 -2.241 1.393) 6.582 ======================= Grid point 22 (15/344) ======================= q-point: ( 0.47 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( -3.190 10.778 -2.083) 11.432 2.597 ( -4.035 7.651 4.030) 9.543 2.772 ( 0.879 4.167 -3.008) 5.214 2.970 ( 5.233 2.934 1.377) 6.155 3.450 ( 3.323 -1.756 -3.139) 4.897 3.534 ( -3.150 4.712 2.395) 6.153 3.553 ( -1.130 2.452 -0.367) 2.725 3.676 ( -5.876 7.754 1.188) 9.801 4.606 ( 4.467 1.281 -0.717) 4.702 4.826 ( -0.206 -1.589 0.470) 1.670 5.178 ( 10.554 3.557 -1.114) 11.193 5.417 ( 3.978 -2.336 2.266) 5.140 8.035 ( 4.112 -0.922 2.555) 4.928 8.564 ( 1.681 0.093 -1.759) 2.435 8.982 ( -9.978 7.329 0.428) 12.388 9.484 ( -0.107 4.045 0.065) 4.047 9.771 ( 0.948 1.819 -0.020) 2.051 10.100 ( 5.667 4.421 -4.076) 8.263 10.320 ( -0.273 -1.743 5.760) 6.024 10.716 ( 7.884 -1.410 -1.294) 8.113 11.017 ( -2.238 -11.847 -0.934) 12.093 12.582 ( -5.164 12.107 -0.648) 13.178 14.300 ( 1.676 -0.500 -0.121) 1.753 14.966 ( 4.177 -3.745 0.519) 5.634 ======================= Grid point 23 (16/344) ======================= q-point: (-0.47 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( -5.092 9.650 -0.741) 10.936 2.601 ( -4.826 6.949 1.316) 8.563 2.796 ( -1.037 2.728 -0.411) 2.948 3.040 ( -0.098 -0.240 0.531) 0.590 3.476 ( 2.917 -1.255 -2.774) 4.216 3.496 ( -1.989 -1.024 1.371) 2.623 3.580 ( -3.914 8.190 -1.009) 9.133 3.660 ( -5.087 8.065 1.952) 9.733 4.659 ( 0.735 -1.191 0.024) 1.399 4.809 ( 0.393 -0.879 -0.241) 0.993 5.301 ( 1.921 -1.957 -0.661) 2.820 5.428 ( 1.395 -3.977 1.970) 4.652 8.066 ( 1.102 -2.783 0.320) 3.010 8.582 ( 0.608 -0.444 -0.360) 0.834 8.931 ( -5.690 9.779 0.352) 11.319 9.503 ( -1.722 2.967 0.037) 3.431 9.789 ( -0.474 0.829 0.038) 0.956 10.181 ( 0.711 1.375 -1.803) 2.376 10.298 ( -0.657 -1.992 1.963) 2.873 10.856 ( 0.838 -2.694 -0.231) 2.831 10.864 ( 6.347 -9.065 -0.133) 11.067 12.599 ( -6.618 11.685 0.003) 13.429 14.314 ( 0.983 -1.606 0.426) 1.930 14.982 ( 2.636 -4.797 -0.480) 5.495 ======================= Grid point 24 (17/344) ======================= q-point: (-0.40 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( -6.976 8.008 1.733) 10.761 2.574 ( -5.817 6.969 -2.603) 9.444 2.791 ( -2.888 1.556 2.588) 4.178 2.963 ( -6.057 -2.451 -0.660) 6.568 3.462 ( 0.358 -3.380 -0.144) 3.402 3.515 ( 0.910 1.515 -2.383) 2.967 3.559 ( -5.117 5.032 1.114) 7.263 3.673 ( -4.115 8.844 0.365) 9.762 4.611 ( -3.001 -2.718 0.957) 4.160 4.820 ( 1.416 -1.012 -1.416) 2.244 5.187 ( -8.702 -7.569 1.474) 11.628 5.409 ( 0.112 -4.605 0.032) 4.606 8.020 ( -1.951 -4.334 -1.985) 5.151 8.575 ( -0.185 -1.607 1.324) 2.090 8.982 ( -1.786 12.691 0.216) 12.818 9.484 ( -3.450 2.142 0.088) 4.062 9.771 ( -2.035 0.069 0.059) 2.037 10.127 ( -6.390 -2.459 3.783) 7.822 10.283 ( 0.878 -1.193 -5.234) 5.439 10.723 ( -2.130 -7.426 1.018) 7.792 11.022 ( 11.448 -3.726 0.583) 12.053 12.586 ( -7.702 10.538 0.563) 13.065 14.304 ( -0.384 -1.604 0.947) 1.902 14.959 ( 0.991 -5.613 -1.410) 5.872 ======================= Grid point 25 (18/344) ======================= q-point: (-0.33 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -11.754 4.631 2.172) 12.819 2.551 ( -4.242 7.573 -4.787) 9.912 2.671 ( -12.996 -1.360 3.667) 13.571 2.868 ( -1.157 -1.209 0.574) 1.769 3.405 ( -4.090 -5.006 3.744) 7.471 3.472 ( -5.836 5.299 -3.997) 8.839 3.593 ( 3.889 0.410 -0.310) 3.923 3.663 ( -6.257 6.095 -1.833) 8.925 4.525 ( -4.222 -3.277 3.063) 6.160 4.823 ( -0.066 -1.279 -1.054) 1.659 4.878 ( -15.262 -10.347 -1.316) 18.485 5.319 ( -4.285 -6.637 1.002) 7.963 7.915 ( -3.697 -4.731 -3.777) 7.093 8.558 ( 0.288 -2.197 2.767) 3.545 9.112 ( 0.638 14.503 -0.569) 14.528 9.429 ( -4.962 1.514 0.621) 5.224 9.723 ( -3.232 -0.324 -0.037) 3.248 9.946 ( -10.835 -4.430 4.130) 12.413 10.264 ( 0.258 -2.021 -6.912) 7.206 10.660 ( 1.314 -4.173 2.668) 5.124 11.186 ( 12.717 -5.504 0.754) 13.877 12.547 ( -8.220 8.942 0.782) 12.171 14.275 ( -1.966 -0.419 1.255) 2.370 14.895 ( -1.168 -6.438 -2.064) 6.861 ======================= Grid point 26 (19/344) ======================= q-point: (-0.27 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.179 ( -16.309 1.705 0.153) 16.399 2.366 ( -18.551 -3.177 1.396) 18.872 2.561 ( -2.547 6.665 -4.021) 8.190 2.858 ( -0.666 -0.545 5.204) 5.274 3.239 ( -9.806 -4.686 4.506) 11.765 3.421 ( -3.906 2.060 -5.310) 6.906 3.551 ( -10.155 2.261 -4.012) 11.150 3.673 ( 3.552 0.707 0.891) 3.729 4.376 ( -13.011 -7.775 6.128) 16.349 4.424 ( -17.285 -9.461 -3.497) 20.013 4.859 ( 2.425 1.053 -3.055) 4.041 5.138 ( -7.709 -7.700 2.414) 11.160 7.790 ( -4.429 -4.146 -4.526) 7.569 8.565 ( 2.286 -1.509 2.882) 3.976 9.247 ( -1.919 9.943 -3.965) 10.875 9.370 ( -3.034 3.872 3.781) 6.204 9.662 ( -3.385 -0.469 -0.044) 3.417 9.714 ( -10.650 -3.339 3.571) 11.718 10.224 ( -0.372 -2.803 -6.000) 6.633 10.703 ( 5.586 -0.282 3.644) 6.675 11.358 ( 14.391 -7.287 0.087) 16.130 12.488 ( -8.045 7.485 0.613) 11.006 14.235 ( -3.536 1.508 1.147) 4.011 14.777 ( -3.998 -7.332 -2.224) 8.642 ======================= Grid point 27 (20/344) ======================= q-point: (-0.20 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.862 ( -20.662 -0.781 -1.202) 20.712 1.975 ( -22.536 -3.897 0.402) 22.874 2.582 ( -0.731 4.554 -3.911) 6.047 2.829 ( -5.540 -0.868 10.298) 11.725 3.004 ( -11.079 -6.394 1.728) 12.908 3.261 ( -16.701 -1.298 -7.539) 18.370 3.415 ( -4.587 1.491 -1.582) 5.076 3.632 ( -12.557 -4.735 0.639) 13.436 3.998 ( -6.811 -3.176 -0.230) 7.518 4.164 ( -11.499 -7.223 0.736) 13.600 4.760 ( -13.061 -4.970 -0.406) 13.980 5.070 ( 5.619 0.178 1.146) 5.737 7.656 ( -5.759 -3.330 -3.991) 7.757 8.635 ( 6.320 0.271 1.415) 6.482 9.190 ( -6.761 1.377 -2.843) 7.462 9.400 ( -2.408 2.278 1.857) 3.799 9.510 ( -7.649 -2.453 3.687) 8.838 9.691 ( 2.012 6.174 0.279) 6.499 10.171 ( -1.260 -2.742 -4.209) 5.179 10.876 ( 11.159 4.766 5.047) 13.142 11.535 ( 15.956 -9.796 -2.072) 18.837 12.428 ( -7.060 6.882 0.225) 9.862 14.186 ( -5.143 3.202 0.319) 6.066 14.598 ( -7.318 -7.880 -1.589) 10.871 ======================= Grid point 28 (21/344) ======================= q-point: (-0.13 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( -24.719 -1.956 -1.385) 24.834 1.515 ( -25.849 -3.703 -0.292) 26.114 2.511 ( -30.746 -7.988 4.643) 32.104 2.605 ( 0.289 2.229 -5.016) 5.497 2.823 ( -8.395 -0.967 6.833) 10.867 2.869 ( -17.937 -2.676 -3.783) 18.526 3.272 ( -13.042 -4.259 -2.228) 13.899 3.402 ( -3.864 1.789 -0.655) 4.308 3.871 ( -13.628 -4.782 -0.197) 14.444 4.040 ( 5.797 0.676 0.527) 5.860 4.453 ( -15.048 -3.701 0.300) 15.499 5.205 ( 7.293 1.281 0.214) 7.408 7.508 ( -7.100 -2.074 -2.701) 7.874 8.803 ( 11.725 1.576 -0.076) 11.831 9.076 ( -6.048 -0.064 -1.393) 6.207 9.347 ( -2.940 -1.186 1.034) 3.334 9.398 ( -5.094 -0.230 2.004) 5.479 9.826 ( 5.633 4.805 0.592) 7.428 10.103 ( -3.232 -1.909 -2.126) 4.314 11.214 ( 17.348 9.989 7.760) 21.470 11.693 ( 15.984 -12.818 -5.838) 21.304 12.389 ( -4.951 6.382 -0.276) 8.082 14.115 ( -6.962 3.073 -1.452) 7.747 14.367 ( -10.335 -6.371 0.071) 12.141 ======================= Grid point 29 (22/344) ======================= q-point: (-0.07 0.07 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.977 ( -27.530 0.000 0.000) 27.530 1.020 ( -28.260 0.000 0.000) 28.260 1.765 ( -46.477 0.000 0.000) 46.477 2.583 ( -11.769 0.000 0.000) 11.769 2.597 ( -3.809 0.000 0.000) 3.809 2.710 ( -5.469 0.000 0.000) 5.469 3.030 ( -11.163 0.000 0.000) 11.163 3.378 ( -0.823 0.000 0.000) 0.823 3.613 ( -12.380 0.000 0.000) 12.380 4.156 ( 6.213 -0.000 -0.000) 6.213 4.209 ( -10.403 0.000 0.000) 10.403 5.325 ( 5.468 -0.000 -0.000) 5.468 7.373 ( -6.420 0.000 0.000) 6.420 8.984 ( -4.148 0.000 0.000) 4.148 9.058 ( 15.943 -0.000 -0.000) 15.943 9.300 ( -2.024 0.000 0.000) 2.024 9.326 ( -3.393 0.000 0.000) 3.393 9.959 ( 6.503 -0.000 -0.000) 6.503 10.006 ( -6.524 0.000 0.000) 6.524 11.661 ( 21.501 -0.000 -0.000) 21.501 11.827 ( 12.559 -0.000 -0.000) 12.559 12.364 ( -2.927 0.000 0.000) 2.927 13.992 ( -8.339 0.000 0.000) 8.339 14.142 ( -11.285 0.000 0.000) 11.285 ======================= Grid point 32 (23/344) ======================= q-point: ( 0.13 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 0.000 24.722 5.643) 25.358 1.203 ( 0.000 26.654 7.433) 27.671 2.072 ( 0.000 44.478 7.194) 45.056 2.439 ( -0.000 2.754 -13.411) 13.691 2.704 ( -0.000 10.771 -4.434) 11.648 2.828 ( 0.000 6.094 12.042) 13.497 3.091 ( 0.000 13.306 2.374) 13.516 3.348 ( -0.000 -0.477 -2.447) 2.493 3.691 ( -0.000 14.335 -1.606) 14.425 4.070 ( -0.000 -0.959 -9.076) 9.127 4.290 ( 0.000 7.512 1.466) 7.654 5.298 ( 0.000 -6.087 0.959) 6.162 7.427 ( 0.000 3.832 5.906) 7.040 8.942 ( -0.000 -12.896 -4.860) 13.781 8.986 ( -0.000 3.577 -1.197) 3.772 9.344 ( 0.000 3.575 1.360) 3.825 9.387 ( 0.000 3.537 6.862) 7.720 9.909 ( 0.000 -8.959 1.661) 9.112 9.999 ( -0.000 4.880 -6.682) 8.275 11.556 ( 0.000 -23.163 12.333) 26.241 11.888 ( -0.000 -3.663 -21.169) 21.484 12.195 ( -0.000 3.095 -1.592) 3.481 14.072 ( 0.000 2.600 11.146) 11.445 14.302 ( 0.000 8.817 12.825) 15.563 ======================= Grid point 33 (24/344) ======================= q-point: ( 0.20 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( 10.453 21.947 5.275) 24.875 1.556 ( 8.689 24.152 6.344) 26.440 2.446 ( 3.652 10.153 -10.316) 14.927 2.596 ( 8.431 20.839 -2.386) 22.606 2.811 ( 2.013 9.153 1.445) 9.482 2.962 ( 4.245 13.509 9.690) 17.158 3.275 ( 3.652 11.917 2.267) 12.669 3.384 ( 4.587 2.808 -1.762) 5.660 3.859 ( 3.286 13.532 -1.547) 14.011 4.024 ( -1.534 -2.667 -2.675) 4.077 4.427 ( 4.305 13.304 -4.476) 14.683 5.211 ( -2.774 -6.699 0.977) 7.316 7.505 ( 2.999 4.405 2.368) 5.832 8.790 ( -3.430 -9.227 -1.702) 9.990 9.061 ( 4.129 4.434 -0.807) 6.112 9.379 ( -0.611 3.470 3.018) 4.639 9.432 ( -0.688 5.716 3.390) 6.681 9.836 ( 0.676 -6.476 0.604) 6.539 10.047 ( 2.972 1.466 -5.530) 6.447 11.319 ( -7.446 -18.825 7.092) 21.450 11.603 ( -12.356 -6.297 -6.956) 15.515 12.363 ( 8.817 2.082 -3.256) 9.627 14.175 ( 5.584 1.989 8.968) 10.750 14.386 ( -2.464 10.587 3.203) 11.332 ======================= Grid point 34 (25/344) ======================= q-point: ( 0.27 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( 10.572 18.008 4.751) 21.416 1.986 ( 11.339 22.792 3.615) 25.712 2.562 ( 5.766 2.707 -8.047) 10.263 2.779 ( 0.868 7.254 -10.638) 12.905 2.982 ( 3.394 10.647 8.440) 14.004 3.303 ( 10.297 14.687 7.841) 19.576 3.413 ( 4.562 5.536 -1.270) 7.285 3.586 ( 6.980 11.702 -0.252) 13.628 3.976 ( 1.354 1.823 0.189) 2.279 4.075 ( 5.719 11.315 0.154) 12.679 4.667 ( 8.757 12.690 -5.227) 16.280 5.081 ( -4.572 -6.320 0.904) 7.852 7.619 ( 4.789 3.464 1.280) 6.048 8.647 ( -4.192 -5.405 0.980) 6.910 9.202 ( 5.540 6.124 -0.033) 8.258 9.429 ( 2.030 4.582 1.901) 5.360 9.499 ( 0.316 6.851 0.477) 6.874 9.791 ( -2.635 -0.207 -0.205) 2.651 10.102 ( 4.566 -1.821 -2.278) 5.418 10.979 ( -13.238 -10.748 1.773) 17.144 11.371 ( -3.398 -13.379 -1.182) 13.855 12.497 ( 3.660 5.547 -1.807) 6.887 14.284 ( 0.408 4.162 4.182) 5.914 14.485 ( 4.731 5.446 0.926) 7.273 ======================= Grid point 35 (26/344) ======================= q-point: ( 0.33 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( 8.732 14.513 3.597) 17.315 2.388 ( 7.968 22.302 0.712) 23.694 2.658 ( 2.650 3.824 -2.697) 5.378 2.818 ( -0.204 4.947 -7.284) 8.808 3.155 ( 4.896 6.493 3.006) 8.670 3.498 ( 3.212 6.077 1.845) 7.117 3.617 ( 5.495 10.396 3.441) 12.252 3.678 ( -1.432 -0.362 -1.353) 2.003 4.192 ( 11.298 10.971 -3.752) 16.189 4.323 ( 10.895 11.418 4.511) 16.414 4.912 ( 1.537 5.995 -0.532) 6.212 4.965 ( 4.402 -3.184 -1.407) 5.612 7.740 ( 5.413 2.203 2.374) 6.308 8.550 ( -2.427 -2.702 0.951) 3.754 9.351 ( 3.542 7.104 0.461) 7.952 9.527 ( -3.934 8.632 0.882) 9.527 9.588 ( 5.914 5.300 -2.071) 8.207 9.746 ( -3.459 4.916 -0.225) 6.015 10.163 ( 5.640 -3.030 0.975) 6.476 10.706 ( -7.393 -7.819 0.793) 10.790 11.187 ( -1.117 -15.129 -1.577) 15.252 12.611 ( 1.125 9.792 -1.095) 9.917 14.304 ( -3.091 4.905 0.194) 5.801 14.634 ( 8.336 -0.764 1.914) 8.587 ======================= Grid point 36 (27/344) ======================= q-point: ( 0.40 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 4.781 12.337 1.962) 13.375 2.695 ( 1.821 16.001 -3.544) 16.490 2.724 ( 1.157 9.243 2.637) 9.682 2.854 ( -0.472 6.364 -3.425) 7.243 3.286 ( 5.508 0.789 -0.121) 5.565 3.568 ( -0.106 -2.270 0.350) 2.300 3.656 ( -2.452 10.372 1.224) 10.728 3.789 ( 1.228 9.710 2.085) 10.007 4.406 ( 7.446 3.557 -4.515) 9.407 4.694 ( 14.375 11.395 2.371) 18.496 4.845 ( -2.101 -2.490 2.859) 4.334 5.155 ( 9.951 0.652 -0.774) 10.003 7.859 ( 5.333 1.341 3.937) 6.763 8.514 ( 0.236 -0.964 -0.713) 1.222 9.441 ( -13.791 9.356 0.021) 16.665 9.467 ( 1.450 7.174 -0.377) 7.329 9.719 ( 2.707 3.269 -0.905) 4.340 9.850 ( 6.693 8.407 -1.651) 10.872 10.240 ( 5.452 -2.356 3.991) 7.156 10.567 ( -0.704 -6.567 -0.189) 6.608 11.026 ( 0.253 -14.645 -2.167) 14.807 12.725 ( -1.338 13.513 -0.828) 13.604 14.292 ( -2.271 2.481 -0.675) 3.431 14.751 ( 7.652 -4.429 1.588) 8.983 ======================= Grid point 37 (28/344) ======================= q-point: ( 0.47 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -0.362 11.048 0.013) 11.054 2.735 ( -2.326 4.872 1.730) 5.669 2.880 ( -3.481 13.657 -0.975) 14.128 2.950 ( 2.478 10.513 -1.870) 10.961 3.360 ( 4.169 -2.206 -1.460) 4.937 3.531 ( 0.293 -2.940 1.520) 3.323 3.738 ( -4.231 14.328 0.998) 14.973 3.863 ( -4.152 9.896 0.579) 10.747 4.531 ( 5.185 1.793 -2.422) 5.997 4.809 ( -0.020 -1.734 1.621) 2.374 5.015 ( 11.937 4.448 0.530) 12.750 5.290 ( 7.186 -3.766 1.878) 8.327 7.962 ( 4.252 0.323 4.112) 5.924 8.527 ( 1.946 -0.204 -1.950) 2.763 9.291 ( -13.986 10.800 -0.315) 17.673 9.545 ( -0.467 6.445 0.085) 6.462 9.777 ( 1.039 2.565 -0.077) 2.768 10.038 ( 6.285 5.815 -3.639) 9.303 10.303 ( 2.155 -1.917 6.294) 6.924 10.547 ( 5.838 -6.035 -1.263) 8.491 10.895 ( 0.865 -12.488 -2.091) 12.691 12.823 ( -4.559 16.166 -0.585) 16.807 14.277 ( -0.335 -0.448 -0.325) 0.647 14.818 ( 6.408 -6.890 0.727) 9.437 ======================= Grid point 38 (29/344) ======================= q-point: ( 0.53 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( -3.316 9.016 -1.483) 9.720 2.740 ( -4.233 6.406 2.782) 8.167 2.928 ( -5.299 11.726 -0.550) 12.879 3.054 ( -0.050 6.013 -1.097) 6.113 3.392 ( 3.469 -2.847 -2.593) 5.183 3.524 ( -0.893 -0.013 2.914) 3.048 3.787 ( -6.512 14.042 -0.515) 15.487 3.867 ( -6.576 10.521 0.676) 12.425 4.612 ( 3.269 -0.228 -0.543) 3.321 4.794 ( -0.131 -1.675 0.432) 1.735 5.199 ( 7.140 -0.941 -1.126) 7.290 5.337 ( 3.759 -6.881 3.429) 8.558 8.019 ( 1.774 -1.372 2.489) 3.350 8.555 ( 1.734 -0.454 -1.980) 2.671 9.195 ( -10.443 13.099 0.660) 16.765 9.581 ( -2.161 5.423 0.082) 5.838 9.806 ( -0.072 1.574 0.055) 1.577 10.157 ( 3.446 3.017 -4.501) 6.422 10.299 ( -1.023 -2.733 5.533) 6.255 10.615 ( 9.178 -9.089 -0.371) 12.922 10.801 ( 0.823 -7.380 -1.451) 7.566 12.881 ( -7.937 16.963 -0.237) 18.729 14.272 ( 1.239 -2.246 0.453) 2.605 14.843 ( 5.331 -8.416 -0.348) 9.968 ======================= Grid point 39 (30/344) ======================= q-point: (-0.40 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.708 ( -4.378 8.109 -2.052) 9.441 2.722 ( -6.005 5.985 2.647) 8.882 2.926 ( -6.861 9.662 -0.892) 11.884 3.066 ( -4.393 4.080 0.761) 6.044 3.418 ( 3.027 -3.568 0.239) 4.685 3.490 ( -2.784 0.304 -1.137) 3.022 3.790 ( -8.463 12.118 -0.059) 14.780 3.866 ( -6.085 10.946 0.499) 12.533 4.624 ( -0.796 -1.869 1.209) 2.364 4.779 ( 0.776 -1.950 -1.776) 2.749 5.215 ( -2.050 -6.197 0.622) 6.557 5.321 ( 2.998 -7.472 1.744) 8.238 8.003 ( -1.225 -3.236 0.131) 3.463 8.560 ( 0.300 -1.307 -1.076) 1.719 9.203 ( -5.925 16.043 1.651) 17.182 9.581 ( -3.608 4.659 0.164) 5.895 9.806 ( -1.339 0.810 0.025) 1.565 10.194 ( -1.206 0.598 -2.061) 2.461 10.251 ( -1.233 -3.331 1.465) 3.842 10.615 ( 3.750 -12.405 -0.450) 12.967 10.813 ( 6.769 -3.754 0.335) 7.747 12.883 ( -10.450 15.382 0.108) 18.596 14.277 ( 1.560 -1.883 1.266) 2.753 14.835 ( 4.201 -9.147 -1.403) 10.163 ======================= Grid point 40 (31/344) ======================= q-point: (-0.33 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( -10.308 4.795 1.424) 11.457 2.707 ( -3.647 6.113 -2.554) 7.562 2.894 ( -6.722 7.738 0.709) 10.274 2.975 ( -11.802 5.016 1.874) 12.960 3.380 ( -1.692 -4.995 1.148) 5.397 3.499 ( 4.303 -1.163 -2.637) 5.179 3.733 ( -10.797 10.275 0.290) 14.907 3.854 ( -7.218 8.343 -0.631) 11.050 4.566 ( -3.490 -2.718 2.534) 5.097 4.774 ( 1.764 -1.914 -3.369) 4.258 5.025 ( -11.049 -8.463 1.575) 14.006 5.281 ( 0.372 -8.072 0.796) 8.120 7.922 ( -3.273 -4.088 -1.682) 5.500 8.541 ( -0.294 -1.839 0.186) 1.872 9.305 ( -2.943 17.980 1.574) 18.287 9.549 ( -5.252 4.007 0.678) 6.641 9.777 ( -2.689 0.423 -0.097) 2.723 10.092 ( -8.563 -2.876 4.312) 10.009 10.214 ( 0.457 -3.304 -6.655) 7.445 10.562 ( 3.295 -8.352 0.800) 9.014 10.916 ( 10.325 -6.362 0.962) 12.165 12.829 ( -11.448 11.879 0.284) 16.500 14.292 ( 0.523 0.502 1.832) 1.971 14.798 ( 2.515 -9.323 -2.163) 9.895 ======================= Grid point 41 (32/344) ======================= q-point: (-0.27 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.461 ( -13.929 1.126 -0.022) 13.975 2.685 ( -6.932 5.909 -3.235) 9.666 2.740 ( -17.604 5.896 3.196) 18.838 2.894 ( -2.718 3.717 1.985) 5.014 3.288 ( -2.975 -6.498 0.106) 7.148 3.554 ( 0.414 0.463 -1.239) 1.386 3.648 ( -6.566 6.805 -0.091) 9.457 3.765 ( -10.009 4.276 -1.346) 10.967 4.455 ( -5.644 -5.049 2.105) 7.860 4.674 ( -18.244 -8.307 -0.231) 20.048 4.814 ( 2.714 1.632 -1.762) 3.624 5.168 ( -4.218 -8.223 1.240) 9.324 7.814 ( -3.960 -3.438 -2.413) 5.772 8.526 ( 0.710 -1.613 1.015) 2.033 9.417 ( -4.845 11.185 -1.957) 12.345 9.504 ( -4.592 8.020 3.383) 9.841 9.724 ( -3.660 0.335 0.010) 3.676 9.888 ( -11.544 -2.745 4.093) 12.552 10.165 ( 0.865 -4.993 -6.705) 8.405 10.585 ( 6.261 -3.856 1.958) 7.610 11.045 ( 12.168 -7.290 0.615) 14.199 12.733 ( -10.823 7.738 0.240) 13.307 14.310 ( -1.434 3.466 1.913) 4.210 14.723 ( -0.020 -8.975 -2.348) 9.277 ======================= Grid point 42 (33/344) ======================= q-point: (-0.20 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( -17.685 -0.581 -0.516) 17.703 2.388 ( -24.045 2.681 0.808) 24.208 2.666 ( -4.138 3.611 -1.598) 5.720 2.899 ( -1.245 2.133 3.520) 4.300 3.129 ( -8.829 -5.158 -0.201) 10.227 3.470 ( -8.746 2.153 -1.578) 9.144 3.587 ( -11.937 1.788 -1.157) 12.126 3.689 ( 1.604 0.818 0.257) 1.818 4.232 ( -22.494 -5.008 0.764) 23.058 4.282 ( -8.889 -4.518 -0.030) 9.971 4.894 ( -0.792 3.856 -2.335) 4.577 4.996 ( -3.216 -6.925 2.367) 7.994 7.710 ( -4.437 -1.888 -1.822) 5.155 8.549 ( 3.363 -0.691 0.805) 3.527 9.339 ( -8.147 1.989 -1.183) 8.470 9.519 ( -6.480 5.663 -0.285) 8.610 9.621 ( -7.359 -3.264 2.375) 8.393 9.762 ( -3.018 5.220 2.344) 6.469 10.127 ( 1.378 -3.690 -4.148) 5.720 10.718 ( 10.827 0.396 2.206) 11.057 11.194 ( 12.906 -6.219 -0.413) 14.333 12.619 ( -8.824 3.950 0.091) 9.668 14.311 ( -3.805 4.510 1.236) 6.029 14.609 ( -3.295 -6.996 -1.614) 7.899 ======================= Grid point 43 (34/344) ======================= q-point: (-0.13 0.13 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( -21.481 0.000 0.000) 21.481 1.961 ( -26.269 0.000 0.000) 26.269 2.627 ( -2.036 0.000 0.000) 2.036 2.879 ( -16.447 0.000 0.000) 16.447 2.894 ( -2.011 0.000 0.000) 2.011 3.241 ( -20.422 0.000 0.000) 20.422 3.421 ( -7.120 0.000 0.000) 7.120 3.588 ( -14.800 0.000 0.000) 14.800 3.975 ( -0.998 0.000 0.000) 0.998 4.074 ( -12.150 0.000 0.000) 12.150 4.702 ( -15.028 0.000 0.000) 15.028 5.076 ( 7.978 -0.000 -0.000) 7.978 7.610 ( -5.929 0.000 0.000) 5.929 8.640 ( 7.501 -0.000 -0.000) 7.501 9.202 ( -8.146 0.000 0.000) 8.146 9.417 ( -5.876 0.000 0.000) 5.876 9.496 ( -6.020 0.000 0.000) 6.020 9.792 ( 1.715 -0.000 -0.000) 1.715 10.118 ( -0.227 0.000 0.000) 0.227 10.969 ( 16.378 -0.000 -0.000) 16.378 11.377 ( 12.840 -0.000 -0.000) 12.840 12.510 ( -6.163 0.000 0.000) 6.163 14.254 ( -6.099 0.000 0.000) 6.099 14.479 ( -6.883 0.000 0.000) 6.883 ======================= Grid point 48 (35/344) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( 0.000 21.314 6.278) 22.220 1.742 ( 0.000 23.813 7.450) 24.951 2.410 ( -0.000 0.083 -10.179) 10.179 2.753 ( -0.000 14.619 -15.449) 21.269 2.943 ( 0.000 19.683 14.311) 24.336 3.038 ( 0.000 9.407 8.331) 12.566 3.328 ( -0.000 -0.052 -3.349) 3.349 3.436 ( 0.000 19.676 2.301) 19.811 3.943 ( -0.000 6.049 -2.639) 6.600 4.056 ( -0.000 9.003 0.154) 9.004 4.524 ( -0.000 15.092 -6.879) 16.586 5.173 ( 0.000 -6.157 1.578) 6.356 7.530 ( -0.000 5.092 -0.123) 5.093 8.741 ( -0.000 -5.645 -0.442) 5.662 9.057 ( -0.000 3.845 -1.386) 4.087 9.430 ( 0.000 3.804 2.645) 4.633 9.524 ( 0.000 6.863 7.858) 10.433 9.720 ( 0.000 -9.885 1.263) 9.965 10.027 ( -0.000 1.987 -9.724) 9.925 11.191 ( 0.000 -17.598 10.188) 20.334 11.716 ( -0.000 -6.792 -8.803) 11.119 12.257 ( -0.000 3.781 -1.991) 4.273 14.158 ( 0.000 2.253 6.367) 6.754 14.527 ( 0.000 9.728 2.972) 10.172 ======================= Grid point 49 (36/344) ======================= q-point: ( 0.27 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 8.222 18.573 5.681) 21.091 2.046 ( 6.898 21.646 6.430) 23.611 2.450 ( 6.414 0.695 -7.854) 10.164 2.800 ( 0.102 4.311 -13.300) 13.982 3.116 ( -1.348 13.426 10.226) 16.931 3.267 ( 8.221 8.360 4.336) 12.501 3.377 ( 5.540 5.186 -0.829) 7.634 3.630 ( 1.405 11.473 -0.641) 11.577 4.006 ( 0.971 10.091 0.805) 10.170 4.181 ( -0.479 15.035 1.132) 15.085 4.680 ( 3.374 12.334 -7.132) 14.641 5.101 ( -3.024 -3.194 1.796) 4.751 7.601 ( 2.204 5.101 -0.718) 5.603 8.672 ( -3.250 -3.036 1.776) 4.789 9.145 ( 5.830 4.041 -1.225) 7.198 9.461 ( -0.322 2.448 3.829) 4.556 9.576 ( -0.891 5.925 1.773) 6.248 9.735 ( 6.366 -2.345 4.569) 8.179 10.027 ( 0.931 0.256 -9.004) 9.056 11.015 ( -4.860 -13.945 7.204) 16.431 11.461 ( -14.650 -5.911 -4.899) 16.540 12.406 ( 9.740 3.304 -2.082) 10.493 14.239 ( 4.872 1.711 4.120) 6.606 14.590 ( -3.580 8.672 0.905) 9.426 ======================= Grid point 50 (37/344) ======================= q-point: ( 0.33 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 7.673 15.361 4.675) 17.796 2.429 ( 11.597 18.636 2.781) 22.125 2.592 ( 7.803 3.973 -4.627) 9.903 2.820 ( 2.168 2.311 -9.455) 9.972 3.214 ( -1.759 7.318 6.626) 10.028 3.459 ( 8.122 5.238 -0.610) 9.684 3.601 ( 8.113 9.078 2.969) 12.532 3.675 ( 0.156 -1.184 -1.412) 1.850 4.186 ( 2.827 14.257 -3.039) 14.849 4.362 ( 2.950 17.722 5.471) 18.780 4.830 ( 5.914 2.159 -3.878) 7.395 5.030 ( -5.144 4.270 0.958) 6.754 7.700 ( 3.432 4.696 0.953) 5.893 8.583 ( -3.935 -2.315 2.209) 5.072 9.316 ( 7.951 5.167 -0.869) 9.523 9.526 ( 4.011 3.904 1.034) 5.691 9.644 ( 1.171 5.921 -0.043) 6.036 9.835 ( 1.247 5.010 3.680) 6.340 10.030 ( 3.450 -2.878 -4.375) 6.271 10.778 ( -9.291 -9.713 3.428) 13.872 11.163 ( -10.361 -7.565 -2.827) 13.136 12.605 ( 8.244 5.997 -1.294) 10.276 14.344 ( 3.900 0.945 1.561) 4.306 14.598 ( -3.025 5.143 0.679) 6.005 ======================= Grid point 51 (38/344) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( 6.249 12.340 3.085) 14.172 2.699 ( 4.428 1.938 -2.597) 5.487 2.824 ( 8.065 19.685 -0.585) 21.281 2.908 ( 4.633 6.485 -4.949) 9.382 3.247 ( -0.506 1.587 3.837) 4.183 3.547 ( -0.952 -2.697 -0.381) 2.886 3.746 ( 5.283 8.930 0.705) 10.400 3.823 ( 6.187 8.666 1.380) 10.737 4.334 ( 3.975 6.769 -4.053) 8.834 4.643 ( 6.990 15.593 4.429) 17.652 4.863 ( 0.244 -4.262 1.425) 4.500 5.057 ( 1.311 6.279 -0.843) 6.470 7.814 ( 3.839 4.159 3.711) 6.768 8.514 ( -1.866 -1.595 0.132) 2.459 9.488 ( 4.923 6.171 0.016) 7.895 9.665 ( 5.732 4.354 -1.937) 7.455 9.705 ( -3.015 7.141 -0.290) 7.757 9.878 ( -1.438 6.710 -1.342) 6.992 10.098 ( 7.384 -2.474 3.482) 8.531 10.556 ( -6.169 -7.309 1.391) 9.665 10.935 ( -5.594 -9.371 -2.750) 11.255 12.807 ( 5.932 10.146 -0.710) 11.774 14.373 ( -2.314 1.961 -0.925) 3.171 14.610 ( 2.437 -2.004 1.791) 3.628 ======================= Grid point 52 (39/344) ======================= q-point: ( 0.47 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( 2.998 8.961 0.643) 9.471 2.763 ( 2.624 2.140 0.302) 3.399 3.037 ( 0.041 11.001 -2.262) 11.231 3.116 ( 1.372 19.653 -2.494) 19.858 3.262 ( 3.010 -2.904 1.409) 4.413 3.492 ( 0.270 -3.563 1.086) 3.735 3.923 ( 1.052 12.954 1.153) 13.048 3.985 ( 1.485 9.327 0.100) 9.445 4.460 ( 5.269 3.615 -2.855) 6.998 4.817 ( -1.656 -1.494 3.112) 3.829 4.899 ( 7.367 7.989 0.965) 10.910 5.138 ( 5.026 -2.348 1.349) 5.709 7.925 ( 3.183 3.268 5.673) 7.279 8.490 ( 0.848 -0.984 -2.552) 2.863 9.607 ( 1.241 6.319 0.876) 6.499 9.637 ( -12.129 10.432 -1.851) 16.105 9.773 ( 2.523 2.421 -1.035) 3.647 9.978 ( 6.244 3.654 -2.680) 7.715 10.220 ( 6.180 -0.743 6.362) 8.900 10.434 ( -0.497 -6.111 0.098) 6.132 10.770 ( -1.452 -9.582 -3.358) 10.257 13.004 ( 2.434 14.322 -0.387) 14.532 14.319 ( -4.421 0.731 -1.104) 4.614 14.636 ( 5.247 -7.440 1.381) 9.208 ======================= Grid point 53 (40/344) ======================= q-point: ( 0.53 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -0.544 4.067 -0.522) 4.136 2.855 ( 1.146 6.041 2.123) 6.505 3.106 ( -3.346 9.521 -1.565) 10.212 3.211 ( -4.746 9.738 0.117) 10.833 3.300 ( 2.659 -1.541 -3.496) 4.655 3.539 ( 2.714 5.224 2.353) 6.340 4.036 ( -4.097 14.269 1.245) 14.898 4.060 ( -3.073 9.188 -0.556) 9.704 4.561 ( 3.153 2.483 -2.027) 4.497 4.789 ( -0.938 -0.987 2.329) 2.698 5.063 ( 6.664 0.051 -0.149) 6.666 5.183 ( 5.410 -7.760 2.881) 9.889 8.002 ( 1.103 1.564 5.134) 5.479 8.505 ( 2.412 -0.798 -3.639) 4.438 9.525 ( -11.963 11.922 0.459) 16.896 9.673 ( -1.353 6.155 -0.023) 6.302 9.818 ( 0.769 1.562 -0.266) 1.761 10.104 ( 5.116 1.975 -3.698) 6.614 10.291 ( 1.507 -2.189 6.774) 7.277 10.403 ( 3.889 -7.001 -0.921) 8.062 10.688 ( 2.496 -7.093 -3.017) 8.103 13.160 ( -3.062 17.253 -0.222) 17.524 14.252 ( -2.042 -1.787 -0.046) 2.714 14.645 ( 5.852 -10.324 0.144) 11.868 ======================= Grid point 54 (41/344) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.782 ( -2.032 3.560 -0.549) 4.135 2.902 ( -3.336 5.443 2.655) 6.914 3.116 ( -3.225 5.532 -2.539) 6.889 3.211 ( -5.155 8.083 0.423) 9.597 3.320 ( 2.907 -1.609 -2.077) 3.918 3.601 ( -4.751 6.500 1.374) 8.168 4.068 ( -7.203 11.552 0.174) 13.615 4.079 ( -6.267 11.464 0.265) 13.068 4.614 ( 1.201 1.505 0.387) 1.964 4.758 ( -1.317 -2.173 -0.780) 2.658 5.134 ( 4.750 -5.186 -0.624) 7.061 5.180 ( 3.314 -9.579 3.413) 10.696 8.010 ( -1.674 -0.660 2.455) 3.044 8.528 ( 1.722 -0.989 -2.631) 3.296 9.486 ( -7.804 14.611 2.017) 16.687 9.692 ( -2.949 5.391 0.159) 6.147 9.832 ( -0.606 1.058 -0.104) 1.224 10.170 ( 2.331 0.066 -4.153) 4.763 10.264 ( -2.150 -3.578 3.455) 5.419 10.406 ( 5.543 -9.059 0.323) 10.625 10.687 ( 4.048 -4.594 -1.166) 6.233 13.223 ( -9.423 16.421 -0.166) 18.934 14.230 ( 1.649 -1.776 1.294) 2.748 14.637 ( 5.970 -11.436 -1.190) 12.955 ======================= Grid point 55 (42/344) ======================= q-point: (-0.33 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -2.155 2.285 -0.495) 3.180 2.850 ( -8.102 3.105 1.516) 8.808 3.108 ( -4.854 7.516 -1.481) 9.069 3.196 ( -5.114 6.279 -0.553) 8.117 3.363 ( 3.568 -1.507 1.050) 4.013 3.499 ( -10.487 1.165 -0.341) 10.557 4.026 ( -9.614 8.893 0.086) 13.096 4.065 ( -7.857 9.408 0.143) 12.259 4.609 ( -3.577 -1.574 2.298) 4.533 4.724 ( 1.285 -0.525 -3.351) 3.627 5.089 ( -4.163 -5.795 1.176) 7.231 5.153 ( 4.319 -9.432 1.165) 10.439 7.949 ( -3.705 -1.997 0.121) 4.211 8.528 ( 0.105 -1.142 -1.067) 1.567 9.549 ( -4.099 16.141 2.300) 16.811 9.684 ( -4.322 5.529 1.091) 7.102 9.819 ( -1.698 0.437 -0.202) 1.764 10.148 ( -1.488 -5.156 -5.246) 7.505 10.189 ( -2.342 -3.759 3.012) 5.356 10.409 ( 3.900 -6.111 -0.312) 7.256 10.725 ( 5.963 -4.631 0.469) 7.565 13.162 ( -13.152 11.144 -0.078) 17.239 14.277 ( 2.935 1.829 2.231) 4.116 14.619 ( 5.437 -11.029 -2.187) 12.489 ======================= Grid point 56 (43/344) ======================= q-point: (-0.27 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( -11.609 0.863 0.458) 11.650 2.763 ( -1.533 1.011 -0.635) 1.942 3.068 ( -8.724 7.360 0.307) 11.418 3.130 ( -13.457 7.546 -0.428) 15.434 3.270 ( -5.728 -6.724 1.565) 8.970 3.461 ( 5.853 -1.267 -1.124) 6.093 3.912 ( -11.722 5.307 0.106) 12.867 3.979 ( -10.196 4.399 -0.308) 11.108 4.500 ( -4.694 -4.009 0.444) 6.189 4.761 ( 1.354 1.783 -1.309) 2.594 4.904 ( -11.339 -3.298 0.850) 11.840 5.124 ( 1.046 -6.284 0.549) 6.394 7.857 ( -4.379 -1.621 -0.661) 4.716 8.513 ( -0.339 -0.785 -0.070) 0.858 9.588 ( -5.805 4.456 -0.579) 7.341 9.704 ( -4.585 13.453 3.371) 14.607 9.785 ( -2.623 0.427 0.174) 2.663 10.036 ( -3.242 -6.383 1.631) 7.342 10.085 ( -4.382 -4.377 -4.489) 7.650 10.440 ( 5.500 -3.151 0.090) 6.339 10.812 ( 8.707 -3.442 0.611) 9.382 13.008 ( -13.342 4.974 0.012) 14.239 14.357 ( 1.227 4.543 2.129) 5.165 14.596 ( 3.809 -8.480 -2.191) 9.551 ======================= Grid point 57 (44/344) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -14.779 0.000 0.000) 14.779 2.732 ( -4.310 0.000 0.000) 4.310 2.829 ( -20.894 0.000 0.000) 20.894 2.972 ( -5.828 0.000 0.000) 5.828 3.196 ( -2.497 0.000 0.000) 2.497 3.545 ( 3.179 -0.000 -0.000) 3.179 3.739 ( -9.894 0.000 0.000) 9.894 3.809 ( -11.442 0.000 0.000) 11.442 4.387 ( -6.111 0.000 0.000) 6.111 4.586 ( -19.382 0.000 0.000) 19.382 4.849 ( 4.031 -0.000 -0.000) 4.031 5.062 ( -4.580 0.000 0.000) 4.580 7.772 ( -4.205 0.000 0.000) 4.205 8.511 ( 0.830 -0.000 -0.000) 0.830 9.486 ( -7.583 0.000 0.000) 7.583 9.698 ( -7.122 0.000 0.000) 7.122 9.705 ( -5.306 0.000 0.000) 5.306 9.898 ( -8.872 0.000 0.000) 8.872 10.047 ( 3.782 -0.000 -0.000) 3.782 10.546 ( 8.556 -0.000 -0.000) 8.556 10.962 ( 10.697 -0.000 -0.000) 10.697 12.815 ( -11.455 0.000 0.000) 11.455 14.387 ( -1.418 0.000 0.000) 1.418 14.587 ( 0.746 -0.000 -0.000) 0.746 ======================= Grid point 64 (45/344) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 0.000 17.163 6.736) 18.437 2.220 ( 0.000 20.655 7.369) 21.930 2.366 ( -0.000 -0.541 -6.669) 6.691 2.799 ( -0.000 1.457 -12.866) 12.948 3.225 ( 0.000 4.787 0.255) 4.794 3.342 ( 0.000 12.262 8.665) 15.015 3.346 ( 0.000 4.706 0.508) 4.734 3.689 ( -0.000 1.565 -1.616) 2.249 4.159 ( -0.000 19.593 -0.085) 19.593 4.353 ( 0.000 17.026 3.618) 17.406 4.735 ( -0.000 6.330 -6.550) 9.109 5.134 ( 0.000 3.930 1.385) 4.167 7.639 ( -0.000 6.535 -1.124) 6.631 8.695 ( 0.000 -0.438 2.196) 2.239 9.108 ( -0.000 0.824 -0.715) 1.091 9.468 ( 0.000 -4.263 5.680) 7.101 9.598 ( -0.000 1.007 -2.124) 2.351 9.731 ( 0.000 10.114 8.113) 12.966 10.012 ( -0.000 1.644 -10.416) 10.545 10.949 ( 0.000 -10.499 6.278) 12.233 11.540 ( -0.000 -7.933 -3.917) 8.848 12.325 ( -0.000 3.873 -2.021) 4.368 14.227 ( 0.000 2.758 3.003) 4.077 14.708 ( 0.000 7.539 0.467) 7.554 ======================= Grid point 65 (46/344) ======================= q-point: ( 0.33 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( 6.862 14.454 5.763) 17.007 2.406 ( 6.364 4.280 -2.796) 8.163 2.503 ( 7.795 14.641 4.210) 17.112 2.781 ( 0.674 -0.098 -10.534) 10.556 3.303 ( 3.175 0.335 -3.239) 4.548 3.383 ( 1.877 9.513 5.250) 11.027 3.553 ( 7.398 7.456 3.607) 11.105 3.665 ( -1.221 -2.689 -0.833) 3.069 4.326 ( -1.187 14.828 -3.902) 15.379 4.552 ( -0.007 20.657 6.586) 21.682 4.768 ( 1.675 -0.227 -3.293) 3.701 5.178 ( -3.251 9.515 0.179) 10.057 7.720 ( 1.367 7.206 0.383) 7.344 8.647 ( -4.730 -1.253 2.135) 5.339 9.188 ( 8.968 -0.203 -0.493) 8.984 9.471 ( 4.136 -2.274 3.388) 5.810 9.641 ( 1.915 3.594 -1.238) 4.256 9.877 ( 2.436 10.178 7.599) 12.933 10.002 ( -0.876 1.939 -8.960) 9.209 10.825 ( -5.199 -7.790 3.791) 10.104 11.316 ( -13.068 -6.841 -2.854) 15.024 12.471 ( 10.730 3.772 -1.600) 11.486 14.288 ( 2.896 1.968 1.801) 3.938 14.739 ( -4.295 6.017 0.095) 7.394 ======================= Grid point 66 (47/344) ======================= q-point: ( 0.40 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.527 ( 6.043 12.093 4.492) 14.246 2.594 ( 9.923 2.647 -2.749) 10.632 2.806 ( 6.720 0.339 -7.401) 10.002 2.822 ( 9.971 14.097 2.386) 17.431 3.316 ( -1.859 2.510 1.526) 3.476 3.541 ( 0.551 -0.165 -0.436) 0.722 3.667 ( 8.700 3.819 1.484) 9.616 3.763 ( 8.557 5.789 1.397) 10.425 4.406 ( -2.179 9.933 -4.088) 10.960 4.761 ( 1.268 9.764 5.237) 11.152 4.790 ( 1.611 5.177 -0.221) 5.426 5.200 ( -5.557 9.394 0.183) 10.916 7.827 ( 2.094 7.052 3.235) 8.037 8.548 ( -4.241 -2.174 0.217) 4.771 9.381 ( 11.872 0.969 -0.775) 11.937 9.574 ( 7.780 0.270 1.594) 7.946 9.714 ( 2.816 2.784 -0.726) 4.026 9.978 ( -2.754 2.581 -6.163) 7.227 10.042 ( 3.212 9.659 6.368) 12.006 10.634 ( -9.100 -5.775 1.565) 10.891 11.017 ( -12.184 -6.124 -2.616) 13.885 12.721 ( 12.388 5.817 -0.909) 13.715 14.353 ( 2.796 -0.138 0.408) 2.829 14.687 ( -6.891 3.472 0.449) 7.729 ======================= Grid point 67 (48/344) ======================= q-point: ( 0.47 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.715 ( 3.735 1.230 -1.339) 4.154 2.734 ( 4.491 9.448 2.034) 10.657 3.009 ( 12.656 4.972 -3.288) 13.989 3.110 ( 8.613 6.480 -1.561) 10.891 3.322 ( -2.204 7.117 1.896) 7.688 3.474 ( -2.085 -3.239 0.970) 3.973 3.926 ( 8.968 7.088 0.787) 11.458 3.981 ( 10.007 6.883 0.414) 12.153 4.451 ( -0.532 6.508 -2.863) 7.130 4.792 ( 2.648 -3.404 2.492) 4.981 4.937 ( 0.205 11.528 1.722) 11.658 5.169 ( -6.359 4.720 1.326) 8.030 7.942 ( 2.020 6.279 6.319) 9.134 8.472 ( -1.486 -2.119 -3.129) 4.060 9.581 ( 8.488 2.698 -0.097) 8.907 9.731 ( 6.850 2.443 -0.682) 7.304 9.792 ( 5.491 0.387 -0.338) 5.515 9.925 ( -5.439 3.170 -3.260) 7.090 10.199 ( 2.428 7.966 5.919) 10.217 10.435 ( -6.604 -5.145 0.284) 8.376 10.773 ( -8.277 -5.782 -3.334) 10.633 13.001 ( 11.239 9.182 -0.398) 14.518 14.372 ( 0.120 -1.328 -1.286) 1.852 14.583 ( -6.149 -1.298 1.554) 6.474 ======================= Grid point 68 (49/344) ======================= q-point: ( 0.53 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 2.917 2.364 0.242) 3.762 2.879 ( 2.428 6.769 0.078) 7.191 3.190 ( 1.987 -3.646 1.025) 4.277 3.218 ( 2.362 6.093 -2.704) 7.072 3.347 ( -0.408 2.195 -1.353) 2.611 3.553 ( 5.611 11.038 1.668) 12.494 4.102 ( 4.876 5.082 0.551) 7.064 4.199 ( 2.922 11.032 -0.816) 11.442 4.526 ( 3.842 3.867 -1.185) 5.578 4.808 ( 1.112 -1.181 2.458) 2.945 5.012 ( -0.434 2.692 0.679) 2.810 5.090 ( -3.558 -2.291 1.960) 4.664 8.036 ( 0.216 4.645 7.542) 8.860 8.444 ( 1.708 -1.874 -5.513) 6.068 9.716 ( 2.842 3.838 1.014) 4.882 9.797 ( -0.411 1.983 -1.156) 2.332 9.838 ( -7.675 8.144 -0.879) 11.225 9.954 ( 10.975 -2.641 -2.144) 11.490 10.263 ( -0.729 -1.600 7.098) 7.312 10.355 ( -0.219 0.257 -0.538) 0.635 10.607 ( -2.793 -5.166 -4.488) 7.391 13.279 ( 7.633 12.763 -0.086) 14.871 14.316 ( -5.231 -0.356 -1.753) 5.528 14.480 ( 0.044 -8.341 1.733) 8.519 ======================= Grid point 69 (50/344) ======================= q-point: ( 0.60 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( -0.451 4.491 0.266) 4.522 2.955 ( 1.491 2.756 0.751) 3.222 3.185 ( -4.262 -0.702 -3.335) 5.457 3.197 ( 3.182 -2.991 1.916) 4.769 3.410 ( -1.159 7.390 -0.909) 7.535 3.734 ( 0.618 9.762 0.468) 9.793 4.192 ( -0.024 4.007 -0.375) 4.025 4.309 ( -2.834 11.902 0.386) 12.241 4.627 ( 2.451 5.028 -1.481) 5.787 4.796 ( -4.161 1.018 1.579) 4.566 4.977 ( 2.725 -10.000 2.509) 10.664 5.055 ( 2.232 -4.103 0.081) 4.671 8.062 ( -2.705 1.851 4.636) 5.678 8.466 ( 3.378 -1.134 -4.030) 5.380 9.739 ( -5.684 7.270 2.331) 9.518 9.780 ( -2.134 4.118 -0.409) 4.656 9.851 ( -0.117 3.340 -0.853) 3.449 10.074 ( 6.360 -3.255 -2.207) 7.478 10.270 ( 1.014 -2.140 2.676) 3.574 10.301 ( -2.707 -2.713 0.982) 3.957 10.573 ( 3.394 -3.339 -2.694) 5.470 13.487 ( -0.967 14.430 -0.097) 14.462 14.217 ( -2.911 -1.521 0.387) 3.307 14.425 ( 4.141 -10.794 -0.342) 11.566 ======================= Grid point 70 (51/344) ======================= q-point: (-0.33 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.841 ( -3.592 1.984 -0.414) 4.124 2.999 ( -3.645 3.658 3.596) 6.293 3.107 ( 1.424 -3.187 -4.385) 5.604 3.253 ( 4.333 -0.283 1.397) 4.562 3.407 ( -6.306 5.023 -0.969) 8.120 3.731 ( -9.210 4.213 0.347) 10.133 4.185 ( -4.135 2.352 -0.757) 4.817 4.326 ( -7.853 9.119 1.425) 12.119 4.678 ( -6.550 -2.177 0.871) 6.958 4.723 ( 0.840 6.053 -2.215) 6.500 4.957 ( 6.546 -10.366 1.304) 12.329 5.062 ( 1.921 -3.233 0.636) 3.814 8.011 ( -4.382 -0.129 1.136) 4.529 8.501 ( 1.942 -0.545 -1.325) 2.413 9.742 ( -3.553 6.517 1.545) 7.582 9.792 ( -0.672 4.553 0.979) 4.705 9.861 ( -2.151 3.472 -0.209) 4.090 10.112 ( 1.109 -8.518 -0.156) 8.591 10.144 ( -3.058 -1.657 -3.012) 4.601 10.345 ( 2.449 0.048 1.806) 3.043 10.603 ( 3.974 -2.752 -0.623) 4.874 13.485 ( -12.011 8.034 -0.196) 14.452 14.243 ( 4.526 3.200 2.157) 5.948 14.401 ( 5.595 -10.358 -1.979) 11.938 ======================= Grid point 71 (52/344) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( -2.435 0.000 0.000) 2.435 2.885 ( -9.556 0.000 0.000) 9.556 3.160 ( 3.841 -0.000 -0.000) 3.841 3.285 ( -9.855 0.000 0.000) 9.855 3.345 ( 5.853 -0.000 -0.000) 5.853 3.521 ( -16.489 0.000 0.000) 16.489 4.096 ( -7.327 0.000 0.000) 7.327 4.209 ( -11.485 0.000 0.000) 11.485 4.555 ( -4.769 0.000 0.000) 4.769 4.761 ( 0.052 -0.000 -0.000) 0.052 5.023 ( 6.128 -0.000 -0.000) 6.128 5.029 ( -4.484 0.000 0.000) 4.484 7.929 ( -4.756 0.000 0.000) 4.756 8.513 ( 0.082 -0.000 -0.000) 0.082 9.703 ( -4.748 0.000 0.000) 4.748 9.819 ( -0.944 0.000 0.000) 0.944 9.912 ( 2.686 -0.000 -0.000) 2.686 9.931 ( -7.590 0.000 0.000) 7.590 10.151 ( -0.890 0.000 0.000) 0.890 10.367 ( 1.160 -0.000 -0.000) 1.160 10.670 ( 5.877 -0.000 -0.000) 5.877 13.281 ( -14.674 0.000 0.000) 14.674 14.363 ( 2.301 -0.000 -0.000) 2.301 14.434 ( 7.681 -0.000 -0.000) 7.681 ======================= Grid point 80 (53/344) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -0.000 3.532 -2.901) 4.571 2.371 ( 0.000 8.850 5.835) 10.601 2.625 ( 0.000 15.787 4.048) 16.298 2.750 ( -0.000 -0.026 -7.608) 7.608 3.241 ( -0.000 0.263 -5.404) 5.410 3.500 ( 0.000 7.312 3.264) 8.007 3.535 ( 0.000 4.567 3.581) 5.803 3.647 ( 0.000 -3.235 0.643) 3.298 4.461 ( -0.000 11.154 -3.994) 11.847 4.735 ( 0.000 1.254 0.738) 1.455 4.789 ( 0.000 18.606 3.271) 18.891 5.313 ( -0.000 10.836 0.068) 10.836 7.791 ( 0.000 8.605 0.940) 8.656 8.700 ( 0.000 -0.527 1.099) 1.219 9.052 ( 0.000 -6.193 1.282) 6.324 9.419 ( 0.000 -0.406 1.908) 1.950 9.666 ( -0.000 4.268 -0.570) 4.306 9.964 ( -0.000 7.224 0.058) 7.224 10.039 ( -0.000 7.523 -1.174) 7.614 10.813 ( 0.000 -5.179 2.211) 5.631 11.363 ( -0.000 -8.492 -2.047) 8.735 12.390 ( -0.000 3.383 -1.704) 3.788 14.296 ( 0.000 3.065 1.418) 3.377 14.834 ( -0.000 4.959 -0.109) 4.960 ======================= Grid point 81 (54/344) ======================= q-point: ( 0.40 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( 10.458 1.036 -2.881) 10.897 2.547 ( 5.606 10.056 6.410) 13.177 2.703 ( 2.250 -1.170 -9.050) 9.398 2.847 ( 2.951 12.708 5.133) 14.020 3.295 ( 5.712 1.068 -3.675) 6.875 3.538 ( -0.024 2.734 1.096) 2.946 3.608 ( 0.845 -1.065 1.704) 2.180 3.674 ( 6.830 3.351 2.154) 7.907 4.533 ( -1.841 8.374 -3.371) 9.213 4.731 ( 0.399 -1.192 0.369) 1.311 4.977 ( -1.300 17.276 3.507) 17.677 5.384 ( -3.875 9.504 0.679) 10.286 7.889 ( 0.780 8.619 2.706) 9.067 8.616 ( -6.102 -2.460 -0.268) 6.584 9.124 ( 12.970 -5.347 0.803) 14.052 9.468 ( 4.490 0.992 1.000) 4.706 9.716 ( 1.160 3.648 -0.314) 3.841 10.002 ( 0.030 2.906 -5.889) 6.567 10.151 ( 0.104 11.532 6.020) 13.009 10.726 ( -5.670 -3.083 0.487) 6.473 11.162 ( -11.091 -7.576 -1.892) 13.565 12.536 ( 11.953 3.176 -1.185) 12.424 14.334 ( 0.623 1.991 0.807) 2.236 14.834 ( -4.841 3.581 -0.042) 6.022 ======================= Grid point 82 (55/344) ======================= q-point: ( 0.47 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( 8.607 1.471 -0.689) 8.759 2.747 ( 6.429 6.705 0.230) 9.292 2.778 ( 11.546 1.231 -1.554) 11.715 3.026 ( 5.907 5.025 -0.663) 7.784 3.395 ( 1.853 5.470 0.640) 5.811 3.493 ( -2.823 -2.476 0.718) 3.823 3.770 ( 13.938 3.444 1.295) 14.416 3.847 ( 9.057 2.560 0.364) 9.419 4.558 ( -3.001 6.950 -3.191) 8.215 4.730 ( 1.053 -2.028 2.048) 3.069 5.093 ( -2.997 11.827 1.810) 12.335 5.366 ( -7.757 6.542 1.393) 10.242 8.000 ( 1.324 7.809 5.437) 9.607 8.490 ( -4.408 -3.081 -3.038) 6.177 9.342 ( 16.401 -3.773 -0.013) 16.829 9.583 ( 7.327 0.586 0.507) 7.368 9.771 ( 1.323 2.657 -0.219) 2.977 10.011 ( -1.060 3.037 -3.711) 4.911 10.277 ( 0.512 9.484 5.431) 10.941 10.559 ( -10.479 -1.810 -0.494) 10.646 10.887 ( -11.081 -5.857 -2.375) 12.756 12.820 ( 16.059 4.230 -0.597) 16.617 14.349 ( -0.104 -0.222 0.046) 0.250 14.741 ( -8.848 1.778 0.311) 9.030 ======================= Grid point 83 (56/344) ======================= q-point: ( 0.53 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.727 ( 4.898 0.667 -0.551) 4.973 2.905 ( 3.209 6.574 0.822) 7.362 3.064 ( 13.647 0.834 0.707) 13.690 3.131 ( 6.648 -0.287 -2.892) 7.256 3.377 ( -4.044 -1.938 -0.498) 4.512 3.557 ( 5.381 8.165 1.667) 9.920 4.022 ( 8.319 2.658 0.103) 8.734 4.090 ( 16.350 3.390 0.486) 16.705 4.565 ( -2.366 5.805 -2.632) 6.799 4.737 ( 2.272 -3.293 2.692) 4.822 5.117 ( -4.759 5.816 0.580) 7.537 5.253 ( -10.965 2.806 1.570) 11.427 8.109 ( 0.609 6.704 8.332) 10.712 8.395 ( -1.189 -3.527 -6.651) 7.621 9.588 ( 14.073 -1.397 -0.120) 14.143 9.726 ( 9.229 -1.075 -0.218) 9.294 9.808 ( 0.451 1.636 -0.226) 1.712 10.014 ( -2.318 4.974 -1.210) 5.620 10.325 ( -7.900 -2.209 3.050) 8.752 10.398 ( -1.802 5.223 1.355) 5.689 10.663 ( -8.520 -3.841 -3.529) 9.990 13.155 ( 16.347 5.784 -0.184) 17.341 14.328 ( -0.725 -2.032 -0.781) 2.294 14.571 ( -11.368 -0.545 0.853) 11.413 ======================= Grid point 84 (57/344) ======================= q-point: ( 0.60 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.832 ( 5.920 1.582 0.484) 6.146 2.979 ( -1.083 2.998 -1.173) 3.397 3.122 ( 2.825 -2.556 1.450) 4.077 3.249 ( -3.616 -0.518 -1.298) 3.877 3.388 ( 8.610 2.008 -0.120) 8.842 3.748 ( 6.563 5.683 0.212) 8.684 4.166 ( 5.451 1.458 0.095) 5.643 4.359 ( 8.696 4.362 -0.488) 9.741 4.607 ( 2.408 4.691 -1.136) 5.394 4.760 ( 4.589 -4.445 1.905) 6.666 5.041 ( -10.296 1.054 2.017) 10.545 5.072 ( -7.957 -0.804 -0.851) 8.042 8.156 ( -3.689 3.324 5.929) 7.734 8.373 ( 4.098 -2.071 -5.268) 6.988 9.763 ( 5.600 0.695 0.494) 5.664 9.819 ( -0.455 0.898 -0.335) 1.061 9.866 ( 8.163 -1.837 -0.225) 8.370 10.031 ( -4.572 7.935 -1.820) 9.337 10.184 ( 0.913 -6.380 2.777) 7.018 10.418 ( -6.373 2.757 2.777) 7.478 10.514 ( -1.215 -2.361 -4.019) 4.817 13.480 ( 13.334 6.070 0.030) 14.650 14.290 ( -1.331 -1.355 -1.901) 2.687 14.357 ( -10.182 -3.475 1.836) 10.914 ======================= Grid point 85 (58/344) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.928 ( -4.504 0.000 0.000) 4.504 2.960 ( 6.870 -0.000 -0.000) 6.870 3.151 ( -6.081 0.000 0.000) 6.081 3.178 ( 4.132 -0.000 -0.000) 4.132 3.489 ( 0.557 -0.000 -0.000) 0.557 3.841 ( -0.266 0.000 0.000) 0.266 4.226 ( 0.525 -0.000 -0.000) 0.525 4.454 ( -0.636 0.000 0.000) 0.636 4.731 ( 7.726 -0.000 -0.000) 7.726 4.797 ( 0.943 -0.000 -0.000) 0.943 4.830 ( -11.621 0.000 0.000) 11.621 5.001 ( 0.777 -0.000 -0.000) 0.777 8.095 ( -4.888 0.000 0.000) 4.888 8.441 ( 4.329 -0.000 -0.000) 4.329 9.804 ( -0.460 0.000 0.000) 0.460 9.814 ( -0.355 0.000 0.000) 0.355 9.953 ( -5.259 0.000 0.000) 5.259 9.990 ( 6.490 -0.000 -0.000) 6.490 10.248 ( -1.480 0.000 0.000) 1.480 10.281 ( -1.411 0.000 0.000) 1.411 10.532 ( 2.663 -0.000 -0.000) 2.663 13.659 ( 0.179 -0.000 -0.000) 0.179 14.204 ( -1.416 0.000 0.000) 1.416 14.285 ( 1.293 -0.000 -0.000) 1.293 ======================= Grid point 96 (59/344) ======================= q-point: ( 0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( -0.000 0.058 -2.577) 2.578 2.598 ( 0.000 7.954 6.597) 10.334 2.650 ( -0.000 -1.919 -8.108) 8.332 2.979 ( 0.000 12.963 6.402) 14.457 3.216 ( -0.000 -0.189 -5.334) 5.338 3.556 ( -0.000 -1.876 -0.978) 2.116 3.606 ( 0.000 -2.060 2.641) 3.350 3.635 ( 0.000 4.778 1.966) 5.167 4.611 ( -0.000 5.444 -1.743) 5.717 4.728 ( -0.000 0.423 -0.160) 0.452 5.154 ( 0.000 13.666 2.206) 13.843 5.510 ( 0.000 7.973 1.179) 8.060 7.975 ( 0.000 8.375 2.679) 8.793 8.671 ( -0.000 -2.245 -1.393) 2.642 8.921 ( 0.000 -6.468 1.538) 6.649 9.446 ( 0.000 1.751 0.440) 1.805 9.739 ( -0.000 2.963 -0.135) 2.966 10.019 ( -0.000 2.749 -4.770) 5.505 10.275 ( 0.000 10.403 5.812) 11.917 10.759 ( -0.000 -0.386 -0.840) 0.925 11.181 ( -0.000 -8.937 -1.251) 9.025 12.442 ( -0.000 2.328 -1.125) 2.586 14.358 ( 0.000 2.473 0.676) 2.564 14.909 ( -0.000 2.703 -0.114) 2.705 ======================= Grid point 97 (60/344) ======================= q-point: ( 0.47 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( 12.588 0.701 -0.892) 12.639 2.633 ( 2.185 -1.760 -5.635) 6.295 2.732 ( 5.577 5.599 4.853) 9.274 3.046 ( -2.556 4.968 0.322) 5.596 3.347 ( 10.308 5.455 0.082) 11.662 3.515 ( -1.892 -2.194 0.491) 2.939 3.609 ( 4.150 -2.096 0.146) 4.651 3.736 ( 6.098 2.399 0.894) 6.614 4.645 ( -0.880 3.930 -1.355) 4.249 4.725 ( -0.934 0.176 0.554) 1.100 5.251 ( -2.312 8.867 1.047) 9.224 5.541 ( -4.595 5.381 1.325) 7.199 8.066 ( 0.879 6.889 3.512) 7.783 8.552 ( -6.866 -3.026 -2.195) 7.818 9.024 ( 14.258 -4.174 0.532) 14.866 9.497 ( 3.856 1.231 0.217) 4.054 9.773 ( 0.995 1.988 -0.047) 2.224 10.034 ( -0.001 2.097 -3.005) 3.664 10.375 ( -0.309 7.298 4.738) 8.706 10.714 ( -6.251 2.573 -1.359) 6.895 10.996 ( -9.227 -8.262 -1.247) 12.448 12.582 ( 12.884 1.786 -0.647) 13.023 14.371 ( -1.086 1.293 0.329) 1.721 14.885 ( -5.215 1.616 -0.006) 5.460 ======================= Grid point 98 (61/344) ======================= q-point: ( 0.53 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.646 ( 4.940 0.549 0.360) 4.984 2.739 ( 18.553 -0.310 -2.773) 18.762 2.902 ( 6.984 3.942 3.212) 8.640 3.048 ( 0.880 -0.529 -2.181) 2.411 3.431 ( -3.633 -0.874 -0.220) 3.743 3.549 ( 3.248 4.582 1.707) 5.870 3.787 ( 18.362 -1.119 -0.281) 18.398 3.887 ( 8.825 1.207 0.239) 8.910 4.655 ( -2.061 4.061 -2.578) 5.233 4.703 ( -0.645 -2.044 2.402) 3.219 5.256 ( -4.702 3.973 0.357) 6.166 5.463 ( -9.062 2.360 0.875) 9.405 8.161 ( 2.276 4.987 4.616) 7.166 8.406 ( -5.652 -3.005 -3.805) 7.446 9.276 ( 17.597 -2.029 0.041) 17.713 9.596 ( 6.332 0.368 0.065) 6.343 9.807 ( 1.102 0.940 0.001) 1.448 10.048 ( 0.205 1.364 -1.154) 1.799 10.421 ( -1.727 2.218 2.533) 3.784 10.578 ( -12.360 3.797 -0.181) 12.932 10.764 ( -7.992 -5.015 -1.674) 9.583 12.877 ( 18.328 1.539 -0.217) 18.394 14.346 ( -2.266 -0.074 -0.009) 2.268 14.764 ( -9.773 0.518 0.123) 9.788 ======================= Grid point 99 (62/344) ======================= q-point: (-0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 5.645 -0.000 -0.000) 5.645 2.986 ( 4.660 -0.000 -0.000) 4.660 3.059 ( 2.213 -0.000 -0.000) 2.213 3.121 ( 16.495 -0.000 -0.000) 16.495 3.352 ( -4.197 0.000 0.000) 4.197 3.653 ( 6.425 -0.000 -0.000) 6.425 4.046 ( 8.890 -0.000 -0.000) 8.890 4.123 ( 18.230 -0.000 -0.000) 18.230 4.638 ( -1.959 0.000 0.000) 1.959 4.692 ( 0.962 -0.000 -0.000) 0.962 5.176 ( -6.516 0.000 0.000) 6.516 5.286 ( -12.430 0.000 0.000) 12.430 8.265 ( 4.756 -0.000 -0.000) 4.756 8.277 ( -5.750 0.000 0.000) 5.750 9.566 ( 15.987 -0.000 -0.000) 15.987 9.717 ( 7.318 -0.000 -0.000) 7.318 9.825 ( 0.347 -0.000 -0.000) 0.347 10.070 ( 1.871 -0.000 -0.000) 1.871 10.290 ( -12.618 0.000 0.000) 12.618 10.485 ( -1.048 0.000 0.000) 1.048 10.600 ( -8.609 0.000 0.000) 8.609 13.215 ( 18.754 -0.000 -0.000) 18.754 14.303 ( -2.135 0.000 0.000) 2.135 14.567 ( -12.780 0.000 0.000) 12.780 ======================= Grid point 113 (63/344) ======================= q-point: ( 0.47 0.47 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -0.000 0.046 -0.803) 0.804 2.592 ( -0.000 -0.987 -2.962) 3.122 2.730 ( 0.000 2.851 2.910) 4.074 3.192 ( -0.000 -0.208 -2.491) 2.499 3.208 ( 0.000 6.749 2.974) 7.375 3.510 ( 0.000 -2.267 0.657) 2.360 3.562 ( -0.000 -1.773 -0.838) 1.961 3.705 ( 0.000 1.634 0.642) 1.755 4.672 ( -0.000 1.342 0.015) 1.342 4.745 ( -0.000 0.836 -0.331) 0.899 5.342 ( 0.000 4.521 0.375) 4.536 5.626 ( 0.000 2.926 0.847) 3.046 8.119 ( 0.000 3.983 1.822) 4.380 8.616 ( -0.000 -1.754 -1.487) 2.299 8.833 ( 0.000 -2.498 0.600) 2.569 9.474 ( 0.000 0.794 0.088) 0.798 9.779 ( -0.000 1.042 -0.025) 1.042 10.045 ( -0.000 1.129 -1.563) 1.928 10.443 ( 0.000 3.609 2.756) 4.541 10.805 ( -0.000 5.245 -1.154) 5.370 11.000 ( -0.000 -8.117 -0.450) 8.129 12.471 ( -0.000 0.832 -0.392) 0.920 14.395 ( 0.000 0.953 0.207) 0.976 14.944 ( -0.000 0.844 -0.031) 0.845 ======================= Grid point 114 (64/344) ======================= q-point: (-0.47 -0.53 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 13.802 -0.000 -0.000) 13.802 2.600 ( 1.859 -0.000 -0.000) 1.859 2.802 ( 5.851 -0.000 -0.000) 5.851 3.083 ( -4.663 0.000 0.000) 4.663 3.458 ( 16.454 -0.000 -0.000) 16.454 3.479 ( -2.111 0.000 0.000) 2.111 3.554 ( 0.396 -0.000 -0.000) 0.396 3.764 ( 5.587 -0.000 -0.000) 5.587 4.680 ( 0.140 -0.000 -0.000) 0.140 4.731 ( -1.995 0.000 0.000) 1.995 5.342 ( -2.595 0.000 0.000) 2.595 5.599 ( -4.899 0.000 0.000) 4.899 8.155 ( 1.512 -0.000 -0.000) 1.512 8.507 ( -7.566 0.000 0.000) 7.566 8.981 ( 14.441 -0.000 -0.000) 14.441 9.511 ( 3.607 -0.000 -0.000) 3.607 9.793 ( 0.930 -0.000 -0.000) 0.930 10.050 ( 0.100 -0.000 -0.000) 0.100 10.457 ( -0.768 0.000 0.000) 0.768 10.814 ( -3.301 0.000 0.000) 3.301 10.836 ( -11.450 0.000 0.000) 11.450 12.599 ( 13.216 -0.000 -0.000) 13.216 14.385 ( -1.708 0.000 0.000) 1.708 14.901 ( -5.351 0.000 0.000) 5.351 ======================= Grid point 245 (65/344) ======================= q-point: ( 0.07 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.187 ( 0.000 -0.000 27.802) 27.802 0.187 ( 0.000 -0.000 27.802) 27.802 0.346 ( 0.000 -0.000 51.776) 51.776 2.345 ( -0.000 0.000 -8.538) 8.538 2.345 ( -0.000 0.000 -8.538) 8.538 2.719 ( 0.000 -0.000 7.049) 7.049 2.719 ( 0.000 -0.000 7.049) 7.049 3.367 ( -0.000 0.000 -1.244) 1.244 3.367 ( -0.000 0.000 -1.244) 1.244 4.082 ( -0.000 0.000 -14.199) 14.199 4.304 ( 0.000 -0.000 5.040) 5.040 5.433 ( 0.000 -0.000 3.260) 3.260 8.914 ( 0.000 -0.000 0.253) 0.253 8.914 ( 0.000 -0.000 0.253) 0.253 9.260 ( -0.000 0.000 -0.191) 0.191 9.260 ( -0.000 0.000 -0.191) 0.191 9.370 ( 0.000 -0.000 0.224) 0.224 9.682 ( -0.000 0.000 -0.206) 0.206 10.100 ( 0.000 -0.000 0.722) 0.722 10.100 ( 0.000 -0.000 0.722) 0.722 12.132 ( -0.000 0.000 -0.640) 0.640 12.132 ( -0.000 0.000 -0.640) 0.640 13.886 ( 0.000 -0.000 0.015) 0.015 16.654 ( 0.000 -0.000 0.048) 0.048 ======================= Grid point 246 (66/344) ======================= q-point: ( 0.13 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.622 ( 21.795 12.583 11.598) 27.710 0.656 ( 22.943 13.246 12.589) 29.332 1.123 ( 40.095 23.149 16.906) 49.288 2.407 ( 6.275 3.623 -10.176) 12.493 2.424 ( 8.527 4.923 -10.220) 14.191 2.708 ( -1.627 -0.940 8.062) 8.278 2.934 ( 8.858 5.114 5.327) 11.533 3.365 ( 0.005 0.003 -1.155) 1.155 3.458 ( 7.773 4.488 -1.255) 9.063 4.026 ( 2.946 1.701 -12.578) 13.030 4.278 ( -2.700 -1.559 5.612) 6.420 5.396 ( -3.150 -1.818 2.140) 4.220 7.474 ( -9.871 -5.699 34.064) 35.920 8.945 ( 2.275 1.313 1.073) 2.837 9.233 ( -3.220 -1.859 -8.794) 9.547 9.272 ( 1.292 0.746 -0.883) 1.734 9.341 ( -9.889 -5.709 6.584) 13.181 9.879 ( 9.122 5.267 -2.948) 10.938 10.045 ( -4.607 -2.660 0.632) 5.357 11.537 ( 2.909 1.680 -45.831) 45.954 12.153 ( 1.712 0.988 -0.543) 2.050 12.233 ( 6.431 3.713 -12.363) 14.421 13.981 ( 8.041 4.642 0.070) 9.285 14.379 ( -36.442 -21.040 88.071) 97.608 ======================= Grid point 247 (67/344) ======================= q-point: ( 0.20 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( 20.552 11.866 7.333) 24.839 1.205 ( 22.235 12.837 7.548) 26.761 2.034 ( 34.514 19.926 2.998) 39.965 2.557 ( 7.337 4.236 -14.668) 16.939 2.665 ( 13.912 8.032 -4.690) 16.735 2.697 ( 0.133 0.077 12.024) 12.025 3.171 ( 10.173 5.873 7.251) 13.804 3.366 ( 0.324 0.187 -0.644) 0.745 3.699 ( 12.617 7.284 -1.222) 14.619 4.072 ( -0.143 -0.083 -8.248) 8.250 4.287 ( 6.398 3.694 0.295) 7.393 5.297 ( -5.627 -3.249 1.118) 6.593 7.490 ( 3.581 2.068 11.178) 11.919 8.976 ( -12.145 -7.012 -2.948) 14.330 9.020 ( 3.867 2.233 1.750) 4.796 9.311 ( 2.165 1.250 -1.443) 2.886 9.316 ( 2.042 1.179 1.390) 2.737 9.902 ( -7.560 -4.365 0.991) 8.786 10.046 ( 6.098 3.521 -2.649) 7.523 11.283 ( -13.257 -7.654 -11.387) 19.079 12.141 ( -10.457 -6.038 0.220) 12.077 12.204 ( 2.686 1.551 -0.817) 3.207 14.120 ( -3.424 -1.977 18.572) 18.988 14.243 ( 11.679 6.743 5.244) 14.469 ======================= Grid point 248 (68/344) ======================= q-point: ( 0.27 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 17.128 9.889 4.786) 20.349 1.705 ( 19.713 11.382 4.522) 23.208 2.586 ( 13.782 7.957 -12.152) 20.023 2.589 ( -1.112 -0.642 -2.434) 2.752 2.843 ( 9.284 5.360 -0.527) 10.733 3.097 ( 20.636 11.914 11.087) 26.281 3.382 ( 1.141 0.659 0.484) 1.404 3.444 ( 13.372 7.720 2.309) 15.613 3.978 ( 4.325 2.497 -1.067) 5.106 4.030 ( 6.680 3.856 -0.946) 7.771 4.560 ( 15.161 8.753 -4.443) 18.061 5.153 ( -6.455 -3.727 0.317) 7.460 7.629 ( 6.222 3.592 5.379) 8.975 8.732 ( -8.279 -4.780 -1.132) 9.627 9.125 ( 4.654 2.687 2.372) 5.874 9.348 ( 0.647 0.374 -1.767) 1.919 9.399 ( 5.136 2.965 -0.346) 5.941 9.726 ( -6.965 -4.021 1.422) 8.168 10.159 ( 4.328 2.499 -1.823) 5.320 10.972 ( -11.416 -6.591 -2.156) 13.357 11.866 ( -12.132 -7.005 0.335) 14.013 12.268 ( 3.021 1.744 -1.310) 3.727 14.127 ( 1.089 0.629 5.336) 5.483 14.526 ( 11.086 6.400 2.515) 13.045 ======================= Grid point 249 (69/344) ======================= q-point: ( 0.33 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.944 ( 12.716 7.341 2.168) 14.842 2.132 ( 16.561 9.561 1.911) 19.218 2.552 ( -1.745 -1.007 2.267) 3.033 2.759 ( 5.370 3.100 -9.072) 10.988 3.057 ( 9.290 5.364 -5.084) 11.871 3.422 ( 2.077 1.199 2.099) 3.187 3.460 ( 8.848 5.108 10.760) 14.838 3.681 ( 1.852 1.069 -2.641) 3.398 4.134 ( 16.654 9.615 -0.685) 19.242 4.299 ( 11.811 6.819 0.291) 13.642 4.862 ( 7.532 4.349 -0.631) 8.720 5.059 ( 2.040 1.178 -1.618) 2.858 7.783 ( 5.969 3.446 3.960) 7.949 8.591 ( -3.753 -2.167 -1.577) 4.612 9.232 ( 2.340 1.351 5.496) 6.124 9.293 ( -3.791 -2.189 -3.498) 5.604 9.558 ( 8.777 5.067 -1.180) 10.203 9.641 ( -0.209 -0.121 0.579) 0.627 10.245 ( 3.385 1.955 0.052) 3.909 10.764 ( -6.365 -3.675 0.102) 7.350 11.606 ( -10.268 -5.928 -1.007) 11.899 12.334 ( 2.903 1.676 -1.680) 3.750 14.176 ( 2.354 1.359 1.207) 2.974 14.752 ( 7.947 4.588 2.020) 9.396 ======================= Grid point 250 (70/344) ======================= q-point: ( 0.40 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( 8.124 4.690 -0.653) 9.404 2.473 ( 12.619 7.285 -0.902) 14.598 2.526 ( -1.066 -0.615 4.468) 4.635 2.840 ( 3.316 1.915 -2.821) 4.756 3.238 ( 7.437 4.294 -6.500) 10.770 3.482 ( 2.407 1.390 3.679) 4.611 3.596 ( 1.025 0.592 5.725) 5.846 3.638 ( -2.223 -1.283 -1.025) 2.763 4.430 ( 7.648 4.416 -4.859) 10.080 4.657 ( 17.243 9.955 0.815) 19.927 4.892 ( 0.247 0.143 3.928) 3.938 5.250 ( 9.491 5.479 -1.418) 11.050 7.920 ( 5.128 2.961 3.977) 7.133 8.542 ( -0.291 -0.168 -2.802) 2.822 9.104 ( -8.126 -4.691 2.625) 9.743 9.350 ( 3.934 2.271 0.013) 4.542 9.680 ( 2.618 1.512 -0.084) 3.024 9.782 ( 10.354 5.978 -2.194) 12.156 10.316 ( 2.261 1.305 3.190) 4.122 10.674 ( -1.385 -0.799 -0.933) 1.851 11.386 ( -8.639 -4.987 -1.268) 10.055 12.393 ( 2.464 1.423 -1.646) 3.287 14.236 ( 2.591 1.496 0.187) 2.997 14.903 ( 4.939 2.852 1.327) 5.856 ======================= Grid point 251 (71/344) ======================= q-point: ( 0.47 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( 4.023 2.323 -2.720) 5.383 2.524 ( -0.182 -0.105 5.529) 5.533 2.690 ( 6.177 3.566 -3.724) 8.047 2.928 ( 4.754 2.745 2.815) 6.169 3.368 ( 5.001 2.887 -6.934) 9.024 3.541 ( 1.690 0.976 4.802) 5.183 3.553 ( -2.606 -1.505 -0.833) 3.123 3.604 ( -2.581 -1.490 2.000) 3.589 4.561 ( 5.082 2.934 -1.329) 6.017 4.842 ( 0.398 0.230 -0.768) 0.895 5.070 ( 11.952 6.900 1.217) 13.854 5.417 ( 4.786 2.763 1.811) 5.816 8.033 ( 3.736 2.157 3.244) 5.398 8.551 ( 1.285 0.742 -2.728) 3.105 8.940 ( -6.102 -3.523 1.716) 7.252 9.427 ( 2.571 1.484 0.208) 2.976 9.738 ( 2.234 1.290 -0.086) 2.581 9.997 ( 8.247 4.761 -3.467) 10.134 10.353 ( -0.091 -0.052 5.612) 5.613 10.700 ( 3.845 2.220 -1.934) 4.843 11.195 ( -7.767 -4.484 -0.975) 9.022 12.439 ( 1.745 1.007 -1.146) 2.318 14.292 ( 2.055 1.187 0.215) 2.383 14.990 ( 2.511 1.450 0.460) 2.936 ======================= Grid point 252 (72/344) ======================= q-point: ( 0.53 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 1.515 0.875 -2.556) 3.098 2.531 ( -0.535 -0.309 4.422) 4.465 2.764 ( 1.734 1.001 -2.476) 3.185 3.039 ( 2.729 1.576 3.190) 4.484 3.438 ( 2.435 1.406 -6.865) 7.419 3.498 ( -1.356 -0.783 -3.024) 3.405 3.551 ( -1.701 -0.982 2.548) 3.217 3.575 ( 0.092 0.053 5.352) 5.353 4.656 ( 2.622 1.514 0.052) 3.029 4.824 ( -1.064 -0.614 -0.451) 1.309 5.282 ( 5.793 3.345 -1.441) 6.843 5.478 ( 0.027 0.016 3.926) 3.926 8.095 ( 0.978 0.565 1.371) 1.776 8.578 ( 1.201 0.694 -0.924) 1.667 8.842 ( -2.455 -1.417 0.545) 2.886 9.467 ( 0.872 0.504 0.099) 1.012 9.775 ( 0.848 0.489 0.025) 0.979 10.134 ( 4.218 2.435 -3.752) 6.148 10.339 ( -1.963 -1.133 4.791) 5.300 10.825 ( 6.441 3.719 -0.957) 7.499 11.022 ( -6.754 -3.900 -0.514) 7.816 12.467 ( 0.776 0.448 -0.367) 0.968 14.327 ( 0.826 0.477 0.596) 1.125 15.026 ( 0.633 0.365 -0.491) 0.881 ======================= Grid point 253 (73/344) ======================= q-point: (-0.40 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 0.314 0.181 -0.865) 0.938 2.508 ( -2.161 -1.247 1.748) 3.046 2.784 ( 0.330 0.191 0.430) 0.575 3.020 ( -4.611 -2.662 0.486) 5.347 3.451 ( 0.017 0.010 -5.891) 5.891 3.506 ( 2.522 1.456 -3.331) 4.424 3.544 ( 0.431 0.249 3.004) 3.045 3.566 ( -1.927 -1.112 5.006) 5.478 4.655 ( -2.395 -1.383 0.010) 2.766 4.822 ( 0.850 0.491 -0.763) 1.243 5.299 ( -4.934 -2.848 0.456) 5.715 5.463 ( -1.235 -0.713 2.372) 2.768 8.079 ( -2.425 -1.400 -0.977) 2.965 8.597 ( 0.291 0.168 1.738) 1.770 8.833 ( 1.764 1.018 -0.623) 2.130 9.467 ( -0.903 -0.521 0.061) 1.044 9.776 ( -0.816 -0.471 0.100) 0.948 10.167 ( -1.524 -0.880 0.072) 1.762 10.296 ( -1.682 -0.971 -0.455) 1.994 10.834 ( -5.605 -3.236 0.317) 6.479 11.025 ( 7.134 4.119 -0.028) 8.238 12.472 ( -0.344 -0.198 0.364) 0.538 14.330 ( -0.726 -0.419 1.037) 1.333 15.019 ( -0.992 -0.573 -1.397) 1.806 ======================= Grid point 254 (74/344) ======================= q-point: (-0.33 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.366 ( -3.963 -2.288 3.839) 5.973 2.457 ( -0.860 -0.497 -4.229) 4.344 2.743 ( -6.612 -3.818 4.497) 8.861 2.896 ( -3.137 -1.811 -2.505) 4.405 3.414 ( -2.538 -1.465 -2.528) 3.870 3.510 ( -3.399 -1.963 2.576) 4.695 3.567 ( 0.448 0.259 0.455) 0.688 3.570 ( 3.182 1.837 -2.035) 4.200 4.582 ( -3.606 -2.082 1.723) 4.506 4.832 ( 0.145 0.084 -2.347) 2.353 5.072 ( -14.301 -8.257 1.346) 16.568 5.413 ( -4.029 -2.326 1.442) 4.870 7.987 ( -4.829 -2.788 -3.225) 6.442 8.600 ( -0.496 -0.286 4.134) 4.174 8.918 ( 5.547 3.203 -1.452) 6.568 9.428 ( -2.476 -1.430 0.287) 2.873 9.740 ( -2.240 -1.294 0.077) 2.588 10.051 ( -8.491 -4.902 4.357) 10.729 10.269 ( -0.319 -0.184 -6.484) 6.495 10.729 ( -3.081 -1.779 2.164) 4.164 11.204 ( 7.977 4.606 0.309) 9.217 12.452 ( -1.454 -0.840 0.738) 1.835 14.300 ( -2.057 -1.188 1.356) 2.735 14.972 ( -2.791 -1.611 -2.075) 3.833 ======================= Grid point 255 (75/344) ======================= q-point: (-0.27 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.210 ( -9.738 -5.622 3.027) 11.645 2.461 ( 1.601 0.924 -5.155) 5.477 2.494 ( -14.151 -8.170 2.523) 16.534 2.878 ( 0.080 0.046 1.791) 1.794 3.313 ( -6.433 -3.714 3.634) 8.270 3.437 ( -2.561 -1.478 -2.149) 3.655 3.521 ( -4.553 -2.629 -4.640) 7.012 3.648 ( 3.587 2.071 0.302) 4.152 4.488 ( -5.770 -3.331 3.215) 7.398 4.657 ( -21.206 -12.243 1.198) 24.516 4.837 ( 1.253 0.723 -4.081) 4.330 5.273 ( -8.372 -4.833 1.991) 9.870 7.856 ( -5.495 -3.173 -4.972) 8.061 8.599 ( -0.188 -0.109 5.109) 5.114 9.068 ( 7.149 4.128 -2.419) 8.602 9.363 ( -2.896 -1.672 1.644) 3.727 9.678 ( -2.821 -1.629 -0.240) 3.266 9.827 ( -10.944 -6.318 4.457) 13.399 10.240 ( -0.874 -0.505 -7.460) 7.528 10.712 ( 1.175 0.679 4.122) 4.340 11.395 ( 8.539 4.930 0.010) 9.860 12.409 ( -2.388 -1.379 0.623) 2.827 14.245 ( -2.853 -1.647 1.447) 3.598 14.878 ( -5.072 -2.928 -2.315) 6.297 ======================= Grid point 256 (76/344) ======================= q-point: (-0.20 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( -14.257 -8.231 1.310) 16.514 2.127 ( -17.780 -10.265 1.454) 20.582 2.496 ( 2.357 1.361 -5.657) 6.278 2.874 ( -1.676 -0.968 6.540) 6.820 3.138 ( -9.482 -5.474 6.392) 12.678 3.323 ( -11.636 -6.718 -8.298) 15.792 3.388 ( -1.258 -0.726 -2.931) 3.271 3.704 ( -1.410 -0.814 0.601) 1.735 4.144 ( -19.804 -11.434 0.938) 22.887 4.306 ( -10.542 -6.086 1.225) 12.234 4.840 ( -4.155 -2.399 -3.453) 5.911 5.091 ( -3.877 -2.238 2.678) 5.216 7.715 ( -5.756 -3.323 -5.516) 8.637 8.629 ( 2.322 1.341 3.680) 4.554 9.160 ( -0.359 -0.207 -4.508) 4.527 9.356 ( 2.466 1.423 5.232) 5.956 9.598 ( -9.203 -5.313 4.671) 11.608 9.629 ( -0.326 -0.188 -1.126) 1.188 10.196 ( -1.622 -0.936 -6.831) 7.083 10.809 ( 6.495 3.750 6.087) 9.659 11.601 ( 9.451 5.456 -1.664) 11.039 12.347 ( -3.003 -1.734 0.118) 3.470 14.177 ( -3.264 -1.885 1.325) 3.995 14.724 ( -7.835 -4.524 -1.824) 9.229 ======================= Grid point 257 (77/344) ======================= q-point: (-0.13 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -18.446 -10.650 0.499) 21.305 1.682 ( -20.938 -12.089 1.300) 24.213 2.537 ( 2.177 1.257 -8.115) 8.496 2.756 ( -17.149 -9.901 13.329) 23.870 2.920 ( -10.324 -5.960 8.730) 14.775 2.942 ( -14.626 -8.444 -12.500) 21.011 3.365 ( -0.315 -0.182 -2.071) 2.103 3.423 ( -17.097 -9.871 -0.453) 19.747 3.974 ( -3.394 -1.960 -1.564) 4.220 4.046 ( -6.871 -3.967 1.181) 8.021 4.578 ( -14.290 -8.250 -1.392) 16.560 5.158 ( 5.904 3.409 0.775) 6.861 7.561 ( -6.539 -3.775 -4.229) 8.654 8.742 ( 7.328 4.231 0.360) 8.470 9.087 ( -3.844 -2.219 -2.857) 5.279 9.387 ( -1.670 -0.964 3.491) 3.988 9.436 ( -5.784 -3.340 4.985) 8.334 9.714 ( 7.379 4.260 -0.278) 8.525 10.132 ( -2.786 -1.608 -5.539) 6.405 11.054 ( 13.434 7.756 9.260) 18.066 11.820 ( 10.116 5.840 -6.215) 13.231 12.274 ( -3.166 -1.828 -0.494) 3.689 14.099 ( -3.809 -2.199 1.498) 4.646 14.508 ( -10.581 -6.109 -0.048) 12.218 ======================= Grid point 258 (78/344) ======================= q-point: (-0.07 0.07 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.094 ( -21.771 -12.569 1.109) 25.163 1.170 ( -23.645 -13.651 2.430) 27.410 2.034 ( -39.487 -22.798 3.784) 45.752 2.528 ( -2.007 -1.159 -13.066) 13.270 2.717 ( -9.223 -5.325 0.693) 10.672 2.744 ( -5.554 -3.207 13.023) 14.517 3.092 ( -11.392 -6.577 -2.810) 13.451 3.361 ( 0.230 0.133 -1.435) 1.459 3.699 ( -12.552 -7.247 -0.960) 14.525 4.116 ( 4.821 2.784 -4.028) 6.871 4.277 ( -10.253 -5.920 1.596) 11.946 5.295 ( 5.257 3.035 0.249) 6.075 7.407 ( -5.850 -3.378 -0.250) 6.760 8.970 ( 12.385 7.151 -3.288) 14.674 8.996 ( -3.345 -1.931 -1.671) 4.209 9.333 ( -2.752 -1.589 1.686) 3.598 9.346 ( -3.139 -1.813 5.230) 6.363 9.901 ( 7.710 4.451 0.847) 8.943 10.035 ( -4.888 -2.822 -4.125) 6.991 11.466 ( 19.405 11.203 14.314) 26.589 12.020 ( 8.642 4.989 -17.487) 20.134 12.203 ( -2.716 -1.568 -0.886) 3.258 14.008 ( -4.560 -2.633 5.739) 7.788 14.249 ( -11.667 -6.736 4.235) 14.122 ======================= Grid point 261 (79/344) ======================= q-point: ( 0.13 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.635 ( 0.000 24.190 12.746) 27.342 0.694 ( 0.000 25.515 15.511) 29.860 1.180 ( 0.000 44.944 21.446) 49.799 2.332 ( -0.000 3.749 -13.108) 13.633 2.445 ( -0.000 11.701 -9.972) 15.374 2.782 ( 0.000 1.836 10.910) 11.064 2.888 ( 0.000 8.283 3.773) 9.102 3.353 ( -0.000 -0.488 -2.389) 2.438 3.452 ( -0.000 8.535 -1.310) 8.635 3.987 ( -0.000 2.308 -14.658) 14.839 4.292 ( 0.000 -2.652 4.310) 5.061 5.402 ( 0.000 -3.866 3.256) 5.055 7.535 ( 0.000 -18.446 35.813) 40.285 8.929 ( -0.000 1.799 -0.300) 1.824 9.175 ( -0.000 -8.612 -8.971) 12.435 9.286 ( 0.000 2.272 0.348) 2.299 9.396 ( 0.000 -5.255 6.534) 8.385 9.851 ( -0.000 8.887 -5.181) 10.287 10.056 ( 0.000 -4.985 1.617) 5.241 11.622 ( -0.000 31.929 -57.428) 65.707 12.005 ( 0.000 -14.919 4.861) 15.690 12.143 ( -0.000 1.646 -1.441) 2.187 13.973 ( 0.000 7.646 0.654) 7.674 14.632 ( 0.000 -48.368 86.169) 98.816 ======================= Grid point 262 (80/344) ======================= q-point: ( 0.20 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( 13.475 21.908 9.414) 27.388 1.096 ( 12.145 22.718 10.872) 27.961 1.840 ( 18.774 36.485 10.145) 42.268 2.424 ( 8.458 4.381 -13.320) 16.375 2.585 ( 4.550 12.258 -7.904) 15.279 2.793 ( -2.982 5.509 10.800) 12.485 3.087 ( 8.555 7.650 6.840) 13.360 3.361 ( 1.372 0.289 -2.367) 2.751 3.604 ( 6.583 10.534 -1.367) 12.497 4.020 ( 3.057 2.986 -13.229) 13.902 4.271 ( 0.051 0.820 1.413) 1.635 5.335 ( -3.099 -5.120 2.398) 6.447 7.485 ( 1.023 -2.117 15.052) 15.235 8.986 ( 3.388 2.688 0.311) 4.335 9.007 ( -4.469 -12.366 -6.470) 14.655 9.317 ( 0.560 3.278 0.338) 3.343 9.354 ( -3.195 2.532 5.526) 6.867 9.929 ( -0.034 -1.257 -4.865) 5.025 10.009 ( 1.699 0.315 0.881) 1.939 11.492 ( -18.161 2.265 -16.669) 24.755 11.889 ( 4.725 -20.449 3.506) 21.279 12.300 ( 6.472 4.019 -7.037) 10.371 14.128 ( 7.928 8.103 1.744) 11.469 14.320 ( -11.971 -8.383 37.140) 39.912 ======================= Grid point 263 (81/344) ======================= q-point: ( 0.27 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( 13.067 19.710 7.114) 24.695 1.563 ( 14.557 19.041 6.712) 24.891 2.408 ( 13.443 13.661 -9.261) 21.286 2.588 ( 4.649 6.516 -10.128) 12.910 2.806 ( 5.207 7.964 7.214) 11.940 2.954 ( 12.738 18.133 7.915) 23.531 3.321 ( 8.035 5.444 3.855) 10.443 3.402 ( 2.374 4.874 -0.274) 5.428 3.863 ( 11.080 9.618 -1.410) 14.739 4.013 ( -1.318 -2.880 -3.080) 4.418 4.414 ( 10.423 10.213 -6.047) 15.795 5.209 ( -5.251 -5.840 1.324) 7.964 7.569 ( 5.124 1.980 6.006) 8.139 8.790 ( -6.269 -8.657 -1.975) 10.870 9.094 ( 4.329 4.482 1.003) 6.312 9.362 ( 0.273 2.854 3.266) 4.346 9.378 ( 1.094 5.002 -0.917) 5.202 9.821 ( -6.094 -3.140 -0.280) 6.860 10.097 ( 4.649 1.981 -2.761) 5.758 11.139 ( -16.235 -5.391 -2.686) 17.316 11.740 ( 2.156 -22.189 0.701) 22.305 12.369 ( -1.621 7.273 -3.042) 8.049 14.211 ( -5.631 3.565 11.149) 12.989 14.382 ( 11.803 5.243 2.800) 13.216 ======================= Grid point 264 (82/344) ======================= q-point: ( 0.33 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( 9.186 17.544 4.759) 20.367 1.995 ( 13.582 15.896 3.337) 21.173 2.583 ( 2.143 2.443 -4.059) 5.200 2.690 ( 3.430 6.437 -10.027) 12.399 2.989 ( 5.939 9.050 0.987) 10.870 3.391 ( 9.009 9.274 9.996) 16.343 3.429 ( 3.665 5.564 0.786) 6.709 3.616 ( 8.147 7.357 -1.637) 11.099 4.006 ( 6.283 4.244 0.736) 7.617 4.156 ( 12.267 7.342 -0.258) 14.299 4.729 ( 13.352 9.814 -5.069) 17.328 5.065 ( -4.172 -5.099 0.623) 6.617 7.705 ( 6.597 2.102 2.906) 7.509 8.626 ( -4.487 -4.701 0.208) 6.502 9.220 ( 3.721 5.758 1.094) 6.942 9.392 ( -3.577 4.692 0.917) 5.971 9.479 ( 5.712 4.888 -0.394) 7.528 9.694 ( -5.565 0.338 0.530) 5.601 10.185 ( 4.652 0.734 -2.152) 5.178 10.850 ( -9.701 -6.261 1.464) 11.639 11.541 ( -0.348 -19.537 -1.381) 19.589 12.413 ( -2.262 9.655 -1.838) 10.086 14.206 ( -2.110 4.569 3.002) 5.860 14.625 ( 10.676 2.348 2.171) 11.145 ======================= Grid point 265 (83/344) ======================= q-point: ( 0.40 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( 4.352 15.358 1.995) 16.087 2.360 ( 11.179 12.867 0.256) 17.046 2.604 ( -2.712 5.080 2.053) 6.113 2.778 ( 3.943 2.138 -5.938) 7.442 3.182 ( 6.070 8.332 -3.689) 10.949 3.483 ( 0.928 4.069 3.515) 5.456 3.621 ( 3.108 6.786 5.707) 9.396 3.653 ( -1.982 -1.928 -1.801) 3.300 4.299 ( 12.006 6.635 -5.282) 14.699 4.474 ( 15.715 10.447 3.968) 19.283 4.893 ( -0.544 -1.066 1.832) 2.188 5.104 ( 11.332 3.542 -2.348) 12.103 7.844 ( 6.540 1.342 2.905) 7.281 8.542 ( -1.515 -1.942 -0.272) 2.478 9.296 ( -11.814 4.369 0.545) 12.608 9.336 ( 2.513 5.790 1.383) 6.462 9.652 ( 5.245 3.379 -1.207) 6.355 9.693 ( 4.514 6.201 0.099) 7.671 10.267 ( 4.559 0.220 0.128) 4.567 10.685 ( -3.477 -4.987 1.415) 6.242 11.344 ( -0.967 -16.494 -1.941) 16.636 12.472 ( -2.554 11.027 -1.564) 11.426 14.232 ( 0.043 3.166 0.686) 3.239 14.803 ( 8.195 -0.239 1.412) 8.319 ======================= Grid point 266 (84/344) ======================= q-point: ( 0.47 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( -0.281 13.155 -0.641) 13.174 2.614 ( -3.516 6.662 4.140) 8.596 2.627 ( 6.428 9.248 -2.708) 11.583 2.860 ( 5.025 1.305 -0.152) 5.194 3.337 ( 4.523 5.972 -5.295) 9.174 3.535 ( -1.316 4.029 4.465) 6.156 3.588 ( -1.272 -2.278 -0.915) 2.764 3.695 ( -3.163 6.431 2.449) 7.574 4.482 ( 6.779 2.767 -3.019) 7.920 4.807 ( 5.838 3.787 -1.765) 7.179 4.930 ( 9.501 2.820 4.775) 11.001 5.318 ( 9.125 1.339 0.618) 9.243 7.967 ( 5.630 0.444 3.490) 6.639 8.527 ( 1.011 -0.255 -1.622) 1.928 9.124 ( -12.698 5.171 1.071) 13.752 9.427 ( 1.374 5.074 0.498) 5.280 9.722 ( 1.926 2.663 -0.177) 3.291 9.902 ( 8.432 6.689 -2.420) 11.032 10.340 ( 2.806 -0.364 3.853) 4.781 10.633 ( 2.408 -3.084 -0.818) 3.997 11.169 ( -1.223 -14.008 -1.633) 14.156 12.532 ( -3.600 11.978 -1.212) 12.566 14.269 ( 1.411 1.217 0.368) 1.900 14.913 ( 5.840 -2.292 0.514) 6.295 ======================= Grid point 267 (85/344) ======================= q-point: ( 0.53 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.454 ( -3.506 11.327 -1.883) 12.006 2.626 ( -4.152 6.805 4.641) 9.225 2.750 ( 1.337 4.883 -3.435) 6.118 2.981 ( 5.633 1.835 1.965) 6.242 3.426 ( 2.945 0.611 -4.008) 5.010 3.537 ( -4.146 7.530 -0.767) 8.630 3.561 ( -0.908 -1.887 1.988) 2.887 3.688 ( -5.242 7.446 2.171) 9.361 4.602 ( 4.997 1.325 -0.446) 5.189 4.826 ( -0.359 -1.300 -0.537) 1.452 5.174 ( 9.767 3.144 0.067) 10.260 5.437 ( 4.466 -2.124 3.581) 6.106 8.053 ( 3.476 -1.024 2.839) 4.604 8.552 ( 1.922 0.243 -1.971) 2.764 8.987 ( -9.946 7.052 0.957) 12.230 9.485 ( -0.145 4.012 0.219) 4.021 9.771 ( 0.963 1.849 0.016) 2.085 10.073 ( 5.547 4.251 -3.784) 7.947 10.358 ( -0.555 -1.777 5.500) 5.807 10.706 ( 8.161 -1.093 -1.417) 8.355 11.010 ( -1.968 -11.952 -1.157) 12.168 12.578 ( -5.024 12.280 -0.620) 13.282 14.302 ( 1.769 -0.519 0.715) 1.978 14.966 ( 3.968 -3.821 -0.449) 5.527 ======================= Grid point 268 (86/344) ======================= q-point: (-0.40 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -4.830 10.196 -1.760) 11.418 2.618 ( -5.464 5.974 3.422) 8.789 2.790 ( -0.342 3.305 -1.648) 3.709 3.047 ( -0.122 -0.850 1.517) 1.744 3.457 ( 2.780 -1.096 -2.693) 4.023 3.496 ( -4.052 1.581 -1.377) 4.562 3.574 ( -2.147 6.648 -0.475) 7.002 3.681 ( -4.935 7.180 3.634) 9.440 4.659 ( 0.766 -1.062 0.098) 1.313 4.805 ( 0.257 -1.015 -0.815) 1.328 5.295 ( 2.535 -1.539 -0.830) 3.080 5.451 ( 0.653 -4.535 4.609) 6.499 8.071 ( 0.245 -2.968 1.005) 3.143 8.577 ( 1.366 -0.595 -1.058) 1.828 8.936 ( -5.905 10.028 0.981) 11.678 9.503 ( -1.739 2.966 0.111) 3.441 9.789 ( -0.468 0.833 0.102) 0.961 10.161 ( 2.034 1.804 -3.766) 4.644 10.320 ( -2.396 -2.695 4.224) 5.554 10.853 ( 0.279 -3.257 -0.659) 3.335 10.862 ( 7.505 -8.244 -0.408) 11.156 12.599 ( -6.434 11.772 0.006) 13.416 14.319 ( 1.055 -1.551 1.221) 2.238 14.975 ( 2.444 -4.893 -1.377) 5.640 ======================= Grid point 269 (87/344) ======================= q-point: (-0.33 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( -5.651 8.739 -0.243) 10.409 2.566 ( -7.544 5.595 0.571) 9.410 2.804 ( -1.270 1.951 1.149) 2.596 2.962 ( -7.236 -2.227 0.463) 7.585 3.447 ( -1.338 -0.356 -3.828) 4.070 3.505 ( 3.491 -0.706 -1.040) 3.711 3.568 ( -5.573 4.941 1.724) 7.645 3.680 ( -4.702 7.928 1.588) 9.353 4.618 ( -2.659 -2.192 1.168) 3.638 4.807 ( 1.123 -1.475 -2.304) 2.957 5.197 ( -8.484 -7.420 1.337) 11.350 5.418 ( -0.283 -4.971 2.610) 5.622 8.009 ( -2.804 -4.452 -1.110) 5.377 8.582 ( 0.871 -2.035 0.738) 2.334 8.985 ( -2.316 13.202 0.831) 13.429 9.485 ( -3.410 2.206 0.229) 4.067 9.772 ( -2.039 0.036 0.087) 2.042 10.146 ( -4.754 -1.585 1.710) 5.295 10.255 ( -1.297 -2.418 -2.798) 3.919 10.729 ( -1.452 -7.315 0.639) 7.485 11.024 ( 11.533 -3.519 0.139) 12.058 12.589 ( -7.555 10.525 0.381) 12.962 14.313 ( -0.375 -1.513 1.644) 2.266 14.947 ( 0.859 -5.701 -2.104) 6.137 ======================= Grid point 270 (88/344) ======================= q-point: (-0.27 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -11.884 3.486 3.226) 12.798 2.519 ( -4.451 7.814 -4.685) 10.140 2.698 ( -13.841 -1.503 4.425) 14.608 2.868 ( 0.075 -0.098 -0.945) 0.953 3.410 ( -0.425 -4.081 -2.754) 4.942 3.463 ( -9.174 3.999 1.960) 10.198 3.589 ( 3.908 0.801 -0.688) 4.048 3.655 ( -6.853 5.797 -0.761) 9.009 4.543 ( -3.882 -3.044 2.429) 5.499 4.803 ( 1.270 -1.348 -4.236) 4.623 4.883 ( -17.046 -10.574 2.413) 20.204 5.329 ( -4.150 -6.712 1.925) 8.123 7.893 ( -4.454 -4.603 -2.941) 7.048 8.577 ( 1.201 -2.901 2.666) 4.118 9.110 ( -0.194 14.783 -0.101) 14.785 9.434 ( -4.656 1.825 1.023) 5.104 9.722 ( -3.286 -0.397 -0.115) 3.311 9.976 ( -10.910 -4.504 4.767) 12.730 10.216 ( 0.101 -2.065 -7.403) 7.686 10.678 ( 1.981 -4.177 2.720) 5.364 11.189 ( 12.630 -5.400 0.153) 13.737 12.550 ( -8.159 8.854 0.342) 12.045 14.286 ( -2.045 -0.338 1.848) 2.777 14.879 ( -1.198 -6.475 -2.424) 7.016 ======================= Grid point 271 (89/344) ======================= q-point: (-0.20 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( -16.483 0.672 1.647) 16.578 2.379 ( -18.724 -3.193 2.539) 19.164 2.533 ( -3.197 7.088 -4.395) 8.931 2.884 ( 0.722 0.130 2.021) 2.150 3.269 ( -8.957 -6.501 4.274) 11.864 3.387 ( -4.780 3.214 -4.542) 7.336 3.531 ( -10.669 2.813 -2.097) 11.231 3.677 ( 3.645 0.736 0.156) 3.721 4.399 ( -12.277 -7.931 -3.140) 14.949 4.420 ( -18.422 -10.002 6.060) 21.821 4.837 ( 2.273 1.419 -3.334) 4.277 5.153 ( -7.272 -7.618 2.095) 10.738 7.761 ( -4.919 -3.592 -4.049) 7.314 8.586 ( 2.522 -2.406 3.373) 4.850 9.224 ( -2.971 9.379 -3.134) 10.325 9.396 ( -2.236 4.428 3.909) 6.315 9.660 ( -3.233 -0.044 -0.534) 3.277 9.743 ( -10.965 -3.671 5.140) 12.654 10.177 ( -0.054 -2.330 -7.699) 8.044 10.731 ( 6.193 -0.565 4.755) 7.828 11.356 ( 13.972 -7.360 -0.813) 15.813 12.490 ( -8.074 7.397 -0.062) 10.950 14.245 ( -3.709 1.508 1.847) 4.409 14.762 ( -3.873 -7.272 -2.108) 8.505 ======================= Grid point 272 (90/344) ======================= q-point: (-0.13 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( -20.751 -1.377 1.074) 20.825 1.984 ( -22.874 -4.073 2.559) 23.374 2.547 ( -1.429 5.367 -6.225) 8.343 2.885 ( -2.174 -0.259 4.789) 5.266 3.013 ( -12.517 -9.348 2.122) 15.765 3.229 ( -17.230 0.610 -1.603) 17.315 3.403 ( -4.580 2.072 -2.063) 5.434 3.634 ( -12.626 -4.966 0.131) 13.568 3.998 ( -7.348 -3.392 0.245) 8.097 4.169 ( -11.563 -7.403 0.768) 13.751 4.748 ( -12.346 -4.179 -2.921) 13.358 5.079 ( 5.025 -0.341 1.490) 5.252 7.631 ( -5.851 -2.346 -3.495) 7.208 8.646 ( 5.814 -0.421 1.875) 6.123 9.171 ( -6.643 2.209 -2.604) 7.469 9.415 ( -2.329 0.660 2.779) 3.685 9.536 ( -7.446 -3.104 3.914) 8.967 9.696 ( 1.560 6.997 1.296) 7.285 10.134 ( -0.799 -1.750 -6.595) 6.870 10.917 ( 12.127 4.089 6.859) 14.520 11.517 ( 14.898 -9.866 -3.321) 18.174 12.426 ( -7.184 6.880 -0.716) 9.973 14.195 ( -5.359 3.009 2.078) 6.487 14.590 ( -6.934 -7.717 -0.887) 10.413 ======================= Grid point 273 (91/344) ======================= q-point: (-0.07 0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -24.690 -1.967 1.974) 24.846 1.525 ( -25.882 -4.100 3.115) 26.389 2.506 ( -20.056 -5.531 -6.540) 21.809 2.593 ( -13.905 -0.160 1.625) 14.000 2.823 ( -6.750 -1.859 -3.802) 7.967 2.897 ( -15.276 -2.690 9.256) 18.063 3.266 ( -13.504 -3.671 0.306) 13.998 3.395 ( -3.950 2.290 -1.374) 4.768 3.867 ( -13.511 -4.429 -0.973) 14.252 4.037 ( 5.120 0.533 -1.178) 5.281 4.448 ( -14.683 -3.377 -1.815) 15.175 5.207 ( 7.208 1.110 0.365) 7.302 7.498 ( -6.785 -0.873 -0.220) 6.844 8.799 ( 11.018 1.692 -0.988) 11.191 9.068 ( -5.988 0.721 -1.186) 6.147 9.360 ( -2.670 -2.055 2.583) 4.246 9.413 ( -5.115 -1.665 2.425) 5.900 9.831 ( 5.504 4.609 0.828) 7.226 10.081 ( -2.954 -0.267 -4.291) 5.217 11.267 ( 19.179 7.280 8.111) 22.060 11.650 ( 13.827 -11.040 -6.929) 19.002 12.381 ( -5.446 6.682 -2.050) 8.860 14.127 ( -6.647 2.827 4.927) 8.744 14.372 ( -9.580 -6.622 1.260) 11.714 ======================= Grid point 277 (92/344) ======================= q-point: ( 0.20 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.168 ( 0.000 23.676 9.567) 25.536 1.267 ( 0.000 25.268 11.654) 27.826 2.124 ( 0.000 40.293 7.919) 41.064 2.349 ( -0.000 3.382 -13.552) 13.968 2.666 ( -0.000 13.438 -5.781) 14.629 2.905 ( 0.000 5.621 10.952) 12.310 3.120 ( 0.000 12.769 6.045) 14.128 3.328 ( -0.000 -0.607 -3.377) 3.431 3.678 ( -0.000 14.085 -2.075) 14.237 4.001 ( -0.000 3.514 -11.458) 11.985 4.289 ( -0.000 4.055 -2.020) 4.530 5.310 ( 0.000 -6.473 2.716) 7.019 7.483 ( 0.000 -0.959 10.580) 10.623 8.907 ( -0.000 -11.189 -5.615) 12.518 8.980 ( -0.000 3.357 -0.589) 3.408 9.351 ( 0.000 3.920 0.863) 4.014 9.436 ( 0.000 3.588 7.678) 8.475 9.922 ( 0.000 -8.969 2.214) 9.238 9.948 ( -0.000 4.150 -8.398) 9.368 11.629 ( 0.000 -21.434 9.197) 23.324 11.748 ( -0.000 1.861 -20.003) 20.089 12.183 ( -0.000 3.023 -2.041) 3.648 14.131 ( 0.000 4.692 6.123) 7.714 14.428 ( 0.000 -3.984 24.122) 24.449 ======================= Grid point 278 (93/344) ======================= q-point: ( 0.27 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( 10.114 21.216 8.166) 24.882 1.608 ( 7.657 23.352 9.083) 26.200 2.373 ( 3.628 7.635 -11.175) 14.012 2.553 ( 6.602 16.987 -10.077) 20.825 2.847 ( 3.889 15.709 8.808) 18.425 3.026 ( 3.861 13.167 9.439) 16.655 3.291 ( 2.978 8.191 1.952) 8.931 3.374 ( 5.401 4.966 -0.871) 7.389 3.847 ( 3.748 13.212 -1.845) 13.857 4.002 ( -0.737 0.264 -3.871) 3.949 4.387 ( 4.107 12.120 -7.566) 14.866 5.221 ( -2.974 -6.867 2.128) 7.780 7.529 ( 2.806 1.853 4.640) 5.730 8.777 ( -2.788 -7.701 -2.196) 8.479 9.057 ( 4.441 4.141 -0.336) 6.081 9.397 ( 0.079 4.033 2.068) 4.533 9.460 ( -2.962 5.410 5.227) 8.085 9.836 ( -0.310 -5.195 -0.765) 5.260 10.010 ( 4.974 -0.152 -5.221) 7.212 11.361 ( -12.179 -15.214 5.448) 20.235 11.558 ( -7.138 -7.925 -6.398) 12.437 12.340 ( 8.858 2.897 -3.729) 10.038 14.237 ( 6.292 0.268 8.740) 10.773 14.418 ( -5.125 7.356 6.705) 11.196 ======================= Grid point 279 (94/344) ======================= q-point: ( 0.33 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 10.156 17.403 6.771) 21.257 2.015 ( 10.130 22.283 4.922) 24.968 2.505 ( 6.879 4.158 -8.903) 11.995 2.701 ( 2.263 7.162 -12.324) 14.432 3.040 ( 1.337 10.824 8.887) 14.069 3.359 ( 9.594 11.429 8.081) 16.970 3.403 ( 5.480 6.749 -1.304) 8.791 3.584 ( 6.278 10.554 -0.366) 12.285 3.977 ( 1.862 2.603 0.216) 3.207 4.077 ( 5.974 12.328 0.412) 13.706 4.624 ( 9.503 13.056 -7.498) 17.805 5.089 ( -4.773 -6.193 1.541) 7.969 7.629 ( 5.035 2.608 1.808) 5.952 8.654 ( -3.991 -4.570 1.153) 6.176 9.201 ( 5.918 5.786 -0.107) 8.277 9.445 ( 1.378 3.922 2.796) 5.010 9.503 ( -0.517 7.251 0.731) 7.306 9.789 ( -2.957 0.430 -0.624) 3.053 10.084 ( 5.886 -2.102 -2.846) 6.868 10.996 ( -14.546 -9.583 3.141) 17.700 11.359 ( -2.488 -14.255 -2.558) 14.695 12.483 ( 3.991 5.909 -2.279) 7.486 14.316 ( -1.312 2.409 5.306) 5.973 14.492 ( 5.290 5.335 1.175) 7.604 ======================= Grid point 280 (95/344) ======================= q-point: ( 0.40 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( 8.177 14.029 4.723) 16.911 2.394 ( 6.808 21.907 1.052) 22.965 2.636 ( 4.819 3.857 -3.738) 7.216 2.768 ( 0.951 6.009 -7.654) 9.778 3.178 ( 2.561 7.139 3.736) 8.455 3.506 ( 3.796 5.274 0.421) 6.512 3.643 ( 5.204 9.034 4.197) 11.239 3.668 ( -0.917 0.566 -1.306) 1.693 4.167 ( 9.785 9.251 -3.697) 13.964 4.355 ( 11.424 12.853 5.099) 17.936 4.897 ( 7.144 8.805 -3.624) 11.903 4.964 ( -0.178 -5.052 0.947) 5.143 7.755 ( 5.934 2.412 2.075) 6.733 8.559 ( -2.962 -2.728 1.677) 4.362 9.352 ( 3.571 6.995 -0.316) 7.860 9.534 ( -4.137 7.982 1.321) 9.087 9.578 ( 5.256 5.135 -1.041) 7.421 9.747 ( -3.125 4.924 0.420) 5.847 10.163 ( 6.369 -2.170 -0.942) 6.795 10.718 ( -7.822 -7.914 2.803) 11.475 11.173 ( -1.069 -15.338 -2.770) 15.623 12.602 ( 1.220 10.020 -1.355) 10.185 14.308 ( -3.565 4.204 0.968) 5.597 14.645 ( 8.337 -0.778 1.552) 8.516 ======================= Grid point 281 (96/344) ======================= q-point: ( 0.47 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( 4.107 12.010 2.555) 12.948 2.671 ( 1.416 15.813 -3.694) 16.300 2.742 ( 2.594 8.371 2.624) 9.148 2.831 ( 0.196 7.410 -3.534) 8.212 3.286 ( 4.185 1.782 0.259) 4.556 3.566 ( -0.028 -2.744 -0.800) 2.859 3.666 ( -1.954 10.689 1.741) 11.005 3.803 ( 0.971 8.857 1.988) 9.129 4.376 ( 7.872 4.076 -4.379) 9.887 4.711 ( 12.389 10.710 2.585) 16.579 4.865 ( -1.083 -2.264 3.052) 3.951 5.150 ( 10.765 1.347 -0.675) 10.869 7.885 ( 5.583 1.874 3.815) 7.017 8.510 ( -0.400 -1.410 -0.435) 1.529 9.430 ( -10.235 8.989 -2.565) 13.862 9.479 ( -1.965 6.954 3.098) 7.862 9.711 ( 3.431 3.303 -1.232) 4.920 9.843 ( 5.651 7.925 -0.611) 9.752 10.259 ( 6.358 -1.213 1.655) 6.681 10.572 ( -1.476 -6.853 1.538) 7.177 11.009 ( 0.454 -14.852 -2.745) 15.110 12.719 ( -1.339 13.722 -0.928) 13.819 14.290 ( -2.193 2.143 0.141) 3.070 14.759 ( 7.417 -4.392 0.809) 8.657 ======================= Grid point 282 (97/344) ======================= q-point: ( 0.53 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -0.946 10.668 0.345) 10.715 2.744 ( -1.758 5.777 0.775) 6.088 2.875 ( -3.797 14.201 -0.425) 14.706 2.938 ( 3.289 8.905 -1.698) 9.643 3.353 ( 3.527 -2.019 -0.708) 4.125 3.537 ( 0.825 -2.104 0.286) 2.278 3.746 ( -4.657 13.995 1.508) 14.826 3.866 ( -4.171 9.478 0.352) 10.361 4.517 ( 5.954 1.883 -1.944) 6.541 4.816 ( -0.316 -0.943 0.339) 1.050 5.024 ( 11.032 3.553 2.081) 11.775 5.304 ( 7.848 -3.391 2.371) 8.872 7.992 ( 3.810 0.638 4.777) 6.143 8.511 ( 1.836 -0.599 -2.820) 3.418 9.292 ( -13.624 10.665 0.523) 17.310 9.547 ( -0.565 6.341 0.488) 6.384 9.776 ( 1.208 2.569 -0.191) 2.845 10.015 ( 5.798 5.499 -3.068) 8.559 10.342 ( 2.488 -1.310 5.222) 5.931 10.539 ( 5.533 -5.990 -1.056) 8.222 10.880 ( 1.211 -12.771 -2.315) 13.036 12.819 ( -4.527 16.332 -0.590) 16.958 14.278 ( -0.121 -0.569 0.537) 0.792 14.820 ( 6.130 -6.895 -0.198) 9.228 ======================= Grid point 283 (98/344) ======================= q-point: ( 0.60 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( -3.519 8.597 -1.299) 9.380 2.759 ( -4.308 7.072 2.908) 8.777 2.922 ( -5.576 11.873 -1.346) 13.186 3.046 ( 0.959 5.359 -1.183) 5.571 3.378 ( 3.231 -2.920 -1.586) 4.635 3.541 ( -0.792 0.022 2.203) 2.341 3.783 ( -7.422 14.750 -0.504) 16.520 3.873 ( -5.920 9.924 0.953) 11.595 4.610 ( 3.774 -0.159 -0.162) 3.780 4.794 ( -0.675 -1.615 -0.462) 1.810 5.195 ( 6.748 -1.092 0.107) 6.837 5.363 ( 4.060 -6.967 4.238) 9.110 8.040 ( 0.854 -1.449 3.692) 4.057 8.536 ( 2.162 -0.567 -3.480) 4.136 9.204 ( -10.239 13.256 1.725) 16.839 9.582 ( -2.181 5.403 0.217) 5.831 9.807 ( -0.044 1.563 0.070) 1.565 10.127 ( 3.279 2.790 -4.299) 6.084 10.336 ( -1.351 -2.776 5.400) 6.220 10.612 ( 9.348 -8.894 -0.726) 12.924 10.790 ( 1.277 -7.383 -1.803) 7.707 12.879 ( -7.842 17.037 -0.245) 18.756 14.277 ( 1.421 -2.205 1.276) 2.917 14.838 ( 5.077 -8.481 -1.221) 9.960 ======================= Grid point 284 (99/344) ======================= q-point: (-0.33 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.694 ( -4.196 7.613 -2.136) 8.951 2.743 ( -6.731 6.553 3.462) 10.012 2.916 ( -6.457 9.362 -2.199) 11.583 3.071 ( -3.591 3.942 0.579) 5.364 3.414 ( 4.390 -2.483 -1.133) 5.169 3.490 ( -4.957 -0.375 0.844) 5.042 3.789 ( -8.300 12.796 -0.115) 15.252 3.870 ( -6.070 10.023 0.755) 11.742 4.633 ( -0.499 -1.271 1.457) 1.997 4.765 ( 0.347 -2.550 -2.403) 3.521 5.218 ( -1.288 -5.745 0.313) 5.896 5.341 ( 2.153 -8.244 4.084) 9.448 8.008 ( -2.110 -3.453 1.598) 4.350 8.549 ( 0.975 -1.234 -2.368) 2.843 9.216 ( -6.010 16.286 2.355) 17.518 9.583 ( -3.578 4.740 0.294) 5.946 9.806 ( -1.348 0.753 0.053) 1.545 10.167 ( 0.682 0.469 -4.875) 4.944 10.274 ( -3.536 -3.595 4.629) 6.844 10.610 ( 3.946 -12.405 -0.829) 13.044 10.813 ( 7.222 -3.551 -0.318) 8.054 12.884 ( -10.337 15.358 0.003) 18.512 14.288 ( 1.638 -1.744 1.929) 3.073 14.824 ( 4.024 -9.242 -2.058) 10.288 ======================= Grid point 285 (100/344) ======================= q-point: (-0.27 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( -10.627 4.213 2.352) 11.671 2.688 ( -4.308 6.703 -2.853) 8.464 2.894 ( -4.953 7.167 -0.863) 8.754 2.988 ( -12.015 5.255 2.069) 13.277 3.385 ( -2.920 -4.408 0.388) 5.301 3.484 ( 5.105 -1.042 -1.560) 5.438 3.737 ( -10.846 10.135 0.751) 14.863 3.851 ( -7.403 7.972 -0.508) 10.891 4.581 ( -3.474 -2.769 2.015) 4.878 4.751 ( 1.648 -1.865 -3.422) 4.231 5.036 ( -10.877 -8.489 1.906) 13.929 5.291 ( 0.204 -8.465 2.340) 8.785 7.916 ( -3.984 -4.098 -0.074) 5.716 8.539 ( 0.423 -1.896 -0.536) 2.015 9.316 ( -3.460 17.895 1.679) 18.304 9.554 ( -5.056 4.419 1.008) 6.791 9.776 ( -2.711 0.338 -0.146) 2.736 10.118 ( -7.142 -2.409 2.869) 8.064 10.174 ( -1.376 -4.120 -4.662) 6.372 10.566 ( 4.047 -8.446 0.384) 9.374 10.920 ( 10.346 -6.194 0.217) 12.060 12.830 ( -11.380 11.808 0.039) 16.399 14.306 ( 0.485 0.631 2.235) 2.372 14.782 ( 2.459 -9.371 -2.457) 9.995 ======================= Grid point 286 (101/344) ======================= q-point: (-0.20 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -14.130 0.653 1.260) 14.201 2.663 ( -6.799 6.681 -3.536) 10.167 2.761 ( -18.175 5.116 3.202) 19.151 2.900 ( -1.929 3.924 -0.473) 4.398 3.289 ( -2.654 -6.505 0.461) 7.041 3.547 ( 0.044 0.849 -0.680) 1.089 3.648 ( -6.625 6.620 0.270) 9.369 3.758 ( -10.101 4.412 -0.781) 11.050 4.461 ( -5.827 -5.665 -0.261) 8.131 4.679 ( -17.145 -7.983 1.815) 18.999 4.804 ( 1.590 1.680 -1.221) 2.616 5.177 ( -4.109 -8.470 1.470) 9.528 7.802 ( -4.525 -2.996 -1.037) 5.525 8.533 ( 1.246 -2.027 1.059) 2.605 9.405 ( -5.682 10.582 -1.651) 12.124 9.526 ( -4.427 8.254 3.130) 9.875 9.724 ( -3.595 0.616 -0.236) 3.655 9.919 ( -11.493 -2.987 5.106) 12.926 10.119 ( 0.984 -4.417 -7.136) 8.450 10.598 ( 6.966 -4.367 2.039) 8.470 11.046 ( 11.939 -7.255 -0.210) 13.972 12.733 ( -10.827 7.696 -0.143) 13.285 14.324 ( -1.549 3.421 2.081) 4.293 14.708 ( 0.059 -8.842 -2.163) 9.103 ======================= Grid point 287 (102/344) ======================= q-point: (-0.13 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( -17.734 -0.683 1.298) 17.794 2.396 ( -23.832 1.913 1.741) 23.972 2.649 ( -4.782 4.785 -3.419) 7.580 2.905 ( -0.716 1.224 -1.874) 2.350 3.139 ( -8.492 -5.675 3.294) 10.732 3.463 ( -8.964 2.989 -0.478) 9.461 3.582 ( -12.013 2.270 -0.051) 12.226 3.689 ( 1.538 0.763 -0.454) 1.775 4.225 ( -19.580 -4.777 -2.368) 20.293 4.297 ( -11.814 -5.386 3.837) 13.539 4.877 ( -1.370 4.048 -2.939) 5.187 5.010 ( -2.773 -6.889 1.917) 7.669 7.701 ( -4.735 -0.878 -1.040) 4.927 8.557 ( 3.482 -1.397 1.554) 4.061 9.331 ( -8.288 2.932 -1.190) 8.871 9.518 ( -6.433 4.214 0.072) 7.691 9.635 ( -6.780 -3.171 1.582) 7.650 9.782 ( -3.789 3.919 3.525) 6.492 10.097 ( 1.613 -1.433 -4.940) 5.391 10.735 ( 11.453 -0.998 2.872) 11.850 11.189 ( 12.476 -5.899 -1.182) 13.850 12.618 ( -8.889 4.002 -0.480) 9.760 14.321 ( -3.847 3.980 1.626) 5.770 14.600 ( -3.131 -6.424 -0.977) 7.213 ======================= Grid point 288 (103/344) ======================= q-point: (-0.07 0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( -21.331 0.112 2.445) 21.471 1.968 ( -26.052 -0.781 1.916) 26.134 2.608 ( -3.184 2.544 -5.334) 6.712 2.841 ( -7.775 -4.064 -7.850) 11.773 2.930 ( -10.340 0.612 6.948) 12.472 3.259 ( -19.597 0.801 5.042) 20.251 3.419 ( -7.067 0.610 -0.627) 7.121 3.587 ( -14.500 0.127 -0.123) 14.501 3.975 ( -1.366 0.141 0.070) 1.375 4.074 ( -12.244 -0.359 0.081) 12.249 4.693 ( -15.088 0.644 -2.625) 15.328 5.077 ( 7.899 -0.428 0.353) 7.918 7.612 ( -5.793 1.333 0.650) 5.979 8.642 ( 7.315 -0.514 0.567) 7.355 9.202 ( -8.129 0.942 0.003) 8.184 9.420 ( -5.639 -0.245 0.925) 5.720 9.497 ( -6.048 -1.736 0.248) 6.297 9.792 ( 1.668 -1.184 -0.030) 2.046 10.114 ( -0.360 2.683 -1.258) 2.985 10.971 ( 16.247 -3.379 0.741) 16.611 11.376 ( 12.974 2.046 -0.367) 13.139 12.507 ( -6.289 0.219 -1.000) 6.372 14.262 ( -5.491 -0.918 2.304) 6.025 14.480 ( -6.938 0.716 0.507) 6.993 ======================= Grid point 293 (104/344) ======================= q-point: ( 0.27 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 0.000 20.789 8.584) 22.491 1.800 ( 0.000 23.048 9.795) 25.043 2.342 ( -0.000 1.376 -10.205) 10.297 2.645 ( -0.000 12.520 -16.844) 20.987 3.040 ( 0.000 20.780 14.561) 25.374 3.090 ( 0.000 8.025 7.060) 10.688 3.304 ( -0.000 0.131 -3.565) 3.567 3.454 ( 0.000 18.026 3.065) 18.285 3.926 ( -0.000 7.577 -2.399) 7.947 4.054 ( -0.000 10.365 -0.486) 10.376 4.469 ( -0.000 14.763 -9.335) 17.467 5.185 ( 0.000 -6.223 2.240) 6.614 7.537 ( 0.000 3.251 2.258) 3.958 8.737 ( -0.000 -4.197 -0.802) 4.273 9.051 ( -0.000 3.724 -0.477) 3.754 9.444 ( 0.000 4.618 1.634) 4.898 9.579 ( 0.000 6.959 8.719) 11.156 9.731 ( 0.000 -10.542 1.904) 10.713 9.958 ( -0.000 1.635 -10.712) 10.836 11.254 ( 0.000 -18.369 8.561) 20.267 11.657 ( -0.000 -4.349 -8.490) 9.539 12.242 ( -0.000 3.802 -2.306) 4.447 14.202 ( 0.000 0.689 6.513) 6.549 14.552 ( 0.000 7.510 4.368) 8.688 ======================= Grid point 294 (105/344) ======================= q-point: ( 0.33 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 7.776 18.129 7.444) 21.084 2.093 ( 5.911 20.971 7.477) 23.035 2.397 ( 6.734 2.141 -7.605) 10.381 2.703 ( 1.037 5.662 -15.131) 16.189 3.181 ( -0.990 11.879 9.160) 15.033 3.284 ( 6.143 2.611 0.276) 6.681 3.386 ( 6.887 9.323 3.939) 12.242 3.625 ( 1.055 9.886 -0.818) 9.976 4.011 ( 0.980 10.695 0.679) 10.761 4.190 ( -0.200 16.443 1.625) 16.525 4.627 ( 3.849 13.180 -8.333) 16.061 5.113 ( -3.107 -3.313 1.730) 4.860 7.602 ( 2.422 4.477 1.022) 5.192 8.682 ( -2.935 -2.247 1.292) 3.916 9.139 ( 5.807 3.903 -0.412) 7.009 9.486 ( -0.638 3.005 3.593) 4.727 9.584 ( -1.515 3.333 0.849) 3.759 9.769 ( 5.461 0.344 5.545) 7.790 9.966 ( 2.470 -0.444 -9.060) 9.401 11.060 ( -5.577 -14.769 6.215) 16.966 11.427 ( -14.164 -4.890 -5.185) 15.855 12.391 ( 9.848 3.607 -2.276) 10.731 14.267 ( 4.644 0.420 4.052) 6.178 14.598 ( -3.865 8.002 1.715) 9.050 ======================= Grid point 295 (106/344) ======================= q-point: ( 0.40 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 7.136 14.929 5.864) 17.556 2.446 ( 10.767 16.712 2.213) 20.003 2.563 ( 7.664 6.528 -3.770) 10.750 2.753 ( 3.573 3.371 -10.342) 11.449 3.257 ( -2.090 5.639 5.856) 8.394 3.453 ( 8.516 5.552 -1.191) 10.235 3.625 ( 7.743 8.467 3.893) 12.116 3.666 ( 0.329 -0.749 -1.306) 1.541 4.166 ( 2.014 12.720 -3.068) 13.239 4.399 ( 3.296 18.721 5.573) 19.809 4.804 ( 6.881 4.441 -3.967) 9.100 5.034 ( -5.343 3.174 0.441) 6.230 7.709 ( 3.947 5.029 1.813) 6.645 8.598 ( -4.118 -2.532 1.992) 5.228 9.312 ( 8.157 5.009 -0.576) 9.590 9.534 ( 2.719 3.722 1.410) 4.820 9.642 ( 1.690 5.354 -0.596) 5.646 9.854 ( -1.447 6.125 1.660) 6.509 10.007 ( 6.565 -3.070 -2.219) 7.579 10.801 ( -10.010 -10.212 3.601) 14.747 11.141 ( -10.044 -7.340 -3.684) 12.974 12.596 ( 8.442 6.213 -1.396) 10.575 14.353 ( 3.209 0.274 1.188) 3.433 14.605 ( -2.718 4.971 1.353) 5.824 ======================= Grid point 296 (107/344) ======================= q-point: ( 0.47 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.522 ( 5.600 11.923 3.599) 13.655 2.682 ( 4.878 2.160 -2.435) 5.865 2.819 ( 7.528 19.203 -0.906) 20.646 2.875 ( 5.702 7.321 -4.784) 10.441 3.272 ( -1.017 1.271 3.705) 4.047 3.542 ( -0.771 -2.368 -0.972) 2.674 3.751 ( 5.516 9.137 0.786) 10.702 3.833 ( 5.886 8.018 1.628) 10.078 4.307 ( 4.091 7.246 -3.956) 9.214 4.672 ( 6.343 14.871 4.360) 16.745 4.874 ( 1.045 -4.303 1.963) 4.844 5.049 ( 1.366 7.317 -1.533) 7.599 7.840 ( 4.381 4.930 4.067) 7.748 8.514 ( -2.485 -2.482 -0.052) 3.512 9.487 ( 5.101 6.262 -0.176) 8.079 9.653 ( 4.896 4.454 -1.693) 6.832 9.704 ( -2.940 6.857 0.184) 7.463 9.869 ( -0.948 5.084 -1.419) 5.363 10.119 ( 7.656 -0.418 2.850) 8.179 10.568 ( -6.434 -7.771 2.339) 10.357 10.914 ( -5.635 -9.406 -3.551) 11.525 12.802 ( 6.024 10.302 -0.743) 11.957 14.368 ( -2.465 1.514 -0.694) 2.975 14.622 ( 2.401 -1.902 1.632) 3.471 ======================= Grid point 297 (108/344) ======================= q-point: ( 0.53 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 2.128 8.017 0.580) 8.315 2.767 ( 3.824 2.870 0.927) 4.870 3.022 ( 0.548 11.107 -2.245) 11.345 3.097 ( 1.609 18.586 -3.227) 18.932 3.275 ( 1.588 -2.475 2.293) 3.729 3.497 ( 0.662 -2.669 0.378) 2.776 3.931 ( 1.138 12.990 1.359) 13.111 3.984 ( 1.409 8.697 -0.115) 8.812 4.441 ( 5.325 4.182 -2.653) 7.272 4.834 ( -1.971 -0.975 1.967) 2.950 4.910 ( 7.191 6.925 2.341) 10.254 5.147 ( 5.616 -1.768 1.174) 6.004 7.966 ( 3.191 3.929 6.398) 8.159 8.470 ( 0.447 -1.887 -3.495) 3.997 9.606 ( -0.497 8.101 -1.257) 8.213 9.637 ( -10.005 8.473 1.684) 13.219 9.766 ( 2.871 2.482 -1.083) 3.947 9.961 ( 5.957 3.138 -2.568) 7.206 10.257 ( 6.430 0.628 4.724) 8.003 10.438 ( -1.135 -6.543 1.098) 6.731 10.746 ( -1.306 -9.919 -3.826) 10.711 13.001 ( 2.448 14.459 -0.394) 14.670 14.315 ( -4.004 0.390 -0.371) 4.040 14.643 ( 4.781 -7.251 0.648) 8.709 ======================= Grid point 298 (109/344) ======================= q-point: ( 0.60 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.765 ( -0.726 4.430 -0.756) 4.552 2.873 ( 1.745 5.340 2.993) 6.365 3.094 ( -3.330 9.031 -1.963) 9.824 3.202 ( -5.354 13.086 -2.931) 14.439 3.286 ( 2.888 -4.001 -0.321) 4.945 3.554 ( 2.759 5.152 1.842) 6.128 4.045 ( -4.275 14.214 1.299) 14.900 4.056 ( -2.890 9.029 -0.480) 9.492 4.549 ( 3.619 2.506 -1.511) 4.655 4.800 ( -1.635 -0.708 1.140) 2.115 5.066 ( 6.438 -0.254 1.077) 6.532 5.203 ( 5.821 -7.816 2.917) 10.173 8.041 ( 0.238 1.556 6.509) 6.697 8.475 ( 2.756 -1.017 -5.345) 6.099 9.532 ( -11.586 12.187 1.567) 16.888 9.675 ( -1.348 5.991 0.364) 6.152 9.816 ( 1.006 1.465 -0.378) 1.817 10.080 ( 4.853 2.075 -3.447) 6.304 10.334 ( 0.379 -2.331 6.017) 6.464 10.396 ( 4.425 -6.755 -0.886) 8.124 10.666 ( 3.109 -7.257 -3.451) 8.617 13.159 ( -3.075 17.332 -0.262) 17.605 14.255 ( -1.600 -1.865 0.808) 2.587 14.643 ( 5.422 -10.291 -0.686) 11.653 ======================= Grid point 299 (110/344) ======================= q-point: (-0.33 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.777 ( -2.170 3.761 -1.093) 4.478 2.924 ( -3.413 5.266 3.989) 7.436 3.095 ( -2.775 4.632 -3.665) 6.526 3.211 ( -6.271 10.327 -0.846) 12.112 3.308 ( 3.897 -2.453 -1.145) 4.745 3.612 ( -4.720 5.969 1.764) 7.811 4.067 ( -5.581 8.964 -0.577) 10.575 4.084 ( -7.970 14.035 1.225) 16.186 4.618 ( 2.202 1.801 0.583) 2.904 4.751 ( -2.446 -2.594 -1.439) 3.845 5.134 ( 4.289 -5.100 0.540) 6.685 5.204 ( 3.787 -10.094 3.714) 11.402 8.031 ( -2.648 -1.180 4.077) 5.002 8.505 ( 2.328 -0.534 -4.200) 4.831 9.503 ( -7.652 14.780 2.812) 16.879 9.694 ( -2.860 5.423 0.361) 6.142 9.831 ( -0.525 0.930 -0.172) 1.082 10.143 ( 1.455 0.675 -3.952) 4.265 10.284 ( -0.965 -5.845 2.449) 6.410 10.410 ( 4.519 -7.742 1.061) 9.027 10.677 ( 4.746 -4.369 -1.884) 6.720 13.222 ( -9.390 16.406 -0.250) 18.904 14.241 ( 1.908 -1.641 1.982) 3.204 14.626 ( 5.681 -11.526 -1.836) 12.980 ======================= Grid point 300 (111/344) ======================= q-point: (-0.27 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.767 ( -2.145 2.555 -1.242) 3.560 2.863 ( -8.735 2.610 2.111) 9.357 3.096 ( -3.879 7.525 -1.969) 8.692 3.191 ( -5.693 6.734 -1.022) 8.877 3.366 ( 5.212 -1.656 0.106) 5.469 3.503 ( -11.746 1.188 1.320) 11.879 4.026 ( -8.825 7.701 0.054) 11.713 4.067 ( -8.834 10.679 0.456) 13.867 4.621 ( -4.085 -2.922 1.049) 5.131 4.705 ( 1.794 0.718 -2.235) 2.955 5.094 ( -3.552 -5.884 0.598) 6.899 5.168 ( 3.645 -10.091 3.154) 11.183 7.956 ( -4.281 -2.398 2.098) 5.336 8.517 ( 0.582 -0.633 -2.279) 2.436 9.564 ( -4.463 15.463 2.112) 16.232 9.693 ( -4.002 6.492 1.558) 7.784 9.817 ( -1.688 0.324 -0.316) 1.748 10.111 ( -1.271 -4.878 -5.594) 7.530 10.215 ( -2.427 -4.843 4.138) 6.817 10.406 ( 3.530 -5.818 -0.662) 6.837 10.725 ( 6.355 -4.511 -0.531) 7.811 13.161 ( -13.092 11.130 -0.187) 17.184 14.293 ( 2.948 1.931 2.467) 4.302 14.604 ( 5.353 -11.091 -2.393) 12.546 ======================= Grid point 301 (112/344) ======================= q-point: (-0.20 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( -11.719 0.401 1.026) 11.771 2.755 ( -1.731 1.638 -1.525) 2.829 3.065 ( -8.766 7.807 -1.120) 11.791 3.127 ( -11.897 6.365 -0.494) 13.501 3.281 ( -7.108 -6.577 1.712) 9.834 3.457 ( 6.151 -0.813 0.004) 6.205 3.914 ( -11.573 4.978 0.382) 12.604 3.977 ( -10.538 4.807 -0.140) 11.584 4.498 ( -4.642 -4.279 -1.000) 6.392 4.757 ( 1.359 2.541 0.184) 2.888 4.910 ( -11.266 -3.939 0.962) 11.973 5.131 ( 0.888 -6.815 1.562) 7.048 7.859 ( -4.693 -1.616 1.385) 5.153 8.510 ( 0.001 -0.609 -0.729) 0.950 9.585 ( -6.019 4.768 -0.385) 7.688 9.723 ( -5.226 11.916 2.254) 13.205 9.786 ( -2.453 1.355 0.263) 2.815 10.021 ( 1.542 -8.018 -5.258) 9.712 10.086 ( -8.878 -2.615 3.837) 10.019 10.439 ( 5.900 -3.219 -0.211) 6.724 10.812 ( 8.738 -3.573 -0.432) 9.450 13.008 ( -13.332 4.993 -0.157) 14.237 14.369 ( 1.084 3.963 1.638) 4.423 14.583 ( 3.929 -7.869 -1.604) 8.941 ======================= Grid point 302 (113/344) ======================= q-point: (-0.13 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( -14.666 -0.206 1.192) 14.715 2.728 ( -4.128 1.269 -1.306) 4.512 2.829 ( -21.055 -1.133 -0.187) 21.087 2.963 ( -6.133 -0.176 -2.586) 6.658 3.203 ( -2.260 -0.267 2.102) 3.098 3.546 ( 3.153 0.254 0.211) 3.171 3.739 ( -9.952 -0.001 0.267) 9.956 3.810 ( -11.365 0.422 0.465) 11.382 4.380 ( -6.486 0.160 -2.170) 6.841 4.594 ( -18.930 -0.761 2.305) 19.085 4.851 ( 3.980 0.765 0.446) 4.078 5.062 ( -4.773 -0.726 -0.079) 4.828 7.777 ( -4.355 0.521 1.488) 4.631 8.511 ( 0.997 -0.323 0.154) 1.060 9.486 ( -7.605 0.449 0.098) 7.619 9.691 ( -6.865 3.651 -1.626) 7.944 9.707 ( -5.417 -4.774 0.264) 7.226 9.894 ( -8.090 -3.610 -0.916) 8.906 10.055 ( 2.796 4.638 2.232) 5.858 10.547 ( 8.657 -0.744 0.205) 8.691 10.959 ( 10.732 -0.061 -0.884) 10.769 12.814 ( -11.492 0.028 -0.303) 11.496 14.385 ( -1.296 -1.492 -0.615) 2.070 14.590 ( 0.705 1.543 0.966) 1.953 ======================= Grid point 303 (114/344) ======================= q-point: (-0.07 0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( -17.417 0.471 2.182) 17.560 2.386 ( -23.858 -3.459 0.067) 24.108 2.670 ( -4.065 -1.738 -0.684) 4.473 2.864 ( -2.689 -2.638 -6.353) 7.386 3.138 ( -8.499 3.404 2.078) 9.388 3.483 ( -7.846 -1.225 2.335) 8.278 3.598 ( -11.998 -1.126 2.220) 12.253 3.685 ( 1.454 -0.919 -0.916) 1.949 4.216 ( -18.521 4.782 -3.371) 19.423 4.296 ( -12.542 4.010 3.408) 13.602 4.907 ( -1.718 -3.416 1.509) 4.110 4.979 ( -2.732 6.784 -2.551) 7.746 7.724 ( -4.392 2.853 2.288) 5.715 8.546 ( 3.383 -0.072 0.077) 3.385 9.346 ( -8.020 -1.092 0.973) 8.152 9.522 ( -6.139 -6.933 0.563) 9.277 9.604 ( -7.642 2.921 -2.602) 8.585 9.751 ( -2.583 -5.586 -1.140) 6.259 10.151 ( 0.751 5.395 2.781) 6.116 10.707 ( 10.477 -1.643 -0.986) 10.651 11.194 ( 13.329 6.444 -0.487) 14.813 12.617 ( -8.879 -3.921 -0.648) 9.728 14.305 ( -3.393 -4.903 -0.593) 5.992 14.621 ( -3.435 7.398 1.942) 8.384 ======================= Grid point 309 (115/344) ======================= q-point: ( 0.33 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 0.000 16.652 7.418) 18.229 2.272 ( 0.000 20.036 7.966) 21.562 2.324 ( -0.000 0.692 -5.825) 5.866 2.707 ( -0.000 3.126 -14.394) 14.730 3.215 ( -0.000 1.867 -3.030) 3.559 3.358 ( 0.000 6.738 2.660) 7.244 3.403 ( 0.000 10.223 9.450) 13.922 3.678 ( -0.000 1.765 -1.608) 2.388 4.155 ( -0.000 17.249 -0.943) 17.275 4.380 ( 0.000 19.290 4.317) 19.767 4.691 ( -0.000 8.200 -6.493) 10.460 5.141 ( 0.000 3.158 0.677) 3.230 7.639 ( 0.000 6.420 0.974) 6.493 8.706 ( 0.000 -0.121 1.052) 1.059 9.107 ( 0.000 1.085 0.354) 1.141 9.505 ( 0.000 -5.051 5.408) 7.400 9.582 ( -0.000 1.444 -2.589) 2.964 9.786 ( 0.000 9.584 8.471) 12.791 9.943 ( -0.000 2.281 -10.304) 10.554 10.985 ( 0.000 -11.528 4.528) 12.386 11.514 ( -0.000 -7.006 -3.731) 7.937 12.311 ( -0.000 3.986 -2.195) 4.550 14.246 ( 0.000 1.970 2.568) 3.237 14.714 ( 0.000 6.983 1.301) 7.104 ======================= Grid point 310 (116/344) ======================= q-point: ( 0.40 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( 7.009 13.143 4.884) 15.675 2.388 ( 6.543 3.888 -1.822) 7.826 2.533 ( 6.547 15.873 4.417) 17.729 2.709 ( 1.160 1.743 -10.403) 10.611 3.279 ( 5.425 -0.032 -4.087) 6.793 3.418 ( 0.489 8.612 5.018) 9.979 3.577 ( 6.586 6.062 3.474) 9.601 3.662 ( -1.051 -1.604 0.118) 1.921 4.300 ( -1.311 13.969 -3.942) 14.573 4.594 ( -0.123 20.983 5.779) 21.765 4.748 ( 2.214 1.261 -2.330) 3.452 5.176 ( -3.291 9.220 -0.783) 9.821 7.728 ( 1.711 7.553 1.963) 7.989 8.658 ( -4.632 -1.575 0.997) 4.993 9.187 ( 8.500 0.068 0.252) 8.504 9.492 ( 3.875 -3.106 2.691) 5.648 9.633 ( 1.860 4.161 -1.266) 4.730 9.921 ( 3.041 5.832 1.707) 6.795 9.951 ( -1.107 6.448 -2.435) 6.981 10.846 ( -5.349 -8.707 2.560) 10.534 11.297 ( -13.178 -6.332 -2.954) 14.916 12.460 ( 10.937 3.933 -1.660) 11.741 14.298 ( 2.676 1.563 1.082) 3.283 14.742 ( -4.242 5.717 1.052) 7.196 ======================= Grid point 311 (117/344) ======================= q-point: ( 0.47 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( 5.765 11.542 4.487) 13.660 2.579 ( 9.655 3.341 -1.673) 10.352 2.757 ( 7.971 1.173 -6.958) 10.646 2.835 ( 8.615 13.714 1.355) 16.252 3.324 ( -0.405 1.790 0.911) 2.049 3.537 ( 0.134 -0.164 -0.731) 0.761 3.677 ( 8.589 4.452 1.443) 9.782 3.775 ( 8.086 5.127 2.105) 9.803 4.378 ( -2.005 10.151 -4.009) 11.096 4.784 ( 3.037 -2.110 0.288) 3.709 4.801 ( -0.017 16.850 4.820) 17.526 5.198 ( -5.487 10.011 -0.827) 11.446 7.851 ( 2.729 7.696 3.951) 9.071 8.548 ( -4.677 -3.091 -0.402) 5.621 9.377 ( 11.723 1.068 -0.449) 11.780 9.583 ( 7.252 0.171 0.971) 7.318 9.709 ( 2.830 2.978 -0.944) 4.215 9.938 ( -1.580 2.764 -5.482) 6.339 10.085 ( 2.527 9.687 6.392) 11.878 10.644 ( -9.117 -6.475 1.386) 11.268 10.998 ( -12.392 -5.876 -3.055) 14.050 12.715 ( 12.571 5.933 -0.893) 13.929 14.353 ( 2.342 -0.207 -0.459) 2.395 14.694 ( -6.602 3.232 1.423) 7.487 ======================= Grid point 312 (118/344) ======================= q-point: ( 0.53 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( 4.347 1.228 -0.767) 4.582 2.749 ( 3.605 9.309 2.239) 10.230 2.990 ( 13.096 5.705 -2.293) 14.468 3.098 ( 8.262 6.570 -2.179) 10.779 3.332 ( -2.482 5.531 1.131) 6.167 3.480 ( -1.511 -2.184 0.671) 2.739 3.932 ( 8.928 6.900 0.924) 11.321 3.984 ( 9.548 6.767 0.291) 11.707 4.433 ( 0.021 6.740 -2.469) 7.178 4.808 ( 2.790 -3.350 2.370) 4.962 4.949 ( -0.214 10.935 1.727) 11.072 5.175 ( -6.062 5.327 0.425) 8.081 7.986 ( 2.623 7.011 6.660) 10.020 8.449 ( -2.183 -3.258 -3.693) 5.387 9.580 ( 8.925 2.643 -0.038) 9.308 9.726 ( 5.965 2.740 -0.834) 6.617 9.787 ( 5.572 0.199 -1.091) 5.682 9.908 ( -4.924 3.862 -1.882) 6.535 10.235 ( 2.708 8.016 4.963) 9.809 10.439 ( -6.661 -5.839 1.230) 8.942 10.749 ( -8.677 -5.768 -3.863) 11.113 12.999 ( 11.347 9.266 -0.346) 14.654 14.362 ( -0.322 -1.287 -1.739) 2.187 14.595 ( -5.815 -1.462 2.022) 6.328 ======================= Grid point 313 (119/344) ======================= q-point: ( 0.60 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.789 ( 3.062 2.593 0.643) 4.063 2.881 ( 2.364 6.104 0.302) 6.553 3.193 ( 1.986 -0.278 -0.351) 2.036 3.204 ( 2.579 3.000 -1.036) 4.090 3.336 ( -0.442 3.329 -1.847) 3.833 3.563 ( 5.307 10.178 1.380) 11.561 4.106 ( 4.806 4.811 0.692) 6.835 4.193 ( 2.968 10.895 -0.933) 11.330 4.520 ( 3.836 4.248 -0.806) 5.780 4.823 ( 0.996 -1.294 2.063) 2.631 5.017 ( -0.202 2.869 0.818) 2.990 5.101 ( -3.506 -2.724 1.344) 4.639 8.091 ( -0.210 4.774 8.625) 9.860 8.402 ( 1.837 -2.375 -6.944) 7.565 9.723 ( 3.277 3.902 0.990) 5.190 9.790 ( -0.110 2.079 -0.948) 2.287 9.837 ( -7.846 8.257 0.616) 11.407 9.936 ( 10.458 -2.461 -3.155) 11.198 10.309 ( -0.514 -3.891 6.434) 7.537 10.354 ( -0.247 2.377 0.458) 2.433 10.575 ( -2.813 -5.291 -5.245) 7.964 13.279 ( 7.645 12.840 -0.065) 14.944 14.305 ( -4.379 -0.841 -1.276) 4.638 14.490 ( -0.819 -7.917 1.265) 8.060 ======================= Grid point 314 (120/344) ======================= q-point: ( 0.67 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.852 ( -1.062 4.704 -0.039) 4.823 2.962 ( 2.948 2.162 1.360) 3.901 3.162 ( -4.920 -0.438 -3.191) 5.880 3.209 ( 3.163 -2.895 1.551) 4.559 3.403 ( -1.480 8.019 -1.121) 8.231 3.737 ( 0.728 9.368 0.562) 9.413 4.188 ( -0.540 4.230 -0.682) 4.319 4.313 ( -1.864 11.409 0.986) 11.603 4.619 ( 2.335 5.084 -1.103) 5.702 4.803 ( -4.725 0.782 0.452) 4.811 4.996 ( 2.362 -9.512 2.915) 10.225 5.056 ( 2.909 -4.938 0.242) 5.736 8.096 ( -3.756 0.655 5.577) 6.756 8.435 ( 4.145 -0.125 -5.098) 6.572 9.758 ( -5.796 7.345 3.158) 9.875 9.778 ( -1.631 3.856 -0.243) 4.194 9.845 ( -0.102 3.369 -0.899) 3.488 10.059 ( 7.087 -2.716 -2.296) 7.929 10.269 ( -4.688 -2.706 -1.837) 5.716 10.327 ( 1.454 -3.210 5.341) 6.399 10.553 ( 4.044 -2.622 -3.251) 5.813 13.486 ( -1.073 14.465 -0.166) 14.506 14.221 ( -2.097 -1.580 1.065) 2.833 14.421 ( 3.431 -10.747 -0.953) 11.322 ======================= Grid point 315 (121/344) ======================= q-point: (-0.27 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.838 ( -3.679 2.269 -0.542) 4.357 3.023 ( -5.585 3.006 3.064) 7.044 3.079 ( 3.475 -2.178 -3.538) 5.416 3.261 ( 4.587 -1.073 0.828) 4.783 3.400 ( -6.729 5.809 -0.991) 8.944 3.734 ( -9.054 3.881 0.515) 9.864 4.179 ( -4.193 2.800 -0.829) 5.109 4.336 ( -7.698 8.501 1.527) 11.570 4.674 ( -6.419 -3.478 -2.059) 7.585 4.717 ( 0.808 7.453 0.514) 7.514 4.969 ( 6.115 -10.771 2.236) 12.586 5.067 ( 2.186 -3.761 0.728) 4.411 8.024 ( -4.721 -1.184 2.673) 5.553 8.489 ( 2.212 0.556 -2.469) 3.361 9.751 ( -3.844 5.068 0.908) 6.425 9.801 ( -0.020 4.444 1.765) 4.782 9.859 ( -1.912 4.289 -0.378) 4.711 10.103 ( -3.654 -8.654 -2.551) 9.734 10.134 ( 1.647 -0.401 0.047) 1.696 10.357 ( 1.657 -1.031 1.840) 2.682 10.595 ( 4.298 -2.225 -1.530) 5.076 13.484 ( -11.993 8.131 -0.224) 14.492 14.258 ( 4.817 3.183 2.463) 6.278 14.387 ( 5.280 -10.417 -2.292) 11.902 ======================= Grid point 316 (122/344) ======================= q-point: (-0.20 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.793 ( -2.539 0.384 -0.464) 2.609 2.884 ( -9.301 -0.729 -0.298) 9.335 3.163 ( 3.710 1.220 0.948) 4.019 3.277 ( -8.738 -0.837 -2.213) 9.053 3.349 ( 4.255 0.673 0.810) 4.383 3.523 ( -16.055 -0.472 0.781) 16.081 4.096 ( -7.297 0.491 0.051) 7.313 4.208 ( -11.446 -1.032 -0.156) 11.494 4.552 ( -4.776 0.612 -0.834) 4.887 4.765 ( 0.070 0.405 1.199) 1.267 5.015 ( 0.913 -0.263 -1.198) 1.529 5.041 ( 0.725 -1.110 2.431) 2.769 7.936 ( -4.706 -0.530 2.122) 5.190 8.509 ( 0.133 0.684 -1.185) 1.375 9.704 ( -4.718 -0.027 0.189) 4.722 9.817 ( -0.966 -0.143 -0.493) 1.094 9.892 ( -1.096 -12.216 -3.934) 12.881 9.948 ( -4.061 13.008 2.924) 13.938 10.159 ( -0.636 -1.067 2.241) 2.562 10.366 ( 1.096 0.106 -0.283) 1.137 10.666 ( 5.875 0.037 -1.219) 6.000 13.281 ( -14.689 0.092 -0.047) 14.689 14.357 ( 2.529 -3.525 -1.640) 4.639 14.440 ( 7.463 3.464 1.624) 8.386 ======================= Grid point 317 (123/344) ======================= q-point: (-0.13 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.691 ( -11.150 -1.255 0.083) 11.221 2.764 ( -1.652 -0.297 -0.083) 1.680 3.062 ( -8.950 -6.750 -1.302) 11.285 3.132 ( -15.478 -8.723 -0.010) 17.767 3.261 ( -3.140 6.595 -1.142) 7.393 3.471 ( 5.010 1.687 1.779) 5.578 3.913 ( -11.762 -5.522 0.293) 12.997 3.981 ( -9.807 -4.006 0.354) 10.599 4.493 ( -4.907 3.564 -1.736) 6.308 4.774 ( 1.493 -1.073 2.607) 3.190 4.899 ( -11.210 2.755 -0.632) 11.561 5.124 ( 0.812 5.826 0.498) 5.903 7.868 ( -4.197 1.552 2.613) 5.182 8.511 ( -0.402 0.951 -0.654) 1.222 9.593 ( -5.594 -4.121 0.855) 7.000 9.680 ( -4.093 -14.105 -3.719) 15.150 9.783 ( -2.848 0.103 -0.410) 2.879 10.018 ( -6.300 4.521 -3.180) 8.382 10.126 ( -1.629 5.919 7.032) 9.335 10.438 ( 5.243 3.042 -0.339) 6.071 10.804 ( 8.749 3.375 -1.623) 9.517 13.008 ( -13.400 -4.978 -0.178) 14.296 14.342 ( 1.360 -4.707 -2.124) 5.340 14.611 ( 3.757 8.685 2.277) 9.733 ======================= Grid point 318 (124/344) ======================= q-point: (-0.07 0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -13.567 -1.582 1.122) 13.705 2.706 ( -6.373 -4.678 2.827) 8.396 2.718 ( -17.555 -6.504 -3.283) 19.007 2.876 ( -3.947 -3.632 -3.132) 6.211 3.287 ( -3.209 5.725 -0.156) 6.565 3.562 ( 1.164 0.288 1.228) 1.716 3.650 ( -7.000 -7.112 0.541) 9.994 3.776 ( -9.666 -4.053 1.827) 10.639 4.435 ( -6.102 4.730 -3.804) 8.606 4.681 ( -18.103 7.840 1.675) 19.799 4.828 ( 3.284 -1.235 2.356) 4.226 5.161 ( -4.713 8.149 -0.957) 9.463 7.834 ( -3.697 3.778 3.430) 6.301 8.519 ( 0.502 1.140 -0.894) 1.533 9.431 ( -3.488 -12.722 2.116) 13.360 9.482 ( -5.259 -6.496 -3.167) 8.938 9.723 ( -3.848 0.104 -0.419) 3.872 9.865 ( -11.277 2.271 -2.889) 11.861 10.207 ( 0.336 5.494 5.710) 7.931 10.573 ( 5.900 3.276 -1.405) 6.893 11.038 ( 12.388 7.376 -1.420) 14.487 12.730 ( -10.896 -7.815 -0.584) 13.422 14.299 ( -1.248 -3.383 -1.406) 3.870 14.739 ( -0.035 8.968 2.134) 9.218 ======================= Grid point 325 (125/344) ======================= q-point: ( 0.40 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( -0.000 1.823 -3.924) 4.327 2.418 ( 0.000 10.945 7.583) 13.316 2.621 ( -0.000 7.010 -5.795) 9.095 2.729 ( 0.000 9.560 2.003) 9.767 3.205 ( -0.000 0.076 -5.329) 5.330 3.520 ( 0.000 7.028 2.605) 7.495 3.555 ( 0.000 2.303 2.222) 3.200 3.656 ( 0.000 -1.978 2.048) 2.847 4.433 ( -0.000 11.496 -4.291) 12.271 4.734 ( -0.000 -0.081 -0.675) 0.680 4.818 ( 0.000 19.952 5.111) 20.596 5.309 ( -0.000 11.258 -1.071) 11.309 7.803 ( 0.000 8.911 2.517) 9.260 8.701 ( -0.000 -0.974 -0.781) 1.249 9.063 ( 0.000 -5.947 1.891) 6.241 9.429 ( 0.000 -1.104 1.256) 1.672 9.663 ( -0.000 4.488 -0.428) 4.509 9.936 ( -0.000 3.938 -6.482) 7.585 10.063 ( 0.000 11.299 6.281) 12.927 10.824 ( 0.000 -6.027 0.796) 6.079 11.349 ( -0.000 -8.138 -1.919) 8.361 12.379 ( -0.000 3.570 -1.762) 3.981 14.303 ( 0.000 2.861 0.598) 2.923 14.836 ( 0.000 4.700 0.939) 4.793 ======================= Grid point 326 (126/344) ======================= q-point: ( 0.47 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 11.071 1.638 -2.043) 11.376 2.587 ( 4.692 9.408 5.292) 11.770 2.647 ( 3.082 -0.146 -6.987) 7.638 2.876 ( 1.517 11.994 3.471) 12.578 3.273 ( 7.102 1.705 -2.871) 7.848 3.542 ( -0.709 0.935 0.231) 1.196 3.618 ( 1.842 0.863 1.282) 2.404 3.690 ( 5.969 2.053 2.505) 6.791 4.509 ( -1.952 9.007 -3.712) 9.935 4.737 ( 0.749 -0.885 1.252) 1.706 4.999 ( -1.420 16.318 2.966) 16.646 5.384 ( -3.812 10.170 -0.529) 10.874 7.911 ( 1.214 8.912 3.562) 9.674 8.611 ( -6.158 -3.042 -1.417) 7.014 9.129 ( 12.450 -5.335 0.734) 13.565 9.473 ( 4.514 0.673 0.488) 4.590 9.714 ( 1.123 3.790 -0.257) 3.961 9.964 ( 0.179 3.703 -5.318) 6.483 10.193 ( 0.095 11.222 6.410) 12.924 10.727 ( -5.579 -3.766 -0.401) 6.743 11.149 ( -11.331 -7.325 -1.823) 13.615 12.528 ( 12.124 3.340 -1.179) 12.631 14.336 ( 0.463 1.961 -0.135) 2.020 14.837 ( -4.759 3.352 1.073) 5.919 ======================= Grid point 327 (127/344) ======================= q-point: ( 0.53 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( 7.666 1.798 0.635) 7.900 2.724 ( 12.430 1.787 -4.397) 13.305 2.796 ( 7.019 6.586 4.276) 10.532 3.016 ( 5.034 4.250 -2.196) 6.945 3.398 ( 1.759 5.075 -0.007) 5.371 3.498 ( -2.148 -1.500 0.614) 2.691 3.777 ( 13.824 2.974 0.911) 14.169 3.851 ( 8.846 2.281 0.600) 9.155 4.537 ( -2.982 7.228 -2.973) 8.365 4.745 ( 1.309 -1.883 2.500) 3.393 5.103 ( -3.156 11.213 1.019) 11.694 5.371 ( -7.637 6.965 0.157) 10.337 8.036 ( 2.180 8.094 5.147) 9.837 8.469 ( -5.143 -3.830 -3.012) 7.085 9.340 ( 16.162 -3.676 -0.497) 16.582 9.584 ( 7.213 0.500 -0.113) 7.232 9.769 ( 1.258 2.803 -0.152) 3.076 9.990 ( -0.494 3.711 -2.512) 4.509 10.312 ( 0.311 9.145 4.990) 10.422 10.556 ( -10.207 -2.321 -0.484) 10.479 10.871 ( -11.510 -5.675 -2.381) 13.052 12.816 ( 16.197 4.334 -0.533) 16.776 14.346 ( -0.389 -0.062 -0.974) 1.050 14.747 ( -8.657 1.497 1.403) 8.897 ======================= Grid point 328 (128/344) ======================= q-point: ( 0.60 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.726 ( 5.169 0.725 0.343) 5.230 2.910 ( 2.852 6.088 0.913) 6.785 3.073 ( 14.599 2.273 1.859) 14.891 3.111 ( 6.166 -1.014 -2.972) 6.920 3.369 ( -4.001 -1.384 -1.701) 4.563 3.567 ( 4.913 7.518 1.100) 9.048 4.024 ( 8.334 2.451 0.442) 8.698 4.091 ( 16.080 3.434 -0.132) 16.443 4.550 ( -1.888 5.678 -1.856) 6.265 4.755 ( 2.161 -3.256 2.699) 4.749 5.118 ( -4.823 5.618 -0.144) 7.405 5.259 ( -10.867 2.744 0.372) 11.214 8.164 ( 1.632 7.047 7.894) 10.706 8.350 ( -2.267 -4.357 -6.532) 8.173 9.586 ( 14.377 -1.409 -0.539) 14.456 9.721 ( 8.642 -0.699 -1.208) 8.754 9.807 ( 0.356 1.763 -0.078) 1.801 10.010 ( -1.884 5.102 0.003) 5.439 10.341 ( -8.778 -4.135 1.795) 9.868 10.411 ( -0.220 6.504 2.450) 6.954 10.640 ( -9.248 -3.543 -3.358) 10.457 13.154 ( 16.438 5.833 -0.076) 17.442 14.320 ( -1.144 -1.634 -1.762) 2.661 14.580 ( -11.028 -0.979 1.809) 11.219 ======================= Grid point 329 (129/344) ======================= q-point: ( 0.67 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.836 ( 6.147 1.286 0.771) 6.327 2.975 ( -1.398 3.175 -0.154) 3.473 3.128 ( 3.084 -2.956 0.484) 4.300 3.240 ( -3.775 0.228 -1.167) 3.958 3.387 ( 8.571 2.144 -0.063) 8.835 3.749 ( 6.536 5.553 -0.068) 8.576 4.168 ( 5.416 1.320 0.444) 5.593 4.353 ( 8.448 4.768 -1.193) 9.774 4.603 ( 2.909 4.482 -0.229) 5.348 4.773 ( 4.273 -4.789 1.930) 6.703 5.052 ( -8.637 1.116 1.150) 8.784 5.064 ( -9.369 -1.376 -1.508) 9.589 8.191 ( -5.025 0.095 3.791) 6.296 8.343 ( 5.339 0.781 -3.374) 6.364 9.766 ( 5.866 0.362 0.404) 5.891 9.817 ( -0.564 1.143 -0.042) 1.276 9.860 ( 8.849 -1.513 -1.567) 9.113 10.023 ( -5.431 7.793 -0.590) 9.517 10.202 ( 1.419 -7.019 2.768) 7.677 10.434 ( -9.041 1.543 1.641) 9.317 10.490 ( 1.062 -0.396 -2.905) 3.119 13.480 ( 13.342 6.061 0.126) 14.655 14.275 ( -2.028 -0.833 -2.431) 3.273 14.371 ( -9.494 -3.970 2.305) 10.546 ======================= Grid point 330 (130/344) ======================= q-point: (-0.27 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -4.313 -0.622 0.353) 4.372 2.958 ( 6.188 0.303 -0.469) 6.214 3.152 ( -5.259 0.836 0.414) 5.341 3.177 ( 3.759 -0.368 -0.292) 3.788 3.489 ( 0.514 0.250 -0.001) 0.572 3.841 ( -0.235 -0.073 -0.014) 0.247 4.226 ( 0.467 0.157 -0.001) 0.493 4.454 ( -0.536 -0.050 -0.013) 0.539 4.732 ( 7.272 3.152 0.340) 7.933 4.796 ( 0.100 -2.562 -0.124) 2.567 4.829 ( -10.094 -1.946 -0.253) 10.283 5.001 ( 0.691 0.267 0.059) 0.743 8.095 ( -4.465 -1.995 -0.009) 4.891 8.442 ( 3.966 1.821 0.016) 4.364 9.800 ( -0.505 -0.692 -0.847) 1.204 9.819 ( -0.338 -0.111 0.933) 0.998 9.952 ( -4.595 -1.493 -0.132) 4.833 9.990 ( 5.814 2.450 0.046) 6.310 10.248 ( -1.157 0.326 0.023) 1.203 10.280 ( -1.496 -1.564 -0.036) 2.165 10.532 ( 2.438 1.111 0.007) 2.680 13.659 ( 0.161 0.060 0.000) 0.171 14.204 ( -1.301 -0.615 -0.002) 1.440 14.285 ( 1.190 0.571 0.002) 1.320 ======================= Grid point 331 (131/344) ======================= q-point: (-0.20 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.844 ( -3.641 -1.857 0.350) 4.102 2.977 ( -2.998 -3.371 -2.920) 5.374 3.136 ( 0.724 3.436 4.106) 5.403 3.242 ( 3.944 -0.464 -1.979) 4.437 3.412 ( -5.850 -4.404 0.663) 7.352 3.730 ( -9.267 -4.455 -0.137) 10.283 4.189 ( -4.015 -1.942 0.575) 4.497 4.318 ( -8.100 -9.517 -1.153) 12.551 4.667 ( -5.904 0.428 -2.063) 6.269 4.742 ( 0.315 -4.333 3.198) 5.394 4.952 ( 6.917 9.745 -0.235) 11.953 5.059 ( 1.826 2.926 -0.461) 3.480 8.009 ( -3.721 -0.884 0.433) 3.849 8.506 ( 1.533 1.542 0.070) 2.175 9.732 ( -3.236 -7.704 -1.388) 8.471 9.787 ( -1.502 -4.330 -0.421) 4.602 9.862 ( -2.393 -2.867 -0.107) 3.736 10.109 ( 1.964 7.259 -1.010) 7.588 10.170 ( -3.646 3.545 4.599) 6.857 10.332 ( 3.241 -0.952 -1.846) 3.850 10.604 ( 3.473 3.278 -0.291) 4.784 13.486 ( -12.024 -7.970 0.139) 14.426 14.230 ( 4.110 -3.095 -1.661) 5.407 14.413 ( 6.016 10.208 1.509) 11.945 ======================= Grid point 332 (132/344) ======================= q-point: (-0.13 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.774 ( -2.431 -2.177 -0.119) 3.265 2.844 ( -7.266 -3.128 -0.411) 7.921 3.115 ( -5.941 -7.839 0.497) 9.849 3.200 ( -4.432 -6.031 0.749) 7.522 3.350 ( 1.038 1.361 -2.848) 3.323 3.507 ( -8.284 -0.867 1.955) 8.555 4.026 ( -10.044 -9.770 0.231) 14.014 4.064 ( -7.191 -8.426 -0.128) 11.078 4.593 ( -3.421 1.161 -2.588) 4.444 4.747 ( 1.138 0.703 3.513) 3.759 5.079 ( -4.122 5.938 -1.741) 7.435 5.153 ( 4.393 8.694 1.108) 9.803 7.955 ( -3.091 1.491 1.769) 3.861 8.531 ( -0.230 1.626 -0.312) 1.671 9.535 ( -3.954 -16.431 -1.835) 16.999 9.678 ( -4.563 -4.880 -0.669) 6.714 9.819 ( -1.702 -0.439 0.052) 1.758 10.153 ( -4.168 4.833 -3.222) 7.150 10.201 ( 0.431 3.133 5.986) 6.770 10.410 ( 4.086 6.372 -0.130) 7.571 10.718 ( 5.571 4.869 -1.432) 7.536 13.162 ( -13.235 -11.178 -0.039) 17.324 14.264 ( 2.849 -1.598 -1.675) 3.671 14.632 ( 5.602 10.849 1.677) 12.325 ======================= Grid point 333 (133/344) ======================= q-point: (-0.07 0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( -9.887 -5.365 -0.589) 11.265 2.722 ( -3.090 -5.224 2.165) 6.444 2.887 ( -8.655 -8.788 -1.139) 12.387 2.962 ( -11.174 -4.263 -1.855) 12.103 3.371 ( -0.729 5.067 -1.608) 5.366 3.517 ( 3.370 1.473 2.536) 4.467 3.733 ( -10.637 -10.538 0.319) 14.977 3.859 ( -6.891 -8.547 0.672) 10.999 4.548 ( -3.740 3.052 -2.634) 5.499 4.795 ( 1.784 1.492 2.720) 3.579 5.016 ( -10.713 8.350 -0.812) 13.607 5.281 ( 0.171 7.941 0.778) 7.980 7.938 ( -2.719 3.898 3.050) 5.647 8.537 ( -0.729 1.789 -1.022) 2.186 9.296 ( -2.548 -17.826 -1.086) 18.040 9.546 ( -5.360 -3.742 -0.305) 6.544 9.777 ( -2.695 -0.445 0.024) 2.732 10.064 ( -8.519 2.773 -4.096) 9.851 10.259 ( 0.751 2.995 6.756) 7.428 10.555 ( 2.669 8.238 -1.129) 8.733 10.908 ( 10.337 6.629 -1.610) 12.385 12.827 ( -11.568 -11.958 -0.477) 16.644 14.282 ( 0.545 -0.303 -1.156) 1.314 14.810 ( 2.624 9.190 1.552) 9.683 ======================= Grid point 341 (134/344) ======================= q-point: ( 0.47 0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( -0.000 0.574 -1.793) 1.883 2.603 ( -0.000 -0.710 -5.670) 5.714 2.637 ( 0.000 7.233 5.056) 8.825 3.016 ( 0.000 12.386 4.515) 13.183 3.185 ( -0.000 0.184 -3.742) 3.746 3.550 ( -0.000 -1.470 -0.859) 1.703 3.621 ( 0.000 -3.228 1.798) 3.695 3.645 ( 0.000 4.504 1.077) 4.631 4.596 ( -0.000 6.450 -2.561) 6.940 4.733 ( 0.000 0.116 1.525) 1.529 5.166 ( 0.000 12.872 1.223) 12.930 5.513 ( -0.000 8.497 -0.156) 8.498 7.995 ( 0.000 8.313 3.245) 8.924 8.656 ( -0.000 -2.383 -2.957) 3.798 8.932 ( 0.000 -6.750 1.708) 6.962 9.448 ( 0.000 1.631 0.190) 1.642 9.738 ( -0.000 3.016 -0.127) 3.019 9.990 ( -0.000 3.667 -3.814) 5.291 10.314 ( 0.000 9.845 5.682) 11.367 10.751 ( -0.000 -0.801 -1.625) 1.812 11.173 ( -0.000 -8.739 -0.998) 8.796 12.434 ( -0.000 2.561 -1.122) 2.796 14.359 ( -0.000 2.487 -0.287) 2.503 14.912 ( 0.000 2.482 1.044) 2.693 ======================= Grid point 342 (135/344) ======================= q-point: ( 0.53 0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 13.217 0.986 -0.187) 13.255 2.605 ( 2.047 -0.579 -2.635) 3.386 2.758 ( 5.631 4.639 2.832) 7.826 3.044 ( -3.537 4.245 -0.768) 5.579 3.350 ( 10.665 6.161 0.584) 12.330 3.518 ( -1.504 -1.524 0.345) 2.169 3.608 ( 3.974 -3.208 -0.480) 5.130 3.741 ( 5.985 2.222 0.406) 6.397 4.633 ( -1.346 4.667 -1.957) 5.237 4.734 ( -0.419 -0.270 2.063) 2.123 5.255 ( -2.311 8.476 -0.138) 8.787 5.545 ( -4.568 5.539 -0.090) 7.180 8.088 ( 1.334 6.425 2.903) 7.175 8.537 ( -7.062 -2.889 -2.097) 7.913 9.026 ( 13.948 -4.281 0.010) 14.590 9.498 ( 3.838 1.188 0.009) 4.018 9.773 ( 1.009 2.019 -0.054) 2.258 10.018 ( 0.146 2.910 -1.836) 3.444 10.404 ( -0.370 6.259 3.901) 7.385 10.704 ( -6.073 2.728 -1.467) 6.817 10.989 ( -9.496 -8.032 -0.893) 12.469 12.578 ( 12.973 1.984 -0.617) 13.138 14.369 ( -1.172 1.388 -0.685) 1.942 14.889 ( -5.167 1.371 1.155) 5.469 ======================= Grid point 343 (136/344) ======================= q-point: ( 0.60 0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 3.896 0.224 0.683) 3.962 2.730 ( 19.775 0.921 0.203) 19.797 2.918 ( 7.633 2.448 1.536) 8.162 3.035 ( 0.204 0.530 -1.743) 1.833 3.425 ( -3.537 -0.396 -1.550) 3.881 3.558 ( 2.610 3.712 1.100) 4.669 3.785 ( 18.758 -1.128 -0.313) 18.795 3.889 ( 8.826 1.078 0.114) 8.892 4.639 ( -2.279 4.115 -2.141) 5.169 4.721 ( -0.382 -2.116 2.803) 3.533 5.254 ( -4.692 3.909 -0.810) 6.161 5.464 ( -9.023 2.160 -0.519) 9.293 8.181 ( 3.117 3.150 0.754) 4.495 8.391 ( -6.447 -1.645 -0.197) 6.657 9.273 ( 17.501 -1.879 -0.869) 17.623 9.595 ( 6.267 0.399 -0.212) 6.283 9.807 ( 1.112 0.940 0.015) 1.456 10.044 ( 0.376 1.884 0.021) 1.921 10.432 ( -1.907 0.716 0.923) 2.237 10.579 ( -11.987 4.289 0.451) 12.739 10.755 ( -8.258 -4.418 -0.938) 9.413 12.876 ( 18.387 1.664 -0.139) 18.463 14.343 ( -2.377 0.163 -1.090) 2.620 14.769 ( -9.708 0.192 1.254) 9.790 ======================= Grid point 344 (137/344) ======================= q-point: (-0.33 -0.53 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( 5.561 -0.054 0.894) 5.633 2.992 ( 4.592 0.034 1.992) 5.005 3.046 ( 3.808 -0.957 -3.353) 5.163 3.132 ( 15.021 1.104 2.753) 15.311 3.348 ( -4.194 0.383 -1.314) 4.411 3.651 ( 6.471 -0.333 -0.667) 6.514 4.047 ( 8.925 -0.046 0.376) 8.933 4.121 ( 18.152 -0.074 -0.688) 18.165 4.636 ( -1.612 2.713 -0.499) 3.195 4.697 ( 0.653 -2.959 1.369) 3.325 5.172 ( -6.483 0.066 -0.930) 6.550 5.282 ( -12.368 -0.358 -1.222) 12.434 8.212 ( 0.300 -5.334 -8.580) 10.107 8.329 ( -1.300 4.836 8.381) 9.763 9.564 ( 16.093 0.232 -0.840) 16.116 9.715 ( 7.165 0.213 -0.631) 7.196 9.826 ( 0.388 0.013 0.122) 0.407 10.073 ( 1.778 0.185 0.941) 2.020 10.292 ( -12.362 -0.612 0.433) 12.385 10.477 ( -1.637 -1.624 -2.165) 3.163 10.608 ( -8.141 1.923 2.016) 8.605 13.215 ( 18.762 0.029 0.130) 18.763 14.299 ( -2.177 0.529 -1.229) 2.556 14.571 ( -12.754 -0.537 1.176) 12.820 ======================= Grid point 345 (138/344) ======================= q-point: (-0.27 -0.53 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.830 ( 5.461 -1.823 -0.053) 5.757 2.991 ( -0.809 -3.318 2.336) 4.137 3.109 ( 2.653 2.654 -2.495) 4.506 3.257 ( -3.751 1.378 1.123) 4.151 3.389 ( 8.893 -2.091 0.170) 9.137 3.746 ( 6.748 -5.786 -0.453) 8.900 4.167 ( 5.363 -1.632 0.263) 5.612 4.359 ( 9.204 -3.808 -0.320) 9.966 4.618 ( 1.826 -5.016 2.125) 5.746 4.748 ( 4.893 3.994 -1.810) 6.570 5.025 ( -11.247 -0.999 -2.680) 11.605 5.076 ( -6.970 0.425 0.184) 6.985 8.116 ( -2.132 -4.758 -6.015) 7.960 8.409 ( 2.664 3.095 5.214) 6.623 9.760 ( 5.272 -0.977 -0.441) 5.379 9.821 ( -0.089 -0.587 0.314) 0.671 9.864 ( 7.667 2.162 -0.684) 7.995 10.046 ( -3.737 -8.008 2.559) 9.199 10.166 ( -0.016 5.388 -2.542) 5.958 10.400 ( -4.680 -2.405 -2.582) 5.861 10.541 ( -2.418 2.965 3.746) 5.354 13.480 ( 13.289 -6.110 0.074) 14.626 14.297 ( 0.247 3.299 0.062) 3.309 14.350 ( -11.728 1.586 -0.067) 11.835 ======================= Grid point 346 (139/344) ======================= q-point: (-0.20 -0.53 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.849 ( 0.016 -4.337 -0.409) 4.357 2.954 ( 0.127 -3.262 0.440) 3.294 3.181 ( 2.720 2.060 -2.669) 4.332 3.207 ( -3.195 2.053 3.140) 4.927 3.414 ( -0.906 -6.948 0.433) 7.020 3.731 ( 0.591 -10.080 -0.302) 10.102 4.193 ( 0.349 -3.984 0.019) 3.999 4.308 ( -3.636 -12.135 0.224) 12.671 4.639 ( 2.568 -5.002 1.904) 5.937 4.782 ( -3.765 -1.314 -2.541) 4.729 4.963 ( 3.376 10.420 -1.776) 11.097 5.055 ( 1.775 3.470 0.101) 3.899 8.035 ( -1.478 -2.725 -3.392) 4.595 8.489 ( 2.512 1.748 2.707) 4.085 9.728 ( -5.737 -7.153 -0.986) 9.223 9.783 ( -2.364 -4.107 0.343) 4.751 9.856 ( -0.351 -3.375 0.689) 3.463 10.088 ( 5.764 3.901 1.941) 7.226 10.239 ( 4.171 0.929 -5.405) 6.890 10.307 ( -4.263 2.749 1.769) 5.372 10.588 ( 2.644 3.903 1.987) 5.116 13.487 ( -0.896 -14.404 0.017) 14.432 14.216 ( -3.650 1.577 0.332) 3.990 14.425 ( 4.796 10.732 -0.302) 11.759 ======================= Grid point 347 (140/344) ======================= q-point: (-0.13 0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( -1.974 -3.441 0.153) 3.970 2.890 ( -3.267 -5.557 -0.931) 6.514 3.127 ( -3.610 -6.258 0.946) 7.287 3.208 ( -4.156 -6.840 -0.332) 8.010 3.331 ( 1.727 1.709 0.960) 2.612 3.594 ( -4.476 -7.082 -0.536) 8.395 4.066 ( -7.966 -13.467 -0.224) 15.648 4.079 ( -5.412 -9.593 0.069) 11.015 4.613 ( 0.118 -1.031 -0.134) 1.047 4.761 ( -0.006 1.542 0.234) 1.560 5.142 ( 4.858 5.099 1.632) 7.229 5.159 ( 3.329 9.359 -2.595) 10.267 7.999 ( -0.639 0.095 -0.818) 1.042 8.540 ( 1.162 1.370 0.899) 2.009 9.477 ( -8.082 -14.396 -0.733) 16.526 9.692 ( -3.043 -5.366 -0.042) 6.169 9.833 ( -0.651 -1.129 0.034) 1.303 10.196 ( 3.056 1.656 3.073) 4.639 10.241 ( -2.346 0.731 -2.880) 3.786 10.405 ( 5.785 9.766 -0.049) 11.351 10.692 ( 3.320 4.928 0.394) 5.955 13.224 ( -9.459 -16.420 0.058) 18.950 14.224 ( 1.338 1.943 -0.449) 2.401 14.642 ( 6.300 11.291 0.411) 12.936 ======================= Grid point 348 (141/344) ======================= q-point: (-0.07 0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( -6.779 -7.721 -1.936) 10.456 2.723 ( -3.100 -6.374 2.321) 7.458 2.929 ( -7.256 -10.065 0.113) 12.408 3.061 ( -4.923 -3.796 -0.922) 6.285 3.409 ( 1.244 4.311 -2.220) 5.006 3.504 ( -0.419 -0.759 2.871) 2.999 3.789 ( -8.683 -11.992 -0.237) 14.807 3.864 ( -5.991 -11.339 0.081) 12.825 4.617 ( -1.114 2.443 -0.900) 2.831 4.789 ( 1.186 1.317 1.152) 2.114 5.208 ( -2.720 6.647 -1.411) 7.319 5.320 ( 3.825 6.801 1.379) 7.923 8.006 ( -0.404 2.823 1.222) 3.103 8.562 ( -0.182 1.460 -0.405) 1.526 9.195 ( -5.965 -15.792 -0.565) 16.890 9.581 ( -3.623 -4.607 -0.042) 5.861 9.806 ( -1.331 -0.845 0.017) 1.576 10.185 ( -4.209 1.008 -3.685) 5.684 10.264 ( 2.249 1.320 4.543) 5.238 10.616 ( 3.522 12.438 0.034) 12.927 10.809 ( 6.339 4.045 -0.942) 7.578 12.882 ( -10.586 -15.380 -0.190) 18.672 14.272 ( 1.451 2.040 -0.433) 2.541 14.842 ( 4.411 9.002 0.564) 10.041 ======================= Grid point 357 (142/344) ======================= q-point: ( 0.53 0.53 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 0.000 0.400 0.090) 0.411 2.584 ( 0.000 0.246 0.520) 0.576 2.738 ( -0.000 1.639 -0.530) 1.723 3.186 ( 0.000 0.735 0.853) 1.126 3.217 ( -0.000 5.594 -0.192) 5.598 3.512 ( -0.000 -2.432 -0.134) 2.436 3.558 ( -0.000 -1.572 -0.493) 1.647 3.706 ( -0.000 1.409 -0.309) 1.442 4.670 ( -0.000 1.742 -0.616) 1.847 4.748 ( 0.000 0.491 1.290) 1.381 5.340 ( -0.000 4.467 -0.966) 4.570 5.627 ( -0.000 2.776 -0.663) 2.854 8.129 ( 0.000 3.015 1.010) 3.180 8.605 ( -0.000 -0.791 -1.730) 1.903 8.837 ( 0.000 -2.900 0.638) 2.969 9.475 ( -0.000 0.762 -0.028) 0.763 9.779 ( -0.000 1.066 -0.058) 1.068 10.039 ( -0.000 1.928 -0.373) 1.964 10.456 ( 0.000 2.074 1.271) 2.432 10.799 ( -0.000 5.876 -0.735) 5.922 10.998 ( 0.000 -7.850 -0.041) 7.850 12.468 ( -0.000 1.089 -0.392) 1.157 14.393 ( -0.000 1.033 -0.795) 1.304 14.947 ( 0.000 0.606 1.145) 1.295 ======================= Grid point 358 (143/344) ======================= q-point: (-0.40 -0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.428 ( 13.576 0.078 0.493) 13.585 2.612 ( 1.961 1.208 3.440) 4.140 2.792 ( 6.022 -1.227 -2.888) 6.791 3.086 ( -4.692 0.486 0.620) 4.758 3.451 ( 13.684 0.622 -1.783) 13.814 3.478 ( 0.141 -2.679 -0.474) 2.725 3.558 ( 0.830 1.701 1.033) 2.157 3.762 ( 5.681 -0.195 -0.662) 5.723 4.677 ( -0.066 0.425 -0.799) 0.908 4.737 ( -1.805 -0.477 1.719) 2.538 5.338 ( -2.581 0.091 -1.247) 2.868 5.594 ( -4.885 -0.285 -1.535) 5.129 8.148 ( 1.183 -1.351 -1.751) 2.509 8.512 ( -7.144 1.019 1.354) 7.342 8.979 ( 14.327 -0.030 -0.602) 14.340 9.510 ( 3.595 -0.024 -0.123) 3.597 9.793 ( 0.932 0.013 -0.034) 0.933 10.054 ( 0.101 0.706 1.177) 1.376 10.451 ( -0.778 -1.450 -1.622) 2.311 10.817 ( -3.286 0.188 0.659) 3.357 10.838 ( -11.414 0.718 0.416) 11.445 12.599 ( 13.227 0.216 0.001) 13.228 14.381 ( -1.718 0.126 -1.016) 2.000 14.905 ( -5.354 -0.262 1.162) 5.485 ======================= Grid point 359 (144/344) ======================= q-point: (-0.33 -0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( 6.543 -0.604 0.507) 6.590 2.765 ( 16.544 1.202 4.534) 17.196 2.878 ( 6.883 -4.747 -3.707) 9.147 3.062 ( 1.467 0.785 1.745) 2.411 3.428 ( -3.721 1.404 -0.980) 4.096 3.536 ( 3.695 -5.188 -2.037) 6.687 3.788 ( 17.810 0.918 0.177) 17.834 3.885 ( 8.994 -1.251 -0.329) 9.087 4.671 ( -0.677 -3.316 1.319) 3.632 4.691 ( -2.099 1.258 -0.372) 2.475 5.250 ( -4.642 -3.975 -1.267) 6.241 5.452 ( -9.047 -2.539 -2.324) 9.680 8.125 ( 0.973 -5.555 -5.991) 8.228 8.437 ( -4.381 3.076 5.100) 7.394 9.273 ( 17.649 2.235 -0.946) 17.815 9.594 ( 6.308 -0.386 -0.319) 6.328 9.807 ( 1.118 -0.925 0.003) 1.451 10.060 ( 0.020 -0.834 2.306) 2.452 10.399 ( -1.540 -3.501 -3.728) 5.341 10.582 ( -12.676 -3.276 0.758) 13.115 10.776 ( -7.642 5.330 1.980) 9.526 12.879 ( 18.297 -1.416 0.258) 18.353 14.343 ( -2.195 0.323 -1.080) 2.468 14.767 ( -9.842 -0.851 1.035) 9.933 ======================= Grid point 360 (145/344) ======================= q-point: (-0.27 -0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 4.514 -0.623 1.359) 4.756 2.899 ( 3.934 -7.136 -1.069) 8.219 3.063 ( 12.227 0.463 0.531) 12.247 3.150 ( 7.332 -0.390 2.686) 7.818 3.377 ( -4.088 2.604 -0.475) 4.870 3.545 ( 5.872 -8.773 -2.103) 10.764 4.023 ( 8.448 -2.902 0.175) 8.934 4.085 ( 16.381 -3.258 -0.932) 16.728 4.584 ( -2.694 -6.005 3.121) 7.284 4.720 ( 2.291 3.324 -2.473) 4.734 5.111 ( -4.564 -5.883 -0.976) 7.509 5.238 ( -10.965 -2.815 -2.718) 11.643 8.056 ( 0.236 -6.374 -7.434) 9.795 8.437 ( -0.787 2.675 5.745) 6.386 9.588 ( 14.086 1.648 -0.302) 14.186 9.724 ( 9.421 1.250 -0.819) 9.539 9.810 ( 0.581 -1.530 0.323) 1.669 10.026 ( -2.728 -4.719 2.487) 5.991 10.301 ( -6.345 -0.694 -4.078) 7.574 10.393 ( -3.779 -2.859 -0.025) 4.739 10.686 ( -7.965 3.902 3.123) 9.403 13.156 ( 16.265 -5.750 0.261) 17.253 14.329 ( -0.277 2.577 -0.466) 2.634 14.569 ( -11.763 -0.022 0.381) 11.770 ======================= Grid point 361 (146/344) ======================= q-point: (-0.20 -0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 2.542 -2.187 0.281) 3.365 2.880 ( 2.720 -7.483 0.204) 7.965 3.181 ( 1.266 4.047 -1.437) 4.478 3.238 ( 2.523 -6.501 3.173) 7.661 3.353 ( -0.318 -0.451 0.469) 0.724 3.541 ( 6.124 -12.146 -1.686) 13.707 4.099 ( 4.721 -5.417 -0.340) 7.194 4.203 ( 3.302 -10.998 0.586) 11.498 4.535 ( 3.675 -3.648 1.421) 5.370 4.791 ( 0.971 0.893 -2.481) 2.810 5.009 ( -0.513 -2.062 -0.236) 2.138 5.076 ( -3.227 1.772 -2.437) 4.415 7.991 ( 0.776 -4.577 -6.003) 7.588 8.476 ( 1.417 1.392 3.961) 4.431 9.710 ( 2.482 -3.919 -0.765) 4.701 9.805 ( -0.249 -1.572 1.163) 1.971 9.848 ( -8.164 -8.111 2.211) 11.719 9.964 ( 11.882 3.055 0.655) 12.286 10.217 ( -1.029 0.329 -6.241) 6.334 10.360 ( -0.232 0.503 0.634) 0.842 10.634 ( -2.826 5.133 3.509) 6.829 13.280 ( 7.585 -12.704 0.093) 14.797 14.329 ( -5.730 0.044 2.116) 6.109 14.467 ( 0.575 8.605 -2.089) 8.874 ======================= Grid point 362 (147/344) ======================= q-point: (-0.13 -0.47 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.772 ( -0.529 -3.618 0.401) 3.679 2.845 ( 0.855 -6.924 -0.895) 7.034 3.114 ( -3.568 -9.643 0.679) 10.304 3.206 ( -3.608 -7.249 -1.021) 8.161 3.326 ( 1.688 0.366 4.032) 4.387 3.523 ( 2.869 -5.968 -2.552) 7.096 4.029 ( -3.821 -14.014 -0.750) 14.545 4.063 ( -3.339 -9.722 0.319) 10.284 4.576 ( 2.807 -2.434 2.428) 4.438 4.770 ( -0.320 1.202 -3.153) 3.389 5.068 ( 6.970 -0.294 1.265) 7.090 5.165 ( 5.201 7.822 -2.383) 9.691 7.972 ( 1.996 -1.704 -3.532) 4.401 8.524 ( 2.009 0.665 1.904) 2.846 9.526 ( -12.217 -11.731 0.808) 16.957 9.675 ( -1.544 -6.289 0.337) 6.484 9.819 ( 0.576 -1.645 0.113) 1.747 10.129 ( 5.535 -1.719 3.806) 6.933 10.245 ( 2.219 2.159 -6.860) 7.526 10.408 ( 3.647 6.911 0.577) 7.836 10.706 ( 1.925 7.118 2.305) 7.726 13.162 ( -3.058 -17.154 0.144) 17.425 14.255 ( -2.458 1.720 0.909) 3.135 14.641 ( 6.255 10.316 -0.963) 12.103 ======================= Grid point 373 (148/344) ======================= q-point: (-0.40 -0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 0.000 0.293 1.652) 1.678 2.622 ( 0.000 2.066 5.865) 6.219 2.701 ( -0.000 -3.711 -5.481) 6.619 3.179 ( -0.000 -7.572 -5.350) 9.272 3.218 ( 0.000 0.820 5.056) 5.122 3.503 ( -0.000 2.375 -1.443) 2.779 3.568 ( 0.000 1.519 0.895) 1.763 3.698 ( -0.000 -1.848 -1.602) 2.445 4.670 ( -0.000 -1.209 -0.610) 1.354 4.752 ( 0.000 -0.922 1.839) 2.057 5.335 ( -0.000 -4.526 -1.421) 4.743 5.615 ( -0.000 -3.043 -2.466) 3.916 8.105 ( -0.000 -4.606 -2.179) 5.096 8.625 ( 0.000 2.360 0.899) 2.525 8.829 ( -0.000 2.107 -0.459) 2.156 9.473 ( -0.000 -0.842 -0.181) 0.862 9.779 ( 0.000 -1.013 -0.016) 1.013 10.059 ( 0.000 -0.346 2.659) 2.681 10.420 ( -0.000 -4.828 -3.855) 6.178 10.813 ( 0.000 -4.917 1.280) 5.081 11.004 ( 0.000 8.358 0.766) 8.393 12.473 ( 0.000 -0.571 0.323) 0.656 14.391 ( -0.000 -0.869 -1.164) 1.453 14.948 ( 0.000 -1.083 1.192) 1.611 ======================= Grid point 374 (149/344) ======================= q-point: (-0.33 -0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.429 ( 11.978 -0.350 1.724) 12.107 2.675 ( 2.337 1.969 5.434) 6.234 2.697 ( 5.737 -5.479 -3.881) 8.832 3.038 ( -1.215 -6.339 -2.200) 6.819 3.351 ( 9.021 -4.214 1.370) 10.051 3.510 ( -2.092 2.833 -0.965) 3.652 3.606 ( 4.307 0.848 -0.596) 4.430 3.729 ( 6.439 -2.431 -1.327) 7.009 4.649 ( -0.289 -2.991 -0.096) 3.006 4.729 ( -1.615 -0.859 1.653) 2.465 5.242 ( -2.285 -9.197 -1.781) 9.642 5.527 ( -4.595 -5.137 -2.843) 7.456 8.043 ( 0.191 -6.919 -3.341) 7.685 8.566 ( -6.249 2.705 1.859) 7.059 9.019 ( 14.352 4.135 -1.003) 14.970 9.495 ( 3.836 -1.329 -0.369) 4.076 9.773 ( 0.991 -1.942 0.021) 2.180 10.058 ( -0.118 -1.327 3.991) 4.208 10.342 ( -0.275 -7.964 -5.150) 9.488 10.722 ( -6.313 -2.738 1.084) 6.966 11.005 ( -8.990 8.422 1.337) 12.392 12.586 ( 12.817 -1.580 0.565) 12.926 14.365 ( -1.025 -1.189 -1.277) 2.024 14.889 ( -5.266 -1.866 1.152) 5.705 ======================= Grid point 375 (150/344) ======================= q-point: (-0.27 -0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.635 ( 9.042 -1.129 1.836) 9.296 2.725 ( 6.273 -8.562 -4.254) 11.435 2.811 ( 10.749 0.922 6.135) 12.411 3.025 ( 7.156 -5.936 -0.797) 9.332 3.391 ( 1.297 -5.474 -0.671) 5.665 3.488 ( -3.310 3.223 -0.946) 4.716 3.761 ( 14.056 -3.865 -1.427) 14.647 3.846 ( 9.384 -2.733 -0.093) 9.775 4.578 ( -2.708 -6.560 2.617) 7.564 4.719 ( 0.449 1.974 -0.990) 2.254 5.079 ( -2.757 -12.341 -2.182) 12.832 5.353 ( -7.815 -6.016 -2.570) 10.192 7.965 ( 0.449 -7.320 -4.719) 8.721 8.509 ( -3.651 2.117 2.548) 4.930 9.340 ( 16.701 4.118 -0.496) 17.208 9.578 ( 7.251 -0.843 -0.988) 7.367 9.772 ( 1.399 -2.515 0.230) 2.887 10.040 ( -1.523 -2.383 4.757) 5.534 10.240 ( 0.602 -9.723 -5.548) 11.210 10.563 ( -10.446 1.218 0.478) 10.528 10.902 ( -10.769 5.958 1.973) 12.465 12.824 ( 15.947 -4.124 0.559) 16.481 14.346 ( 0.148 0.418 -1.080) 1.167 14.743 ( -9.049 -2.090 0.852) 9.326 ======================= Grid point 376 (151/344) ======================= q-point: (-0.20 -0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( 4.526 -8.481 -1.449) 9.722 2.730 ( 3.923 -2.294 1.537) 4.798 3.032 ( 12.110 -4.351 3.450) 13.322 3.119 ( 9.245 -6.485 0.969) 11.334 3.308 ( -1.969 -8.434 -2.181) 8.931 3.467 ( -2.686 4.132 -1.160) 5.063 3.921 ( 9.229 -7.310 -0.656) 11.792 3.979 ( 10.107 -6.874 -0.333) 12.227 4.471 ( -1.013 -6.346 2.792) 7.007 4.776 ( 2.395 3.203 -2.215) 4.572 4.926 ( 0.806 -11.794 -1.458) 11.912 5.157 ( -6.526 -4.023 -1.983) 7.919 7.904 ( 1.560 -5.687 -5.106) 7.801 8.491 ( -0.992 1.116 2.277) 2.723 9.582 ( 8.013 -2.761 0.160) 8.477 9.734 ( 8.471 -1.673 0.262) 8.639 9.792 ( 5.000 -0.449 -0.280) 5.028 9.951 ( -6.133 -2.807 4.429) 8.069 10.158 ( 2.028 -8.144 -6.094) 10.372 10.435 ( -6.332 4.470 0.264) 7.755 10.793 ( -7.943 5.781 2.479) 10.132 13.004 ( 11.132 -9.111 0.382) 14.390 14.378 ( 1.000 1.700 0.426) 2.018 14.576 ( -6.945 0.813 -0.636) 7.021 ======================= Grid point 377 (152/344) ======================= q-point: (-0.13 -0.40 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.693 ( 3.804 -9.765 -0.482) 10.491 2.763 ( 1.489 -1.670 0.192) 2.246 3.051 ( -0.638 -11.049 1.935) 11.235 3.129 ( 0.702 -19.532 1.148) 19.578 3.257 ( 5.167 2.462 -0.018) 5.724 3.483 ( -0.300 4.420 -1.680) 4.738 3.916 ( 1.027 -12.973 -0.751) 13.035 3.983 ( 1.502 -9.930 -0.277) 10.047 4.478 ( 5.335 -3.015 2.567) 6.644 4.795 ( -1.458 1.244 -3.319) 3.832 4.897 ( 7.566 -8.307 0.083) 11.236 5.129 ( 4.681 2.999 -1.172) 5.681 7.891 ( 3.293 -2.935 -4.336) 6.185 8.504 ( 1.032 0.411 1.535) 1.895 9.600 ( -0.267 -6.522 -1.166) 6.631 9.656 ( -10.796 -10.543 3.343) 15.456 9.779 ( 2.035 -2.400 0.767) 3.238 9.997 ( 6.666 -3.786 2.920) 8.204 10.174 ( 6.017 1.578 -7.119) 9.454 10.436 ( -0.118 5.954 0.347) 5.965 10.790 ( -1.489 9.369 2.566) 9.828 13.006 ( 2.414 -14.193 0.311) 14.400 14.329 ( -4.688 -1.003 1.734) 5.098 14.625 ( 5.553 7.557 -1.964) 9.581 ======================= Grid point 389 (153/344) ======================= q-point: (-0.33 -0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 0.000 0.414 3.243) 3.269 2.551 ( -0.000 -8.256 -7.192) 10.950 2.708 ( 0.000 2.803 9.053) 9.477 2.933 ( -0.000 -13.368 -7.196) 15.182 3.255 ( 0.000 0.187 6.206) 6.209 3.561 ( 0.000 3.019 0.393) 3.045 3.588 ( -0.000 0.325 -2.471) 2.492 3.619 ( -0.000 -5.012 -2.858) 5.770 4.617 ( 0.000 -4.233 0.185) 4.237 4.737 ( 0.000 -1.007 2.360) 2.566 5.137 ( -0.000 -14.380 -2.738) 14.639 5.497 ( -0.000 -7.332 -2.547) 7.762 7.961 ( -0.000 -8.146 -1.659) 8.314 8.675 ( -0.000 1.878 -0.293) 1.901 8.912 ( -0.000 6.239 -1.111) 6.337 9.442 ( -0.000 -1.950 -0.591) 2.037 9.739 ( 0.000 -2.885 0.107) 2.887 10.052 ( 0.000 -2.104 5.154) 5.567 10.238 ( -0.000 -10.550 -5.348) 11.828 10.762 ( 0.000 -0.255 0.050) 0.259 11.189 ( 0.000 9.108 1.241) 9.192 12.449 ( 0.000 -2.082 0.935) 2.282 14.350 ( -0.000 -2.444 -1.502) 2.869 14.914 ( 0.000 -2.936 1.226) 3.182 ======================= Grid point 390 (154/344) ======================= q-point: (-0.27 -0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 9.990 -0.491 3.596) 10.629 2.504 ( 6.327 -10.122 -6.156) 13.430 2.763 ( 1.837 0.692 8.545) 8.768 2.809 ( 3.951 -12.247 -5.742) 14.092 3.322 ( 4.138 -0.842 4.195) 5.953 3.526 ( 1.122 -4.771 -2.313) 5.420 3.597 ( -0.162 2.915 -1.564) 3.312 3.662 ( 7.571 -4.051 -1.394) 8.699 4.552 ( -1.538 -7.379 2.128) 7.832 4.734 ( -0.191 0.904 1.196) 1.512 4.953 ( -1.138 -17.982 -3.741) 18.402 5.375 ( -3.910 -8.760 -1.785) 9.758 7.876 ( 0.195 -8.129 -1.414) 8.254 8.615 ( -5.719 1.737 -0.773) 6.027 9.118 ( 13.335 5.588 -0.784) 14.479 9.460 ( 4.390 -1.462 -1.301) 4.807 9.718 ( 1.193 -3.483 0.303) 3.694 10.038 ( 0.474 -3.584 4.085) 5.455 10.117 ( -0.482 -10.367 -3.309) 10.893 10.721 ( -5.569 2.252 -1.255) 6.137 11.173 ( -10.944 7.814 1.612) 13.544 12.543 ( 11.812 -2.995 0.988) 12.226 14.326 ( 0.744 -1.993 -1.594) 2.658 14.838 ( -4.919 -3.837 1.125) 6.339 ======================= Grid point 391 (155/344) ======================= q-point: (-0.20 -0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( 6.651 -12.232 -3.721) 14.412 2.615 ( 9.798 -2.335 3.373) 10.622 2.804 ( 11.578 -14.205 -3.013) 18.572 2.852 ( 5.356 0.309 6.264) 8.248 3.305 ( -3.067 -3.590 -1.685) 5.014 3.543 ( 0.778 0.259 0.150) 0.833 3.658 ( 8.899 -3.241 -1.213) 9.548 3.756 ( 8.810 -6.227 -0.567) 10.803 4.432 ( -2.264 -9.518 3.593) 10.423 4.726 ( 1.186 -13.987 -4.834) 14.846 4.793 ( 1.544 -1.300 0.528) 2.086 5.196 ( -5.556 -8.749 -0.998) 10.412 7.809 ( 1.309 -6.414 -2.015) 6.849 8.545 ( -3.673 1.308 -0.696) 3.960 9.387 ( 11.965 -0.713 1.073) 12.034 9.562 ( 8.436 -0.123 -2.145) 8.705 9.718 ( 2.684 -2.706 0.531) 3.849 9.996 ( 1.441 -11.130 -5.364) 12.439 10.025 ( -1.571 -1.136 5.892) 6.203 10.623 ( -8.705 5.067 -1.709) 10.216 11.032 ( -12.118 6.336 1.883) 13.804 12.726 ( 12.228 -5.698 0.771) 13.513 14.347 ( 3.247 0.163 -1.246) 3.481 14.688 ( -7.224 -3.795 0.632) 8.185 ======================= Grid point 392 (156/344) ======================= q-point: (-0.13 -0.33 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( 6.777 -12.640 -2.255) 14.518 2.716 ( 3.884 -2.212 2.248) 5.004 2.827 ( 8.776 -19.478 0.351) 21.366 2.940 ( 3.560 -5.912 4.275) 8.118 3.222 ( 0.222 -1.855 -3.387) 3.868 3.547 ( -1.142 2.861 -0.098) 3.082 3.742 ( 5.087 -8.750 -0.514) 10.134 3.815 ( 6.230 -9.220 -0.946) 11.168 4.360 ( 3.753 -6.164 3.525) 8.031 4.615 ( 7.824 -16.245 -3.795) 18.426 4.855 ( -0.572 4.090 -0.916) 4.230 5.061 ( 1.436 -5.302 0.334) 5.503 7.792 ( 3.231 -3.677 -2.789) 5.634 8.513 ( -1.276 0.992 -0.213) 1.630 9.487 ( 4.588 -6.217 -0.119) 7.728 9.679 ( 6.357 -4.198 1.968) 7.869 9.707 ( -2.434 -7.248 0.240) 7.650 9.887 ( -1.087 -8.173 1.273) 8.342 10.074 ( 5.845 4.152 -3.403) 7.937 10.549 ( -5.646 7.080 -0.634) 9.078 10.950 ( -5.511 9.312 1.811) 10.971 12.811 ( 5.843 -10.018 0.554) 11.610 14.380 ( -1.711 -2.113 0.941) 2.877 14.599 ( 1.976 1.847 -1.597) 3.141 ======================= Grid point 405 (157/344) ======================= q-point: (-0.27 -0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( -0.000 -12.164 -5.124) 13.200 2.363 ( 0.000 0.382 3.279) 3.301 2.587 ( -0.000 -17.429 -6.224) 18.507 2.808 ( 0.000 2.268 8.585) 8.880 3.276 ( 0.000 -0.833 5.044) 5.112 3.477 ( -0.000 -7.377 -3.714) 8.259 3.511 ( -0.000 -6.110 -3.305) 6.947 3.646 ( -0.000 3.997 0.146) 4.000 4.485 ( 0.000 -10.292 3.060) 10.737 4.720 ( -0.000 -12.707 -3.562) 13.196 4.780 ( 0.000 -7.649 0.535) 7.667 5.309 ( -0.000 -10.361 -1.067) 10.416 7.791 ( 0.000 -8.129 0.843) 8.173 8.687 ( -0.000 0.177 -2.776) 2.782 9.047 ( -0.000 6.559 -0.431) 6.573 9.405 ( -0.000 -0.483 -2.216) 2.268 9.670 ( 0.000 -3.989 0.575) 4.030 9.939 ( -0.000 -11.445 -5.776) 12.820 10.075 ( 0.000 -2.885 7.688) 8.212 10.795 ( -0.000 4.159 -3.320) 5.322 11.376 ( 0.000 8.891 1.794) 9.070 12.401 ( 0.000 -3.177 1.357) 3.455 14.285 ( -0.000 -3.222 -1.976) 3.780 14.838 ( 0.000 -5.262 1.108) 5.378 ======================= Grid point 406 (158/344) ======================= q-point: (-0.20 -0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( 7.362 -14.607 -4.779) 17.041 2.415 ( 5.619 -11.407 -0.871) 12.746 2.488 ( 9.002 -6.919 0.419) 11.362 2.844 ( 0.134 1.142 7.868) 7.952 3.316 ( -2.928 -4.063 -0.386) 5.022 3.355 ( 7.313 -7.417 -1.885) 10.585 3.532 ( 7.874 -7.975 -2.272) 11.436 3.671 ( -1.203 3.190 0.869) 3.518 4.351 ( -0.983 -15.692 3.766) 16.167 4.508 ( 0.083 -20.092 -6.726) 21.189 4.791 ( 1.111 1.412 3.550) 3.979 5.174 ( -3.184 -9.702 -1.003) 10.260 7.724 ( 0.816 -6.793 1.324) 6.969 8.630 ( -4.550 1.032 -2.939) 5.514 9.194 ( 9.333 0.646 1.320) 9.448 9.447 ( 4.485 1.576 -3.729) 6.042 9.649 ( 1.856 -3.180 1.053) 3.829 9.827 ( 2.343 -10.812 -7.167) 13.181 10.063 ( -1.218 -1.322 9.081) 9.257 10.797 ( -4.781 6.794 -4.613) 9.502 11.334 ( -13.102 7.389 2.349) 15.224 12.480 ( 10.564 -3.592 1.268) 11.230 14.274 ( 3.067 -2.276 -2.208) 4.412 14.741 ( -4.337 -6.377 0.858) 7.760 ======================= Grid point 407 (159/344) ======================= q-point: (-0.13 -0.27 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( 8.060 -15.616 -3.092) 17.843 2.411 ( 12.625 -19.463 -2.494) 23.332 2.622 ( 7.399 -2.490 4.456) 8.989 2.875 ( 1.304 -1.111 6.804) 7.016 3.171 ( -1.174 -8.890 -6.002) 10.790 3.461 ( 7.610 -5.633 0.117) 9.469 3.587 ( 8.219 -9.272 -1.397) 12.469 3.684 ( -0.010 1.497 1.056) 1.832 4.206 ( 3.977 -16.317 2.932) 17.048 4.327 ( 2.347 -15.953 -4.995) 16.880 4.855 ( 4.967 -0.359 3.481) 6.076 5.022 ( -4.867 -5.157 -1.442) 7.236 7.697 ( 2.611 -4.516 0.060) 5.217 8.569 ( -3.530 2.236 -2.050) 4.655 9.323 ( 7.442 -5.405 1.076) 9.260 9.520 ( 5.431 -3.835 -0.538) 6.670 9.642 ( 0.792 -6.658 -0.689) 6.740 9.808 ( 3.679 -3.150 -4.131) 6.365 10.063 ( 0.406 1.891 5.093) 5.448 10.756 ( -8.085 9.459 -3.204) 12.849 11.179 ( -10.826 7.704 1.959) 13.431 12.613 ( 8.056 -5.814 0.970) 9.982 14.333 ( 4.686 -1.318 -1.724) 5.164 14.596 ( -3.499 -5.486 0.155) 6.508 ======================= Grid point 421 (160/344) ======================= q-point: (-0.20 -0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.981 ( -0.000 -17.239 -5.201) 18.006 2.176 ( -0.000 -20.891 -5.774) 21.674 2.411 ( 0.000 1.500 6.776) 6.940 2.871 ( 0.000 -0.024 8.047) 8.047 3.211 ( -0.000 -8.081 -3.768) 8.917 3.294 ( -0.000 -14.243 -4.839) 15.043 3.351 ( 0.000 -2.393 1.911) 3.062 3.699 ( 0.000 -1.484 1.186) 1.900 4.157 ( 0.000 -21.693 -0.636) 21.703 4.332 ( -0.000 -14.690 -2.706) 14.937 4.777 ( 0.000 -5.045 5.911) 7.771 5.123 ( -0.000 -4.435 -1.955) 4.847 7.653 ( 0.000 -6.583 3.145) 7.296 8.677 ( -0.000 1.014 -3.112) 3.273 9.117 ( 0.000 -0.583 1.937) 2.023 9.429 ( -0.000 3.689 -5.692) 6.783 9.610 ( 0.000 -0.795 1.726) 1.900 9.679 ( -0.000 -10.410 -7.258) 12.691 10.081 ( 0.000 -1.400 9.888) 9.986 10.903 ( -0.000 9.356 -7.219) 11.817 11.565 ( 0.000 8.982 3.510) 9.643 12.337 ( 0.000 -3.733 1.511) 4.027 14.207 ( -0.000 -3.393 -2.926) 4.481 14.708 ( 0.000 -8.134 0.434) 8.145 ======================= Grid point 422 (161/344) ======================= q-point: (-0.13 -0.20 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.876 ( 8.703 -18.753 -3.455) 20.961 2.009 ( 7.581 -21.913 -4.676) 23.654 2.501 ( 5.997 0.530 7.424) 9.558 2.873 ( -0.313 -2.047 7.785) 8.056 3.050 ( -1.441 -15.628 -8.684) 17.937 3.238 ( 9.293 -12.292 -3.510) 15.804 3.389 ( 4.663 -3.259 2.164) 6.087 3.634 ( 1.744 -12.762 0.308) 12.885 4.001 ( 0.859 -9.053 -0.622) 9.115 4.175 ( -0.620 -14.164 -0.877) 14.205 4.721 ( 2.935 -12.226 5.219) 13.613 5.089 ( -2.925 3.521 -1.683) 4.877 7.611 ( 1.672 -5.705 2.332) 6.386 8.659 ( -3.380 3.928 -1.990) 5.551 9.156 ( 5.652 -4.279 1.997) 7.365 9.436 ( 0.533 -2.124 -3.474) 4.106 9.559 ( -0.006 -7.551 -3.086) 8.158 9.710 ( 6.162 4.184 -2.875) 7.984 10.084 ( -0.212 -0.853 8.164) 8.211 10.965 ( -3.744 13.198 -7.485) 15.628 11.492 ( -15.342 6.940 4.242) 17.365 12.418 ( 9.637 -3.009 1.531) 10.211 14.213 ( 5.106 -2.705 -3.430) 6.719 14.587 ( -3.355 -9.310 0.016) 9.896 ======================= Grid point 437 (162/344) ======================= q-point: (-0.13 -0.13 0.07) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -0.000 -21.501 -3.470) 21.779 1.702 ( -0.000 -24.201 -4.479) 24.611 2.477 ( 0.000 1.231 9.595) 9.674 2.840 ( -0.000 -31.065 -3.005) 31.210 2.860 ( 0.000 -4.292 3.037) 5.258 2.980 ( -0.000 -10.684 -8.978) 13.955 3.348 ( 0.000 -0.067 2.781) 2.782 3.425 ( -0.000 -20.338 -1.021) 20.363 3.960 ( 0.000 -4.784 2.387) 5.347 4.052 ( -0.000 -8.191 -0.784) 8.229 4.560 ( 0.000 -15.785 4.069) 16.301 5.164 ( -0.000 6.436 -1.022) 6.516 7.539 ( 0.000 -6.605 2.429) 7.038 8.743 ( -0.000 7.135 0.045) 7.135 9.070 ( 0.000 -4.077 2.235) 4.650 9.410 ( -0.000 -2.848 -3.323) 4.376 9.475 ( -0.000 -6.790 -6.635) 9.494 9.715 ( -0.000 9.144 -0.478) 9.157 10.086 ( 0.000 -2.501 8.066) 8.445 11.121 ( -0.000 16.630 -10.492) 19.663 11.772 ( 0.000 9.364 8.003) 12.318 12.268 ( 0.000 -3.729 1.350) 3.966 14.120 ( -0.000 -3.786 -4.625) 5.977 14.513 ( -0.000 -11.245 -1.407) 11.333 ======================= Grid point 486 (163/344) ======================= q-point: ( 0.13 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.371 ( 0.000 -0.000 27.164) 27.164 0.371 ( 0.000 -0.000 27.164) 27.164 0.692 ( 0.000 -0.000 51.765) 51.765 2.271 ( -0.000 0.000 -12.808) 12.808 2.271 ( -0.000 0.000 -12.808) 12.808 2.778 ( 0.000 -0.000 9.889) 9.889 2.778 ( 0.000 -0.000 9.889) 9.889 3.355 ( -0.000 0.000 -2.431) 2.431 3.355 ( -0.000 0.000 -2.431) 2.431 3.963 ( -0.000 0.000 -21.089) 21.089 4.332 ( 0.000 -0.000 3.025) 3.025 5.464 ( 0.000 -0.000 6.155) 6.155 8.916 ( 0.000 -0.000 0.455) 0.455 8.916 ( 0.000 -0.000 0.455) 0.455 9.258 ( -0.000 0.000 -0.343) 0.343 9.258 ( -0.000 0.000 -0.343) 0.343 9.373 ( 0.000 -0.000 0.463) 0.463 9.680 ( -0.000 0.000 -0.455) 0.455 10.107 ( 0.000 -0.000 1.326) 1.326 10.107 ( 0.000 -0.000 1.326) 1.326 12.126 ( -0.000 0.000 -1.178) 1.178 12.126 ( -0.000 0.000 -1.178) 1.178 13.886 ( 0.000 -0.000 0.029) 0.029 16.655 ( 0.000 -0.000 0.091) 0.091 ======================= Grid point 487 (164/344) ======================= q-point: ( 0.20 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.717 ( 18.917 10.922 16.302) 27.256 0.759 ( 20.280 11.709 17.677) 29.340 1.270 ( 32.839 18.960 26.441) 46.228 2.324 ( 5.941 3.430 -13.991) 15.583 2.349 ( 9.392 5.422 -11.837) 16.054 2.772 ( -1.316 -0.760 10.506) 10.615 2.974 ( 9.872 5.700 6.837) 13.293 3.354 ( 0.201 0.116 -2.279) 2.291 3.445 ( 8.023 4.632 -2.793) 9.676 3.926 ( 3.189 1.841 -17.614) 17.995 4.302 ( -2.623 -1.514 1.382) 3.329 5.421 ( -4.034 -2.329 5.484) 7.195 7.719 ( -22.951 -13.251 36.950) 45.471 8.952 ( 2.452 1.415 0.991) 2.999 9.170 ( -4.877 -2.816 -9.881) 11.373 9.266 ( 1.149 0.663 -0.766) 1.532 9.384 ( -7.574 -4.373 6.310) 10.784 9.851 ( 9.299 5.369 -5.238) 11.947 10.052 ( -4.619 -2.667 1.350) 5.502 11.253 ( 19.947 11.517 -36.559) 43.210 12.147 ( 1.732 1.000 -1.188) 2.326 12.164 ( 5.018 2.897 -8.317) 10.137 13.981 ( 7.968 4.600 0.129) 9.202 14.946 ( -58.866 -33.986 76.709) 102.491 ======================= Grid point 488 (165/344) ======================= q-point: ( 0.27 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( 19.234 11.105 10.272) 24.470 1.270 ( 20.535 11.856 11.650) 26.420 2.056 ( 28.534 16.474 2.842) 33.071 2.457 ( 7.406 4.276 -15.326) 17.551 2.644 ( 18.128 10.466 -0.971) 20.955 2.776 ( 0.077 0.044 11.455) 11.455 3.218 ( 9.665 5.580 6.686) 13.009 3.358 ( 0.676 0.390 -1.641) 1.817 3.686 ( 12.707 7.337 -2.563) 14.896 4.010 ( 4.070 2.350 -10.206) 11.236 4.276 ( 3.631 2.096 -3.703) 5.594 5.311 ( -6.255 -3.611 3.178) 7.891 7.574 ( -0.141 -0.082 13.530) 13.531 8.946 ( -10.471 -6.045 -5.802) 13.411 9.030 ( 4.013 2.317 1.196) 4.786 9.303 ( 2.071 1.196 -0.789) 2.518 9.337 ( 0.746 0.431 4.692) 4.770 9.911 ( -7.494 -4.327 1.739) 8.826 10.018 ( 6.444 3.720 -5.735) 9.395 11.221 ( -9.136 -5.275 -6.961) 12.639 12.121 ( -8.166 -4.715 -5.702) 11.020 12.196 ( 2.626 1.516 -1.545) 3.403 14.194 ( 4.831 2.789 3.535) 6.604 14.356 ( -6.637 -3.832 27.398) 28.450 ======================= Grid point 489 (166/344) ======================= q-point: ( 0.33 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( 16.105 9.298 6.700) 19.767 1.744 ( 18.475 10.667 7.005) 22.454 2.506 ( 12.988 7.499 -11.601) 18.961 2.550 ( 2.548 1.471 -8.876) 9.351 2.859 ( 5.719 3.302 4.911) 8.229 3.171 ( 22.236 12.838 11.010) 27.937 3.382 ( 1.663 0.960 -0.344) 1.951 3.460 ( 11.063 6.387 2.189) 12.961 3.966 ( 6.272 3.621 -2.342) 7.612 4.026 ( 6.214 3.588 -0.290) 7.182 4.519 ( 15.789 9.116 -7.782) 19.823 5.159 ( -6.818 -3.936 1.585) 8.030 7.663 ( 5.082 2.934 4.687) 7.510 8.723 ( -7.716 -4.455 -1.373) 9.015 9.136 ( 4.819 2.782 0.900) 5.637 9.342 ( 0.729 0.421 0.157) 0.856 9.405 ( 4.469 2.580 2.371) 5.679 9.737 ( -7.102 -4.100 1.753) 8.386 10.135 ( 4.993 2.883 -5.344) 7.861 10.973 ( -10.489 -6.056 2.167) 12.304 11.858 ( -11.949 -6.899 -2.832) 14.085 12.257 ( 2.964 1.711 -1.971) 3.950 14.169 ( -1.302 -0.752 6.994) 7.154 14.546 ( 10.433 6.024 3.583) 12.569 ======================= Grid point 490 (167/344) ======================= q-point: ( 0.40 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 11.712 6.762 3.439) 13.954 2.149 ( 15.528 8.965 3.095) 18.195 2.558 ( -0.229 -0.132 -0.619) 0.673 2.702 ( 6.977 4.028 -8.160) 11.467 3.029 ( 8.019 4.630 -2.918) 9.709 3.434 ( 2.661 1.536 1.450) 3.398 3.529 ( 7.755 4.477 9.701) 13.202 3.662 ( 2.112 1.219 -3.160) 3.991 4.129 ( 14.227 8.214 -1.094) 16.465 4.305 ( 13.354 7.710 1.653) 15.508 4.848 ( 10.379 5.992 -3.536) 12.495 5.054 ( 0.450 0.260 0.113) 0.531 7.803 ( 6.012 3.471 1.817) 7.176 8.586 ( -4.081 -2.356 0.328) 4.724 9.247 ( 4.038 2.331 -2.072) 5.102 9.295 ( -5.149 -2.973 4.950) 7.737 9.557 ( 8.243 4.759 0.775) 9.550 9.643 ( -0.557 -0.321 0.223) 0.680 10.233 ( 4.489 2.591 -3.587) 6.303 10.778 ( -6.779 -3.914 3.723) 8.668 11.594 ( -10.174 -5.874 -2.364) 11.983 12.321 ( 2.928 1.691 -2.110) 3.985 14.188 ( 1.597 0.922 2.260) 2.916 14.764 ( 7.709 4.451 1.612) 9.046 ======================= Grid point 491 (168/344) ======================= q-point: ( 0.47 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.185 ( 7.213 4.164 0.226) 8.331 2.468 ( 11.567 6.678 -0.739) 13.377 2.554 ( -0.292 -0.168 3.636) 3.651 2.824 ( 5.102 2.945 -1.728) 6.139 3.196 ( 7.004 4.044 -6.180) 10.179 3.506 ( 2.890 1.669 3.225) 4.641 3.621 ( -2.967 -1.713 -0.179) 3.431 3.642 ( 0.837 0.483 3.749) 3.872 4.398 ( 8.581 4.954 -4.307) 10.804 4.664 ( 15.022 8.673 1.387) 17.401 4.916 ( 1.359 0.784 3.181) 3.547 5.242 ( 10.382 5.994 -0.953) 12.026 7.940 ( 5.403 3.119 1.959) 6.539 8.532 ( -0.818 -0.472 -0.318) 0.997 9.119 ( -8.130 -4.694 1.755) 9.550 9.355 ( 3.760 2.171 1.250) 4.518 9.678 ( 2.619 1.512 -0.277) 3.037 9.772 ( 9.787 5.650 -0.937) 11.340 10.327 ( 3.751 2.166 -0.034) 4.332 10.677 ( -2.374 -1.371 1.724) 3.238 11.376 ( -8.478 -4.895 -1.727) 9.940 12.381 ( 2.600 1.501 -1.779) 3.489 14.240 ( 2.404 1.388 1.016) 2.956 14.909 ( 4.753 2.744 0.466) 5.508 ======================= Grid point 492 (169/344) ======================= q-point: ( 0.53 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.305 ( 3.602 2.079 -2.052) 4.637 2.562 ( -0.052 -0.030 5.673) 5.673 2.665 ( 5.836 3.369 -3.997) 7.835 2.950 ( 5.625 3.248 3.641) 7.447 3.319 ( 4.907 2.833 -7.503) 9.402 3.549 ( -3.010 -1.738 -0.183) 3.481 3.573 ( 2.000 1.155 4.548) 5.101 3.614 ( -2.841 -1.640 0.967) 3.420 4.554 ( 5.807 3.353 -0.921) 6.769 4.833 ( 0.931 0.537 -1.841) 2.132 5.083 ( 10.358 5.980 2.531) 12.225 5.432 ( 5.636 3.254 2.576) 6.999 8.052 ( 3.582 2.068 2.298) 4.731 8.538 ( 1.269 0.732 -1.079) 1.820 8.951 ( -6.353 -3.668 1.378) 7.464 9.429 ( 2.466 1.424 0.465) 2.885 9.738 ( 2.280 1.316 -0.082) 2.634 9.977 ( 7.790 4.497 -2.719) 9.397 10.386 ( 0.540 0.312 4.198) 4.244 10.689 ( 3.606 2.082 -1.171) 4.325 11.188 ( -7.624 -4.402 -1.126) 8.875 12.431 ( 1.957 1.130 -1.066) 2.499 14.296 ( 2.055 1.187 1.001) 2.575 14.990 ( 2.333 1.347 -0.524) 2.744 ======================= Grid point 493 (170/344) ======================= q-point: ( 0.60 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 1.645 0.950 -2.698) 3.299 2.565 ( -1.013 -0.585 5.748) 5.866 2.743 ( 2.406 1.389 -3.811) 4.716 3.065 ( 2.262 1.306 4.662) 5.344 3.388 ( 2.579 1.489 -7.872) 8.416 3.482 ( -1.959 -1.131 -1.634) 2.791 3.563 ( -1.229 -0.709 1.311) 1.932 3.611 ( 0.203 0.117 5.264) 5.269 4.656 ( 2.587 1.494 0.056) 2.988 4.819 ( -0.905 -0.523 -1.149) 1.553 5.276 ( 5.392 3.113 -0.191) 6.229 5.508 ( 0.275 0.159 5.031) 5.041 8.105 ( 0.427 0.246 1.391) 1.476 8.574 ( 1.729 0.999 -0.318) 2.022 8.845 ( -2.770 -1.599 0.354) 3.218 9.468 ( 0.829 0.479 0.171) 0.973 9.775 ( 0.873 0.504 0.079) 1.011 10.109 ( 4.262 2.461 -3.779) 6.205 10.372 ( -2.372 -1.369 4.974) 5.678 10.818 ( 6.736 3.889 -1.152) 7.863 11.018 ( -6.586 -3.802 -0.695) 7.636 12.465 ( 0.991 0.572 -0.270) 1.176 14.333 ( 0.875 0.505 1.343) 1.681 15.019 ( 0.462 0.267 -1.411) 1.508 ======================= Grid point 494 (171/344) ======================= q-point: (-0.33 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 0.921 0.532 -2.515) 2.731 2.530 ( -3.203 -1.849 4.736) 6.009 2.780 ( 1.533 0.885 -1.886) 2.587 3.031 ( -5.780 -3.337 2.801) 7.238 3.406 ( 0.521 0.301 -7.416) 7.440 3.487 ( 2.522 1.456 -2.212) 3.657 3.561 ( 0.414 0.239 2.102) 2.156 3.602 ( -2.105 -1.215 5.385) 5.908 4.656 ( -2.134 -1.232 0.156) 2.470 4.814 ( 0.512 0.296 -1.498) 1.611 5.300 ( -4.127 -2.382 0.181) 4.768 5.489 ( -2.195 -1.267 4.927) 5.541 8.074 ( -3.110 -1.795 -0.397) 3.613 8.608 ( 1.025 0.592 1.717) 2.086 8.830 ( 1.510 0.872 -0.497) 1.813 9.468 ( -0.890 -0.514 0.136) 1.036 9.776 ( -0.813 -0.469 0.135) 0.948 10.157 ( 0.395 0.228 -2.864) 2.900 10.305 ( -4.085 -2.358 2.860) 5.516 10.835 ( -5.157 -2.977 -0.074) 5.955 11.024 ( 7.293 4.211 -0.352) 8.429 12.474 ( -0.201 -0.116 0.266) 0.353 14.339 ( -0.687 -0.397 1.696) 1.873 15.007 ( -1.126 -0.650 -2.114) 2.482 ======================= Grid point 495 (172/344) ======================= q-point: (-0.27 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.386 ( -1.149 -0.664 0.933) 1.622 2.439 ( -4.244 -2.450 0.028) 4.900 2.775 ( -5.788 -3.342 4.781) 8.218 2.876 ( -3.503 -2.022 -3.383) 5.273 3.383 ( -1.109 -0.640 -5.794) 5.934 3.537 ( -4.367 -2.521 4.770) 6.942 3.555 ( 2.420 1.397 -1.379) 3.116 3.573 ( 0.608 0.351 0.613) 0.932 4.594 ( -3.077 -1.777 1.733) 3.954 4.812 ( -0.277 -0.160 -3.612) 3.626 5.084 ( -14.246 -8.225 2.144) 16.589 5.428 ( -4.354 -2.514 3.004) 5.857 7.968 ( -5.494 -3.172 -2.346) 6.763 8.627 ( 0.069 0.040 3.882) 3.883 8.910 ( 5.352 3.090 -0.911) 6.247 9.430 ( -2.316 -1.337 0.469) 2.716 9.740 ( -2.285 -1.319 0.050) 2.639 10.079 ( -7.760 -4.480 3.840) 9.748 10.228 ( -1.584 -0.915 -5.587) 5.879 10.742 ( -2.395 -1.383 1.843) 3.323 11.205 ( 8.027 4.634 -0.143) 9.270 12.456 ( -1.424 -0.822 0.324) 1.676 14.311 ( -2.061 -1.190 1.902) 3.046 14.957 ( -2.844 -1.642 -2.475) 4.112 ======================= Grid point 496 (173/344) ======================= q-point: (-0.20 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( -10.386 -5.996 4.356) 12.759 2.426 ( 1.537 0.887 -5.190) 5.485 2.515 ( -14.690 -8.482 4.026) 17.434 2.880 ( 1.403 0.810 -1.443) 2.170 3.324 ( -3.940 -2.275 -0.778) 4.616 3.434 ( -4.442 -2.565 1.342) 5.302 3.498 ( -5.571 -3.216 -2.023) 6.743 3.649 ( 3.762 2.172 -0.100) 4.346 4.502 ( -6.100 -3.522 0.945) 7.107 4.671 ( -20.981 -12.113 2.754) 24.383 4.811 ( 1.090 0.629 -3.505) 3.724 5.286 ( -8.339 -4.815 2.028) 9.840 7.825 ( -5.983 -3.454 -4.078) 8.022 8.633 ( -0.179 -0.103 4.934) 4.939 9.054 ( 6.585 3.802 -1.588) 7.768 9.375 ( -2.099 -1.212 2.053) 3.176 9.676 ( -2.999 -1.731 -0.377) 3.483 9.860 ( -10.951 -6.323 5.371) 13.739 10.187 ( -0.943 -0.544 -8.332) 8.403 10.741 ( 1.812 1.046 4.397) 4.869 11.392 ( 8.322 4.805 -0.663) 9.633 12.411 ( -2.457 -1.418 -0.089) 2.838 14.257 ( -2.895 -1.671 1.976) 3.883 14.862 ( -4.985 -2.878 -2.287) 6.194 ======================= Grid point 497 (174/344) ======================= q-point: (-0.13 0.13 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( -14.716 -8.496 3.299) 17.310 2.144 ( -18.045 -10.418 3.643) 21.153 2.456 ( 1.949 1.125 -6.433) 6.816 2.899 ( 0.010 0.006 0.056) 0.057 3.178 ( -8.665 -5.002 5.674) 11.502 3.285 ( -12.861 -7.425 -2.370) 15.038 3.368 ( -1.277 -0.737 -2.869) 3.226 3.704 ( -1.301 -0.751 -0.412) 1.558 4.151 ( -19.841 -11.455 0.993) 22.932 4.316 ( -11.211 -6.473 1.879) 13.081 4.813 ( -3.887 -2.244 -4.831) 6.595 5.108 ( -4.015 -2.318 2.402) 5.222 7.680 ( -5.716 -3.300 -4.724) 8.117 8.654 ( 1.548 0.894 3.666) 4.078 9.134 ( -0.361 -0.208 -3.240) 3.267 9.392 ( 2.769 1.599 5.527) 6.385 9.621 ( -0.522 -0.301 -1.402) 1.526 9.634 ( -9.167 -5.293 6.096) 12.215 10.143 ( -1.261 -0.728 -8.765) 8.885 10.854 ( 7.178 4.144 7.239) 11.004 11.586 ( 8.673 5.007 -2.723) 10.378 12.345 ( -3.110 -1.795 -0.757) 3.670 14.189 ( -3.255 -1.879 2.337) 4.426 14.714 ( -7.503 -4.332 -1.242) 8.752 ======================= Grid point 502 (175/344) ======================= q-point: ( 0.20 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.737 ( 0.000 20.721 17.312) 27.002 0.812 ( 0.000 22.727 19.114) 29.696 1.351 ( 0.000 36.741 29.067) 46.848 2.240 ( -0.000 3.488 -14.360) 14.778 2.366 ( -0.000 12.796 -12.786) 18.089 2.855 ( 0.000 2.224 10.884) 11.109 2.927 ( 0.000 8.472 7.385) 11.239 3.333 ( -0.000 -0.583 -3.451) 3.499 3.440 ( -0.000 8.743 -2.293) 9.039 3.872 ( -0.000 2.963 -19.691) 19.913 4.306 ( 0.000 -2.809 0.257) 2.820 5.435 ( 0.000 -4.932 6.440) 8.112 7.779 ( 0.000 -31.906 35.525) 47.750 8.929 ( 0.000 1.601 0.094) 1.604 9.113 ( -0.000 -8.956 -9.551) 13.094 9.287 ( -0.000 2.482 0.033) 2.482 9.437 ( 0.000 -3.336 5.834) 6.720 9.812 ( -0.000 8.096 -6.258) 10.232 10.068 ( 0.000 -4.833 1.985) 5.225 11.301 ( -0.000 42.210 -38.756) 57.303 12.026 ( 0.000 -11.960 1.647) 12.073 12.132 ( -0.000 1.507 -1.762) 2.319 13.976 ( 0.000 8.178 0.351) 8.185 15.152 ( 0.000 -66.292 67.101) 94.325 ======================= Grid point 503 (176/344) ======================= q-point: ( 0.27 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 12.592 20.360 12.538) 27.024 1.182 ( 10.758 20.876 14.555) 27.630 1.911 ( 14.339 30.569 10.199) 35.272 2.334 ( 8.508 5.215 -13.583) 16.855 2.536 ( 7.048 15.055 -5.452) 17.494 2.866 ( -2.996 5.353 10.836) 12.452 3.134 ( 8.454 7.275 7.061) 13.200 3.342 ( 1.872 0.166 -3.298) 3.796 3.592 ( 6.557 10.787 -2.274) 12.827 3.924 ( 4.983 5.542 -15.599) 17.288 4.265 ( -0.852 -0.642 -2.795) 2.991 5.359 ( -3.598 -5.908 4.772) 8.404 7.596 ( -1.790 -7.906 17.628) 19.402 8.960 ( -3.587 -10.739 -7.603) 13.638 8.989 ( 3.809 2.469 0.409) 4.558 9.317 ( 0.307 3.839 -0.068) 3.851 9.397 ( -4.070 2.097 6.981) 8.349 9.889 ( 2.170 -0.001 -6.845) 7.181 10.017 ( -0.080 -1.323 1.521) 2.018 11.389 ( -12.465 7.937 -13.705) 20.155 11.902 ( 3.153 -19.037 0.533) 19.304 12.255 ( 6.405 4.941 -6.100) 10.132 14.135 ( 7.228 9.316 0.692) 11.812 14.582 ( -17.977 -21.516 39.152) 48.155 ======================= Grid point 504 (177/344) ======================= q-point: ( 0.33 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 12.086 19.205 8.928) 24.385 1.617 ( 13.464 17.444 9.510) 24.000 2.343 ( 11.487 11.087 -10.219) 18.956 2.507 ( 5.501 7.846 -13.384) 16.461 2.866 ( 4.814 7.922 10.131) 13.732 3.012 ( 13.533 19.226 9.558) 25.380 3.340 ( 5.800 2.978 1.420) 6.673 3.403 ( 4.388 6.232 0.724) 7.656 3.851 ( 10.890 10.111 -2.134) 15.012 3.991 ( 0.917 -1.242 -3.557) 3.877 4.362 ( 10.160 9.848 -9.307) 16.936 5.223 ( -5.696 -6.248 2.711) 8.878 7.611 ( 3.796 -0.188 6.386) 7.431 8.774 ( -5.280 -7.341 -2.684) 9.432 9.099 ( 4.546 4.261 0.411) 6.244 9.374 ( 0.293 5.386 -0.152) 5.396 9.391 ( -0.203 2.491 5.350) 5.905 9.818 ( -4.783 -3.711 -0.783) 6.104 10.074 ( 3.936 2.631 -4.182) 6.317 11.132 ( -14.516 -4.016 0.703) 15.078 11.735 ( 1.444 -21.856 -2.281) 22.022 12.346 ( -0.735 7.577 -3.729) 8.477 14.282 ( -7.454 2.930 8.885) 11.963 14.414 ( 9.814 1.643 7.278) 12.328 ======================= Grid point 505 (178/344) ======================= q-point: ( 0.40 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 8.005 17.414 5.802) 20.024 2.023 ( 12.766 14.466 4.980) 19.926 2.546 ( 5.798 3.689 -6.661) 9.570 2.623 ( 3.662 6.857 -10.173) 12.803 3.005 ( 2.881 8.996 3.613) 10.114 3.423 ( 2.514 3.182 -0.152) 4.058 3.465 ( 10.811 10.409 9.301) 17.656 3.604 ( 6.628 6.558 -1.892) 9.514 4.009 ( 6.440 4.191 0.231) 7.687 4.158 ( 12.872 8.367 0.808) 15.374 4.687 ( 14.613 10.616 -7.410) 19.523 5.072 ( -4.485 -5.236 1.687) 7.098 7.720 ( 6.342 1.647 1.608) 6.746 8.631 ( -4.393 -4.068 1.052) 6.078 9.221 ( 3.571 5.559 -0.631) 6.637 9.404 ( -3.527 5.027 2.604) 6.671 9.484 ( 5.478 4.052 1.827) 7.054 9.698 ( -5.399 0.004 0.615) 5.434 10.161 ( 4.871 1.692 -4.810) 7.052 10.871 ( -9.492 -6.407 4.647) 12.359 11.526 ( -0.399 -19.472 -3.223) 19.741 12.399 ( -2.080 9.847 -2.230) 10.308 14.229 ( -3.301 3.523 3.919) 6.218 14.639 ( 10.441 2.007 1.968) 10.812 ======================= Grid point 506 (179/344) ======================= q-point: ( 0.47 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 3.126 15.334 2.599) 15.863 2.363 ( 10.412 11.615 0.837) 15.621 2.612 ( -1.182 5.620 0.518) 5.767 2.741 ( 5.814 2.799 -5.102) 8.226 3.162 ( 4.176 8.906 -2.256) 10.092 3.502 ( 1.736 4.426 2.150) 5.218 3.634 ( -1.096 -1.174 -1.974) 2.545 3.664 ( 1.907 4.914 5.195) 7.401 4.266 ( 11.410 6.154 -4.449) 13.706 4.501 ( 15.091 10.471 4.282) 18.860 4.901 ( 1.126 0.070 0.240) 1.154 5.091 ( 11.252 3.428 -1.375) 11.843 7.857 ( 6.823 1.793 1.053) 7.133 8.546 ( -2.154 -2.055 1.521) 3.343 9.284 ( -7.079 4.551 -2.891) 8.898 9.363 ( -2.008 5.022 5.391) 7.636 9.645 ( 5.427 3.066 -0.919) 6.300 9.697 ( 3.795 5.999 1.014) 7.171 10.258 ( 5.538 1.291 -2.891) 6.380 10.703 ( -4.167 -5.554 4.026) 8.026 11.329 ( -0.684 -16.522 -2.674) 16.751 12.461 ( -2.541 11.276 -1.675) 11.680 14.239 ( -0.226 2.770 1.495) 3.155 14.810 ( 7.963 -0.338 0.615) 7.994 ======================= Grid point 507 (180/344) ======================= q-point: ( 0.53 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( -1.283 13.329 -0.170) 13.391 2.604 ( 5.822 7.496 -3.260) 10.036 2.645 ( -2.823 7.522 4.116) 9.027 2.862 ( 6.643 1.443 0.622) 6.826 3.304 ( 3.458 7.337 -4.658) 9.353 3.561 ( -1.923 2.476 3.272) 4.531 3.582 ( -0.042 -0.923 -0.686) 1.150 3.710 ( -3.602 5.578 1.895) 6.905 4.464 ( 7.785 3.147 -2.316) 8.710 4.796 ( 5.147 3.666 -1.513) 6.497 4.961 ( 8.892 2.574 4.514) 10.299 5.323 ( 10.079 1.914 1.030) 10.311 7.987 ( 5.688 1.054 2.288) 6.221 8.520 ( 0.506 -0.736 -0.303) 0.943 9.131 ( -12.357 4.844 0.942) 13.306 9.433 ( 1.050 4.926 1.085) 5.152 9.721 ( 2.078 2.693 -0.296) 3.415 9.889 ( 7.784 6.263 -1.441) 10.094 10.357 ( 4.216 0.709 1.226) 4.447 10.634 ( 1.329 -3.704 0.997) 4.059 11.158 ( -0.911 -14.095 -1.784) 14.236 12.524 ( -3.527 12.206 -1.123) 12.755 14.274 ( 1.435 1.089 1.141) 2.132 14.913 ( 5.620 -2.349 -0.453) 6.108 ======================= Grid point 508 (181/344) ======================= q-point: ( 0.60 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( -4.012 11.734 -1.608) 12.505 2.657 ( -3.466 5.659 4.327) 7.922 2.726 ( 1.118 5.775 -3.704) 6.951 2.996 ( 6.185 0.690 2.325) 6.643 3.399 ( 2.271 3.387 -3.746) 5.538 3.533 ( -3.935 5.059 -0.462) 6.426 3.572 ( -1.926 -1.048 1.206) 2.503 3.703 ( -4.240 7.130 2.399) 8.636 4.600 ( 5.389 1.362 -0.129) 5.560 4.819 ( -0.359 -0.955 -1.517) 1.828 5.180 ( 8.893 2.677 1.601) 9.424 5.462 ( 5.153 -1.854 3.951) 6.753 8.072 ( 2.938 -0.679 2.826) 4.133 8.539 ( 2.159 -0.318 -1.898) 2.892 8.995 ( -10.006 7.119 1.274) 12.346 9.487 ( -0.242 3.965 0.355) 3.988 9.771 ( 1.005 1.881 0.036) 2.133 10.050 ( 5.222 3.947 -3.227) 7.298 10.393 ( -0.406 -1.537 4.677) 4.940 10.697 ( 8.234 -1.004 -1.311) 8.398 11.002 ( -1.724 -12.077 -1.220) 12.261 12.574 ( -4.878 12.429 -0.485) 13.361 14.310 ( 1.851 -0.523 1.446) 2.406 14.960 ( 3.769 -3.881 -1.367) 5.580 ======================= Grid point 509 (182/344) ======================= q-point: (-0.33 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( -5.013 10.608 -2.124) 11.924 2.645 ( -5.387 4.981 4.619) 8.670 2.773 ( 0.033 3.978 -3.519) 5.311 3.060 ( 0.295 -1.742 2.187) 2.811 3.443 ( 2.711 -0.922 -1.358) 3.169 3.480 ( -6.569 5.146 -2.863) 8.822 3.574 ( -0.595 4.304 0.312) 4.356 3.705 ( -4.505 6.404 3.553) 8.598 4.660 ( 0.778 -0.856 0.232) 1.180 4.798 ( 0.166 -1.167 -1.533) 1.933 5.293 ( 2.475 -1.497 0.252) 2.904 5.486 ( 0.645 -4.744 5.483) 7.279 8.080 ( -0.627 -2.879 1.773) 3.439 8.568 ( 2.267 -1.151 -1.687) 3.051 8.944 ( -6.210 10.495 1.409) 12.276 9.504 ( -1.761 2.975 0.181) 3.462 9.790 ( -0.461 0.836 0.136) 0.964 10.134 ( 2.279 1.695 -4.124) 5.007 10.350 ( -2.982 -2.833 4.825) 6.340 10.847 ( 0.380 -3.398 -1.008) 3.565 10.858 ( 7.931 -7.960 -0.670) 11.257 12.599 ( -6.290 11.820 0.007) 13.389 14.330 ( 1.108 -1.494 1.847) 2.621 14.964 ( 2.289 -4.957 -2.090) 5.846 ======================= Grid point 510 (183/344) ======================= q-point: (-0.27 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( -5.046 9.505 -2.265) 10.997 2.582 ( -8.482 4.121 3.820) 10.174 2.802 ( 0.389 2.485 -2.064) 3.254 2.971 ( -8.228 -2.426 2.300) 8.881 3.418 ( -2.832 1.603 -4.515) 5.566 3.499 ( 4.094 -0.440 -0.618) 4.164 3.581 ( -4.567 3.956 1.912) 6.337 3.693 ( -5.197 6.787 2.046) 8.790 4.627 ( -2.357 -1.713 1.329) 3.202 4.789 ( 0.695 -1.915 -3.048) 3.666 5.206 ( -7.954 -7.104 1.407) 10.757 5.442 ( -0.919 -5.518 4.348) 7.085 8.005 ( -3.721 -4.391 0.039) 5.756 8.584 ( 2.087 -2.567 0.074) 3.309 8.992 ( -2.831 13.715 1.269) 14.061 9.487 ( -3.340 2.303 0.348) 4.072 9.772 ( -2.060 -0.003 0.088) 2.062 10.143 ( -1.606 -0.409 -2.584) 3.070 10.252 ( -4.984 -3.938 1.953) 6.645 10.732 ( -0.758 -7.206 0.196) 7.248 11.024 ( 11.623 -3.384 -0.348) 12.110 12.591 ( -7.485 10.488 0.132) 12.885 14.325 ( -0.382 -1.443 2.101) 2.577 14.932 ( 0.785 -5.738 -2.492) 6.305 ======================= Grid point 511 (184/344) ======================= q-point: (-0.20 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( -11.865 2.433 4.346) 12.868 2.488 ( -4.816 7.943 -4.471) 10.309 2.730 ( -14.429 -1.856 5.298) 15.483 2.853 ( 1.018 0.925 -3.728) 3.973 3.382 ( -1.218 -0.303 -4.679) 4.845 3.484 ( -7.999 0.373 3.595) 8.778 3.586 ( 3.733 1.149 -0.121) 3.907 3.653 ( -7.125 5.322 0.040) 8.893 4.556 ( -4.050 -3.272 1.330) 5.374 4.773 ( 0.606 -1.442 -4.338) 4.611 4.904 ( -16.250 -10.209 3.457) 19.500 5.344 ( -4.422 -6.993 2.494) 8.641 7.877 ( -5.348 -4.404 -1.651) 7.122 8.593 ( 2.274 -3.492 2.262) 4.742 9.110 ( -0.953 14.846 0.331) 14.880 9.442 ( -4.273 2.227 1.286) 4.988 9.721 ( -3.373 -0.493 -0.185) 3.414 10.009 ( -10.605 -4.349 5.032) 12.518 10.167 ( -0.570 -2.365 -7.232) 7.630 10.695 ( 2.867 -4.090 2.425) 5.552 11.188 ( 12.513 -5.372 -0.487) 13.627 12.551 ( -8.191 8.783 -0.154) 12.011 14.299 ( -2.097 -0.291 2.143) 3.012 14.863 ( -1.151 -6.443 -2.398) 6.970 ======================= Grid point 512 (185/344) ======================= q-point: (-0.13 0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -16.492 -0.228 3.270) 16.815 2.399 ( -17.693 -3.052 3.166) 18.231 2.505 ( -4.957 6.935 -3.884) 9.368 2.881 ( 1.353 0.550 -3.060) 3.391 3.297 ( -7.019 -8.006 4.117) 11.415 3.362 ( -6.212 4.989 -2.877) 8.471 3.524 ( -10.945 2.965 0.141) 11.340 3.676 ( 3.580 0.694 -0.472) 3.677 4.376 ( -13.752 -8.777 -3.612) 16.710 4.463 ( -17.010 -9.631 6.635) 20.643 4.814 ( 1.672 1.627 -3.517) 4.221 5.165 ( -6.996 -7.605 1.637) 10.462 7.738 ( -5.584 -3.090 -2.895) 7.008 8.609 ( 2.844 -3.066 3.368) 5.370 9.206 ( -3.673 8.907 -2.215) 9.886 9.422 ( -1.569 4.626 3.881) 6.239 9.655 ( -3.393 0.052 -0.819) 3.491 9.782 ( -10.849 -3.601 6.311) 13.057 10.122 ( -0.142 -1.961 -8.659) 8.880 10.764 ( 7.162 -0.720 4.990) 8.758 11.347 ( 13.473 -7.482 -1.636) 15.498 12.487 ( -8.196 7.350 -0.725) 11.033 14.259 ( -3.699 1.512 2.224) 4.573 14.750 ( -3.644 -7.137 -1.633) 8.178 ======================= Grid point 518 (186/344) ======================= q-point: ( 0.27 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( 0.000 22.275 12.372) 25.480 1.356 ( 0.000 23.549 14.576) 27.695 2.164 ( 0.000 32.083 2.777) 32.203 2.259 ( -0.000 4.114 -13.372) 13.991 2.643 ( -0.000 19.088 0.294) 19.090 2.974 ( 0.000 5.067 9.722) 10.963 3.166 ( 0.000 12.046 7.354) 14.113 3.303 ( -0.000 -0.642 -4.137) 4.187 3.663 ( -0.000 13.880 -2.669) 14.134 3.917 ( -0.000 7.950 -13.628) 15.777 4.264 ( -0.000 1.609 -5.024) 5.275 5.334 ( 0.000 -7.321 4.565) 8.628 7.563 ( 0.000 -6.214 13.125) 14.521 8.869 ( -0.000 -9.393 -5.811) 11.045 8.978 ( -0.000 3.218 0.054) 3.219 9.355 ( 0.000 4.173 0.288) 4.183 9.488 ( 0.000 3.896 8.025) 8.921 9.888 ( -0.000 3.415 -9.312) 9.918 9.938 ( 0.000 -8.925 2.390) 9.240 11.616 ( -0.000 8.135 -16.569) 18.458 11.690 ( 0.000 -21.368 6.236) 22.259 12.168 ( -0.000 2.929 -2.151) 3.634 14.160 ( 0.000 7.470 3.015) 8.056 14.603 ( 0.000 -16.815 26.742) 31.589 ======================= Grid point 519 (187/344) ======================= q-point: ( 0.33 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( 9.686 20.304 10.255) 24.723 1.676 ( 6.422 22.133 11.094) 25.577 2.298 ( 3.811 7.248 -11.336) 13.985 2.471 ( 5.591 13.490 -14.100) 20.299 2.920 ( 4.430 18.801 12.495) 23.005 3.088 ( 4.121 13.049 9.170) 16.473 3.294 ( 2.430 3.122 -1.407) 4.199 3.378 ( 5.607 8.610 1.936) 10.456 3.834 ( 4.334 13.187 -1.957) 14.018 3.973 ( 0.234 3.812 -4.837) 6.163 4.328 ( 3.805 11.070 -9.810) 15.273 5.239 ( -3.236 -7.409 3.138) 8.673 7.566 ( 2.130 -0.865 6.182) 6.596 8.761 ( -2.198 -6.049 -2.436) 6.881 9.057 ( 4.534 3.970 0.155) 6.028 9.407 ( 0.654 4.729 0.917) 4.862 9.501 ( -4.651 4.674 6.817) 9.485 9.822 ( -1.036 -3.050 -3.804) 4.985 9.982 ( 6.548 -2.340 -2.967) 7.560 11.391 ( -16.630 -8.721 3.510) 19.103 11.519 ( -1.875 -12.490 -5.339) 13.712 12.315 ( 8.686 3.595 -3.535) 10.043 14.285 ( 7.005 1.792 5.497) 9.083 14.476 ( -7.620 0.575 10.276) 12.806 ======================= Grid point 520 (188/344) ======================= q-point: ( 0.40 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( 9.571 16.638 8.337) 20.926 2.051 ( 8.794 21.421 5.744) 23.858 2.445 ( 7.620 5.565 -8.854) 12.939 2.616 ( 3.741 7.593 -12.976) 15.493 3.099 ( -0.125 10.392 8.664) 13.531 3.379 ( 5.556 2.134 -2.188) 6.341 3.425 ( 9.640 14.216 7.906) 18.908 3.581 ( 5.371 9.260 -0.438) 10.714 3.978 ( 2.063 3.135 -0.085) 3.754 4.082 ( 6.703 13.851 1.139) 15.429 4.569 ( 10.286 13.936 -8.929) 19.488 5.101 ( -4.921 -6.357 1.945) 8.271 7.642 ( 4.747 1.900 2.092) 5.524 8.662 ( -3.533 -3.695 1.091) 5.227 9.200 ( 5.926 5.612 -0.181) 8.164 9.465 ( 1.026 3.314 3.170) 4.699 9.509 ( -1.147 6.965 1.213) 7.162 9.783 ( -2.598 1.086 -1.265) 3.087 10.065 ( 6.176 -1.918 -2.837) 7.062 11.022 ( -15.081 -8.976 4.655) 18.157 11.337 ( -1.845 -14.792 -4.257) 15.502 12.468 ( 4.260 6.342 -2.345) 7.992 14.353 ( -2.891 0.346 5.510) 6.232 14.500 ( 5.667 5.298 1.199) 7.850 ======================= Grid point 521 (189/344) ======================= q-point: ( 0.47 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( 7.489 13.384 5.547) 16.309 2.402 ( 5.490 21.190 1.129) 21.919 2.610 ( 6.841 4.398 -3.770) 8.964 2.716 ( 2.294 7.074 -7.805) 10.780 3.204 ( 0.580 7.346 4.266) 8.514 3.504 ( 4.464 4.948 -1.022) 6.742 3.656 ( -1.110 1.390 -0.996) 2.038 3.675 ( 5.357 7.699 4.028) 10.208 4.143 ( 8.714 8.079 -3.363) 12.350 4.390 ( 11.630 13.599 5.361) 18.680 4.867 ( 9.656 10.053 -5.147) 14.859 4.974 ( -1.568 -5.178 1.947) 5.749 7.767 ( 6.112 2.958 1.432) 6.939 8.572 ( -3.235 -2.970 2.129) 4.880 9.347 ( 3.129 7.162 -1.072) 7.889 9.544 ( -2.970 6.741 1.641) 7.547 9.575 ( 3.991 4.979 0.141) 6.383 9.752 ( -2.704 4.955 0.948) 5.724 10.152 ( 6.440 -0.961 -2.571) 7.000 10.743 ( -7.979 -8.421 4.531) 12.454 11.151 ( -0.849 -15.372 -3.830) 15.864 12.593 ( 1.312 10.294 -1.381) 10.468 14.316 ( -3.914 3.409 1.567) 5.422 14.654 ( 8.151 -0.762 0.931) 8.240 ======================= Grid point 522 (190/344) ======================= q-point: ( 0.53 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 3.436 11.503 2.972) 12.368 2.646 ( 0.893 15.619 -3.680) 16.072 2.759 ( 4.474 7.379 2.597) 9.012 2.807 ( 0.570 8.673 -3.590) 9.404 3.290 ( 2.829 2.702 0.870) 4.007 3.558 ( 0.012 -2.628 -1.535) 3.043 3.678 ( -1.342 10.604 1.714) 10.825 3.815 ( 0.577 8.028 1.492) 8.186 4.349 ( 8.351 4.419 -3.565) 10.098 4.728 ( 10.241 9.786 2.515) 14.386 4.885 ( 0.195 -1.542 2.657) 3.078 5.146 ( 11.682 1.914 -0.449) 11.846 7.908 ( 5.842 2.901 3.006) 7.182 8.508 ( -1.065 -2.364 -0.006) 2.593 9.413 ( -7.896 8.989 -2.410) 12.205 9.503 ( -4.026 6.536 3.807) 8.569 9.703 ( 3.935 3.342 -1.243) 5.310 9.841 ( 4.773 7.226 0.134) 8.661 10.262 ( 7.072 0.187 -0.722) 7.111 10.588 ( -2.212 -7.440 3.071) 8.347 10.990 ( 0.819 -15.011 -2.969) 15.324 12.713 ( -1.322 13.936 -0.866) 14.026 14.293 ( -2.080 1.804 0.902) 2.897 14.762 ( 7.109 -4.337 -0.083) 8.328 ======================= Grid point 523 (191/344) ======================= q-point: ( 0.60 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( -1.404 9.963 0.486) 10.073 2.743 ( -1.706 8.589 -1.203) 8.839 2.876 ( -3.865 12.910 0.495) 13.485 2.928 ( 4.161 7.231 -1.007) 8.403 3.352 ( 2.956 -1.430 0.403) 3.308 3.535 ( 1.156 -1.281 -0.686) 1.857 3.757 ( -4.988 13.607 1.673) 14.589 3.868 ( -4.019 9.074 0.046) 9.925 4.506 ( 6.683 1.939 -1.254) 7.071 4.814 ( -0.570 -0.227 -0.756) 0.974 5.042 ( 10.208 2.747 3.164) 11.035 5.321 ( 8.608 -3.051 2.400) 9.442 8.025 ( 3.535 1.446 4.862) 6.183 8.490 ( 1.574 -1.547 -3.351) 4.013 9.298 ( -13.143 10.743 1.194) 17.017 9.551 ( -0.857 6.216 0.879) 6.336 9.774 ( 1.440 2.571 -0.286) 2.960 9.997 ( 5.276 5.057 -2.406) 7.694 10.371 ( 3.413 -0.223 3.362) 4.796 10.534 ( 4.679 -6.446 -0.369) 7.974 10.865 ( 1.564 -13.082 -2.161) 13.351 12.815 ( -4.483 16.466 -0.493) 17.073 14.284 ( 0.082 -0.667 1.310) 1.473 14.816 ( 5.847 -6.877 -1.103) 9.094 ======================= Grid point 524 (192/344) ======================= q-point: ( 0.67 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.677 ( -3.662 8.040 -1.301) 8.930 2.776 ( -4.385 8.692 1.836) 9.908 2.911 ( -5.931 11.293 -1.564) 12.851 3.039 ( 2.003 4.287 -1.047) 4.847 3.373 ( 2.801 -3.023 0.135) 4.123 3.553 ( -0.454 0.489 1.408) 1.558 3.781 ( -8.398 15.381 -0.253) 17.526 3.879 ( -5.198 9.301 0.890) 10.692 4.610 ( 4.172 -0.069 0.222) 4.178 4.788 ( -1.078 -1.529 -1.422) 2.350 5.201 ( 6.275 -1.342 1.476) 6.584 5.391 ( 4.582 -6.998 4.244) 9.380 8.068 ( -0.026 -1.238 4.767) 4.925 8.509 ( 2.652 -0.940 -4.727) 5.501 9.218 ( -10.123 13.493 2.395) 17.037 9.584 ( -2.244 5.394 0.358) 5.853 9.807 ( 0.012 1.542 0.056) 1.544 10.100 ( 2.960 2.545 -3.788) 5.439 10.370 ( -1.376 -2.792 4.825) 5.742 10.606 ( 9.503 -8.656 -0.991) 12.893 10.777 ( 1.615 -7.564 -1.918) 7.969 12.878 ( -7.759 17.066 -0.214) 18.748 14.288 ( 1.563 -2.155 1.923) 3.284 14.827 ( 4.862 -8.511 -1.939) 9.992 ======================= Grid point 525 (193/344) ======================= q-point: (-0.27 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( -4.355 7.455 -2.191) 8.908 2.768 ( -6.907 6.905 3.856) 10.500 2.896 ( -6.307 9.148 -3.816) 11.749 3.074 ( -2.565 3.448 0.310) 4.308 3.408 ( 4.405 -2.078 -0.309) 4.881 3.498 ( -5.942 -0.325 1.526) 6.143 3.789 ( -8.193 13.623 -0.013) 15.897 3.875 ( -5.973 9.007 0.717) 10.831 4.643 ( -0.244 -0.703 1.643) 1.804 4.747 ( -0.029 -3.058 -2.981) 4.271 5.221 ( -0.994 -5.613 0.864) 5.766 5.372 ( 1.852 -8.747 4.887) 10.189 8.024 ( -3.012 -3.470 3.140) 5.565 8.529 ( 1.826 -1.235 -3.460) 4.103 9.233 ( -6.196 16.464 2.573) 17.778 9.585 ( -3.542 4.856 0.419) 6.025 9.807 ( -1.355 0.685 0.055) 1.519 10.134 ( 0.677 0.129 -4.834) 4.883 10.307 ( -3.849 -3.579 5.019) 7.267 10.604 ( 4.072 -12.442 -1.111) 13.138 10.809 ( 7.656 -3.452 -0.959) 8.453 12.883 ( -10.266 15.312 -0.106) 18.435 14.302 ( 1.668 -1.642 2.313) 3.291 14.809 ( 3.913 -9.276 -2.422) 10.355 ======================= Grid point 526 (194/344) ======================= q-point: (-0.20 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.667 ( -6.375 7.659 -1.636) 10.098 2.674 ( -9.282 2.839 1.980) 9.907 2.881 ( -4.014 7.410 -3.315) 9.056 3.002 ( -11.443 4.860 2.211) 12.627 3.386 ( -3.987 -3.433 0.028) 5.262 3.479 ( 5.385 -1.138 -0.093) 5.505 3.743 ( -10.814 10.111 1.099) 14.845 3.848 ( -7.423 7.523 -0.347) 10.575 4.591 ( -3.723 -3.427 0.839) 5.129 4.730 ( 1.622 -1.116 -2.601) 3.262 5.050 ( -10.409 -8.501 2.098) 13.602 5.310 ( -0.236 -8.970 3.268) 9.550 7.921 ( -4.795 -3.952 1.666) 6.433 8.534 ( 1.356 -1.946 -1.205) 2.660 9.327 ( -3.998 17.560 1.445) 18.067 9.562 ( -4.816 4.935 1.223) 7.003 9.775 ( -2.753 0.219 -0.181) 2.768 10.110 ( -1.048 -2.052 -4.808) 5.332 10.172 ( -7.928 -4.716 3.751) 9.959 10.567 ( 4.838 -8.515 -0.019) 9.794 10.919 ( 10.397 -6.128 -0.569) 12.082 12.830 ( -11.375 11.757 -0.211) 16.360 14.321 ( 0.429 0.659 2.267) 2.399 14.766 ( 2.474 -9.318 -2.350) 9.923 ======================= Grid point 527 (195/344) ======================= q-point: (-0.13 0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( -14.133 0.154 2.572) 14.366 2.639 ( -6.770 7.131 -3.618) 10.478 2.783 ( -18.365 4.089 3.219) 19.088 2.886 ( -1.834 4.274 -3.666) 5.922 3.295 ( -2.146 -5.753 1.209) 6.259 3.544 ( -0.099 0.915 -0.201) 0.942 3.652 ( -6.920 6.430 0.731) 9.474 3.755 ( -10.032 4.480 -0.163) 10.988 4.452 ( -6.493 -6.318 -2.345) 9.358 4.698 ( -15.111 -7.116 3.667) 17.101 4.797 ( 0.053 1.380 -0.808) 1.599 5.187 ( -4.340 -8.819 1.434) 9.933 7.801 ( -5.302 -2.520 0.512) 5.893 8.539 ( 2.024 -2.338 0.972) 3.242 9.395 ( -6.244 10.249 -1.359) 12.078 9.546 ( -4.396 7.887 2.674) 9.417 9.721 ( -3.608 0.817 -0.384) 3.719 9.956 ( -11.234 -3.160 5.841) 13.050 10.071 ( 0.777 -3.698 -7.134) 8.073 10.611 ( 7.840 -4.770 1.893) 9.370 11.042 ( 11.728 -7.261 -1.050) 13.834 12.731 ( -10.907 7.697 -0.500) 13.359 14.337 ( -1.571 3.226 1.850) 4.037 14.695 ( 0.186 -8.560 -1.566) 8.704 ======================= Grid point 534 (196/344) ======================= q-point: ( 0.33 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.718 ( 0.000 19.995 9.981) 22.348 1.871 ( 0.000 21.938 11.213) 24.637 2.276 ( -0.000 2.682 -9.593) 9.961 2.529 ( -0.000 11.713 -17.711) 21.234 3.130 ( 0.000 6.148 4.703) 7.741 3.137 ( 0.000 20.384 14.361) 24.935 3.282 ( -0.000 0.986 -2.775) 2.945 3.475 ( 0.000 15.849 3.044) 16.138 3.911 ( -0.000 9.330 -1.895) 9.520 4.050 ( -0.000 12.225 -0.820) 12.252 4.402 ( -0.000 14.877 -10.597) 18.265 5.202 ( 0.000 -6.710 2.531) 7.171 7.559 ( 0.000 1.367 4.244) 4.459 8.731 ( -0.000 -2.943 -1.088) 3.137 9.051 ( 0.000 3.689 0.388) 3.710 9.451 ( 0.000 5.140 0.500) 5.164 9.639 ( 0.000 7.110 9.279) 11.690 9.745 ( 0.000 -10.947 2.188) 11.164 9.885 ( -0.000 1.377 -11.199) 11.284 11.302 ( 0.000 -18.727 5.202) 19.436 11.606 ( -0.000 -2.523 -6.336) 6.820 12.227 ( -0.000 3.787 -2.231) 4.395 14.242 ( 0.000 -0.304 5.487) 5.496 14.584 ( 0.000 4.739 5.061) 6.933 ======================= Grid point 535 (197/344) ======================= q-point: ( 0.40 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 7.464 17.418 8.311) 20.692 2.144 ( 4.703 19.662 7.455) 21.548 2.350 ( 6.977 3.992 -6.365) 10.253 2.601 ( 2.045 6.764 -15.360) 16.908 3.234 ( 2.021 9.753 5.706) 11.479 3.275 ( 2.705 0.889 -1.436) 3.189 3.425 ( 7.012 10.569 7.129) 14.550 3.620 ( 0.770 8.399 -0.802) 8.472 4.014 ( 0.833 10.603 0.182) 10.637 4.203 ( 0.193 18.253 2.316) 18.401 4.571 ( 4.303 14.654 -8.436) 17.448 5.123 ( -3.160 -3.826 1.373) 5.149 7.614 ( 2.314 3.901 2.545) 5.201 8.689 ( -2.511 -1.656 0.616) 3.070 9.139 ( 5.633 3.841 0.366) 6.828 9.507 ( -0.149 4.132 2.409) 4.785 9.589 ( -2.361 0.196 0.698) 2.470 9.804 ( 2.902 3.723 4.401) 6.454 9.910 ( 5.214 -1.820 -7.060) 8.963 11.096 ( -5.553 -15.624 4.314) 17.134 11.394 ( -14.221 -3.918 -4.579) 15.445 12.377 ( 9.947 3.863 -2.079) 10.871 14.291 ( 4.450 -0.893 3.292) 5.607 14.612 ( -4.153 7.379 2.239) 8.758 ======================= Grid point 536 (198/344) ======================= q-point: ( 0.47 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( 6.529 14.302 6.453) 16.994 2.455 ( 10.638 13.054 0.371) 16.844 2.544 ( 6.621 10.708 -1.631) 12.695 2.684 ( 5.217 4.440 -9.896) 12.036 3.290 ( -1.664 3.652 4.060) 5.709 3.445 ( 8.296 6.592 -1.107) 10.654 3.646 ( 5.287 4.445 1.076) 6.990 3.664 ( 2.447 3.001 2.026) 4.370 4.146 ( 1.486 11.577 -2.961) 12.042 4.436 ( 3.519 19.079 5.112) 20.063 4.779 ( 7.683 7.075 -3.494) 11.013 5.035 ( -5.406 1.892 -0.119) 5.729 7.723 ( 4.085 5.456 2.355) 7.211 8.609 ( -4.058 -2.860 1.421) 5.164 9.309 ( 8.071 4.930 -0.200) 9.460 9.544 ( 1.608 3.379 1.517) 4.038 9.637 ( 2.364 4.931 -1.016) 5.562 9.854 ( -2.250 5.301 -1.464) 5.942 10.004 ( 7.586 -1.354 1.073) 7.780 10.825 ( -10.089 -10.976 3.501) 15.314 11.114 ( -9.998 -6.933 -4.170) 12.861 12.587 ( 8.618 6.424 -1.259) 10.822 14.359 ( 2.774 -0.567 0.644) 2.904 14.615 ( -2.674 4.987 1.765) 5.927 ======================= Grid point 537 (199/344) ======================= q-point: ( 0.53 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( 4.909 11.393 3.714) 12.949 2.667 ( 5.187 2.753 -2.084) 6.231 2.812 ( 7.499 17.932 -1.134) 19.469 2.846 ( 6.305 8.690 -3.949) 11.439 3.295 ( -1.190 0.876 3.144) 3.474 3.534 ( -0.611 -1.953 -1.327) 2.439 3.756 ( 5.705 9.362 0.716) 10.987 3.844 ( 5.377 7.392 1.563) 9.274 4.283 ( 4.196 7.605 -3.337) 9.305 4.700 ( 5.926 13.980 3.656) 15.619 4.889 ( 1.608 -4.169 2.430) 5.087 5.037 ( 1.651 8.336 -2.176) 8.772 7.866 ( 4.774 5.897 3.716) 8.448 8.513 ( -3.026 -3.549 -0.226) 4.670 9.485 ( 5.052 6.484 -0.328) 8.226 9.643 ( 4.055 4.503 -1.317) 6.201 9.708 ( -2.120 6.411 0.802) 6.799 9.859 ( -0.244 3.565 -1.477) 3.866 10.135 ( 7.025 1.634 1.930) 7.467 10.587 ( -6.412 -8.354 3.050) 10.964 10.889 ( -5.609 -9.395 -3.910) 11.620 12.798 ( 6.103 10.459 -0.648) 12.127 14.364 ( -2.231 0.889 -0.411) 2.437 14.632 ( 1.966 -1.599 1.255) 2.827 ======================= Grid point 538 (200/344) ======================= q-point: ( 0.60 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( 1.289 7.174 0.382) 7.299 2.774 ( 4.875 3.647 1.090) 6.184 3.008 ( 0.766 11.598 -1.941) 11.784 3.075 ( 1.499 17.015 -2.974) 17.338 3.291 ( 1.036 -2.083 2.591) 3.482 3.497 ( 0.891 -1.807 -0.189) 2.023 3.940 ( 1.226 13.140 1.229) 13.254 3.983 ( 1.327 8.105 -0.243) 8.217 4.425 ( 5.449 4.623 -2.071) 7.440 4.843 ( -2.131 0.076 0.731) 2.254 4.929 ( 6.873 5.403 3.028) 9.252 5.154 ( 6.354 -1.331 0.914) 6.556 8.008 ( 3.435 4.976 6.164) 8.634 8.444 ( -0.203 -3.140 -3.938) 5.041 9.596 ( -2.569 9.169 -1.368) 9.620 9.654 ( -7.336 7.343 3.035) 10.815 9.759 ( 2.926 2.581 -0.841) 3.991 9.944 ( 5.891 2.378 -2.511) 6.831 10.281 ( 6.564 2.142 2.520) 7.350 10.449 ( -1.833 -6.948 2.120) 7.491 10.721 ( -1.024 -10.399 -3.652) 11.069 12.999 ( 2.452 14.581 -0.335) 14.789 14.315 ( -3.475 0.013 0.346) 3.493 14.645 ( 4.199 -6.992 -0.125) 8.157 ======================= Grid point 539 (201/344) ======================= q-point: ( 0.67 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.758 ( -1.041 4.699 -1.130) 4.944 2.894 ( 2.583 4.874 3.077) 6.316 3.081 ( -3.673 8.440 -1.693) 9.360 3.175 ( -4.779 13.633 -4.809) 15.225 3.294 ( 1.995 -4.111 2.231) 5.086 3.564 ( 2.904 5.480 1.268) 6.330 4.047 ( -3.161 9.936 -0.737) 10.452 4.060 ( -3.987 13.212 1.537) 13.886 4.541 ( 4.124 2.460 -0.957) 4.896 4.804 ( -2.308 -0.418 -0.138) 2.350 5.077 ( 6.356 -0.645 1.953) 6.680 5.222 ( 6.336 -7.872 2.658) 10.449 8.088 ( -0.474 1.776 7.518) 7.739 8.434 ( 3.027 -1.385 -6.783) 7.556 9.544 ( -11.100 12.445 2.171) 16.816 9.679 ( -1.580 5.858 0.883) 6.131 9.813 ( 1.234 1.373 -0.424) 1.894 10.058 ( 4.741 2.039 -3.081) 6.011 10.365 ( -1.169 -4.959 2.439) 5.648 10.396 ( 5.395 -3.698 1.603) 6.734 10.643 ( 3.669 -7.735 -3.379) 9.203 13.157 ( -3.096 17.375 -0.262) 17.651 14.263 ( -1.176 -1.940 1.551) 2.749 14.636 ( 5.007 -10.221 -1.436) 11.472 ======================= Grid point 540 (202/344) ======================= q-point: (-0.27 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.768 ( -2.364 4.019 -1.607) 4.932 2.954 ( -3.498 5.021 4.768) 7.757 3.068 ( -2.446 3.982 -4.335) 6.374 3.199 ( -6.430 11.985 -2.730) 13.872 3.308 ( 3.884 -3.174 1.051) 5.125 3.624 ( -4.507 5.623 1.804) 7.429 4.062 ( -4.991 8.231 -0.852) 9.664 4.094 ( -8.624 14.798 1.602) 17.202 4.622 ( 3.056 1.890 0.692) 3.660 4.739 ( -3.307 -2.776 -2.036) 4.773 5.141 ( 3.863 -5.139 1.426) 6.585 5.229 ( 4.360 -10.521 3.618) 11.949 8.064 ( -3.494 -1.652 5.621) 6.822 8.473 ( 2.985 -0.017 -5.574) 6.323 9.522 ( -7.633 14.828 2.960) 16.938 9.697 ( -2.817 5.521 0.649) 6.232 9.830 ( -0.422 0.767 -0.226) 0.904 10.118 ( 0.704 1.038 -3.423) 3.645 10.296 ( 1.011 -8.070 0.999) 8.194 10.421 ( 2.689 -6.084 2.160) 6.993 10.662 ( 5.369 -4.300 -2.490) 7.315 13.220 ( -9.363 16.376 -0.296) 18.866 14.256 ( 2.070 -1.547 2.411) 3.534 14.613 ( 5.481 -11.560 -2.254) 12.991 ======================= Grid point 541 (203/344) ======================= q-point: (-0.20 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -2.310 2.893 -1.770) 4.103 2.877 ( -9.035 1.726 2.098) 9.435 3.082 ( -3.547 8.272 -1.992) 9.218 3.181 ( -5.649 6.858 -1.845) 9.075 3.367 ( 5.428 -1.786 0.429) 5.731 3.515 ( -11.764 1.035 2.147) 12.003 4.026 ( -7.894 6.633 -0.181) 10.312 4.071 ( -9.887 11.798 0.887) 15.419 4.620 ( -4.412 -4.852 -1.399) 6.705 4.697 ( 2.161 2.692 0.149) 3.456 5.099 ( -3.099 -6.234 0.732) 7.000 5.192 ( 3.181 -10.505 3.831) 11.626 7.977 ( -4.793 -2.702 4.077) 6.848 8.498 ( 1.190 -0.127 -3.429) 3.631 9.576 ( -4.918 14.497 1.500) 15.381 9.704 ( -3.729 7.607 1.818) 8.665 9.814 ( -1.665 0.136 -0.376) 1.712 10.076 ( -1.705 -4.892 -4.792) 7.057 10.243 ( -1.506 -5.416 4.348) 7.107 10.401 ( 2.838 -5.489 -0.818) 6.233 10.718 ( 6.729 -4.511 -1.510) 8.241 13.160 ( -13.063 11.137 -0.263) 17.168 14.309 ( 2.856 1.864 2.276) 4.100 14.588 ( 5.391 -11.001 -2.188) 12.445 ======================= Grid point 542 (204/344) ======================= q-point: (-0.13 0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( -11.407 -0.105 1.518) 11.508 2.743 ( -2.195 2.144 -2.050) 3.690 3.053 ( -9.164 8.092 -2.615) 12.502 3.124 ( -10.855 5.462 -0.606) 12.167 3.294 ( -7.144 -6.301 2.007) 9.735 3.460 ( 5.765 -0.462 0.891) 5.851 3.917 ( -11.298 4.617 0.543) 12.217 3.977 ( -10.830 5.151 0.108) 11.993 4.488 ( -4.742 -4.275 -2.164) 6.742 4.763 ( 1.455 3.184 1.441) 3.786 4.917 ( -11.006 -4.607 1.157) 11.987 5.143 ( 0.415 -7.301 2.101) 7.609 7.875 ( -5.131 -1.567 3.374) 6.337 8.503 ( 0.602 -0.439 -1.446) 1.627 9.583 ( -6.213 5.135 -0.252) 8.064 9.733 ( -5.659 9.204 0.761) 10.831 9.789 ( -2.546 2.896 0.492) 3.887 9.984 ( 1.149 -7.316 -5.350) 9.136 10.119 ( -8.354 -2.679 5.549) 10.380 10.437 ( 6.410 -3.255 -0.384) 7.200 10.806 ( 8.835 -3.756 -1.478) 9.713 13.006 ( -13.373 5.032 -0.297) 14.291 14.377 ( 0.976 2.937 0.684) 3.169 14.575 ( 4.076 -6.828 -0.557) 7.972 ======================= Grid point 550 (205/344) ======================= q-point: ( 0.40 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( 0.000 15.134 5.880) 16.236 2.292 ( -0.000 2.752 -3.022) 4.087 2.323 ( 0.000 18.757 6.984) 20.015 2.612 ( -0.000 5.197 -13.343) 14.320 3.188 ( -0.000 0.580 -4.697) 4.732 3.378 ( 0.000 7.279 3.241) 7.968 3.464 ( 0.000 8.283 8.494) 11.864 3.669 ( -0.000 2.193 -1.054) 2.433 4.146 ( -0.000 15.185 -1.693) 15.280 4.409 ( 0.000 20.807 4.196) 21.225 4.650 ( -0.000 10.571 -5.252) 11.804 5.143 ( -0.000 2.188 -0.161) 2.194 7.652 ( 0.000 6.249 2.828) 6.859 8.709 ( -0.000 -0.109 -0.227) 0.252 9.112 ( 0.000 1.327 1.241) 1.817 9.538 ( 0.000 -7.628 4.235) 8.725 9.564 ( -0.000 3.735 -2.520) 4.506 9.836 ( 0.000 6.353 3.109) 7.073 9.883 ( -0.000 5.773 -4.370) 7.240 11.008 ( 0.000 -12.226 1.996) 12.388 11.492 ( -0.000 -6.404 -2.694) 6.948 12.297 ( -0.000 4.053 -1.990) 4.515 14.261 ( 0.000 1.153 1.706) 2.060 14.725 ( 0.000 6.571 1.909) 6.843 ======================= Grid point 551 (206/344) ======================= q-point: ( 0.47 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.318 ( 8.782 8.195 -0.552) 12.024 2.395 ( 4.797 8.668 4.067) 10.709 2.551 ( 6.042 12.251 -0.283) 13.663 2.653 ( 1.202 6.645 -5.187) 8.515 3.250 ( 6.602 0.151 -4.396) 7.933 3.449 ( 0.252 7.640 4.134) 8.691 3.595 ( 4.980 3.391 1.587) 6.231 3.669 ( -0.092 0.541 2.253) 2.319 4.274 ( -1.348 13.253 -3.767) 13.843 4.625 ( -0.048 20.046 3.036) 20.275 4.741 ( 2.457 3.847 0.503) 4.592 5.168 ( -3.306 8.806 -1.759) 9.569 7.746 ( 1.810 7.797 3.204) 8.622 8.660 ( -4.288 -1.985 -0.389) 4.741 9.191 ( 7.986 0.175 0.916) 8.040 9.506 ( 3.861 -3.957 1.368) 5.695 9.625 ( 1.580 4.777 -0.915) 5.114 9.880 ( 1.256 2.611 -7.940) 8.452 9.989 ( 0.971 10.015 7.941) 12.818 10.858 ( -5.173 -9.400 0.870) 10.765 11.278 ( -13.462 -5.964 -2.408) 14.920 12.449 ( 11.148 4.047 -1.433) 11.946 14.302 ( 2.451 1.127 0.185) 2.704 14.752 ( -4.193 5.533 1.822) 7.177 ======================= Grid point 552 (207/344) ======================= q-point: ( 0.53 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 10.556 4.078 -0.444) 11.325 2.586 ( 4.616 10.554 3.087) 11.925 2.717 ( 9.030 2.663 -4.524) 10.445 2.840 ( 7.296 12.916 0.014) 14.834 3.328 ( 1.057 1.528 0.103) 1.861 3.532 ( -0.418 -0.276 -0.704) 0.864 3.686 ( 8.609 4.958 1.164) 10.002 3.790 ( 7.482 4.397 2.386) 9.000 4.353 ( -1.751 10.291 -3.446) 10.993 4.782 ( 2.992 2.466 -0.583) 3.920 4.836 ( 0.129 12.043 5.154) 13.100 5.189 ( -5.362 10.578 -1.742) 11.987 7.878 ( 3.104 8.243 3.999) 9.674 8.543 ( -4.891 -3.919 -1.016) 6.349 9.375 ( 11.541 1.006 -0.079) 11.585 9.587 ( 7.006 -0.230 0.145) 7.012 9.702 ( 2.617 3.349 -1.071) 4.383 9.905 ( -0.489 3.447 -4.412) 5.620 10.127 ( 1.774 9.419 6.026) 11.321 10.652 ( -8.688 -7.088 0.930) 11.251 10.977 ( -12.772 -5.625 -2.919) 14.258 12.709 ( 12.746 6.026 -0.723) 14.117 14.347 ( 2.002 -0.364 -1.183) 2.354 14.706 ( -6.446 3.123 2.084) 7.459 ======================= Grid point 553 (208/344) ======================= q-point: ( 0.60 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( 4.811 1.595 -0.134) 5.071 2.763 ( 2.823 8.860 1.983) 9.508 2.979 ( 13.274 6.452 -0.851) 14.784 3.082 ( 8.282 6.732 -2.486) 10.958 3.336 ( -2.681 3.784 0.066) 4.638 3.484 ( -1.051 -1.088 0.517) 1.599 3.938 ( 9.136 6.843 0.980) 11.457 3.985 ( 8.778 6.481 0.018) 10.911 4.419 ( 0.568 7.002 -1.730) 7.235 4.823 ( 2.799 -3.017 1.976) 4.565 4.959 ( -0.416 10.029 1.258) 10.116 5.175 ( -5.672 5.806 -0.373) 8.126 8.028 ( 3.362 7.795 5.664) 10.205 8.425 ( -3.046 -4.381 -3.421) 6.338 9.580 ( 9.278 2.588 0.060) 9.632 9.720 ( 5.851 2.493 -1.047) 6.445 9.777 ( 5.191 0.120 -1.740) 5.476 9.900 ( -4.426 4.699 -0.340) 6.464 10.264 ( 2.508 8.037 3.467) 9.105 10.451 ( -6.247 -6.269 2.061) 9.087 10.723 ( -9.141 -5.757 -3.754) 11.436 12.997 ( 11.439 9.348 -0.237) 14.775 14.350 ( -0.327 -1.505 -1.855) 2.411 14.609 ( -5.924 -1.355 2.099) 6.430 ======================= Grid point 554 (209/344) ======================= q-point: ( 0.67 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.794 ( 2.875 2.907 0.663) 4.142 2.883 ( 2.484 5.570 0.333) 6.107 3.186 ( 1.792 4.301 -1.198) 4.811 3.203 ( 2.463 -1.064 0.335) 2.704 3.324 ( -0.048 3.728 -1.655) 4.079 3.571 ( 5.190 9.598 0.902) 10.949 4.111 ( 4.377 4.710 0.629) 6.461 4.187 ( 3.574 10.561 -0.799) 11.178 4.516 ( 3.643 4.697 -0.436) 5.960 4.835 ( 0.594 -1.176 1.371) 1.902 5.022 ( 0.225 2.672 0.651) 2.759 5.108 ( -3.118 -3.120 0.742) 4.473 8.150 ( -0.220 5.216 8.956) 10.366 8.352 ( 1.591 -3.089 -7.859) 8.593 9.728 ( 3.417 4.208 0.661) 5.461 9.785 ( 0.387 1.944 -0.627) 2.079 9.846 ( -8.076 8.263 2.120) 11.747 9.913 ( 10.356 -2.499 -3.710) 11.280 10.336 ( -0.756 -5.158 1.156) 5.340 10.373 ( 0.166 4.015 5.342) 6.685 10.538 ( -3.027 -5.741 -5.467) 8.486 13.278 ( 7.619 12.922 -0.039) 15.001 14.299 ( -3.299 -1.455 -0.765) 3.686 14.497 ( -1.888 -7.365 0.761) 7.642 ======================= Grid point 555 (210/344) ======================= q-point: ( 0.73 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( -1.637 5.027 -0.400) 5.302 2.971 ( 4.101 1.456 1.097) 4.488 3.144 ( -5.535 0.182 -2.258) 5.981 3.218 ( 3.214 -3.106 1.256) 4.642 3.395 ( -1.802 8.570 -0.998) 8.814 3.741 ( 0.908 8.980 0.571) 9.044 4.183 ( -1.028 4.560 -0.860) 4.753 4.321 ( -0.960 10.812 1.451) 10.951 4.612 ( 2.224 5.137 -0.857) 5.663 4.803 ( -5.360 0.678 -0.582) 5.434 5.015 ( 2.316 -8.970 2.964) 9.726 5.058 ( 3.704 -5.911 0.276) 6.981 8.135 ( -4.445 -0.966 5.989) 7.520 8.399 ( 4.683 1.397 -5.671) 7.486 9.771 ( -4.370 5.843 0.170) 7.298 9.786 ( -2.449 4.733 3.180) 6.206 9.839 ( -0.478 3.638 -0.738) 3.743 10.044 ( 7.901 -2.275 -2.143) 8.497 10.254 ( -6.051 -2.631 -2.365) 7.009 10.364 ( 1.511 -4.363 5.554) 7.223 10.530 ( 4.479 -1.677 -3.583) 5.976 13.484 ( -1.192 14.505 -0.213) 14.556 14.231 ( -1.265 -1.737 1.652) 2.710 14.412 ( 2.706 -10.608 -1.494) 11.049 ======================= Grid point 556 (211/344) ======================= q-point: (-0.20 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( -3.892 2.701 -0.564) 4.771 3.029 ( -6.625 -1.123 -1.874) 6.976 3.071 ( 4.686 2.189 1.649) 5.428 3.264 ( 4.489 -1.793 0.160) 4.837 3.394 ( -6.877 6.470 -0.744) 9.472 3.738 ( -8.838 3.519 0.608) 9.533 4.174 ( -4.200 3.215 -0.765) 5.345 4.346 ( -7.654 7.745 1.401) 10.979 4.656 ( -5.583 -2.441 -3.087) 6.830 4.725 ( 0.289 6.682 1.535) 6.862 4.986 ( 5.663 -10.900 2.844) 12.608 5.072 ( 2.608 -4.420 0.646) 5.172 8.046 ( -4.676 -2.254 4.091) 6.609 8.469 ( 2.292 1.703 -3.531) 4.541 9.755 ( -3.767 4.160 0.394) 5.626 9.813 ( 0.012 3.035 1.695) 3.476 9.857 ( -1.726 5.614 -0.130) 5.874 10.084 ( -5.346 -7.360 -2.954) 9.565 10.139 ( 3.586 -0.152 1.265) 3.806 10.369 ( 0.948 -2.296 1.981) 3.178 10.582 ( 4.412 -1.703 -2.386) 5.297 13.482 ( -11.974 8.245 -0.213) 14.540 14.275 ( 4.839 3.131 2.480) 6.275 14.371 ( 5.220 -10.458 -2.345) 11.921 ======================= Grid point 557 (212/344) ======================= q-point: (-0.13 0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.790 ( -2.813 0.763 -0.587) 2.973 2.882 ( -8.650 -1.219 -0.373) 8.744 3.171 ( 3.366 2.290 1.459) 4.324 3.259 ( -7.480 -1.050 -3.106) 8.167 3.353 ( 1.778 0.375 0.433) 1.868 3.531 ( -14.941 -0.738 1.383) 15.023 4.097 ( -7.205 0.963 0.159) 7.270 4.207 ( -11.335 -1.950 -0.349) 11.507 4.545 ( -4.834 1.089 -1.339) 5.134 4.776 ( 0.144 0.855 2.069) 2.243 5.009 ( -0.586 -0.946 -0.440) 1.197 5.058 ( 2.210 -1.618 2.628) 3.796 7.957 ( -4.563 -1.071 4.156) 6.264 8.497 ( 0.279 1.336 -2.492) 2.841 9.706 ( -4.656 0.010 0.446) 4.677 9.812 ( -1.049 -0.468 -0.914) 1.468 9.867 ( -2.307 -11.891 -3.339) 12.565 9.962 ( -3.429 12.885 1.237) 13.391 10.181 ( 0.005 -1.303 4.491) 4.676 10.363 ( 0.903 0.148 -0.514) 1.049 10.654 ( 5.867 0.077 -2.402) 6.340 13.280 ( -14.731 0.168 -0.081) 14.732 14.343 ( 2.797 -4.885 -2.200) 6.043 14.453 ( 7.225 4.774 2.174) 8.928 ======================= Grid point 566 (213/344) ======================= q-point: ( 0.47 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.263 ( -0.000 2.220 -3.555) 4.191 2.469 ( 0.000 10.632 7.421) 12.966 2.569 ( -0.000 3.750 -8.127) 8.950 2.756 ( 0.000 13.731 4.714) 14.518 3.170 ( -0.000 0.265 -4.799) 4.806 3.535 ( 0.000 6.638 1.860) 6.894 3.565 ( 0.000 0.313 0.889) 0.943 3.673 ( 0.000 -1.091 2.882) 3.081 4.405 ( -0.000 11.633 -4.041) 12.315 4.728 ( -0.000 2.267 -1.003) 2.479 4.854 ( 0.000 17.709 5.305) 18.487 5.299 ( -0.000 11.633 -2.085) 11.818 7.824 ( 0.000 9.017 3.724) 9.755 8.690 ( -0.000 -1.477 -2.672) 3.053 9.077 ( 0.000 -5.853 2.222) 6.261 9.435 ( 0.000 -1.450 0.256) 1.472 9.661 ( -0.000 4.561 -0.135) 4.563 9.892 ( -0.000 4.577 -6.584) 8.019 10.110 ( 0.000 11.209 7.372) 13.416 10.824 ( -0.000 -6.593 -0.850) 6.647 11.338 ( -0.000 -7.913 -1.347) 8.026 12.367 ( -0.000 3.703 -1.514) 4.000 14.304 ( -0.000 2.642 -0.320) 2.661 14.846 ( 0.000 4.534 1.817) 4.885 ======================= Grid point 567 (214/344) ======================= q-point: ( 0.53 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( 11.815 2.276 -1.258) 12.098 2.591 ( 2.218 2.616 -4.292) 5.494 2.637 ( 5.560 7.118 4.003) 9.879 2.892 ( 0.001 10.891 1.365) 10.976 3.257 ( 8.140 2.706 -1.820) 8.769 3.542 ( -1.034 -0.177 0.063) 1.051 3.625 ( 2.470 1.952 0.547) 3.195 3.706 ( 5.416 0.761 2.210) 5.899 4.485 ( -1.929 9.439 -3.339) 10.196 4.747 ( 0.917 -0.144 1.599) 1.849 5.016 ( -1.512 15.038 2.013) 15.248 5.377 ( -3.735 10.752 -1.482) 11.479 7.936 ( 1.410 8.941 3.859) 9.840 8.598 ( -5.847 -3.375 -2.486) 7.194 9.133 ( 11.846 -5.554 0.605) 13.097 9.474 ( 4.454 0.583 -0.179) 4.495 9.713 ( 1.087 3.876 -0.121) 4.028 9.932 ( 0.468 4.723 -4.247) 6.369 10.235 ( -0.078 10.646 6.249) 12.344 10.721 ( -5.304 -4.217 -1.404) 6.920 11.138 ( -11.627 -7.117 -1.343) 13.698 12.520 ( 12.295 3.460 -0.969) 12.809 14.332 ( 0.303 1.905 -1.024) 2.184 14.848 ( -4.694 3.196 1.968) 6.010 ======================= Grid point 568 (215/344) ======================= q-point: ( 0.60 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.634 ( 5.816 1.953 1.566) 6.332 2.700 ( 15.700 2.183 -2.670) 16.074 2.825 ( 6.153 6.818 4.182) 10.092 2.997 ( 4.516 3.771 -3.449) 6.820 3.394 ( 1.084 4.200 -1.080) 4.470 3.502 ( -1.429 -0.376 0.893) 1.726 3.781 ( 13.771 2.544 0.310) 14.008 3.855 ( 8.775 1.947 0.725) 9.018 4.520 ( -2.808 7.452 -2.315) 8.293 4.762 ( 1.360 -1.625 2.584) 3.341 5.106 ( -3.221 10.522 -0.166) 11.005 5.369 ( -7.490 7.260 -0.838) 10.465 8.066 ( 2.777 7.946 3.561) 9.140 8.452 ( -5.612 -4.057 -2.062) 7.225 9.335 ( 16.001 -3.835 -0.945) 16.482 9.582 ( 6.939 0.613 -0.722) 7.003 9.769 ( 1.220 2.919 -0.022) 3.163 9.978 ( 0.103 4.375 -1.298) 4.565 10.343 ( -0.024 8.658 4.214) 9.629 10.553 ( -9.630 -2.662 -0.614) 10.010 10.856 ( -12.006 -5.441 -1.862) 13.312 12.813 ( 16.338 4.419 -0.379) 16.929 14.337 ( -0.630 0.020 -1.748) 1.858 14.759 ( -8.537 1.310 2.170) 8.905 ======================= Grid point 569 (216/344) ======================= q-point: ( 0.67 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.731 ( 5.268 0.827 1.072) 5.439 2.916 ( 2.572 5.912 0.790) 6.495 3.086 ( 15.479 3.779 0.762) 15.952 3.095 ( 5.807 -1.999 -0.464) 6.159 3.355 ( -3.935 -0.994 -2.718) 4.885 3.572 ( 4.474 6.870 0.484) 8.212 4.028 ( 8.449 2.279 0.748) 8.783 4.088 ( 15.661 3.425 -0.783) 16.050 4.540 ( -1.337 5.561 -1.020) 5.810 4.773 ( 1.971 -3.139 2.487) 4.464 5.114 ( -4.726 5.354 -1.028) 7.215 5.258 ( -10.705 2.606 -0.692) 11.040 8.204 ( 3.991 6.362 2.526) 7.924 8.318 ( -4.690 -4.048 -1.671) 6.417 9.581 ( 14.937 -1.670 -1.047) 15.066 9.711 ( 7.783 -0.173 -1.837) 7.999 9.807 ( 0.311 1.867 0.104) 1.896 10.014 ( -1.451 5.126 1.063) 5.432 10.351 ( -8.636 -4.275 1.284) 9.721 10.426 ( 0.415 5.777 1.725) 6.043 10.621 ( -9.999 -2.868 -2.162) 10.624 13.154 ( 16.520 5.889 0.041) 17.539 14.306 ( -1.391 -1.471 -2.286) 3.054 14.594 ( -10.873 -1.188 2.296) 11.176 ======================= Grid point 570 (217/344) ======================= q-point: ( 0.73 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.842 ( 6.073 1.039 0.841) 6.218 2.975 ( -1.672 3.728 0.236) 4.092 3.130 ( 3.410 -3.709 0.192) 5.042 3.233 ( -4.121 0.776 -1.024) 4.317 3.387 ( 8.687 2.391 0.187) 9.012 3.747 ( 6.668 5.418 -0.316) 8.597 4.172 ( 5.244 1.242 0.720) 5.437 4.343 ( 8.559 4.942 -1.607) 10.013 4.604 ( 3.236 4.409 0.371) 5.482 4.785 ( 3.937 -4.910 1.777) 6.539 5.051 ( -6.665 -0.980 -2.027) 7.035 5.058 ( -10.819 0.078 0.273) 10.823 8.199 ( -3.776 -4.304 -1.658) 5.961 8.337 ( 4.040 4.888 1.799) 6.592 9.768 ( 5.906 0.062 0.307) 5.914 9.817 ( 0.033 1.147 -0.320) 1.191 9.846 ( 8.977 -0.926 -2.210) 9.291 10.023 ( -5.901 7.342 0.711) 9.447 10.220 ( 1.490 -7.235 2.656) 7.850 10.429 ( -8.594 -1.702 -3.251) 9.344 10.486 ( 0.370 3.371 1.887) 3.881 13.481 ( 13.311 6.086 0.196) 14.638 14.258 ( -1.905 -0.978 -2.398) 3.215 14.387 ( -9.603 -3.835 2.233) 10.579 ======================= Grid point 571 (218/344) ======================= q-point: (-0.20 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.931 ( -3.059 -1.956 0.276) 3.641 2.955 ( 3.767 1.779 -0.347) 4.180 3.155 ( -2.464 0.452 0.306) 2.524 3.174 ( 2.021 0.003 -0.232) 2.035 3.489 ( 0.389 0.450 -0.000) 0.595 3.841 ( -0.155 -0.145 -0.009) 0.212 4.226 ( 0.313 0.304 -0.001) 0.436 4.454 ( -0.285 -0.158 -0.008) 0.326 4.734 ( 5.616 6.192 0.222) 8.362 4.796 ( -1.756 -4.272 -0.090) 4.620 4.827 ( -5.927 -4.336 -0.155) 7.345 5.002 ( 0.473 0.492 0.036) 0.683 8.095 ( -3.273 -3.641 -0.006) 4.896 8.442 ( 2.935 3.306 0.010) 4.421 9.796 ( -0.559 -0.934 -0.348) 1.143 9.824 ( -0.305 -0.390 0.402) 0.638 9.951 ( -2.960 -2.821 -0.082) 4.090 9.990 ( 4.092 4.431 0.027) 6.032 10.249 ( -0.363 0.315 0.015) 0.481 10.280 ( -1.612 -2.556 -0.022) 3.022 10.532 ( 1.800 2.021 0.004) 2.706 13.659 ( 0.111 0.114 0.000) 0.159 14.204 ( -0.974 -1.112 -0.001) 1.478 14.285 ( 0.895 1.028 0.001) 1.363 ======================= Grid point 572 (219/344) ======================= q-point: (-0.13 0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.846 ( -3.741 -1.900 0.391) 4.215 2.961 ( -2.809 -2.641 -1.776) 4.244 3.161 ( 0.491 3.494 3.452) 4.936 3.227 ( 3.585 -1.158 -2.604) 4.579 3.415 ( -5.568 -4.133 0.149) 6.936 3.730 ( -9.204 -4.567 0.090) 10.275 4.192 ( -3.834 -1.679 0.309) 4.197 4.311 ( -8.401 -9.585 -0.748) 12.768 4.653 ( -5.693 -0.107 -2.182) 6.098 4.763 ( 0.403 -3.908 3.125) 5.020 4.954 ( 7.193 8.974 0.825) 11.531 5.056 ( 1.900 2.921 -0.276) 3.495 8.017 ( -2.788 -1.823 1.965) 3.867 8.502 ( 0.985 2.387 -1.296) 2.890 9.726 ( -3.200 -8.325 -0.394) 8.928 9.785 ( -2.069 -4.204 -0.289) 4.695 9.860 ( -2.599 -2.371 -0.430) 3.544 10.100 ( 1.335 6.939 -1.543) 7.233 10.203 ( -2.630 4.111 5.274) 7.186 10.320 ( 3.963 -1.716 -1.903) 4.719 10.599 ( 2.825 3.784 -1.173) 4.865 13.487 ( -12.030 -7.949 0.064) 14.419 14.221 ( 3.648 -2.823 -1.034) 4.727 14.421 ( 6.466 9.931 0.934) 11.887 ======================= Grid point 582 (220/344) ======================= q-point: ( 0.53 0.53 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -0.000 1.135 -0.986) 1.503 2.576 ( -0.000 0.755 -2.490) 2.601 2.663 ( 0.000 5.990 2.580) 6.522 3.038 ( 0.000 11.577 1.909) 11.733 3.168 ( -0.000 1.043 -1.312) 1.676 3.546 ( -0.000 -1.296 -0.300) 1.331 3.629 ( 0.000 -4.197 0.613) 4.242 3.649 ( 0.000 4.201 0.169) 4.205 4.579 ( -0.000 7.133 -2.464) 7.547 4.747 ( 0.000 0.183 2.390) 2.397 5.170 ( -0.000 11.985 -0.144) 11.985 5.508 ( -0.000 8.882 -1.177) 8.960 8.018 ( 0.000 7.919 3.303) 8.580 8.632 ( -0.000 -2.215 -4.098) 4.658 8.943 ( 0.000 -7.041 1.597) 7.220 9.448 ( -0.000 1.626 -0.120) 1.630 9.737 ( -0.000 3.030 -0.086) 3.031 9.968 ( -0.000 4.664 -2.621) 5.350 10.350 ( 0.000 8.983 5.119) 10.339 10.737 ( -0.000 -0.888 -2.288) 2.454 11.168 ( -0.000 -8.560 -0.527) 8.576 12.427 ( -0.000 2.740 -0.922) 2.891 14.354 ( -0.000 2.478 -1.170) 2.740 14.922 ( 0.000 2.319 1.985) 3.053 ======================= Grid point 583 (221/344) ======================= q-point: ( 0.60 0.53 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 13.585 1.192 0.264) 13.639 2.599 ( 1.956 0.791 0.824) 2.265 2.768 ( 6.099 3.275 0.040) 6.923 3.038 ( -4.294 4.388 -0.896) 6.205 3.353 ( 10.196 6.088 0.399) 11.882 3.521 ( -0.922 -0.905 0.646) 1.444 3.602 ( 3.847 -3.991 -1.162) 5.664 3.742 ( 6.092 1.941 -0.164) 6.396 4.620 ( -1.559 5.141 -1.753) 5.650 4.751 ( -0.201 -0.443 2.736) 2.779 5.249 ( -2.276 8.085 -1.506) 8.533 5.540 ( -4.527 5.561 -1.261) 7.281 8.103 ( 1.353 5.494 1.599) 5.880 8.525 ( -6.653 -2.191 -1.456) 7.154 9.024 ( 13.451 -4.450 -0.490) 14.177 9.497 ( 3.785 1.214 -0.206) 3.981 9.772 ( 1.034 2.025 -0.047) 2.274 10.010 ( 0.297 3.723 -0.617) 3.786 10.426 ( -0.459 4.804 2.566) 5.466 10.695 ( -5.816 3.311 -1.284) 6.814 10.984 ( -9.736 -7.781 -0.345) 12.468 12.574 ( 13.068 2.141 -0.481) 13.251 14.362 ( -1.263 1.448 -1.532) 2.458 14.900 ( -5.136 1.183 2.060) 5.658 ======================= Grid point 584 (222/344) ======================= q-point: ( 0.67 0.53 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( 4.864 -0.025 0.737) 4.920 2.741 ( 18.615 2.017 2.827) 18.936 2.921 ( 8.610 0.416 -0.692) 8.648 3.027 ( -0.247 2.279 -0.454) 2.337 3.411 ( -3.506 -0.017 -2.455) 4.280 3.563 ( 1.990 2.674 0.416) 3.359 3.783 ( 18.908 -0.928 -0.297) 18.933 3.889 ( 8.990 0.895 -0.075) 9.035 4.627 ( -2.302 4.127 -1.570) 4.980 4.740 ( -0.350 -2.127 2.909) 3.620 5.245 ( -4.609 3.883 -1.879) 6.313 5.456 ( -8.943 1.880 -1.777) 9.309 8.171 ( 2.384 0.716 -3.501) 4.296 8.404 ( -5.656 0.417 3.786) 6.819 9.264 ( 17.363 -1.800 -1.689) 17.537 9.593 ( 6.135 0.471 -0.422) 6.167 9.807 ( 1.148 0.921 0.021) 1.472 10.048 ( 0.514 2.391 1.151) 2.704 10.433 ( -1.984 -0.678 -0.867) 2.269 10.584 ( -11.777 4.505 0.916) 12.642 10.752 ( -8.314 -3.639 0.081) 9.076 12.876 ( 18.464 1.768 -0.040) 18.548 14.332 ( -2.495 0.329 -1.901) 3.154 14.780 ( -9.670 -0.051 2.081) 9.891 ======================= Grid point 585 (223/344) ======================= q-point: (-0.27 -0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.745 ( 5.332 -0.083 1.561) 5.557 3.011 ( 4.445 0.466 3.519) 5.688 3.019 ( 5.195 -1.483 -4.532) 7.052 3.153 ( 13.964 1.295 3.499) 14.454 3.336 ( -4.234 0.774 -2.203) 4.835 3.645 ( 6.606 -0.649 -1.225) 6.750 4.051 ( 9.038 -0.090 0.679) 9.063 4.114 ( 17.934 -0.126 -1.248) 17.978 4.632 ( -0.954 3.935 -0.691) 4.107 4.709 ( 0.091 -4.391 2.148) 4.889 5.164 ( -6.408 0.199 -1.599) 6.607 5.270 ( -12.170 -0.735 -2.308) 12.409 8.156 ( 0.233 -5.139 -8.008) 9.518 8.383 ( -1.259 4.220 7.719) 8.887 9.555 ( 16.341 0.471 -1.715) 16.437 9.709 ( 6.794 0.348 -0.967) 6.871 9.827 ( 0.504 0.021 0.210) 0.546 10.083 ( 1.510 0.417 1.854) 2.428 10.295 ( -11.539 -1.323 0.566) 11.628 10.459 ( -2.853 -2.084 -3.091) 4.694 10.624 ( -7.373 2.769 2.861) 8.379 13.216 ( 18.787 0.055 0.234) 18.788 14.288 ( -2.267 0.901 -2.102) 3.220 14.582 ( -12.713 -0.914 2.000) 12.902 ======================= Grid point 586 (224/344) ======================= q-point: (-0.20 -0.47 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.831 ( 4.876 -1.963 0.353) 5.268 3.009 ( -0.260 -4.304 3.147) 5.338 3.089 ( 2.170 3.410 -3.129) 5.111 3.263 ( -3.937 2.258 0.572) 4.574 3.390 ( 9.170 -2.383 0.393) 9.482 3.742 ( 7.065 -5.856 -0.593) 9.195 4.169 ( 5.170 -1.826 0.567) 5.513 4.355 ( 9.847 -3.238 -0.995) 10.413 4.635 ( 1.252 -5.423 2.872) 6.263 4.736 ( 5.221 3.606 -1.715) 6.573 5.006 ( -11.894 -0.846 -2.994) 12.294 5.075 ( -6.025 0.180 -0.339) 6.037 8.078 ( -0.769 -5.255 -5.268) 7.480 8.442 ( 1.417 3.209 4.494) 5.701 9.757 ( 5.172 -1.161 -0.324) 5.310 9.821 ( 0.833 0.166 -0.526) 1.000 9.859 ( 7.059 2.131 -0.600) 7.398 10.064 ( -3.332 -8.186 2.856) 9.288 10.150 ( -1.147 4.227 -2.008) 4.819 10.383 ( -3.436 -1.491 -2.243) 4.366 10.564 ( -3.156 3.109 3.146) 5.433 13.481 ( 13.216 -6.173 0.160) 14.587 14.290 ( 0.512 5.197 -1.877) 5.549 14.356 ( -11.945 -0.234 1.800) 12.082 ======================= Grid point 598 (225/344) ======================= q-point: ( 0.60 0.60 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( 0.000 0.764 0.923) 1.198 2.599 ( 0.000 1.448 3.693) 3.967 2.723 ( -0.000 0.408 -3.691) 3.713 3.203 ( 0.000 1.701 3.988) 4.336 3.206 ( -0.000 4.354 -3.160) 5.380 3.507 ( -0.000 -3.051 -1.188) 3.274 3.557 ( 0.000 -0.835 0.270) 0.878 3.701 ( -0.000 1.178 -1.291) 1.748 4.665 ( -0.000 2.148 -0.746) 2.274 4.760 ( 0.000 0.135 2.271) 2.275 5.329 ( -0.000 4.467 -2.167) 4.965 5.618 ( -0.000 2.513 -2.044) 3.240 8.132 ( -0.000 1.899 0.040) 1.900 8.594 ( -0.000 0.342 -1.624) 1.660 8.841 ( 0.000 -3.246 0.568) 3.295 9.474 ( -0.000 0.757 -0.137) 0.769 9.778 ( -0.000 1.080 -0.084) 1.083 10.040 ( 0.000 2.707 0.793) 2.821 10.459 ( -0.000 0.429 -0.457) 0.626 10.796 ( -0.000 6.672 -0.099) 6.672 10.999 ( 0.000 -7.617 0.353) 7.625 12.466 ( -0.000 1.296 -0.324) 1.336 14.385 ( -0.000 1.088 -1.608) 1.941 14.958 ( 0.000 0.418 2.063) 2.105 ======================= Grid point 599 (226/344) ======================= q-point: (-0.33 -0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 13.089 0.256 1.109) 13.138 2.643 ( 2.055 2.084 5.606) 6.324 2.766 ( 6.549 -2.021 -4.560) 8.232 3.089 ( -4.592 0.520 0.159) 4.624 3.440 ( 10.731 0.971 -1.205) 10.842 3.471 ( 1.955 -3.768 -1.404) 4.472 3.566 ( 1.546 2.307 1.228) 3.037 3.756 ( 5.961 -0.373 -1.372) 6.129 4.671 ( -0.390 0.544 -0.887) 1.111 4.751 ( -1.532 -0.647 2.500) 3.002 5.326 ( -2.546 0.281 -2.074) 3.296 5.579 ( -4.839 -0.641 -3.022) 5.741 8.133 ( 0.380 -2.267 -2.801) 3.624 8.524 ( -6.076 1.676 2.190) 6.673 8.973 ( 13.998 -0.064 -1.116) 14.043 9.509 ( 3.564 -0.042 -0.212) 3.571 9.792 ( 0.938 0.022 -0.072) 0.941 10.065 ( 0.109 1.384 2.258) 2.650 10.436 ( -0.803 -2.664 -3.014) 4.102 10.823 ( -3.256 0.120 1.122) 3.446 10.842 ( -11.310 1.454 0.733) 11.426 12.599 ( 13.255 0.396 0.001) 13.261 14.372 ( -1.746 0.219 -1.796) 2.514 14.916 ( -5.365 -0.468 2.052) 5.763 ======================= Grid point 600 (227/344) ======================= q-point: (-0.27 -0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( 7.698 -0.476 1.415) 7.842 2.793 ( 14.281 1.242 2.906) 14.627 2.858 ( 7.661 -4.657 -1.445) 9.081 3.071 ( 2.178 0.570 0.938) 2.439 3.419 ( -3.780 1.929 -1.486) 4.496 3.522 ( 3.738 -5.502 -2.032) 6.955 3.789 ( 17.192 0.586 0.034) 17.202 3.883 ( 9.368 -1.183 -0.427) 9.452 4.667 ( 0.200 -0.347 -1.659) 1.707 4.704 ( -3.071 -1.759 3.101) 4.705 5.240 ( -4.540 -3.875 -1.672) 6.198 5.432 ( -8.954 -2.717 -3.654) 10.045 8.085 ( -0.088 -5.446 -5.713) 7.894 8.471 ( -3.344 2.527 5.021) 6.541 9.263 ( 17.638 2.471 -1.749) 17.896 9.592 ( 6.213 -0.449 -0.471) 6.247 9.807 ( 1.157 -0.900 -0.011) 1.466 10.078 ( -0.144 -0.301 3.358) 3.374 10.372 ( -1.376 -4.405 -4.487) 6.437 10.588 ( -12.839 -2.905 1.121) 13.211 10.789 ( -7.305 5.380 1.892) 9.268 12.881 ( 18.299 -1.313 0.252) 18.348 14.333 ( -2.176 0.517 -1.909) 2.940 14.778 ( -9.901 -1.110 1.931) 10.148 ======================= Grid point 601 (228/344) ======================= q-point: (-0.20 -0.40 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( 4.086 -0.581 1.821) 4.511 2.890 ( 5.003 -7.321 -1.630) 9.016 3.070 ( 10.402 1.168 1.518) 10.577 3.167 ( 8.174 -1.020 2.414) 8.584 3.372 ( -4.178 3.292 -0.811) 5.381 3.530 ( 6.360 -9.304 -2.312) 11.505 4.024 ( 8.835 -3.192 0.292) 9.398 4.078 ( 16.050 -3.014 -1.086) 16.367 4.605 ( -2.722 -6.293 2.947) 7.463 4.705 ( 2.099 3.417 -1.847) 4.415 5.104 ( -4.261 -5.835 -0.990) 7.293 5.217 ( -10.856 -2.745 -3.564) 11.752 8.011 ( 0.099 -5.989 -5.921) 8.422 8.471 ( -0.670 1.813 4.594) 4.984 9.584 ( 14.427 2.187 -0.834) 14.616 9.716 ( 9.142 1.109 -1.578) 9.343 9.812 ( 0.753 -1.450 0.376) 1.677 10.047 ( -3.092 -4.352 3.716) 6.505 10.272 ( -5.016 -2.808 -4.395) 7.236 10.396 ( -5.230 -1.188 0.653) 5.403 10.705 ( -7.559 3.799 2.403) 8.795 13.158 ( 16.205 -5.736 0.289) 17.192 14.322 ( 0.041 3.083 -1.587) 3.468 14.576 ( -12.062 -0.528 1.496) 12.166 ======================= Grid point 614 (229/344) ======================= q-point: (-0.33 -0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 0.000 0.612 2.356) 2.434 2.660 ( -0.000 -4.163 -6.792) 7.966 2.668 ( 0.000 2.821 7.393) 7.913 3.139 ( -0.000 -8.018 -6.487) 10.314 3.257 ( 0.000 1.066 6.600) 6.685 3.492 ( -0.000 2.509 -1.781) 3.077 3.574 ( 0.000 1.150 0.575) 1.286 3.684 ( -0.000 -2.047 -2.598) 3.308 4.665 ( -0.000 -1.380 -0.744) 1.568 4.767 ( 0.000 -0.708 2.602) 2.697 5.324 ( -0.000 -4.443 -1.870) 4.820 5.594 ( -0.000 -3.160 -4.038) 5.127 8.091 ( -0.000 -4.826 -1.972) 5.213 8.628 ( -0.000 2.554 0.102) 2.556 8.827 ( -0.000 1.794 -0.239) 1.810 9.472 ( -0.000 -0.898 -0.232) 0.927 9.779 ( -0.000 -0.984 -0.064) 0.986 10.080 ( 0.000 0.368 3.538) 3.557 10.392 ( -0.000 -5.650 -4.536) 7.246 10.822 ( 0.000 -4.894 1.155) 5.028 11.010 ( 0.000 8.523 0.910) 8.572 12.475 ( 0.000 -0.350 0.200) 0.403 14.380 ( -0.000 -0.803 -1.862) 2.028 14.959 ( 0.000 -1.272 2.076) 2.435 ======================= Grid point 615 (230/344) ======================= q-point: (-0.27 -0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 11.497 0.011 2.420) 11.749 2.652 ( 6.163 -5.708 -5.978) 10.311 2.731 ( 2.304 2.452 7.444) 8.169 3.018 ( 0.305 -7.676 -3.677) 8.517 3.365 ( 7.067 -3.034 2.973) 8.246 3.503 ( -2.117 3.315 -1.040) 4.069 3.601 ( 4.443 -0.297 -1.029) 4.570 3.719 ( 6.991 -2.264 -1.711) 7.545 4.644 ( -0.041 -2.488 -1.086) 2.715 4.745 ( -1.986 -1.139 3.088) 3.844 5.229 ( -2.240 -9.501 -1.981) 9.960 5.503 ( -4.553 -4.792 -4.139) 7.799 8.023 ( -0.567 -6.619 -2.526) 7.107 8.576 ( -5.377 2.093 1.284) 5.912 9.011 ( 14.220 4.164 -1.334) 14.877 9.492 ( 3.787 -1.461 -0.439) 4.083 9.773 ( 0.996 -1.888 -0.020) 2.135 10.087 ( -0.159 -0.692 4.625) 4.679 10.307 ( -0.294 -8.264 -5.141) 9.737 10.728 ( -6.252 -3.120 0.707) 7.023 11.013 ( -8.825 8.490 1.170) 12.302 12.589 ( 12.783 -1.402 0.386) 12.865 14.354 ( -1.001 -1.105 -1.945) 2.451 14.900 ( -5.310 -2.066 2.027) 6.048 ======================= Grid point 616 (231/344) ======================= q-point: (-0.20 -0.33 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 9.188 -0.810 2.592) 9.581 2.697 ( 7.197 -8.243 -3.984) 11.646 2.851 ( 9.218 0.742 5.430) 10.724 3.016 ( 8.620 -6.809 -1.827) 11.136 3.387 ( 0.287 -5.346 -0.305) 5.363 3.482 ( -3.611 3.783 -0.790) 5.289 3.751 ( 14.131 -4.161 -1.341) 14.791 3.846 ( 9.793 -2.772 0.151) 10.179 4.591 ( -1.960 -5.852 1.023) 6.256 4.718 ( -0.622 1.532 0.821) 1.846 5.064 ( -2.462 -12.805 -2.229) 13.229 5.333 ( -7.783 -5.387 -3.306) 10.026 7.938 ( -0.346 -6.743 -3.353) 7.539 8.523 ( -2.963 1.123 1.882) 3.685 9.335 ( 17.002 4.664 -1.007) 17.659 9.570 ( 7.012 -1.234 -1.234) 7.226 9.774 ( 1.481 -2.388 0.211) 2.817 10.074 ( -1.771 -1.821 5.466) 6.028 10.204 ( 0.559 -9.826 -5.294) 11.175 10.565 ( -10.188 0.585 0.325) 10.210 10.913 ( -10.581 5.979 1.329) 12.226 12.828 ( 15.880 -4.033 0.423) 16.390 14.336 ( 0.308 0.591 -1.872) 1.987 14.752 ( -9.208 -2.355 1.799) 9.674 ======================= Grid point 630 (232/344) ======================= q-point: (-0.27 -0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 0.000 0.846 3.659) 3.755 2.504 ( -0.000 -8.274 -6.943) 10.801 2.766 ( 0.000 3.309 7.647) 8.332 2.886 ( -0.000 -13.646 -6.389) 15.068 3.298 ( 0.000 -0.069 6.575) 6.575 3.558 ( -0.000 4.255 -1.140) 4.405 3.577 ( -0.000 -1.215 -0.607) 1.358 3.597 ( -0.000 -5.185 -3.741) 6.394 4.614 ( -0.000 -3.428 -1.018) 3.576 4.758 ( 0.000 -1.252 3.850) 4.048 5.119 ( -0.000 -15.091 -2.860) 15.360 5.476 ( -0.000 -6.577 -3.537) 7.467 7.954 ( -0.000 -7.689 -0.332) 7.696 8.667 ( -0.000 1.358 -1.849) 2.294 8.907 ( -0.000 6.098 -0.491) 6.117 9.438 ( -0.000 -2.191 -0.637) 2.282 9.740 ( 0.000 -2.797 0.055) 2.798 10.084 ( 0.000 -2.517 3.942) 4.677 10.207 ( -0.000 -9.553 -3.367) 10.129 10.760 ( -0.000 -1.040 -0.687) 1.247 11.197 ( 0.000 9.223 0.999) 9.277 12.454 ( 0.000 -1.864 0.588) 1.954 14.338 ( -0.000 -2.413 -2.018) 3.146 14.925 ( 0.000 -3.133 2.060) 3.749 ======================= Grid point 631 (233/344) ======================= q-point: (-0.20 -0.27 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 9.433 -0.015 3.089) 9.926 2.466 ( 7.324 -9.966 -4.356) 13.112 2.768 ( 5.264 -14.092 -5.780) 16.115 2.818 ( 0.753 2.393 6.609) 7.069 3.351 ( 2.429 -0.923 4.547) 5.237 3.508 ( 2.503 -6.167 -3.226) 7.396 3.589 ( -0.665 3.706 -0.859) 3.862 3.655 ( 7.940 -3.952 -0.664) 8.894 4.560 ( -1.120 -6.110 0.301) 6.219 4.748 ( -0.930 0.186 3.066) 3.209 4.928 ( -0.933 -18.556 -3.741) 18.952 5.361 ( -3.903 -7.991 -2.456) 9.226 7.871 ( -0.467 -7.512 0.118) 7.528 8.607 ( -5.057 0.965 -1.623) 5.398 9.114 ( 13.475 6.024 -0.634) 14.774 9.451 ( 4.237 -2.014 -1.388) 4.893 9.720 ( 1.225 -3.318 0.251) 3.546 10.039 ( 1.492 -9.372 -3.462) 10.102 10.123 ( -1.625 -4.107 5.026) 6.691 10.710 ( -5.317 1.345 -1.910) 5.807 11.183 ( -10.889 8.008 1.104) 13.561 12.548 ( 11.724 -2.828 0.624) 12.076 14.313 ( 0.803 -1.981 -2.064) 2.971 14.848 ( -4.975 -4.064 1.954) 6.714 ======================= Grid point 646 (234/344) ======================= q-point: (-0.20 -0.20 0.13) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( -0.000 -12.551 -5.488) 13.698 2.392 ( 0.000 1.512 4.947) 5.173 2.547 ( -0.000 -17.381 -5.503) 18.231 2.856 ( 0.000 2.426 5.582) 6.086 3.306 ( 0.000 -2.036 3.900) 4.400 3.452 ( -0.000 -6.896 -3.500) 7.734 3.495 ( -0.000 -6.753 -1.131) 6.847 3.647 ( 0.000 4.310 0.304) 4.321 4.501 ( 0.000 -8.711 1.382) 8.820 4.693 ( -0.000 -20.716 -3.902) 21.080 4.791 ( 0.000 -0.889 2.481) 2.636 5.299 ( -0.000 -9.912 -1.740) 10.064 7.802 ( 0.000 -7.537 2.605) 7.975 8.664 ( -0.000 -0.068 -4.102) 4.103 9.047 ( 0.000 7.032 0.573) 7.055 9.390 ( -0.000 -1.450 -2.246) 2.673 9.673 ( 0.000 -3.711 0.496) 3.744 9.899 ( -0.000 -12.370 -6.002) 13.749 10.131 ( 0.000 -1.617 8.552) 8.703 10.770 ( -0.000 3.085 -4.077) 5.113 11.386 ( 0.000 9.276 1.292) 9.366 12.408 ( 0.000 -2.984 0.787) 3.086 14.271 ( -0.000 -3.317 -2.169) 3.964 14.848 ( 0.000 -5.547 1.871) 5.854 ======================= Grid point 727 (235/344) ======================= q-point: ( 0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.548 ( 0.000 -0.000 25.971) 25.971 0.548 ( 0.000 -0.000 25.971) 25.971 1.037 ( 0.000 -0.000 51.416) 51.416 2.179 ( -0.000 0.000 -14.604) 14.604 2.179 ( -0.000 0.000 -14.604) 14.604 2.846 ( 0.000 -0.000 10.421) 10.421 2.846 ( 0.000 -0.000 10.421) 10.421 3.335 ( -0.000 0.000 -3.503) 3.503 3.335 ( -0.000 0.000 -3.503) 3.503 3.803 ( -0.000 0.000 -26.769) 26.769 4.344 ( 0.000 -0.000 0.660) 0.660 5.513 ( 0.000 -0.000 8.105) 8.105 8.920 ( 0.000 -0.000 0.567) 0.567 8.920 ( 0.000 -0.000 0.567) 0.567 9.255 ( -0.000 0.000 -0.425) 0.425 9.255 ( -0.000 0.000 -0.425) 0.425 9.377 ( 0.000 -0.000 0.706) 0.706 9.676 ( -0.000 0.000 -0.741) 0.741 10.117 ( 0.000 -0.000 1.711) 1.711 10.117 ( 0.000 -0.000 1.711) 1.711 12.117 ( -0.000 0.000 -1.525) 1.525 12.117 ( -0.000 0.000 -1.525) 1.525 13.887 ( 0.000 -0.000 0.038) 0.038 16.655 ( 0.000 -0.000 0.121) 0.121 ======================= Grid point 728 (236/344) ======================= q-point: ( 0.27 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( 16.187 9.346 18.322) 26.174 0.885 ( 18.400 10.623 19.810) 29.049 1.464 ( 24.109 13.919 30.504) 41.297 2.226 ( 5.709 3.296 -15.333) 16.690 2.272 ( 11.331 6.542 -10.293) 16.647 2.844 ( -1.093 -0.631 10.684) 10.758 3.023 ( 9.653 5.573 7.522) 13.447 3.335 ( 0.412 0.238 -3.296) 3.330 3.422 ( 8.169 4.717 -4.048) 10.265 3.790 ( 5.089 2.938 -23.178) 23.911 4.301 ( -3.154 -1.821 -1.307) 3.869 5.466 ( -4.889 -2.823 7.710) 9.556 7.949 ( -29.699 -17.147 31.362) 46.472 8.958 ( 2.525 1.458 0.701) 2.999 9.102 ( -5.634 -3.253 -10.436) 12.297 9.262 ( 1.111 0.642 -0.484) 1.371 9.425 ( -5.749 -3.319 5.796) 8.812 9.812 ( 8.920 5.150 -6.281) 12.063 10.062 ( -4.580 -2.644 1.848) 5.602 11.056 ( 27.085 15.638 -22.812) 38.711 12.117 ( 2.035 1.175 -5.865) 6.318 12.138 ( 1.701 0.982 -1.640) 2.559 13.982 ( 7.969 4.601 0.174) 9.204 15.381 ( -62.482 -36.074 53.504) 89.822 ======================= Grid point 729 (237/344) ======================= q-point: ( 0.33 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.273 ( 17.757 10.252 12.039) 23.778 1.359 ( 18.637 10.760 14.782) 26.108 2.063 ( 21.459 12.390 -1.144) 24.805 2.353 ( 7.663 4.424 -15.628) 17.959 2.660 ( 22.558 13.024 6.336) 26.807 2.850 ( -0.135 -0.078 10.760) 10.761 3.258 ( 9.083 5.244 5.062) 11.646 3.344 ( 1.059 0.611 -2.570) 2.846 3.665 ( 12.870 7.431 -3.805) 15.340 3.935 ( 8.775 5.066 -12.468) 16.067 4.241 ( 1.208 0.697 -6.092) 6.250 5.338 ( -7.160 -4.134 4.932) 9.627 7.666 ( -4.244 -2.450 13.511) 14.372 8.902 ( -8.619 -4.976 -7.209) 12.289 9.036 ( 3.994 2.306 0.337) 4.625 9.301 ( 2.184 1.261 0.086) 2.524 9.376 ( -0.176 -0.101 6.858) 6.861 9.924 ( -7.444 -4.298 2.216) 8.876 9.972 ( 6.521 3.765 -7.822) 10.858 11.190 ( -5.233 -3.021 -2.365) 6.489 12.072 ( -6.530 -3.770 -8.499) 11.362 12.184 ( 2.546 1.470 -2.025) 3.570 14.205 ( 8.440 4.873 0.718) 9.772 14.554 ( -18.998 -10.968 29.727) 36.945 ======================= Grid point 730 (238/344) ======================= q-point: ( 0.40 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 14.968 8.642 7.989) 19.041 1.798 ( 16.877 9.744 9.222) 21.560 2.430 ( 12.830 7.407 -11.180) 18.560 2.479 ( 5.346 3.086 -11.906) 13.411 2.901 ( 3.069 1.772 7.148) 7.978 3.244 ( 22.439 12.955 10.991) 28.145 3.377 ( 2.225 1.284 -1.172) 2.823 3.472 ( 9.126 5.269 1.357) 10.625 3.947 ( 8.174 4.719 -3.188) 9.962 4.026 ( 6.297 3.636 0.540) 7.292 4.457 ( 16.696 9.640 -10.455) 21.932 5.174 ( -7.279 -4.203 2.689) 8.825 7.690 ( 3.471 2.004 3.270) 5.172 8.714 ( -6.500 -3.753 -1.339) 7.624 9.137 ( 4.606 2.659 -0.796) 5.378 9.350 ( 1.343 0.775 2.053) 2.573 9.430 ( 3.654 2.110 4.967) 6.518 9.749 ( -7.412 -4.279 1.868) 8.760 10.090 ( 5.488 3.168 -7.794) 10.045 10.999 ( -9.717 -5.610 5.692) 12.581 11.830 ( -11.227 -6.482 -5.457) 14.065 12.243 ( 2.931 1.692 -2.309) 4.097 14.217 ( -3.105 -1.793 6.854) 7.735 14.573 ( 8.798 5.080 4.392) 11.068 ======================= Grid point 731 (239/344) ======================= q-point: ( 0.47 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 10.617 6.130 4.368) 13.014 2.173 ( 14.187 8.191 4.228) 16.918 2.543 ( 2.076 1.198 -3.908) 4.585 2.651 ( 8.595 4.962 -7.008) 12.149 3.019 ( 6.029 3.481 -0.145) 6.963 3.442 ( 3.287 1.898 0.705) 3.861 3.586 ( 6.379 3.683 6.902) 10.094 3.642 ( 2.682 1.548 -2.343) 3.883 4.120 ( 12.141 7.010 -1.506) 14.100 4.321 ( 14.789 8.539 3.198) 17.374 4.816 ( 12.949 7.476 -6.099) 16.148 5.060 ( -0.703 -0.406 1.765) 1.943 7.807 ( 5.898 3.405 -0.617) 6.839 8.595 ( -3.959 -2.286 2.207) 5.076 9.225 ( 2.082 1.202 -3.720) 4.429 9.338 ( -2.856 -1.649 7.063) 7.794 9.569 ( 7.485 4.321 2.750) 9.070 9.643 ( -0.949 -0.548 -0.245) 1.123 10.200 ( 5.463 3.154 -6.199) 8.845 10.812 ( -7.308 -4.219 6.276) 10.517 11.575 ( -9.735 -5.621 -3.465) 11.764 12.307 ( 3.002 1.733 -2.184) 4.097 14.205 ( 0.826 0.477 2.901) 3.054 14.772 ( 7.312 4.222 0.932) 8.494 ======================= Grid point 732 (240/344) ======================= q-point: ( 0.53 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( 6.264 3.617 0.906) 7.290 2.464 ( 10.273 5.931 -0.521) 11.873 2.574 ( 0.956 0.552 2.253) 2.509 2.816 ( 6.861 3.961 -0.657) 7.949 3.158 ( 6.126 3.537 -5.007) 8.667 3.525 ( 3.422 1.976 2.504) 4.678 3.611 ( -2.244 -1.296 -1.997) 3.272 3.671 ( -0.553 -0.319 4.070) 4.119 4.373 ( 9.322 5.382 -3.102) 11.202 4.675 ( 12.918 7.458 1.770) 15.021 4.934 ( 2.825 1.631 1.908) 3.779 5.237 ( 11.139 6.431 -0.226) 12.864 7.945 ( 5.920 3.418 -0.511) 6.854 8.539 ( -1.408 -0.813 2.405) 2.903 9.127 ( -7.615 -4.396 0.515) 8.808 9.367 ( 2.941 1.698 2.389) 4.153 9.676 ( 2.710 1.565 -0.473) 3.165 9.770 ( 9.048 5.224 0.361) 10.454 10.316 ( 5.320 3.072 -2.929) 6.806 10.696 ( -3.530 -2.038 3.905) 5.644 11.363 ( -8.181 -4.724 -1.959) 9.648 12.370 ( 2.775 1.602 -1.603) 3.582 14.249 ( 2.220 1.282 1.670) 3.060 14.909 ( 4.526 2.613 -0.485) 5.248 ======================= Grid point 733 (241/344) ======================= q-point: ( 0.60 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 3.109 1.795 -1.487) 3.885 2.599 ( 0.377 0.218 5.459) 5.477 2.637 ( 5.311 3.067 -4.376) 7.534 2.976 ( 6.459 3.729 4.213) 8.566 3.269 ( 4.578 2.643 -7.213) 8.943 3.550 ( -2.835 -1.637 0.235) 3.282 3.601 ( 2.362 1.364 3.775) 4.658 3.618 ( -3.377 -1.950 0.350) 3.915 4.550 ( 6.369 3.677 -0.366) 7.363 4.819 ( 1.144 0.660 -2.444) 2.778 5.103 ( 9.286 5.361 3.383) 11.244 5.450 ( 6.514 3.761 2.743) 8.006 8.063 ( 3.859 2.228 0.895) 4.545 8.537 ( 0.852 0.492 0.922) 1.348 8.958 ( -6.514 -3.761 0.794) 7.564 9.433 ( 2.263 1.306 0.660) 2.695 9.737 ( 2.353 1.359 -0.075) 2.718 9.961 ( 7.200 4.157 -1.859) 8.520 10.407 ( 1.825 1.054 2.107) 2.980 10.685 ( 2.767 1.597 0.075) 3.195 11.180 ( -7.478 -4.317 -1.121) 8.707 12.425 ( 2.168 1.252 -0.798) 2.627 14.305 ( 2.059 1.189 1.634) 2.885 14.983 ( 2.163 1.249 -1.450) 2.889 ======================= Grid point 734 (242/344) ======================= q-point: ( 0.67 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.339 ( 1.514 0.874 -2.503) 3.053 2.606 ( -1.115 -0.644 6.445) 6.572 2.712 ( 2.737 1.580 -5.403) 6.259 3.100 ( 2.132 1.231 5.692) 6.202 3.335 ( 2.564 1.480 -7.922) 8.457 3.478 ( -2.574 -1.486 0.192) 2.978 3.568 ( -0.729 -0.421 0.140) 0.853 3.644 ( 0.400 0.231 4.429) 4.453 4.657 ( 2.484 1.434 0.129) 2.872 4.808 ( -0.650 -0.375 -1.883) 2.027 5.280 ( 4.838 2.793 1.407) 5.760 5.542 ( 0.756 0.437 5.037) 5.113 8.114 ( 0.156 0.090 1.372) 1.384 8.574 ( 1.949 1.125 0.274) 2.267 8.846 ( -2.989 -1.726 0.103) 3.453 9.470 ( 0.775 0.447 0.224) 0.922 9.776 ( 0.899 0.519 0.110) 1.044 10.085 ( 3.984 2.300 -3.376) 5.706 10.404 ( -2.297 -1.326 4.524) 5.244 10.810 ( 6.869 3.966 -1.193) 8.021 11.013 ( -6.467 -3.734 -0.796) 7.510 12.463 ( 1.155 0.667 -0.126) 1.340 14.344 ( 0.918 0.530 1.898) 2.174 15.007 ( 0.332 0.192 -2.141) 2.175 ======================= Grid point 735 (243/344) ======================= q-point: (-0.27 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 0.954 0.551 -2.972) 3.169 2.568 ( -3.617 -2.088 6.343) 7.594 2.758 ( 2.399 1.385 -4.878) 5.610 3.057 ( -6.635 -3.830 5.010) 9.153 3.355 ( 0.775 0.447 -7.655) 7.707 3.478 ( 2.422 1.398 -0.400) 2.825 3.571 ( 0.513 0.296 1.053) 1.209 3.635 ( -2.047 -1.182 4.623) 5.192 4.657 ( -1.815 -1.048 0.371) 2.128 4.802 ( 0.112 0.065 -2.225) 2.229 5.303 ( -3.772 -2.178 0.860) 4.440 5.525 ( -2.679 -1.547 5.725) 6.507 8.074 ( -3.672 -2.120 0.426) 4.262 8.619 ( 1.637 0.945 1.356) 2.326 8.827 ( 1.381 0.797 -0.284) 1.619 9.469 ( -0.862 -0.498 0.199) 1.016 9.777 ( -0.819 -0.473 0.137) 0.955 10.133 ( 0.977 0.564 -4.037) 4.192 10.330 ( -5.092 -2.940 4.398) 7.343 10.833 ( -4.747 -2.741 -0.481) 5.502 11.021 ( 7.401 4.273 -0.652) 8.571 12.475 ( -0.143 -0.082 0.122) 0.205 14.352 ( -0.665 -0.384 2.107) 2.243 14.992 ( -1.198 -0.692 -2.524) 2.879 ======================= Grid point 736 (244/344) ======================= q-point: (-0.20 0.20 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( 0.941 0.543 -3.317) 3.491 2.461 ( -6.888 -3.977 5.550) 9.699 2.797 ( -0.154 -0.089 -0.079) 0.194 2.859 ( -8.852 -5.111 0.122) 10.222 3.342 ( -0.457 -0.264 -6.529) 6.550 3.552 ( 2.910 1.680 0.395) 3.383 3.569 ( -4.545 -2.624 4.514) 6.922 3.576 ( -0.233 -0.135 0.213) 0.344 4.605 ( -2.820 -1.628 1.562) 3.612 4.785 ( -0.808 -0.467 -4.197) 4.300 5.100 ( -13.711 -7.916 2.644) 16.052 5.452 ( -4.985 -2.878 3.757) 6.874 7.956 ( -6.121 -3.534 -1.086) 7.151 8.651 ( 0.642 0.371 3.088) 3.176 8.906 ( 5.260 3.037 -0.223) 6.078 9.434 ( -2.115 -1.221 0.591) 2.513 9.740 ( -2.348 -1.356 0.004) 2.712 10.096 ( -5.145 -2.971 0.677) 5.979 10.201 ( -4.760 -2.748 -1.901) 5.816 10.753 ( -1.646 -0.950 1.333) 2.321 11.202 ( 8.033 4.638 -0.604) 9.295 12.457 ( -1.481 -0.855 -0.144) 1.716 14.324 ( -2.070 -1.195 2.146) 3.213 14.940 ( -2.819 -1.627 -2.485) 4.095 ======================= Grid point 743 (245/344) ======================= q-point: ( 0.27 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.860 ( 0.000 17.735 19.128) 26.084 0.944 ( 0.000 20.982 19.951) 28.953 1.556 ( 0.000 27.118 31.086) 41.252 2.142 ( -0.000 3.597 -14.622) 15.058 2.284 ( -0.000 14.658 -10.890) 18.261 2.926 ( 0.000 2.268 10.153) 10.404 2.981 ( 0.000 8.216 8.559) 11.864 3.307 ( -0.000 -0.642 -4.345) 4.392 3.421 ( -0.000 9.111 -3.423) 9.732 3.723 ( -0.000 5.230 -25.032) 25.573 4.300 ( -0.000 -3.538 -1.749) 3.947 5.484 ( 0.000 -5.803 8.031) 9.908 7.998 ( 0.000 -37.984 29.701) 48.217 8.930 ( 0.000 1.493 0.457) 1.561 9.049 ( -0.000 -8.842 -9.798) 13.198 9.286 ( -0.000 2.614 -0.272) 2.628 9.474 ( 0.000 -1.416 5.102) 5.295 9.769 ( -0.000 6.873 -6.259) 9.296 10.082 ( 0.000 -4.700 2.015) 5.114 11.095 ( -0.000 43.745 -23.835) 49.817 12.031 ( 0.000 -10.010 0.122) 10.011 12.120 ( -0.000 1.392 -1.787) 2.265 13.979 ( -0.000 8.454 0.316) 8.460 15.524 ( 0.000 -67.291 44.862) 80.875 ======================= Grid point 744 (246/344) ======================= q-point: ( 0.33 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( 11.449 18.864 14.106) 26.189 1.287 ( 9.659 19.068 16.756) 27.159 1.961 ( 8.868 21.965 3.556) 23.953 2.242 ( 8.007 6.171 -13.896) 17.184 2.529 ( 10.973 19.419 4.456) 22.746 2.937 ( -2.874 5.097 10.194) 11.754 3.178 ( 7.644 6.814 5.751) 11.744 3.318 ( 2.401 0.210 -3.914) 4.597 3.573 ( 6.489 11.283 -3.292) 13.426 3.810 ( 7.262 8.775 -18.476) 21.705 4.240 ( -1.684 -1.988 -4.386) 5.102 5.397 ( -4.173 -6.880 6.102) 10.099 7.714 ( -4.611 -12.858 17.187) 21.954 8.908 ( -3.035 -9.010 -7.800) 12.298 8.992 ( 3.867 2.372 0.434) 4.557 9.317 ( 0.236 4.060 -0.138) 4.069 9.446 ( -4.154 2.179 7.528) 8.870 9.839 ( 3.351 0.279 -7.891) 8.577 10.029 ( -1.136 -2.063 1.743) 2.930 11.311 ( -6.934 11.477 -9.549) 16.462 11.899 ( 1.057 -17.426 -1.387) 17.513 12.219 ( 5.593 5.151 -4.627) 8.900 14.139 ( 6.904 9.745 0.555) 11.956 14.826 ( -21.738 -30.258 33.222) 49.918 ======================= Grid point 745 (247/344) ======================= q-point: ( 0.40 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 10.962 18.601 9.752) 23.691 1.689 ( 12.285 15.556 11.945) 23.143 2.272 ( 10.763 9.944 -10.994) 18.319 2.414 ( 6.025 8.436 -14.331) 17.687 2.937 ( 3.029 7.298 10.611) 13.230 3.082 ( 14.367 19.430 11.311) 26.681 3.338 ( 4.326 1.619 -1.794) 4.955 3.412 ( 5.810 7.033 1.462) 9.239 3.835 ( 10.570 10.901 -2.713) 15.424 3.966 ( 4.023 0.867 -3.787) 5.592 4.293 ( 9.580 9.458 -10.905) 17.325 5.244 ( -6.202 -6.848 3.521) 9.887 7.652 ( 1.937 -2.251 5.738) 6.461 8.755 ( -4.177 -5.726 -2.872) 7.648 9.099 ( 4.354 4.221 -0.262) 6.070 9.375 ( 0.705 5.319 0.538) 5.392 9.433 ( -1.112 2.146 7.075) 7.477 9.809 ( -2.637 -4.231 -2.048) 5.389 10.044 ( 2.070 3.337 -4.312) 5.832 11.147 ( -12.455 -3.187 3.684) 13.374 11.711 ( 0.685 -21.197 -4.774) 21.739 12.321 ( -0.071 7.930 -3.674) 8.740 14.323 ( -2.982 5.359 3.709) 7.167 14.480 ( 1.918 -4.955 11.642) 12.797 ======================= Grid point 746 (248/344) ======================= q-point: ( 0.47 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.979 ( 6.850 17.111 6.221) 19.453 2.062 ( 11.697 12.782 6.651) 18.559 2.498 ( 8.137 5.274 -7.396) 12.195 2.553 ( 4.895 7.424 -10.691) 13.906 3.035 ( 0.420 8.474 5.300) 10.003 3.417 ( 3.564 3.366 -1.435) 5.108 3.523 ( 10.036 8.997 7.978) 15.663 3.592 ( 5.283 5.927 -1.884) 8.160 4.008 ( 6.522 4.108 -0.533) 7.727 4.168 ( 13.718 9.516 2.369) 16.863 4.632 ( 15.761 11.621 -8.818) 21.475 5.086 ( -4.606 -5.412 2.339) 7.481 7.726 ( 5.629 1.396 0.088) 5.800 8.640 ( -3.818 -3.358 1.693) 5.359 9.213 ( 2.882 5.560 -1.879) 6.539 9.425 ( -2.370 5.083 3.684) 6.710 9.503 ( 4.873 2.839 3.719) 6.755 9.702 ( -5.255 -0.156 0.631) 5.295 10.123 ( 4.666 2.729 -6.507) 8.460 10.910 ( -9.305 -6.812 6.917) 13.447 11.499 ( -0.120 -19.171 -4.752) 19.752 12.384 ( -1.886 10.091 -2.237) 10.506 14.256 ( -4.310 2.593 4.114) 6.498 14.650 ( 9.988 1.477 1.437) 10.199 ======================= Grid point 747 (249/344) ======================= q-point: ( 0.53 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 1.973 15.132 2.894) 15.533 2.371 ( 9.371 10.153 1.661) 13.916 2.609 ( 0.476 6.757 -1.648) 6.971 2.711 ( 7.881 3.339 -3.900) 9.406 3.153 ( 2.083 9.071 -0.413) 9.316 3.512 ( 2.699 4.553 0.775) 5.350 3.620 ( -1.394 -0.901 -2.053) 2.640 3.696 ( 1.738 4.062 4.068) 6.006 4.241 ( 11.114 5.804 -3.152) 12.929 4.531 ( 14.335 10.281 4.504) 18.206 4.894 ( 3.635 1.933 -2.187) 4.661 5.088 ( 10.374 2.705 0.395) 10.729 7.858 ( 6.902 2.585 -0.937) 7.430 8.562 ( -2.406 -2.478 3.066) 4.619 9.264 ( -5.065 4.921 -3.074) 7.702 9.401 ( -3.850 4.147 5.814) 8.113 9.639 ( 4.855 2.437 -0.706) 5.478 9.706 ( 3.725 6.015 1.960) 7.342 10.231 ( 6.283 2.349 -5.052) 8.398 10.736 ( -4.803 -6.233 5.569) 9.640 11.309 ( -0.178 -16.431 -3.043) 16.711 12.451 ( -2.489 11.534 -1.495) 11.894 14.251 ( -0.473 2.412 2.039) 3.194 14.811 ( 7.675 -0.466 -0.295) 7.695 ======================= Grid point 748 (250/344) ======================= q-point: ( 0.60 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( -2.194 13.392 0.153) 13.572 2.582 ( 5.170 6.592 -3.068) 8.922 2.669 ( -1.897 7.630 3.015) 8.420 2.868 ( 7.982 1.474 1.239) 8.211 3.276 ( 2.282 8.485 -3.495) 9.457 3.567 ( -1.581 -2.036 -1.125) 2.813 3.590 ( 0.296 3.580 2.770) 4.536 3.720 ( -3.866 4.929 1.159) 6.370 4.452 ( 8.607 3.413 -1.251) 9.343 4.786 ( 3.959 3.168 -1.342) 5.245 4.990 ( 9.079 2.882 3.821) 10.264 5.331 ( 10.954 2.381 1.307) 11.285 7.997 ( 5.908 2.180 0.605) 6.327 8.523 ( 0.022 -1.921 1.249) 2.292 9.136 ( -11.906 4.911 0.615) 12.893 9.442 ( 0.465 4.688 1.516) 4.949 9.718 ( 2.299 2.732 -0.372) 3.590 9.882 ( 7.032 5.726 -0.414) 9.078 10.356 ( 5.787 1.942 -1.429) 6.269 10.646 ( 0.095 -4.548 2.616) 5.247 11.146 ( -0.566 -14.132 -1.645) 14.239 12.518 ( -3.431 12.406 -0.837) 12.899 14.284 ( 1.454 0.994 1.731) 2.470 14.907 ( 5.400 -2.400 -1.369) 6.066 ======================= Grid point 749 (251/344) ======================= q-point: ( 0.67 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( -4.570 12.034 -1.313) 12.939 2.671 ( 0.387 3.401 -1.832) 3.882 2.713 ( -2.296 7.603 1.558) 8.093 3.011 ( 6.710 -0.394 2.195) 7.071 3.377 ( 1.451 6.175 -2.816) 6.940 3.531 ( -3.025 2.875 -0.048) 4.173 3.578 ( -3.255 -0.267 0.777) 3.357 3.718 ( -3.270 6.813 2.094) 7.842 4.600 ( 5.613 1.379 0.254) 5.786 4.806 ( -0.330 -0.660 -2.295) 2.411 5.195 ( 8.220 2.290 2.781) 8.974 5.488 ( 5.863 -1.580 3.675) 7.098 8.090 ( 2.652 0.170 2.419) 3.593 8.527 ( 2.293 -1.597 -1.478) 3.161 9.003 ( -10.132 7.498 1.354) 12.677 9.489 ( -0.388 3.915 0.446) 3.960 9.771 ( 1.068 1.908 0.040) 2.187 10.031 ( 4.779 3.562 -2.489) 6.459 10.420 ( 0.222 -0.981 3.284) 3.435 10.690 ( 7.985 -1.238 -0.880) 8.128 10.994 ( -1.556 -12.202 -1.095) 12.349 12.572 ( -4.754 12.526 -0.266) 13.400 14.321 ( 1.912 -0.509 1.966) 2.789 14.948 ( 3.609 -3.916 -2.103) 5.726 ======================= Grid point 750 (252/344) ======================= q-point: (-0.27 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( -5.395 10.900 -2.065) 12.336 2.676 ( -4.123 3.737 4.102) 6.913 2.745 ( -0.746 4.874 -4.310) 6.549 3.075 ( 1.131 -2.693 2.114) 3.605 3.438 ( 2.374 1.034 -0.339) 2.611 3.464 ( -8.371 5.660 -1.584) 10.228 3.575 ( 0.290 3.278 -0.048) 3.291 3.727 ( -4.066 5.775 2.921) 7.643 4.662 ( 0.781 -0.603 0.433) 1.078 4.785 ( 0.116 -1.321 -2.210) 2.577 5.299 ( 2.142 -1.652 1.491) 3.089 5.522 ( 0.989 -4.750 5.249) 7.148 8.094 ( -1.412 -2.497 2.518) 3.816 8.555 ( 3.191 -2.028 -2.176) 4.363 8.954 ( -6.536 11.068 1.571) 12.950 9.506 ( -1.784 2.995 0.234) 3.494 9.791 ( -0.455 0.836 0.137) 0.962 10.107 ( 2.075 1.433 -3.817) 4.575 10.382 ( -2.995 -2.744 4.672) 6.191 10.840 ( 0.843 -3.214 -1.244) 3.548 10.853 ( 7.843 -8.141 -0.851) 11.336 12.599 ( -6.210 11.819 0.005) 13.351 14.343 ( 1.132 -1.445 2.201) 2.866 14.948 ( 2.198 -4.978 -2.502) 5.989 ======================= Grid point 751 (253/344) ======================= q-point: (-0.20 0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.460 ( -5.278 9.786 -2.736) 11.450 2.613 ( -8.483 3.166 5.441) 10.563 2.776 ( 1.168 2.963 -5.588) 6.432 2.992 ( -8.081 -2.916 3.756) 9.376 3.389 ( -4.369 3.153 -4.061) 6.747 3.498 ( 4.112 -0.101 0.334) 4.127 3.593 ( -3.468 3.532 1.532) 5.182 3.706 ( -5.441 5.749 1.997) 8.164 4.636 ( -2.150 -1.361 1.366) 2.887 4.768 ( 0.269 -2.233 -3.416) 4.091 5.216 ( -7.463 -6.845 1.752) 10.277 5.473 ( -1.479 -6.002 4.785) 7.817 8.010 ( -4.628 -4.170 1.330) 6.369 8.583 ( 3.333 -3.108 -0.614) 4.598 9.001 ( -3.243 14.131 1.440) 14.570 9.489 ( -3.253 2.423 0.426) 4.078 9.773 ( -2.093 -0.044 0.063) 2.094 10.118 ( -0.376 -0.252 -4.550) 4.573 10.275 ( -6.718 -4.395 4.457) 9.182 10.731 ( -0.112 -7.096 -0.268) 7.102 11.020 ( 11.705 -3.338 -0.812) 12.199 12.591 ( -7.502 10.433 -0.139) 12.851 14.340 ( -0.409 -1.407 2.221) 2.661 14.915 ( 0.785 -5.716 -2.483) 6.281 ======================= Grid point 759 (254/344) ======================= q-point: ( 0.33 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 0.000 20.801 13.634) 24.871 1.459 ( 0.000 21.867 16.108) 27.159 2.150 ( -0.000 22.319 -7.153) 23.438 2.172 ( -0.000 4.926 -12.575) 13.505 2.682 ( 0.000 25.203 11.502) 27.704 3.034 ( 0.000 4.391 8.167) 9.273 3.214 ( 0.000 11.327 6.669) 13.145 3.274 ( -0.000 -0.526 -4.511) 4.542 3.641 ( -0.000 13.874 -4.014) 14.443 3.821 ( -0.000 12.902 -14.946) 19.744 4.227 ( -0.000 -0.424 -5.692) 5.708 5.368 ( 0.000 -8.397 5.290) 9.925 7.653 ( 0.000 -10.880 13.498) 17.337 8.831 ( -0.000 -7.618 -5.470) 9.378 8.981 ( 0.000 3.166 0.658) 3.234 9.355 ( -0.000 4.316 -0.294) 4.326 9.542 ( 0.000 4.452 8.001) 9.156 9.825 ( -0.000 2.600 -9.490) 9.840 9.953 ( 0.000 -8.841 2.138) 9.096 11.511 ( -0.000 10.395 -14.363) 17.730 11.730 ( 0.000 -19.061 5.674) 19.888 12.155 ( -0.000 2.830 -1.887) 3.402 14.176 ( 0.000 8.968 1.939) 9.175 14.771 ( 0.000 -25.893 22.874) 34.550 ======================= Grid point 760 (255/344) ======================= q-point: ( 0.40 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( 9.248 19.363 11.051) 24.136 1.755 ( 5.185 20.541 12.369) 24.531 2.223 ( 3.852 7.921 -11.017) 14.105 2.370 ( 5.721 11.764 -15.599) 20.358 3.008 ( 3.352 17.618 13.377) 22.374 3.149 ( 5.369 13.325 8.995) 16.949 3.275 ( 2.429 1.161 -3.612) 4.505 3.395 ( 4.761 9.847 2.584) 11.239 3.821 ( 5.167 13.657 -2.079) 14.749 3.939 ( 1.288 8.017 -5.319) 9.706 4.261 ( 3.240 9.794 -9.901) 14.299 5.261 ( -3.496 -8.205 3.345) 9.525 7.609 ( 1.103 -3.292 6.676) 7.525 8.745 ( -1.699 -4.498 -2.355) 5.354 9.059 ( 4.415 3.929 0.604) 5.941 9.410 ( 1.003 5.116 0.105) 5.214 9.550 ( -5.691 3.909 7.656) 10.309 9.785 ( -0.471 -1.043 -6.918) 7.012 9.971 ( 6.749 -4.081 -0.447) 7.900 11.403 ( -16.665 0.282 -0.749) 16.684 11.493 ( -0.904 -19.949 -1.561) 20.030 12.294 ( 8.396 4.097 -2.828) 9.761 14.313 ( 6.792 4.131 3.100) 8.533 14.547 ( -8.765 -6.363 10.441) 15.044 ======================= Grid point 761 (256/344) ======================= q-point: ( 0.47 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( 8.969 15.816 9.139) 20.350 2.091 ( 7.442 20.120 6.104) 22.304 2.388 ( 8.185 7.030 -8.336) 13.635 2.530 ( 5.137 8.309 -12.558) 15.910 3.155 ( -1.076 9.745 8.095) 12.714 3.358 ( 6.018 2.284 -3.800) 7.475 3.478 ( 9.095 12.367 7.470) 17.072 3.578 ( 4.484 8.152 -0.500) 9.317 3.975 ( 1.984 3.435 -0.608) 4.013 4.093 ( 7.756 15.511 2.177) 17.478 4.508 ( 10.949 15.202 -9.009) 20.788 5.114 ( -4.975 -6.752 1.891) 8.597 7.656 ( 3.987 1.450 1.987) 4.685 8.668 ( -2.903 -2.924 0.860) 4.209 9.199 ( 5.565 5.629 -0.210) 7.918 9.484 ( 1.408 3.735 2.320) 4.617 9.521 ( -1.885 5.007 2.282) 5.816 9.772 ( -1.478 1.833 -1.884) 3.016 10.047 ( 5.378 -1.369 -2.297) 6.006 11.058 ( -15.108 -8.887 6.054) 18.543 11.303 ( -1.303 -14.995 -5.881) 16.159 12.453 ( 4.423 6.768 -2.013) 8.332 14.388 ( -4.006 -1.675 4.797) 6.470 14.508 ( 5.741 5.361 0.989) 7.917 ======================= Grid point 762 (257/344) ======================= q-point: ( 0.53 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 6.776 12.557 5.974) 15.469 2.409 ( 4.125 20.126 1.089) 20.574 2.586 ( 8.695 5.272 -3.323) 10.698 2.665 ( 3.464 8.355 -7.441) 11.712 3.234 ( -0.864 7.077 4.476) 8.418 3.493 ( 5.010 4.903 -2.024) 7.296 3.649 ( -0.914 1.731 -1.046) 2.219 3.701 ( 5.004 7.077 3.330) 9.285 4.123 ( 8.072 7.282 -2.591) 11.176 4.426 ( 11.705 13.811 5.141) 18.820 4.831 ( 10.499 11.233 -5.581) 16.357 4.988 ( -1.382 -5.169 2.200) 5.785 7.774 ( 5.914 3.731 0.536) 7.013 8.586 ( -3.182 -3.372 2.221) 5.141 9.338 ( 2.445 7.501 -1.488) 8.029 9.554 ( -0.323 4.619 1.304) 4.810 9.580 ( 1.807 5.510 1.379) 5.961 9.760 ( -2.204 4.855 1.527) 5.546 10.130 ( 5.926 0.402 -3.686) 6.991 10.777 ( -8.027 -9.205 5.505) 13.397 11.123 ( -0.402 -15.206 -4.402) 15.836 12.585 ( 1.385 10.566 -1.168) 10.720 14.328 ( -4.084 2.640 1.863) 5.208 14.658 ( 7.817 -0.698 0.167) 7.850 ======================= Grid point 763 (258/344) ======================= q-point: ( 0.60 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.530 ( 2.877 10.684 3.280) 11.540 2.622 ( 0.184 15.517 -3.427) 15.892 2.769 ( 6.268 5.297 -1.476) 8.338 2.790 ( 0.909 11.268 0.306) 11.309 3.298 ( 1.649 3.375 1.422) 4.017 3.547 ( 0.071 -2.319 -1.692) 2.872 3.688 ( -0.758 10.453 1.248) 10.555 3.822 ( 0.154 7.414 0.653) 7.444 4.330 ( 8.836 4.567 -2.234) 10.194 4.744 ( 8.150 8.705 2.247) 12.134 4.899 ( 1.729 -0.338 1.427) 2.267 5.145 ( 12.428 2.157 0.174) 12.615 7.924 ( 6.053 4.250 1.578) 7.562 8.510 ( -1.611 -3.675 0.563) 4.052 9.398 ( -6.648 9.215 -1.919) 11.523 9.529 ( -4.897 6.116 3.897) 8.751 9.695 ( 4.095 3.378 -0.937) 5.390 9.844 ( 4.179 6.345 0.701) 7.630 10.251 ( 7.468 1.599 -2.585) 8.063 10.611 ( -2.770 -8.132 3.663) 9.339 10.971 ( 1.312 -15.079 -2.598) 15.357 12.708 ( -1.291 14.117 -0.653) 14.191 14.302 ( -1.935 1.509 1.491) 2.872 14.758 ( 6.767 -4.259 -0.963) 8.053 ======================= Grid point 764 (259/344) ======================= q-point: ( 0.67 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( -1.610 8.684 0.553) 8.849 2.728 ( -2.483 12.196 -3.087) 12.823 2.878 ( -2.341 10.809 -0.187) 11.061 2.928 ( 3.788 5.983 1.221) 7.186 3.358 ( 2.578 -0.551 1.466) 3.016 3.528 ( 1.302 -0.651 -1.258) 1.923 3.768 ( -5.165 13.294 1.495) 14.340 3.867 ( -3.737 8.748 -0.269) 9.517 4.500 ( 7.268 1.917 -0.419) 7.529 4.806 ( -0.911 0.224 -1.532) 1.797 5.064 ( 9.763 2.246 3.386) 10.575 5.336 ( 9.305 -2.790 2.189) 9.958 8.055 ( 3.582 2.795 4.062) 6.095 8.468 ( 1.121 -3.064 -3.164) 4.544 9.307 ( -12.602 10.992 1.545) 16.793 9.558 ( -1.323 6.113 1.189) 6.367 9.772 ( 1.681 2.569 -0.320) 3.087 9.983 ( 4.782 4.500 -1.658) 6.772 10.385 ( 4.875 1.206 0.886) 5.100 10.535 ( 3.387 -7.325 0.585) 8.091 10.852 ( 1.833 -13.349 -1.526) 13.561 12.813 ( -4.435 16.544 -0.313) 17.131 14.295 ( 0.253 -0.725 1.890) 2.040 14.806 ( 5.595 -6.840 -1.864) 9.031 ======================= Grid point 765 (260/344) ======================= q-point: ( 0.73 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( -3.617 7.152 -1.254) 8.112 2.780 ( -4.763 11.815 -1.085) 12.785 2.905 ( -6.098 9.456 0.079) 11.252 3.033 ( 2.794 3.080 -0.837) 4.242 3.379 ( 2.384 -3.016 1.719) 4.211 3.561 ( 0.040 1.203 0.754) 1.421 3.780 ( -9.236 15.797 0.037) 18.299 3.884 ( -4.573 8.784 0.636) 9.923 4.613 ( 4.462 0.013 0.613) 4.504 4.776 ( -1.371 -1.448 -2.226) 2.989 5.214 ( 5.899 -1.630 2.363) 6.560 5.418 ( 5.161 -6.966 3.727) 9.437 8.103 ( -0.734 -0.642 5.494) 5.580 8.474 ( 3.150 -1.644 -5.524) 6.568 9.234 ( -10.097 13.752 2.575) 17.254 9.587 ( -2.354 5.412 0.472) 5.921 9.807 ( 0.087 1.515 0.023) 1.518 10.077 ( 2.586 2.275 -3.071) 4.614 10.400 ( -1.112 -2.731 3.869) 4.864 10.599 ( 9.636 -8.354 -1.133) 12.803 10.765 ( 1.732 -7.945 -1.693) 8.306 12.876 ( -7.704 17.045 -0.150) 18.705 14.303 ( 1.643 -2.099 2.296) 3.518 14.812 ( 4.722 -8.504 -2.387) 10.016 ======================= Grid point 766 (261/344) ======================= q-point: (-0.20 0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.665 ( -4.415 7.101 -2.000) 8.598 2.791 ( -6.585 8.459 2.794) 11.078 2.868 ( -6.835 8.051 -3.923) 11.266 3.075 ( -1.490 2.782 -0.180) 3.161 3.410 ( 4.018 -2.123 0.974) 4.648 3.509 ( -6.470 0.115 1.817) 6.721 3.789 ( -8.123 14.425 0.042) 16.555 3.880 ( -5.842 8.141 0.566) 10.037 4.655 ( -0.099 -0.222 1.767) 1.784 4.726 ( -0.255 -3.434 -3.326) 4.788 5.229 ( -1.004 -5.703 1.488) 5.978 5.404 ( 1.923 -9.012 4.611) 10.304 8.050 ( -3.882 -3.271 4.607) 6.855 8.503 ( 2.809 -1.341 -4.369) 5.364 9.250 ( -6.435 16.540 2.335) 17.901 9.588 ( -3.512 5.003 0.495) 6.133 9.807 ( -1.357 0.614 0.035) 1.490 10.104 ( 0.306 -0.107 -4.231) 4.244 10.340 ( -3.653 -3.542 4.901) 7.065 10.596 ( 4.078 -12.503 -1.229) 13.209 10.801 ( 8.034 -3.474 -1.515) 8.883 12.882 ( -10.249 15.252 -0.197) 18.377 14.318 ( 1.637 -1.597 2.326) 3.262 14.792 ( 3.896 -9.240 -2.401) 10.311 ======================= Grid point 775 (262/344) ======================= q-point: ( 0.40 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( 0.000 18.966 9.758) 21.329 1.947 ( 0.000 20.463 11.605) 23.524 2.216 ( -0.000 4.082 -7.779) 8.785 2.410 ( -0.000 11.834 -17.794) 21.370 3.147 ( 0.000 3.247 0.247) 3.256 3.231 ( 0.000 18.816 13.520) 23.170 3.272 ( 0.000 3.026 0.123) 3.029 3.493 ( 0.000 13.784 1.918) 13.916 3.901 ( -0.000 11.220 -1.388) 11.305 4.045 ( -0.000 14.445 -0.485) 14.453 4.332 ( -0.000 15.177 -9.988) 18.168 5.218 ( 0.000 -7.470 2.168) 7.778 7.592 ( 0.000 -0.267 5.453) 5.460 8.723 ( -0.000 -2.013 -1.251) 2.370 9.056 ( 0.000 3.720 1.150) 3.893 9.451 ( -0.000 5.327 -0.593) 5.360 9.702 ( 0.000 7.399 9.457) 12.008 9.759 ( 0.000 -11.049 1.994) 11.227 9.809 ( -0.000 1.091 -11.160) 11.213 11.318 ( 0.000 -17.532 -0.704) 17.546 11.579 ( -0.000 -2.631 -1.285) 2.928 12.213 ( -0.000 3.738 -1.759) 4.131 14.274 ( 0.000 -0.769 3.950) 4.025 14.617 ( 0.000 2.053 4.590) 5.028 ======================= Grid point 776 (263/344) ======================= q-point: ( 0.47 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.058 ( 7.562 16.304 7.274) 19.389 2.189 ( 3.414 17.002 5.705) 18.256 2.317 ( 6.943 7.031 -2.891) 10.296 2.501 ( 2.997 8.107 -14.130) 16.564 3.233 ( 7.515 1.613 -4.274) 8.794 3.295 ( -2.165 7.534 5.618) 9.644 3.474 ( 6.145 9.711 7.105) 13.511 3.615 ( 0.637 7.458 -0.604) 7.510 4.013 ( 0.591 9.998 -0.494) 10.028 4.220 ( 0.607 19.858 2.618) 20.039 4.518 ( 4.632 16.559 -6.916) 18.533 5.130 ( -3.161 -4.571 0.703) 5.602 7.635 ( 1.909 3.469 3.572) 5.333 8.690 ( -2.048 -1.357 -0.165) 2.463 9.144 ( 5.356 3.844 1.068) 6.679 9.517 ( 1.048 5.284 0.374) 5.399 9.594 ( -3.536 -2.512 0.872) 4.424 9.808 ( 0.069 4.880 -4.293) 6.500 9.892 ( 8.032 -1.368 2.777) 8.608 11.114 ( -4.615 -16.069 0.857) 16.741 11.370 ( -15.019 -3.453 -2.187) 15.565 12.364 ( 10.020 4.034 -1.523) 10.908 14.309 ( 4.291 -2.042 2.026) 5.166 14.627 ( -4.370 6.932 2.340) 8.522 ======================= Grid point 777 (264/344) ======================= q-point: ( 0.53 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 6.033 13.434 5.988) 15.898 2.451 ( 11.143 9.701 -1.593) 14.860 2.541 ( 4.696 14.407 0.435) 15.159 2.624 ( 6.976 5.679 -7.871) 11.953 3.309 ( 0.194 1.607 1.269) 2.057 3.441 ( 6.759 7.908 0.068) 10.403 3.644 ( 2.508 1.095 -0.738) 2.834 3.687 ( 4.788 6.188 3.766) 8.684 4.127 ( 1.243 10.783 -2.544) 11.148 4.466 ( 3.786 18.802 3.673) 19.528 4.759 ( 8.067 9.913 -2.075) 12.948 5.033 ( -5.301 0.504 -0.707) 5.372 7.740 ( 3.827 5.921 2.471) 7.470 8.616 ( -3.761 -3.266 0.583) 5.015 9.309 ( 7.747 4.932 0.246) 9.187 9.553 ( 0.716 3.007 1.271) 3.342 9.629 ( 3.214 4.579 -1.361) 5.757 9.837 ( -0.504 3.465 -3.353) 4.849 10.019 ( 5.832 1.283 3.314) 6.830 10.846 ( -9.372 -11.946 2.526) 15.393 11.087 ( -10.417 -6.344 -3.601) 12.717 12.580 ( 8.739 6.594 -0.902) 10.985 14.361 ( 2.659 -1.403 -0.032) 3.007 14.628 ( -2.893 5.160 1.881) 6.207 ======================= Grid point 778 (265/344) ======================= q-point: ( 0.60 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 4.394 10.742 3.240) 12.049 2.654 ( 5.145 3.609 -1.770) 6.529 2.805 ( 8.289 16.144 -0.934) 18.171 2.824 ( 6.106 10.442 -2.659) 12.385 3.313 ( -1.006 0.407 2.170) 2.426 3.526 ( -0.527 -1.553 -1.182) 2.022 3.761 ( 5.784 9.587 0.499) 11.208 3.853 ( 4.770 6.942 1.137) 8.500 4.264 ( 4.340 7.846 -2.247) 9.244 4.720 ( 5.871 12.920 2.415) 14.395 4.906 ( 1.429 -3.908 2.463) 4.835 5.021 ( 2.412 9.270 -2.330) 9.858 7.888 ( 4.922 6.878 2.626) 8.856 8.511 ( -3.355 -4.596 -0.263) 5.696 9.483 ( 4.792 6.783 -0.315) 8.311 9.636 ( 3.384 4.546 -0.838) 5.728 9.714 ( -0.632 5.789 1.009) 5.911 9.850 ( 0.324 2.313 -1.262) 2.655 10.145 ( 5.776 3.455 1.049) 6.812 10.607 ( -6.167 -8.929 2.875) 11.226 10.864 ( -5.520 -9.346 -3.351) 11.360 12.794 ( 6.156 10.589 -0.441) 12.256 14.362 ( -1.682 0.196 -0.187) 1.704 14.638 ( 1.234 -1.145 0.774) 1.853 ======================= Grid point 779 (266/344) ======================= q-point: ( 0.67 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( 0.506 6.523 0.110) 6.543 2.780 ( 5.629 4.415 0.538) 7.174 2.996 ( 0.624 12.734 -1.665) 12.857 3.060 ( 1.411 14.912 -1.528) 15.056 3.308 ( 1.208 -1.899 2.444) 3.323 3.495 ( 0.934 -1.101 -0.510) 1.531 3.947 ( 1.257 13.204 0.636) 13.279 3.982 ( 1.297 7.854 -0.104) 7.961 4.414 ( 5.581 4.851 -1.230) 7.497 4.845 ( -2.417 0.793 -0.130) 2.547 4.948 ( 6.814 4.363 2.515) 8.473 5.159 ( 7.090 -1.109 0.804) 7.221 8.045 ( 3.997 6.329 4.479) 8.723 8.420 ( -1.094 -4.626 -3.259) 5.763 9.589 ( -2.878 9.483 -0.935) 9.954 9.675 ( -6.061 7.025 3.304) 9.849 9.755 ( 2.444 2.744 -0.253) 3.683 9.928 ( 6.036 1.470 -2.358) 6.645 10.292 ( 6.420 3.394 0.604) 7.287 10.464 ( -2.380 -7.034 1.890) 7.663 10.700 ( -0.628 -10.962 -2.367) 11.232 12.997 ( 2.445 14.664 -0.220) 14.868 14.319 ( -2.867 -0.365 0.963) 3.046 14.642 ( 3.542 -6.679 -0.848) 7.607 ======================= Grid point 780 (267/344) ======================= q-point: ( 0.73 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.750 ( -1.409 4.885 -1.440) 5.284 2.911 ( 3.458 4.715 2.006) 6.181 3.074 ( -4.278 7.887 -0.466) 8.985 3.142 ( -4.452 13.268 -4.739) 14.775 3.312 ( 1.482 -3.784 3.166) 5.152 3.570 ( 3.116 6.013 0.700) 6.809 4.041 ( -2.719 8.883 -1.014) 9.345 4.071 ( -4.411 14.321 1.658) 15.076 4.536 ( 4.615 2.301 -0.381) 5.171 4.799 ( -2.898 -0.174 -1.226) 3.151 5.091 ( 6.445 -1.031 2.194) 6.885 5.238 ( 6.854 -7.899 2.192) 10.685 8.140 ( -0.800 2.479 7.823) 8.246 8.386 ( 3.082 -2.138 -7.576) 8.454 9.559 ( -10.455 12.562 2.138) 16.483 9.687 ( -2.143 5.882 1.480) 6.433 9.810 ( 1.405 1.296 -0.389) 1.951 10.039 ( 4.782 1.885 -2.583) 5.753 10.367 ( 0.314 -8.168 -0.942) 8.228 10.416 ( 3.608 0.380 3.201) 4.839 10.623 ( 3.940 -8.646 -2.380) 9.795 13.155 ( -3.120 17.375 -0.222) 17.654 14.275 ( -0.821 -1.994 2.098) 3.009 14.624 ( 4.655 -10.130 -2.015) 11.329 ======================= Grid point 781 (268/344) ======================= q-point: (-0.20 0.40 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( -2.570 4.303 -1.815) 5.331 2.987 ( -3.514 4.675 4.951) 7.663 3.038 ( -2.332 3.723 -4.356) 6.187 3.177 ( -5.987 12.458 -3.544) 14.269 3.320 ( 3.273 -3.231 2.256) 5.123 3.635 ( -4.205 5.448 1.610) 7.068 4.056 ( -4.742 7.941 -0.853) 9.288 4.104 ( -8.917 15.176 1.576) 17.672 4.627 ( 3.685 1.716 0.724) 4.129 4.724 ( -3.834 -2.663 -2.330) 5.217 5.152 ( 3.553 -5.280 1.799) 6.614 5.251 ( 4.935 -10.792 3.135) 12.274 8.106 ( -4.149 -2.063 6.976) 8.375 8.431 ( 3.658 0.524 -6.754) 7.698 9.541 ( -7.691 14.691 2.512) 16.772 9.703 ( -2.883 5.743 0.921) 6.491 9.828 ( -0.318 0.597 -0.244) 0.719 10.098 ( 0.085 1.310 -2.700) 3.002 10.298 ( 3.073 -9.734 -0.129) 10.209 10.438 ( 0.818 -4.661 2.990) 5.598 10.644 ( 5.856 -4.463 -2.882) 7.907 13.218 ( -9.348 16.337 -0.292) 18.825 14.272 ( 2.086 -1.499 2.482) 3.572 14.597 ( 5.425 -11.542 -2.343) 12.967 ======================= Grid point 791 (269/344) ======================= q-point: ( 0.47 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -0.000 11.477 0.221) 11.479 2.293 ( 0.000 6.753 3.533) 7.621 2.358 ( 0.000 15.781 2.517) 15.980 2.537 ( -0.000 8.849 -8.272) 12.113 3.154 ( -0.000 0.250 -5.407) 5.413 3.399 ( 0.000 7.061 3.001) 7.672 3.514 ( 0.000 6.274 6.408) 8.968 3.665 ( -0.000 3.047 0.044) 3.047 4.133 ( -0.000 13.629 -2.115) 13.792 4.431 ( 0.000 20.915 2.082) 21.019 4.625 ( -0.000 13.584 -1.837) 13.708 5.139 ( -0.000 1.132 -1.069) 1.557 7.675 ( 0.000 6.076 4.201) 7.387 8.703 ( -0.000 -0.428 -1.549) 1.607 9.123 ( 0.000 1.524 1.952) 2.476 9.535 ( -0.000 -3.229 -3.716) 4.923 9.573 ( 0.000 -0.849 3.979) 4.069 9.796 ( -0.000 2.880 -9.300) 9.736 9.917 ( 0.000 9.661 8.730) 13.021 11.011 ( -0.000 -12.358 -1.116) 12.409 11.480 ( -0.000 -6.378 -0.808) 6.429 12.285 ( -0.000 4.060 -1.428) 4.304 14.268 ( 0.000 0.428 0.565) 0.708 14.739 ( 0.000 6.385 2.173) 6.744 ======================= Grid point 792 (270/344) ======================= q-point: ( 0.53 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( 10.037 6.114 -2.755) 12.071 2.429 ( 3.127 10.633 4.938) 12.134 2.528 ( 6.234 7.002 -4.693) 10.485 2.645 ( 1.035 12.791 1.627) 12.935 3.221 ( 7.360 0.688 -4.321) 8.562 3.473 ( 0.378 6.813 3.208) 7.540 3.600 ( 3.274 1.145 0.161) 3.472 3.689 ( 1.057 2.132 3.358) 4.116 4.250 ( -1.292 12.756 -3.224) 13.220 4.631 ( 0.666 17.082 -1.107) 17.131 4.758 ( 1.916 8.061 4.505) 9.431 5.153 ( -3.294 8.355 -2.580) 9.344 7.770 ( 1.640 7.926 3.961) 9.011 8.653 ( -3.745 -2.455 -1.854) 4.847 9.199 ( 7.487 0.131 1.507) 7.638 9.508 ( 4.167 -4.356 -0.673) 6.066 9.622 ( 1.029 5.037 -0.095) 5.142 9.829 ( 1.594 3.618 -7.200) 8.214 10.043 ( 0.848 9.488 8.043) 12.467 10.857 ( -4.725 -9.702 -1.244) 10.863 11.266 ( -13.852 -5.899 -1.140) 15.099 12.441 ( 11.325 4.092 -0.951) 12.079 14.300 ( 2.267 0.741 -0.732) 2.495 14.766 ( -4.164 5.490 2.250) 7.249 ======================= Grid point 793 (271/344) ======================= q-point: ( 0.60 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.570 ( 9.474 4.729 0.500) 10.600 2.595 ( 7.167 8.592 -0.426) 11.197 2.702 ( 8.238 5.356 0.421) 9.835 2.835 ( 6.319 11.820 -1.334) 13.469 3.326 ( 2.224 1.654 -0.721) 2.864 3.529 ( -0.980 -0.464 -0.213) 1.105 3.693 ( 8.708 5.200 0.715) 10.168 3.805 ( 6.906 3.784 2.117) 8.154 4.333 ( -1.429 10.390 -2.435) 10.767 4.777 ( 3.149 4.888 -0.941) 5.890 4.868 ( -0.011 9.220 4.248) 10.151 5.175 ( -5.188 11.129 -2.231) 12.479 7.903 ( 3.104 8.568 3.316) 9.697 8.535 ( -4.774 -4.478 -1.426) 6.700 9.376 ( 11.360 0.770 0.346) 11.392 9.584 ( 7.103 -0.865 -1.001) 7.225 9.695 ( 2.120 3.942 -0.897) 4.565 9.880 ( 0.616 4.286 -3.216) 5.394 10.166 ( 0.857 9.070 5.472) 10.627 10.655 ( -7.874 -7.479 -0.089) 10.860 10.961 ( -13.280 -5.477 -1.959) 14.498 12.705 ( 12.882 6.079 -0.428) 14.251 14.338 ( 1.837 -0.564 -1.673) 2.548 14.721 ( -6.454 3.147 2.340) 7.552 ======================= Grid point 794 (272/344) ======================= q-point: ( 0.67 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 5.117 2.125 0.181) 5.543 2.774 ( 2.122 8.388 1.374) 8.761 2.979 ( 13.025 7.027 0.552) 14.810 3.066 ( 8.845 7.027 -2.065) 11.484 3.333 ( -2.674 2.128 -1.033) 3.570 3.487 ( -0.851 -0.191 0.541) 1.026 3.944 ( 9.633 7.011 0.808) 11.942 3.984 ( 7.769 6.003 -0.237) 9.821 4.411 ( 1.028 7.224 -0.782) 7.338 4.834 ( 2.664 -2.504 1.428) 3.925 4.964 ( -0.394 9.018 0.217) 9.029 5.170 ( -5.241 6.082 -0.805) 8.069 8.058 ( 4.024 8.262 2.908) 9.639 8.407 ( -3.828 -5.053 -1.728) 6.571 9.581 ( 9.528 2.506 0.242) 9.855 9.711 ( 6.719 1.375 -1.696) 7.065 9.765 ( 3.911 0.886 -1.694) 4.354 9.903 ( -3.680 5.326 1.026) 6.555 10.282 ( 1.772 7.843 1.991) 8.283 10.464 ( -5.449 -6.251 1.763) 8.478 10.701 ( -9.572 -5.793 -2.548) 11.475 12.996 ( 11.497 9.414 -0.090) 14.859 14.338 ( -0.009 -1.867 -1.735) 2.549 14.623 ( -6.342 -1.070 1.886) 6.702 ======================= Grid point 795 (273/344) ======================= q-point: ( 0.73 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( 2.360 3.305 0.279) 4.071 2.885 ( 2.747 5.190 0.144) 5.874 3.180 ( 2.122 4.317 -0.443) 4.831 3.205 ( 1.141 -0.308 0.167) 1.194 3.316 ( 1.017 3.372 -0.679) 3.587 3.575 ( 5.232 9.268 0.313) 10.648 4.114 ( 3.518 4.938 0.266) 6.069 4.183 ( 4.777 9.955 -0.327) 11.047 4.514 ( 3.276 5.106 -0.133) 6.069 4.841 ( -0.030 -0.862 0.481) 0.987 5.025 ( 0.837 2.275 0.248) 2.437 5.112 ( -2.501 -3.522 0.230) 4.326 8.205 ( 1.515 6.852 6.491) 9.559 8.302 ( -0.316 -4.855 -6.111) 7.812 9.731 ( 3.087 4.652 0.220) 5.587 9.782 ( 0.799 1.769 -0.221) 1.954 9.864 ( -7.933 8.070 3.246) 11.772 9.888 ( 10.573 -2.673 -3.769) 11.538 10.338 ( -1.246 -3.152 0.023) 3.389 10.408 ( 1.301 3.361 3.725) 5.183 10.506 ( -3.851 -7.035 -3.400) 8.711 13.278 ( 7.558 12.994 -0.013) 15.032 14.295 ( -2.084 -2.153 -0.254) 3.007 14.500 ( -3.072 -6.718 0.253) 7.392 ======================= Grid point 796 (274/344) ======================= q-point: ( 0.80 0.47 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.847 ( -2.027 5.424 -0.700) 5.833 2.976 ( 4.483 0.790 0.257) 4.560 3.133 ( -5.574 0.766 -0.952) 5.707 3.226 ( 3.119 -3.221 1.067) 4.608 3.390 ( -2.074 8.817 -0.613) 9.078 3.745 ( 1.132 8.670 0.489) 8.757 4.177 ( -1.373 4.891 -0.870) 5.154 4.332 ( -0.304 10.269 1.681) 10.410 4.607 ( 2.157 5.129 -0.674) 5.605 4.796 ( -5.901 0.737 -1.344) 6.097 5.035 ( 2.457 -8.241 2.700) 9.013 5.059 ( 4.533 -7.053 0.064) 8.385 8.173 ( -4.292 -3.185 5.260) 7.499 8.362 ( 4.531 3.612 -5.148) 7.751 9.770 ( -3.153 5.068 -0.294) 5.976 9.807 ( -1.833 3.517 2.745) 4.824 9.837 ( -2.239 5.122 0.263) 5.596 10.031 ( 8.705 -1.883 -1.647) 9.057 10.238 ( -6.735 -2.470 -2.529) 7.606 10.400 ( 1.472 -5.918 5.107) 7.955 10.506 ( 4.418 -0.278 -3.496) 5.641 13.483 ( -1.304 14.543 -0.225) 14.603 14.243 ( -0.492 -1.947 2.110) 2.913 14.401 ( 2.022 -10.413 -1.933) 10.782 ======================= Grid point 807 (275/344) ======================= q-point: ( 0.53 0.53 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -0.000 3.012 -3.019) 4.265 2.515 ( 0.000 9.514 6.408) 11.471 2.520 ( -0.000 4.504 -6.336) 7.774 2.784 ( 0.000 13.887 3.612) 14.349 3.142 ( -0.000 0.914 -3.673) 3.785 3.544 ( 0.000 6.185 1.052) 6.274 3.569 ( 0.000 -0.732 0.627) 0.964 3.691 ( 0.000 -1.135 2.413) 2.667 4.381 ( -0.000 11.730 -3.279) 12.180 4.720 ( -0.000 4.958 -1.245) 5.112 4.888 ( 0.000 14.911 4.777) 15.657 5.282 ( -0.000 12.028 -2.686) 12.325 7.852 ( 0.000 8.913 4.448) 9.962 8.666 ( -0.000 -1.956 -4.309) 4.732 9.092 ( 0.000 -5.956 2.271) 6.375 9.432 ( -0.000 -1.295 -0.956) 1.610 9.661 ( 0.000 4.417 0.237) 4.423 9.851 ( -0.000 5.731 -5.617) 8.024 10.159 ( 0.000 10.616 7.384) 12.931 10.812 ( -0.000 -6.793 -2.547) 7.254 11.332 ( -0.000 -7.896 -0.429) 7.908 12.359 ( -0.000 3.757 -0.993) 3.886 14.299 ( -0.000 2.451 -1.159) 2.711 14.860 ( 0.000 4.487 2.342) 5.061 ======================= Grid point 808 (276/344) ======================= q-point: ( 0.60 0.53 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.377 ( 12.543 2.892 -0.730) 12.893 2.566 ( 2.280 2.986 -2.632) 4.587 2.665 ( 5.740 7.091 3.576) 9.800 2.895 ( -1.376 9.803 -0.454) 9.909 3.249 ( 8.608 3.824 -0.659) 9.442 3.544 ( -1.208 -0.776 0.467) 1.510 3.625 ( 2.800 2.250 -0.351) 3.609 3.718 ( 5.275 -0.241 1.457) 5.478 4.465 ( -1.831 9.735 -2.484) 10.212 4.758 ( 0.970 0.895 1.619) 2.089 5.025 ( -1.600 13.468 0.621) 13.577 5.366 ( -3.653 11.220 -1.940) 11.958 7.961 ( 1.284 8.652 3.543) 9.437 8.578 ( -5.148 -3.347 -3.197) 6.923 9.137 ( 11.233 -5.983 0.415) 12.734 9.470 ( 4.320 0.784 -0.872) 4.476 9.713 ( 1.068 3.873 0.067) 4.018 9.908 ( 0.784 5.801 -3.024) 6.589 10.276 ( -0.326 9.897 5.733) 11.443 10.708 ( -4.918 -4.351 -2.415) 6.997 11.132 ( -11.901 -7.022 -0.532) 13.828 12.515 ( 12.434 3.512 -0.588) 12.934 14.323 ( 0.175 1.837 -1.692) 2.503 14.863 ( -4.665 3.137 2.464) 6.137 ======================= Grid point 809 (277/344) ======================= q-point: ( 0.67 0.53 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 4.086 1.762 0.812) 4.523 2.692 ( 17.902 3.499 0.596) 18.250 2.850 ( 6.321 6.281 3.456) 9.558 2.971 ( 4.217 3.744 -4.083) 6.962 3.384 ( 0.162 3.187 -1.933) 3.731 3.510 ( -0.977 0.515 1.283) 1.693 3.781 ( 13.812 2.229 -0.392) 13.996 3.860 ( 8.858 1.617 0.700) 9.032 4.507 ( -2.559 7.575 -1.442) 8.125 4.779 ( 1.263 -1.291 2.418) 3.018 5.100 ( -3.194 9.882 -1.547) 10.500 5.361 ( -7.342 7.356 -1.487) 10.499 8.081 ( 2.723 7.113 0.822) 7.661 8.444 ( -5.435 -3.432 -0.143) 6.430 9.328 ( 15.901 -4.226 -1.325) 16.507 9.575 ( 6.575 0.929 -1.157) 6.741 9.769 ( 1.226 2.959 0.138) 3.206 9.973 ( 0.667 5.030 -0.176) 5.077 10.368 ( -0.465 7.902 3.070) 8.491 10.548 ( -8.912 -2.660 -0.923) 9.347 10.847 ( -12.433 -5.220 -0.832) 13.510 12.812 ( 16.456 4.468 -0.162) 17.052 14.324 ( -0.777 0.019 -2.160) 2.295 14.775 ( -8.517 1.244 2.489) 8.960 ======================= Grid point 810 (278/344) ======================= q-point: ( 0.73 0.53 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.740 ( 5.180 0.996 1.456) 5.472 2.919 ( 2.286 5.811 -0.266) 6.250 3.077 ( 9.011 -0.080 -1.344) 9.111 3.113 ( 12.992 2.341 3.898) 13.765 3.334 ( -3.891 -0.764 -3.258) 5.132 3.573 ( 4.054 6.256 -0.122) 7.456 4.034 ( 8.667 2.151 0.955) 8.981 4.081 ( 15.168 3.390 -1.329) 15.599 4.536 ( -0.793 5.398 -0.263) 5.462 4.788 ( 1.689 -2.916 2.009) 3.923 5.105 ( -4.474 5.136 -1.810) 7.048 5.250 ( -10.506 2.355 -1.544) 10.877 8.188 ( 3.826 2.184 -6.043) 7.478 8.337 ( -4.593 -0.065 6.335) 7.825 9.572 ( 15.596 -2.156 -1.648) 15.830 9.698 ( 6.860 0.460 -1.903) 7.134 9.808 ( 0.331 1.905 0.275) 1.953 10.024 ( -1.058 5.099 1.922) 5.551 10.359 ( -8.136 -3.893 1.235) 9.103 10.430 ( 0.125 4.259 -0.798) 4.335 10.614 ( -10.176 -1.794 0.183) 10.335 13.154 ( 16.581 5.944 0.145) 17.614 14.290 ( -1.435 -1.516 -2.371) 3.159 14.610 ( -10.916 -1.188 2.333) 11.226 ======================= Grid point 823 (279/344) ======================= q-point: ( 0.60 0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -0.000 1.733 -0.236) 1.749 2.570 ( 0.000 2.339 0.626) 2.422 2.671 ( -0.000 4.339 -0.369) 4.354 3.041 ( -0.000 10.571 -0.794) 10.601 3.169 ( 0.000 2.296 1.616) 2.808 3.546 ( 0.000 -1.281 0.325) 1.322 3.630 ( -0.000 -4.935 -0.409) 4.952 3.647 ( -0.000 3.872 -0.784) 3.951 4.564 ( -0.000 7.581 -1.871) 7.808 4.764 ( 0.000 0.465 2.746) 2.785 5.164 ( -0.000 11.111 -1.649) 11.232 5.498 ( -0.000 9.049 -1.826) 9.232 8.039 ( 0.000 7.199 2.858) 7.746 8.603 ( -0.000 -1.697 -4.538) 4.845 8.953 ( 0.000 -7.302 1.219) 7.403 9.446 ( -0.000 1.751 -0.425) 1.802 9.737 ( -0.000 2.997 -0.030) 2.997 9.955 ( -0.000 5.665 -1.374) 5.829 10.381 ( 0.000 7.777 4.091) 8.787 10.721 ( -0.000 -0.532 -2.628) 2.681 11.166 ( 0.000 -8.446 0.040) 8.446 12.422 ( -0.000 2.831 -0.559) 2.885 14.344 ( -0.000 2.451 -1.800) 3.040 14.938 ( 0.000 2.239 2.516) 3.368 ======================= Grid point 824 (280/344) ======================= q-point: ( 0.67 0.60 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.420 ( 13.524 1.408 0.611) 13.611 2.614 ( 2.041 2.083 3.641) 4.665 2.759 ( 6.809 1.880 -2.550) 7.510 3.032 ( -4.722 4.954 -0.971) 6.912 3.356 ( 9.021 5.550 0.577) 10.608 3.526 ( -0.006 -0.568 0.795) 0.977 3.593 ( 3.620 -4.284 -1.494) 5.805 3.738 ( 6.399 1.580 -0.817) 6.642 4.610 ( -1.639 5.442 -1.254) 5.820 4.770 ( -0.164 -0.495 2.924) 2.970 5.235 ( -2.219 7.830 -2.648) 8.559 5.528 ( -4.473 5.372 -2.221) 7.335 8.109 ( 0.823 4.264 -0.034) 4.343 8.519 ( -5.580 -1.041 -0.410) 5.691 9.019 ( 12.823 -4.657 -0.915) 13.673 9.495 ( 3.712 1.309 -0.375) 3.954 9.772 ( 1.065 1.999 -0.039) 2.266 10.010 ( 0.440 4.509 0.547) 4.563 10.438 ( -0.590 2.993 0.725) 3.136 10.688 ( -5.529 4.314 -0.712) 7.049 10.984 ( -9.881 -7.574 0.256) 12.452 12.572 ( 13.151 2.229 -0.262) 13.341 14.350 ( -1.338 1.465 -2.052) 2.854 14.915 ( -5.132 1.083 2.531) 5.824 ======================= Grid point 825 (281/344) ======================= q-point: (-0.27 -0.40 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( 6.654 0.102 1.016) 6.731 2.763 ( 15.944 2.413 3.353) 16.471 2.912 ( 9.612 -0.835 -1.579) 9.777 3.028 ( 0.170 3.551 0.505) 3.591 3.394 ( -3.600 0.276 -2.556) 4.424 3.564 ( 1.467 1.606 -0.193) 2.183 3.781 ( 18.761 -0.564 -0.223) 18.771 3.887 ( 9.338 0.678 -0.335) 9.368 4.618 ( -2.271 4.053 -1.051) 4.763 4.759 ( -0.421 -2.056 2.729) 3.443 5.230 ( -4.481 3.993 -2.484) 6.496 5.441 ( -8.811 1.482 -2.866) 9.383 8.140 ( 0.984 -0.653 -5.386) 5.514 8.437 ( -4.201 1.587 5.494) 7.095 9.251 ( 17.177 -1.795 -2.302) 17.424 9.590 ( 5.985 0.568 -0.508) 6.033 9.807 ( 1.204 0.883 0.008) 1.493 10.059 ( 0.612 2.891 2.182) 3.673 10.421 ( -1.923 -1.710 -2.529) 3.608 10.591 ( -11.842 4.411 1.125) 12.687 10.756 ( -8.111 -2.915 1.054) 8.684 12.876 ( 18.544 1.835 0.062) 18.634 14.318 ( -2.588 0.398 -2.307) 3.490 14.796 ( -9.676 -0.171 2.460) 9.986 ======================= Grid point 839 (282/344) ======================= q-point: (-0.33 -0.33 -0.80) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( 0.000 1.126 1.617) 1.971 2.631 ( 0.000 2.436 5.775) 6.268 2.691 ( -0.000 -0.521 -5.695) 5.719 3.177 ( -0.000 3.342 -5.138) 6.129 3.238 ( 0.000 2.399 6.164) 6.614 3.496 ( -0.000 -3.510 -1.934) 4.007 3.561 ( 0.000 -0.330 0.824) 0.887 3.689 ( -0.000 0.941 -2.326) 2.509 4.661 ( -0.000 2.461 -0.552) 2.522 4.777 ( 0.000 -0.161 2.600) 2.604 5.312 ( -0.000 4.631 -2.787) 5.405 5.600 ( -0.000 2.084 -3.303) 3.906 8.129 ( -0.000 0.917 -0.759) 1.191 8.584 ( -0.000 1.369 -1.278) 1.873 8.844 ( 0.000 -3.475 0.401) 3.498 9.473 ( -0.000 0.781 -0.213) 0.810 9.778 ( -0.000 1.079 -0.105) 1.084 10.049 ( 0.000 3.435 1.840) 3.897 10.450 ( -0.000 -1.032 -2.159) 2.393 10.797 ( 0.000 7.385 0.549) 7.405 11.003 ( 0.000 -7.465 0.644) 7.493 12.464 ( -0.000 1.417 -0.200) 1.431 14.373 ( -0.000 1.107 -2.081) 2.357 14.974 ( 0.000 0.314 2.547) 2.567 ======================= Grid point 840 (283/344) ======================= q-point: (-0.27 -0.33 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 12.590 0.513 1.695) 12.714 2.679 ( 2.056 1.786 4.108) 4.928 2.737 ( 7.225 -1.636 -3.063) 8.017 3.086 ( -4.004 0.119 -1.115) 4.159 3.436 ( 6.258 2.113 0.066) 6.605 3.463 ( 4.824 -4.633 -0.922) 6.752 3.573 ( 2.084 2.203 0.731) 3.119 3.744 ( 6.417 -0.522 -2.142) 6.785 4.666 ( -0.668 0.492 -0.678) 1.071 4.769 ( -1.339 -0.641 2.593) 2.988 5.311 ( -2.511 0.609 -2.182) 3.382 5.554 ( -4.748 -1.077 -4.333) 6.517 8.113 ( -0.571 -2.612 -2.976) 4.001 8.539 ( -4.723 1.886 2.407) 5.626 8.964 ( 13.487 -0.100 -1.460) 13.566 9.507 ( 3.524 -0.050 -0.249) 3.534 9.792 ( 0.946 0.026 -0.111) 0.953 10.084 ( 0.138 2.003 3.160) 3.744 10.412 ( -0.834 -3.512 -4.047) 5.423 10.831 ( -3.230 -0.282 1.306) 3.496 10.847 ( -11.148 2.168 0.883) 11.391 12.599 ( 13.296 0.507 -0.002) 13.305 14.358 ( -1.781 0.263 -2.200) 2.843 14.931 ( -5.384 -0.579 2.509) 5.968 ======================= Grid point 855 (284/344) ======================= q-point: (-0.27 -0.27 0.20) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.340 ( 0.000 0.897 2.830) 2.968 2.613 ( -0.000 -4.300 -7.011) 8.225 2.717 ( 0.000 3.103 7.040) 7.694 3.095 ( -0.000 -8.077 -6.350) 10.275 3.304 ( 0.000 1.059 7.385) 7.461 3.481 ( -0.000 2.645 -1.155) 2.886 3.575 ( -0.000 0.825 -0.117) 0.833 3.663 ( -0.000 -2.223 -3.627) 4.254 4.661 ( -0.000 -1.712 -0.599) 1.813 4.785 ( 0.000 -0.327 2.671) 2.691 5.312 ( -0.000 -4.331 -1.622) 4.625 5.562 ( -0.000 -3.226 -5.259) 6.170 8.080 ( -0.000 -4.678 -1.305) 4.857 8.626 ( -0.000 2.373 -0.709) 2.476 8.826 ( -0.000 1.612 0.024) 1.613 9.470 ( -0.000 -0.951 -0.236) 0.980 9.778 ( -0.000 -0.961 -0.109) 0.967 10.106 ( 0.000 0.924 4.071) 4.174 10.361 ( -0.000 -6.041 -4.772) 7.699 10.828 ( 0.000 -5.107 0.861) 5.179 11.016 ( 0.000 8.586 0.861) 8.629 12.476 ( 0.000 -0.206 0.042) 0.211 14.367 ( -0.000 -0.769 -2.181) 2.312 14.975 ( 0.000 -1.377 2.530) 2.880 ======================= Grid point 968 (285/344) ======================= q-point: ( 0.27 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.716 ( 0.000 -0.000 23.969) 23.969 0.716 ( 0.000 -0.000 23.969) 23.969 1.377 ( 0.000 -0.000 50.377) 50.377 2.079 ( -0.000 0.000 -15.075) 15.075 2.079 ( -0.000 0.000 -15.075) 15.075 2.915 ( 0.000 -0.000 10.014) 10.014 2.915 ( 0.000 -0.000 10.014) 10.014 3.309 ( -0.000 0.000 -4.398) 4.398 3.309 ( -0.000 0.000 -4.398) 4.398 3.606 ( -0.000 0.000 -31.902) 31.902 4.343 ( -0.000 0.000 -0.637) 0.637 5.570 ( 0.000 -0.000 8.601) 8.601 8.924 ( 0.000 -0.000 0.574) 0.574 8.924 ( 0.000 -0.000 0.574) 0.574 9.252 ( -0.000 0.000 -0.427) 0.427 9.252 ( -0.000 0.000 -0.427) 0.427 9.382 ( 0.000 -0.000 0.898) 0.898 9.670 ( -0.000 0.000 -0.989) 0.989 10.129 ( 0.000 -0.000 1.807) 1.807 10.129 ( 0.000 -0.000 1.807) 1.807 12.106 ( -0.000 0.000 -1.615) 1.615 12.106 ( -0.000 0.000 -1.615) 1.615 13.887 ( 0.000 -0.000 0.041) 0.041 16.656 ( 0.000 -0.000 0.131) 0.131 ======================= Grid point 969 (286/344) ======================= q-point: ( 0.33 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.957 ( 13.991 8.078 18.200) 24.335 1.019 ( 17.291 9.983 19.995) 28.257 1.659 ( 13.934 8.045 25.743) 30.357 2.122 ( 5.563 3.212 -15.467) 16.748 2.225 ( 15.457 8.924 -2.347) 18.002 2.913 ( -0.952 -0.550 10.130) 10.189 3.072 ( 8.740 5.046 6.825) 12.183 3.310 ( 0.624 0.360 -4.156) 4.218 3.391 ( 8.203 4.736 -5.073) 10.745 3.618 ( 7.797 4.501 -27.668) 29.096 4.289 ( -3.864 -2.231 -1.943) 4.867 5.520 ( -5.458 -3.151 7.987) 10.173 8.136 ( -32.176 -18.577 24.607) 44.564 8.961 ( 2.472 1.427 0.264) 2.867 9.032 ( -6.028 -3.480 -10.524) 12.618 9.260 ( 1.195 0.690 -0.096) 1.384 9.462 ( -3.860 -2.229 5.219) 6.863 9.770 ( 7.875 4.547 -6.172) 10.990 10.076 ( -4.494 -2.595 2.039) 5.575 10.940 ( 29.496 17.029 -12.819) 36.391 12.083 ( -0.371 -0.214 -4.451) 4.472 12.126 ( 1.624 0.938 -1.820) 2.613 13.983 ( 7.990 4.613 0.164) 9.228 15.671 ( -58.335 -33.680 34.278) 75.579 ======================= Grid point 970 (287/344) ======================= q-point: ( 0.40 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.356 ( 16.357 9.443 12.486) 22.641 1.465 ( 16.917 9.767 16.922) 25.844 2.037 ( 16.036 9.258 -6.704) 19.693 2.249 ( 7.891 4.556 -15.348) 17.849 2.730 ( 24.739 14.283 14.257) 31.926 2.919 ( -0.316 -0.182 9.969) 9.975 3.282 ( 8.435 4.870 1.886) 9.921 3.324 ( 1.450 0.837 -3.402) 3.791 3.636 ( 13.107 7.567 -4.725) 15.855 3.844 ( 13.937 8.047 -14.474) 21.644 4.201 ( -1.124 -0.649 -5.483) 5.635 5.374 ( -8.061 -4.654 5.350) 10.736 7.750 ( -8.077 -4.663 11.442) 14.761 8.853 ( -6.899 -3.983 -7.183) 10.727 9.035 ( 3.815 2.202 -0.571) 4.441 9.304 ( 2.478 1.431 0.921) 3.006 9.427 ( -0.466 -0.269 8.100) 8.118 9.916 ( 6.321 3.650 -8.823) 11.451 9.940 ( -7.410 -4.278 2.336) 8.869 11.188 ( -1.766 -1.020 1.450) 2.502 12.012 ( -6.069 -3.504 -9.294) 11.640 12.169 ( 2.461 1.421 -2.165) 3.572 14.208 ( 9.250 5.340 0.202) 10.683 14.739 ( -25.896 -14.951 24.983) 38.965 ======================= Grid point 971 (288/344) ======================= q-point: ( 0.47 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( 13.852 7.998 8.562) 18.143 1.866 ( 15.033 8.679 11.180) 20.647 2.357 ( 13.308 7.683 -10.893) 18.836 2.395 ( 7.045 4.068 -12.943) 15.287 2.951 ( 1.529 0.883 7.754) 7.953 3.317 ( 21.108 12.187 10.642) 26.596 3.367 ( 2.802 1.618 -1.980) 3.793 3.476 ( 8.005 4.622 -0.218) 9.246 3.925 ( 9.610 5.548 -3.301) 11.577 4.033 ( 7.277 4.201 1.258) 8.496 4.383 ( 17.584 10.152 -11.481) 23.325 5.193 ( -7.721 -4.458 3.074) 9.430 7.706 ( 1.671 0.964 1.288) 2.319 8.706 ( -4.917 -2.839 -0.951) 5.757 9.127 ( 4.206 2.428 -1.953) 5.234 9.368 ( 2.219 1.281 3.149) 4.060 9.471 ( 2.851 1.646 7.171) 7.891 9.761 ( -7.831 -4.521 1.708) 9.203 10.033 ( 5.823 3.362 -9.162) 11.364 11.046 ( -9.194 -5.308 8.126) 13.369 11.787 ( -10.242 -5.913 -7.252) 13.873 12.227 ( 2.929 1.691 -2.252) 4.063 14.258 ( -3.674 -2.121 5.360) 6.836 14.603 ( 6.212 3.586 4.555) 8.497 ======================= Grid point 972 (289/344) ======================= q-point: ( 0.53 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 9.498 5.483 4.983) 12.046 2.206 ( 12.596 7.272 5.511) 15.554 2.507 ( 4.575 2.641 -6.767) 8.584 2.607 ( 10.227 5.904 -6.060) 13.273 3.027 ( 3.906 2.255 2.399) 5.109 3.444 ( 3.924 2.266 -0.100) 4.532 3.604 ( 2.804 1.619 -1.479) 3.560 3.646 ( 5.460 3.152 3.690) 7.305 4.110 ( 10.878 6.281 -1.242) 12.623 4.347 ( 15.689 9.058 4.395) 18.642 4.769 ( 14.811 8.551 -7.637) 18.730 5.076 ( -1.147 -0.662 2.700) 3.007 7.795 ( 5.651 3.263 -2.762) 7.086 8.615 ( -3.407 -1.967 3.523) 5.281 9.200 ( 1.670 0.964 -3.609) 4.092 9.385 ( -2.124 -1.226 7.017) 7.433 9.593 ( 6.538 3.775 4.640) 8.861 9.640 ( -1.364 -0.788 -0.854) 1.792 10.153 ( 6.270 3.620 -7.755) 10.609 10.858 ( -7.934 -4.581 7.517) 11.851 11.549 ( -9.003 -5.198 -4.085) 11.169 12.293 ( 3.115 1.798 -1.873) 4.055 14.226 ( 0.191 0.110 3.028) 3.036 14.776 ( 6.818 3.936 0.083) 7.873 ======================= Grid point 973 (290/344) ======================= q-point: ( 0.60 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 5.302 3.061 1.456) 6.293 2.462 ( 8.744 5.049 0.198) 10.099 2.582 ( 2.698 1.558 0.225) 3.124 2.814 ( 8.529 4.924 -0.214) 9.850 3.130 ( 4.817 2.781 -3.029) 6.334 3.539 ( 3.950 2.280 1.643) 4.847 3.597 ( -1.639 -0.946 -2.079) 2.811 3.693 ( -1.454 -0.839 2.559) 3.060 4.358 ( 9.853 5.689 -1.447) 11.469 4.687 ( 10.852 6.265 1.912) 12.676 4.941 ( 4.862 2.807 0.118) 5.616 5.239 ( 11.452 6.612 0.822) 13.250 7.934 ( 6.512 3.760 -2.665) 7.977 8.562 ( -1.868 -1.078 4.524) 5.012 9.126 ( -6.800 -3.926 -0.656) 7.879 9.385 ( 1.720 0.993 2.988) 3.588 9.672 ( 2.905 1.677 -0.627) 3.413 9.777 ( 8.156 4.709 1.683) 9.567 10.289 ( 6.643 3.836 -4.947) 9.128 10.727 ( -4.515 -2.607 4.950) 7.190 11.350 ( -7.790 -4.498 -1.871) 9.188 12.361 ( 2.958 1.708 -1.140) 3.601 14.262 ( 2.076 1.199 2.047) 3.152 14.903 ( 4.293 2.479 -1.381) 5.146 ======================= Grid point 974 (291/344) ======================= q-point: ( 0.67 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 2.581 1.490 -0.967) 3.133 2.607 ( 4.483 2.588 -4.212) 6.674 2.633 ( 1.152 0.665 4.642) 4.829 3.004 ( 7.311 4.221 4.068) 9.371 3.224 ( 3.996 2.307 -6.173) 7.707 3.551 ( -2.099 -1.212 -0.036) 2.424 3.621 ( -4.105 -2.370 0.508) 4.767 3.623 ( 2.715 1.568 2.810) 4.210 4.549 ( 6.690 3.863 0.320) 7.732 4.801 ( 1.026 0.592 -2.729) 2.975 5.126 ( 8.885 5.130 3.529) 10.850 5.468 ( 7.244 4.182 2.561) 8.748 8.064 ( 4.533 2.617 -0.630) 5.272 8.550 ( 0.105 0.061 2.808) 2.811 8.961 ( -6.559 -3.787 0.080) 7.574 9.438 ( 1.996 1.153 0.732) 2.419 9.737 ( 2.443 1.411 -0.058) 2.822 9.952 ( 6.509 3.758 -0.894) 7.569 10.413 ( 3.578 2.066 -0.324) 4.144 10.690 ( 1.506 0.870 1.457) 2.269 11.173 ( -7.359 -4.248 -0.936) 8.548 12.421 ( 2.339 1.351 -0.387) 2.729 14.317 ( 2.072 1.196 2.019) 3.131 14.971 ( 2.028 1.171 -2.176) 3.197 ======================= Grid point 975 (292/344) ======================= q-point: ( 0.73 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( 1.270 0.733 -2.141) 2.595 2.650 ( -0.930 -0.537 6.510) 6.598 2.672 ( 2.636 1.522 -6.311) 7.007 3.140 ( 2.342 1.352 5.940) 6.526 3.283 ( 2.418 1.396 -7.389) 7.899 3.484 ( -2.986 -1.724 1.584) 3.795 3.566 ( -0.351 -0.203 -0.642) 0.760 3.670 ( 0.608 0.351 3.395) 3.467 4.658 ( 2.333 1.347 0.303) 2.711 4.794 ( -0.385 -0.222 -2.430) 2.470 5.294 ( 4.341 2.506 2.535) 5.617 5.574 ( 1.305 0.753 4.365) 4.617 8.123 ( 0.268 0.155 1.214) 1.253 8.577 ( 1.771 1.023 0.810) 2.200 8.846 ( -3.073 -1.774 -0.164) 3.553 9.471 ( 0.720 0.415 0.242) 0.865 9.777 ( 0.922 0.532 0.116) 1.070 10.064 ( 3.533 2.040 -2.712) 4.899 10.431 ( -1.804 -1.042 3.564) 4.128 10.803 ( 6.772 3.910 -1.005) 7.884 11.007 ( -6.422 -3.708 -0.790) 7.457 12.463 ( 1.239 0.715 0.040) 1.431 14.358 ( 0.949 0.548 2.168) 2.429 14.991 ( 0.263 0.152 -2.555) 2.573 ======================= Grid point 984 (293/344) ======================= q-point: ( 0.33 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.987 ( 0.000 15.526 18.560) 24.197 1.075 ( 0.000 20.020 19.040) 27.628 1.743 ( 0.000 15.273 22.213) 26.957 2.046 ( -0.000 3.903 -13.859) 14.398 2.240 ( -0.000 19.376 0.141) 19.377 2.990 ( 0.000 2.119 8.982) 9.228 3.038 ( 0.000 7.710 7.972) 11.091 3.276 ( -0.000 -0.649 -4.928) 4.970 3.394 ( -0.000 9.299 -5.108) 10.610 3.542 ( -0.000 8.475 -28.272) 29.515 4.287 ( -0.000 -4.375 -1.985) 4.804 5.538 ( 0.000 -6.365 7.675) 9.972 8.175 ( 0.000 -39.918 23.323) 46.232 8.935 ( 0.000 1.488 0.748) 1.665 8.984 ( -0.000 -8.348 -9.506) 12.651 9.283 ( -0.000 2.652 -0.534) 2.706 9.505 ( 0.000 0.596 4.243) 4.284 9.730 ( -0.000 5.188 -5.456) 7.529 10.094 ( 0.000 -4.613 1.690) 4.913 10.970 ( -0.000 42.306 -14.144) 44.608 12.029 ( -0.000 -8.666 -0.480) 8.680 12.109 ( -0.000 1.322 -1.499) 1.998 13.981 ( -0.000 8.674 0.296) 8.679 15.763 ( 0.000 -62.560 27.801) 68.458 ======================= Grid point 985 (294/344) ======================= q-point: ( 0.40 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.302 ( 10.282 17.604 13.799) 24.617 1.403 ( 9.124 17.658 17.637) 26.573 1.953 ( 5.069 14.384 -5.704) 16.283 2.149 ( 7.136 6.756 -13.782) 16.927 2.601 ( 13.354 22.508 16.486) 30.931 3.002 ( -2.595 4.808 9.226) 10.722 3.205 ( 6.099 5.843 1.793) 8.635 3.291 ( 3.035 0.791 -3.912) 5.014 3.547 ( 6.734 11.905 -4.653) 14.448 3.683 ( 9.536 12.554 -18.804) 24.538 4.211 ( -2.355 -3.244 -3.761) 5.497 5.437 ( -4.654 -7.750 5.763) 10.721 7.821 ( -7.133 -16.513 14.456) 23.077 8.858 ( -2.666 -7.291 -7.041) 10.480 8.995 ( 3.602 2.457 0.372) 4.376 9.316 ( 0.460 4.057 -0.127) 4.085 9.497 ( -3.754 2.622 7.667) 8.930 9.785 ( 3.762 -0.006 -8.172) 8.996 10.040 ( -1.664 -2.454 1.579) 3.360 11.260 ( -2.091 13.269 -5.857) 14.654 11.886 ( -1.333 -16.037 -2.089) 16.228 12.193 ( 4.719 5.084 -3.213) 7.644 14.142 ( 6.675 10.036 0.452) 12.061 15.019 ( -23.441 -35.386 24.296) 48.908 ======================= Grid point 986 (295/344) ======================= q-point: ( 0.47 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( 9.963 17.813 9.467) 22.499 1.776 ( 11.092 13.665 13.834) 22.386 2.196 ( 10.876 9.912 -11.661) 18.775 2.319 ( 6.421 8.824 -13.846) 17.629 3.005 ( 0.757 6.344 9.866) 11.754 3.163 ( 14.461 18.353 12.584) 26.539 3.319 ( 4.557 1.562 -3.517) 5.964 3.417 ( 5.978 7.349 -0.369) 9.481 3.816 ( 10.260 11.914 -2.857) 15.981 3.940 ( 8.089 3.825 -4.102) 9.843 4.223 ( 8.090 8.350 -9.581) 15.066 5.268 ( -6.619 -7.463 3.329) 10.516 7.686 ( -0.150 -3.880 4.048) 5.609 8.737 ( -3.110 -4.155 -2.442) 5.736 9.095 ( 3.829 4.356 -0.827) 5.858 9.380 ( 1.347 5.127 1.043) 5.403 9.484 ( -1.536 1.608 8.275) 8.569 9.789 ( 0.190 -4.344 -3.960) 5.881 10.018 ( -0.665 3.686 -3.363) 5.034 11.180 ( -10.225 -2.752 5.939) 12.141 11.673 ( -0.218 -20.535 -6.438) 21.521 12.298 ( 0.300 8.246 -3.049) 8.797 14.339 ( 0.593 6.871 1.390) 7.035 14.557 ( -4.224 -9.884 10.743) 15.197 ======================= Grid point 987 (296/344) ======================= q-point: ( 0.53 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 5.969 16.454 6.064) 18.524 2.112 ( 10.392 11.111 8.175) 17.271 2.448 ( 9.165 6.975 -7.477) 13.731 2.481 ( 6.733 8.107 -10.469) 14.854 3.074 ( -1.251 7.879 6.120) 10.055 3.404 ( 4.464 3.297 -2.313) 6.012 3.568 ( 7.783 7.127 4.496) 11.470 3.580 ( 5.600 6.285 -0.854) 8.461 4.004 ( 6.665 4.147 -0.722) 7.883 4.188 ( 14.597 10.454 3.612) 18.314 4.572 ( 16.596 12.682 -8.884) 22.698 5.102 ( -4.529 -5.576 2.412) 7.578 7.722 ( 4.629 1.396 -1.435) 5.044 8.652 ( -2.914 -2.708 2.017) 4.460 9.198 ( 2.170 5.672 -2.406) 6.532 9.451 ( -0.792 5.030 3.943) 6.440 9.532 ( 3.956 1.117 4.855) 6.362 9.707 ( -4.920 0.063 0.808) 4.987 10.076 ( 4.067 3.733 -7.353) 9.195 10.961 ( -9.328 -7.387 8.142) 14.418 11.463 ( 0.505 -18.703 -5.680) 19.553 12.370 ( -1.712 10.343 -1.855) 10.647 14.283 ( -4.967 1.960 3.612) 6.446 14.657 ( 9.397 0.834 0.638) 9.456 ======================= Grid point 988 (297/344) ======================= q-point: ( 0.60 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( 1.036 14.658 2.922) 14.983 2.386 ( 8.090 8.637 2.950) 12.196 2.589 ( 2.242 8.007 -4.234) 9.331 2.689 ( 9.628 4.221 -2.554) 10.818 3.156 ( 0.107 8.834 1.409) 8.946 3.512 ( 3.609 4.313 -0.534) 5.649 3.608 ( -1.385 0.007 -1.367) 1.946 3.716 ( 1.387 3.254 1.869) 4.001 4.225 ( 11.079 5.559 -1.387) 12.473 4.561 ( 13.539 9.900 4.494) 17.364 4.872 ( 6.246 3.941 -4.522) 8.660 5.096 ( 9.251 1.832 2.084) 9.658 7.845 ( 6.779 3.508 -2.608) 8.066 8.585 ( -2.229 -3.053 3.923) 5.448 9.244 ( -4.179 5.269 -2.841) 7.301 9.439 ( -4.691 3.407 5.420) 7.936 9.635 ( 4.206 2.044 -0.767) 4.739 9.723 ( 3.717 5.767 3.185) 7.564 10.192 ( 6.818 3.301 -6.405) 9.920 10.775 ( -5.384 -6.941 5.897) 10.580 11.289 ( 0.488 -16.213 -2.859) 16.470 12.442 ( -2.405 11.755 -1.049) 12.044 14.266 ( -0.648 2.156 2.231) 3.169 14.806 ( 7.375 -0.600 -1.175) 7.493 ======================= Grid point 989 (298/344) ======================= q-point: ( 0.67 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( -2.956 13.312 0.358) 13.641 2.565 ( 4.127 5.502 -2.061) 7.180 2.683 ( -0.319 7.915 1.067) 7.993 2.877 ( 8.779 1.697 1.578) 9.080 3.258 ( 1.081 9.326 -2.042) 9.608 3.558 ( -0.703 -1.955 -1.435) 2.525 3.608 ( 0.100 3.649 2.272) 4.299 3.725 ( -3.836 4.477 0.346) 5.906 4.448 ( 9.142 3.517 0.020) 9.795 4.777 ( 2.648 2.542 -1.350) 3.911 5.011 ( 9.856 3.540 2.637) 10.800 5.341 ( 11.532 2.635 1.607) 11.938 7.995 ( 6.230 3.521 -1.160) 7.250 8.536 ( -0.327 -3.487 2.577) 4.348 9.139 ( -11.434 5.326 0.217) 12.615 9.452 ( -0.262 4.429 1.646) 4.732 9.716 ( 2.535 2.776 -0.361) 3.777 9.883 ( 6.232 5.091 0.662) 8.074 10.339 ( 7.093 3.043 -3.475) 8.464 10.667 ( -0.827 -5.331 3.356) 6.354 11.137 ( -0.265 -14.101 -1.169) 14.152 12.514 ( -3.328 12.540 -0.403) 12.980 14.297 ( 1.472 0.953 2.050) 2.698 14.895 ( 5.213 -2.438 -2.094) 6.124 ======================= Grid point 990 (299/344) ======================= q-point: ( 0.73 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.425 ( -5.109 12.264 -0.973) 13.321 2.644 ( 1.473 3.296 -4.862) 6.056 2.736 ( -2.960 7.082 3.949) 8.633 3.024 ( 6.947 -1.221 1.560) 7.224 3.363 ( 0.710 8.652 -1.551) 8.818 3.530 ( -1.483 1.014 -0.394) 1.840 3.584 ( -4.777 0.514 1.176) 4.946 3.731 ( -2.463 6.532 1.502) 7.141 4.603 ( 5.660 1.360 0.721) 5.865 4.789 ( -0.336 -0.472 -2.769) 2.829 5.215 ( 7.886 2.057 3.153) 8.739 5.511 ( 6.472 -1.343 3.038) 7.275 8.103 ( 2.755 1.445 1.483) 3.447 8.520 ( 2.214 -3.415 -0.674) 4.125 9.012 ( -10.288 8.093 1.218) 13.147 9.492 ( -0.560 3.880 0.458) 3.947 9.772 ( 1.138 1.923 0.037) 2.235 10.017 ( 4.259 3.120 -1.592) 5.514 10.435 ( 1.374 -0.093 1.377) 1.948 10.686 ( 7.353 -1.828 -0.126) 7.578 10.988 ( -1.510 -12.299 -0.766) 12.415 12.571 ( -4.671 12.552 -0.002) 13.393 14.335 ( 1.944 -0.475 2.189) 2.966 14.933 ( 3.513 -3.923 -2.527) 5.841 ======================= Grid point 1000 (300/344) ======================= q-point: ( 0.40 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 0.000 19.456 12.724) 23.247 1.568 ( 0.000 20.483 16.506) 26.306 2.076 ( -0.000 16.374 -14.228) 21.692 2.094 ( -0.000 5.812 -10.459) 11.965 2.788 ( 0.000 26.694 19.126) 32.839 3.081 ( 0.000 3.380 5.564) 6.510 3.245 ( -0.000 -0.041 -3.757) 3.758 3.249 ( 0.000 10.710 3.031) 11.130 3.604 ( -0.000 14.791 -7.252) 16.473 3.729 ( -0.000 17.527 -11.358) 20.885 4.192 ( -0.000 -2.114 -4.532) 5.001 5.402 ( 0.000 -9.402 4.552) 10.446 7.739 ( 0.000 -14.404 11.835) 18.643 8.797 ( -0.000 -6.008 -4.439) 7.470 8.987 ( 0.000 3.199 1.169) 3.406 9.351 ( -0.000 4.343 -0.831) 4.421 9.594 ( 0.000 5.197 7.123) 8.818 9.764 ( -0.000 1.673 -8.535) 8.698 9.966 ( 0.000 -8.739 1.488) 8.865 11.424 ( -0.000 10.596 -11.807) 15.865 11.767 ( 0.000 -16.399 5.289) 17.231 12.144 ( -0.000 2.743 -1.282) 3.028 14.187 ( 0.000 9.832 1.456) 9.939 14.902 ( 0.000 -31.683 15.993) 35.490 ======================= Grid point 1001 (301/344) ======================= q-point: ( 0.47 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 8.909 18.487 9.673) 22.687 1.840 ( 4.180 18.559 13.078) 23.086 2.151 ( 3.467 9.703 -10.513) 14.720 2.268 ( 6.599 10.686 -14.475) 19.164 3.091 ( 1.484 13.055 10.973) 17.119 3.205 ( 8.006 11.753 6.521) 15.645 3.255 ( 1.333 3.921 -0.797) 4.218 3.405 ( 4.057 10.206 0.091) 10.983 3.806 ( 6.384 14.724 -2.252) 16.205 3.906 ( 1.973 12.481 -4.257) 13.334 4.201 ( 2.437 8.016 -7.608) 11.317 5.282 ( -3.678 -9.016 2.602) 10.079 7.652 ( -0.119 -5.056 5.959) 7.816 8.731 ( -1.316 -3.273 -1.882) 3.998 9.064 ( 4.105 4.022 0.966) 5.827 9.409 ( 1.377 5.202 -0.483) 5.403 9.602 ( -6.537 2.813 7.726) 10.504 9.733 ( 0.920 0.289 -8.363) 8.418 9.973 ( 6.249 -4.588 0.753) 7.789 11.378 ( -8.197 0.774 -6.020) 10.200 11.502 ( -8.465 -19.455 3.719) 21.540 12.278 ( 8.063 4.419 -1.768) 9.363 14.329 ( 6.318 5.529 1.880) 8.604 14.609 ( -9.121 -11.167 7.539) 16.271 ======================= Grid point 1002 (302/344) ======================= q-point: ( 0.53 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( 8.658 15.396 8.107) 19.435 2.132 ( 6.240 17.895 6.247) 19.954 2.335 ( 8.506 8.750 -7.467) 14.306 2.453 ( 6.259 9.219 -10.329) 15.194 3.207 ( -1.613 9.011 7.354) 11.742 3.329 ( 6.735 2.297 -4.756) 8.559 3.522 ( 7.996 10.721 5.555) 14.482 3.574 ( 3.925 7.712 -0.727) 8.684 3.970 ( 1.922 3.628 -0.800) 4.183 4.109 ( 8.777 16.768 2.588) 19.102 4.453 ( 11.245 16.578 -7.177) 21.279 5.125 ( -4.890 -7.220 1.361) 8.826 7.668 ( 2.903 1.346 1.435) 3.507 8.673 ( -2.215 -2.407 0.539) 3.315 9.198 ( 4.920 5.834 -0.170) 7.633 9.495 ( 2.091 4.950 1.014) 5.468 9.538 ( -2.215 1.709 2.747) 3.921 9.759 ( 0.121 2.701 -1.946) 3.331 10.035 ( 3.734 -0.553 -1.439) 4.040 11.102 ( -14.917 -9.350 7.060) 18.968 11.259 ( -0.722 -14.797 -7.034) 16.400 12.441 ( 4.462 7.126 -1.353) 8.516 14.415 ( -4.354 -3.452 3.286) 6.456 14.513 ( 5.361 5.635 0.610) 7.801 ======================= Grid point 1003 (303/344) ======================= q-point: ( 0.60 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 6.271 11.580 5.540) 14.287 2.416 ( 2.930 18.697 1.101) 18.957 2.566 ( 10.113 6.334 -2.917) 12.284 2.620 ( 4.261 9.926 -5.917) 12.317 3.263 ( -1.723 6.324 4.265) 7.819 3.478 ( 5.412 5.221 -2.500) 7.924 3.643 ( -0.566 2.257 -0.684) 2.425 3.718 ( 4.364 6.569 1.496) 8.027 4.110 ( 7.847 6.737 -1.303) 10.424 4.457 ( 11.873 13.593 4.136) 18.516 4.795 ( 10.383 12.353 -5.045) 16.907 5.003 ( -0.605 -5.161 2.105) 5.606 7.774 ( 5.396 4.583 -0.473) 7.096 8.600 ( -2.821 -3.848 1.920) 5.143 9.328 ( 1.759 7.916 -1.489) 8.245 9.561 ( 1.730 2.553 0.607) 3.144 9.592 ( 0.498 6.163 2.094) 6.528 9.772 ( -1.537 4.462 2.269) 5.236 10.103 ( 4.898 1.803 -4.283) 6.752 10.814 ( -8.085 -10.244 5.286) 14.080 11.094 ( 0.239 -14.769 -3.996) 15.301 12.578 ( 1.428 10.791 -0.750) 10.911 14.341 ( -4.030 1.999 1.797) 4.844 14.656 ( 7.373 -0.566 -0.606) 7.420 ======================= Grid point 1004 (304/344) ======================= q-point: ( 0.67 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( 2.695 9.253 3.364) 10.208 2.601 ( -0.749 15.615 -2.733) 15.870 2.746 ( 4.187 7.559 -4.234) 9.623 2.805 ( 4.637 10.031 2.801) 11.400 3.308 ( 0.791 3.665 1.633) 4.090 3.537 ( 0.122 -1.977 -1.323) 2.382 3.694 ( -0.275 10.349 0.577) 10.369 3.823 ( -0.158 7.162 -0.380) 7.174 4.320 ( 9.254 4.509 -0.607) 10.312 4.758 ( 6.209 7.550 1.841) 9.947 4.902 ( 3.616 1.261 -0.546) 3.868 5.150 ( 12.727 1.983 1.176) 12.935 7.929 ( 6.143 5.591 -0.214) 8.310 8.516 ( -1.894 -5.007 1.131) 5.471 9.387 ( -5.839 9.538 -1.369) 11.267 9.554 ( -5.185 5.822 3.408) 8.509 9.691 ( 3.873 3.452 -0.375) 5.202 9.851 ( 3.824 5.282 1.304) 6.650 10.229 ( 7.600 2.926 -3.870) 9.017 10.634 ( -3.085 -8.895 3.078) 9.905 10.957 ( 1.793 -14.982 -1.460) 15.160 12.705 ( -1.252 14.232 -0.325) 14.291 14.313 ( -1.760 1.305 1.834) 2.857 14.749 ( 6.427 -4.165 -1.704) 7.846 ======================= Grid point 1005 (305/344) ======================= q-point: ( 0.73 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( -1.274 6.449 0.408) 6.587 2.706 ( -4.047 15.435 -3.212) 16.277 2.870 ( 0.629 9.189 -2.221) 9.475 2.945 ( 1.946 5.588 3.597) 6.924 3.370 ( 2.479 0.515 2.068) 3.269 3.519 ( 1.243 -0.362 -1.444) 1.940 3.776 ( -5.156 13.110 1.038) 14.126 3.864 ( -3.388 8.541 -0.535) 9.204 4.500 ( 7.655 1.793 0.501) 7.878 4.794 ( -1.332 0.422 -2.064) 2.492 5.085 ( 9.775 2.073 2.757) 10.366 5.350 ( 9.806 -2.655 1.889) 10.334 8.076 ( 4.047 4.497 2.086) 6.399 8.450 ( 0.461 -4.916 -1.931) 5.302 9.318 ( -12.065 11.325 1.561) 16.621 9.567 ( -1.902 6.085 1.312) 6.509 9.770 ( 1.866 2.561 -0.268) 3.180 9.975 ( 4.361 3.840 -0.807) 5.866 10.383 ( 6.240 2.529 -1.413) 6.880 10.541 ( 2.381 -8.251 1.080) 8.655 10.846 ( 1.899 -13.470 -0.438) 13.610 12.811 ( -4.391 16.551 -0.082) 17.124 14.309 ( 0.370 -0.727 2.195) 2.341 14.791 ( 5.411 -6.793 -2.361) 9.000 ======================= Grid point 1016 (306/344) ======================= q-point: ( 0.47 0.47 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( 0.000 17.550 6.419) 18.687 2.023 ( 0.000 18.360 10.602) 21.201 2.177 ( -0.000 5.816 -3.300) 6.687 2.295 ( -0.000 13.075 -16.383) 20.961 3.133 ( -0.000 0.882 -4.087) 4.182 3.284 ( 0.000 4.684 2.958) 5.540 3.316 ( 0.000 16.359 11.787) 20.163 3.498 ( -0.000 12.780 -0.546) 12.791 3.893 ( -0.000 12.873 -0.939) 12.907 4.045 ( -0.000 16.383 0.496) 16.390 4.273 ( -0.000 15.550 -7.096) 17.092 5.229 ( 0.000 -8.268 1.190) 8.353 7.630 ( 0.000 -1.379 5.665) 5.830 8.714 ( -0.000 -1.542 -1.226) 1.970 9.066 ( 0.000 3.802 1.774) 4.195 9.444 ( -0.000 5.222 -1.571) 5.454 9.729 ( -0.000 2.887 -9.695) 10.115 9.771 ( 0.000 -10.895 1.361) 10.980 9.772 ( 0.000 5.697 8.353) 10.111 11.292 ( -0.000 -14.462 -6.538) 15.871 11.590 ( 0.000 -5.101 4.165) 6.585 12.204 ( -0.000 3.662 -0.962) 3.786 14.295 ( 0.000 -1.126 2.296) 2.557 14.643 ( 0.000 0.257 2.955) 2.966 ======================= Grid point 1017 (307/344) ======================= q-point: ( 0.53 0.47 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.093 ( 8.522 14.339 2.424) 16.855 2.216 ( 2.416 13.284 2.467) 13.725 2.318 ( 6.195 11.043 2.904) 12.991 2.418 ( 3.588 10.241 -9.900) 14.689 3.198 ( 7.424 0.745 -5.727) 9.406 3.331 ( -1.244 7.573 5.074) 9.201 3.517 ( 5.053 8.283 5.497) 11.151 3.612 ( 0.760 7.555 -0.396) 7.603 4.008 ( 0.386 9.280 -0.899) 9.331 4.235 ( 1.008 20.426 1.260) 20.489 4.484 ( 4.644 18.724 -2.989) 19.521 5.132 ( -3.095 -5.359 -0.193) 6.192 7.660 ( 1.267 3.287 3.944) 5.288 8.687 ( -1.607 -1.431 -0.942) 2.349 9.153 ( 5.017 3.914 1.668) 6.578 9.512 ( 2.197 5.291 -1.494) 5.921 9.598 ( -4.271 -3.105 -0.073) 5.280 9.768 ( 2.039 2.114 -6.261) 6.915 9.928 ( 5.856 2.113 6.713) 9.155 11.105 ( -3.396 -15.269 -3.679) 16.069 11.368 ( -15.965 -4.352 1.641) 16.629 12.357 ( 10.047 4.099 -0.701) 10.874 14.318 ( 4.162 -2.933 0.483) 5.115 14.642 ( -4.457 6.809 1.981) 8.376 ======================= Grid point 1018 (308/344) ======================= q-point: ( 0.60 0.47 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( 5.997 12.260 3.201) 14.018 2.437 ( 11.753 9.091 -2.170) 15.017 2.545 ( 2.473 14.592 0.314) 14.803 2.587 ( 8.473 7.746 -2.608) 11.772 3.307 ( 3.072 0.603 -1.634) 3.531 3.447 ( 4.290 8.387 1.633) 9.561 3.640 ( 2.369 0.988 -0.321) 2.587 3.709 ( 4.389 6.314 2.616) 8.123 4.113 ( 1.282 10.295 -1.649) 10.505 4.482 ( 4.334 18.037 1.017) 18.579 4.754 ( 7.743 12.631 0.473) 14.823 5.026 ( -5.028 -0.869 -1.280) 5.260 7.755 ( 3.206 6.368 2.137) 7.443 8.617 ( -3.255 -3.701 -0.373) 4.943 9.312 ( 7.254 5.017 0.731) 8.850 9.560 ( 0.163 2.769 0.719) 2.865 9.619 ( 4.156 4.197 -1.699) 6.146 9.813 ( 1.702 2.138 -3.637) 4.549 10.045 ( 3.376 3.269 4.212) 6.310 10.856 ( -7.823 -12.742 -0.046) 14.952 11.070 ( -11.418 -5.920 -1.240) 12.921 12.575 ( 8.785 6.693 -0.386) 11.051 14.359 ( 2.835 -2.068 -0.757) 3.590 14.640 ( -3.291 5.435 1.706) 6.579 ======================= Grid point 1019 (309/344) ======================= q-point: ( 0.67 0.47 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.587 ( 4.707 9.905 1.539) 11.074 2.645 ( 4.178 4.738 -0.945) 6.387 2.801 ( 9.157 15.294 -0.263) 17.828 2.811 ( 5.797 11.152 -1.043) 12.612 3.323 ( -0.506 -0.082 0.788) 0.940 3.520 ( -0.586 -1.255 -0.481) 1.466 3.763 ( 5.736 9.768 0.179) 11.329 3.858 ( 4.199 6.803 0.418) 8.006 4.253 ( 4.505 7.939 -0.796) 9.163 4.731 ( 6.308 11.949 0.840) 13.538 4.919 ( -0.271 -3.425 1.228) 3.649 5.009 ( 4.194 9.704 -1.183) 10.638 7.900 ( 4.744 7.624 0.951) 9.030 8.510 ( -3.344 -5.349 -0.116) 6.309 9.482 ( 4.398 7.089 -0.129) 8.344 9.632 ( 2.909 4.637 -0.287) 5.482 9.720 ( 1.384 4.886 0.475) 5.100 9.843 ( 0.646 1.531 -0.527) 1.743 10.150 ( 4.128 4.938 0.324) 6.444 10.622 ( -5.775 -9.406 1.251) 11.108 10.847 ( -5.412 -9.301 -1.399) 10.852 12.792 ( 6.174 10.667 -0.156) 12.326 14.361 ( -0.892 -0.465 -0.049) 1.008 14.642 ( 0.314 -0.598 0.260) 0.724 ======================= Grid point 1020 (310/344) ======================= q-point: ( 0.73 0.47 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( -0.190 5.993 -0.138) 5.997 2.780 ( 6.040 5.215 -0.449) 7.992 2.985 ( 0.168 14.113 -1.408) 14.184 3.057 ( 1.518 12.649 0.592) 12.753 3.323 ( 1.970 -1.709 1.913) 3.235 3.491 ( 0.734 -0.722 -0.595) 1.189 3.948 ( 1.235 12.673 -0.235) 12.735 3.982 ( 1.325 8.502 0.211) 8.607 4.409 ( 5.682 4.810 -0.244) 7.449 4.842 ( -2.915 1.061 -0.808) 3.206 4.961 ( 7.222 4.002 1.217) 8.346 5.165 ( 7.639 -1.166 0.857) 7.775 8.064 ( 4.723 7.478 1.093) 8.912 8.404 ( -2.012 -5.800 -1.060) 6.230 9.584 ( -2.774 9.563 -0.535) 9.972 9.696 ( -4.413 6.838 2.747) 8.589 9.757 ( 1.004 3.107 0.735) 3.347 9.913 ( 6.291 0.485 -1.920) 6.595 10.291 ( 6.151 4.455 -0.755) 7.632 10.471 ( -2.715 -7.195 0.049) 7.690 10.692 ( -0.285 -11.315 0.115) 11.319 12.996 ( 2.429 14.693 -0.071) 14.892 14.327 ( -2.223 -0.699 1.432) 2.735 14.634 ( 2.865 -6.340 -1.452) 7.108 ======================= Grid point 1032 (311/344) ======================= q-point: ( 0.53 0.53 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( -0.000 8.942 -4.047) 9.815 2.335 ( 0.000 9.393 8.242) 12.496 2.346 ( -0.000 11.433 -5.678) 12.766 2.513 ( 0.000 13.818 0.966) 13.851 3.117 ( -0.000 0.480 -5.556) 5.577 3.417 ( 0.000 6.558 2.434) 6.995 3.549 ( 0.000 4.324 4.051) 5.926 3.669 ( 0.000 4.281 0.939) 4.382 4.119 ( -0.000 12.605 -1.980) 12.760 4.432 ( -0.000 19.719 -1.856) 19.806 4.630 ( 0.000 16.836 3.352) 17.167 5.129 ( -0.000 0.124 -1.932) 1.936 7.706 ( 0.000 5.977 4.945) 7.758 8.688 ( -0.000 -1.068 -2.770) 2.969 9.138 ( 0.000 1.664 2.512) 3.013 9.506 ( -0.000 -1.827 -4.821) 5.156 9.598 ( 0.000 -2.323 3.382) 4.103 9.734 ( -0.000 3.894 -8.929) 9.741 9.977 ( 0.000 9.196 9.194) 13.004 10.993 ( -0.000 -11.864 -4.171) 12.576 11.482 ( 0.000 -7.016 1.380) 7.151 12.278 ( -0.000 4.004 -0.601) 4.049 14.268 ( -0.000 -0.099 -0.670) 0.678 14.753 ( 0.000 6.461 2.044) 6.777 ======================= Grid point 1033 (312/344) ======================= q-point: ( 0.60 0.53 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 10.967 6.428 -2.883) 13.035 2.439 ( 2.111 9.138 -2.810) 9.791 2.520 ( 6.712 7.988 3.366) 10.963 2.660 ( 0.361 13.334 2.355) 13.545 3.193 ( 7.808 1.589 -3.831) 8.841 3.492 ( 0.693 6.172 2.393) 6.656 3.600 ( 2.281 0.097 0.071) 2.284 3.710 ( 1.563 2.475 2.533) 3.871 4.232 ( -1.150 12.484 -2.159) 12.721 4.615 ( 1.357 15.644 -3.279) 16.042 4.795 ( 1.235 10.110 6.138) 11.891 5.134 ( -3.251 8.045 -3.052) 9.198 7.797 ( 1.196 7.941 4.144) 9.037 8.636 ( -3.055 -2.924 -3.133) 5.263 9.211 ( 7.063 -0.062 2.027) 7.348 9.496 ( 4.605 -3.973 -2.823) 6.705 9.624 ( 0.407 4.727 0.658) 4.790 9.785 ( 2.130 4.655 -5.991) 7.880 10.096 ( 0.463 8.937 7.757) 11.843 10.841 ( -4.182 -9.513 -3.429) 10.943 11.264 ( -14.184 -6.244 0.525) 15.506 12.437 ( 11.434 4.060 -0.296) 12.137 14.293 ( 2.155 0.483 -1.517) 2.679 14.781 ( -4.160 5.586 2.263) 7.323 ======================= Grid point 1034 (313/344) ======================= q-point: ( 0.67 0.53 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( 5.024 5.912 -1.436) 7.890 2.589 ( 14.118 7.010 0.204) 15.764 2.718 ( 6.114 7.183 3.690) 10.129 2.823 ( 5.892 10.519 -2.375) 12.289 3.318 ( 2.835 2.020 -1.372) 3.742 3.530 ( -1.438 -0.675 0.583) 1.692 3.695 ( 8.867 5.172 0.117) 10.266 3.817 ( 6.481 3.432 1.383) 7.463 4.322 ( -1.068 10.408 -1.034) 10.513 4.769 ( 3.314 7.007 -1.376) 7.872 4.891 ( -0.298 6.498 2.645) 7.022 5.161 ( -4.951 11.666 -2.031) 12.835 7.921 ( 2.650 8.544 1.973) 9.161 8.525 ( -4.258 -4.585 -1.471) 6.428 9.380 ( 11.222 0.344 0.833) 11.259 9.573 ( 7.394 -1.437 -2.336) 7.886 9.691 ( 1.501 4.612 -0.331) 4.861 9.862 ( 1.699 5.137 -2.129) 5.815 10.200 ( -0.179 8.626 4.774) 9.860 10.650 ( -6.928 -7.499 -1.635) 10.339 10.953 ( -13.723 -5.575 -0.282) 14.815 12.704 ( 12.955 6.081 -0.057) 14.312 14.325 ( 1.851 -0.748 -1.895) 2.752 14.736 ( -6.597 3.278 2.193) 7.686 ======================= Grid point 1048 (314/344) ======================= q-point: ( 0.60 0.60 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -0.000 3.973 -2.473) 4.679 2.486 ( -0.000 6.189 -3.867) 7.297 2.553 ( 0.000 7.742 4.615) 9.013 2.803 ( 0.000 12.989 1.963) 13.137 3.123 ( -0.000 2.106 -1.847) 2.801 3.549 ( -0.000 5.684 0.185) 5.687 3.574 ( 0.000 -1.184 1.086) 1.607 3.703 ( 0.000 -1.618 1.049) 1.928 4.363 ( -0.000 11.790 -2.023) 11.962 4.711 ( -0.000 7.585 -1.539) 7.740 4.916 ( 0.000 11.824 3.618) 12.365 5.264 ( -0.000 12.511 -2.648) 12.788 7.882 ( 0.000 8.612 4.594) 9.761 8.634 ( -0.000 -2.296 -5.369) 5.839 9.107 ( 0.000 -6.310 2.041) 6.632 9.422 ( -0.000 -0.599 -2.099) 2.183 9.664 ( 0.000 4.086 0.540) 4.122 9.817 ( -0.000 6.995 -4.362) 8.243 10.207 ( 0.000 9.838 6.980) 12.063 10.790 ( -0.000 -6.603 -4.003) 7.722 11.332 ( 0.000 -8.115 0.580) 8.136 12.355 ( -0.000 3.721 -0.289) 3.732 14.289 ( -0.000 2.332 -1.778) 2.932 14.876 ( 0.000 4.555 2.423) 5.160 ======================= Grid point 1049 (315/344) ======================= q-point: (-0.33 -0.40 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 12.988 3.476 -0.494) 13.454 2.557 ( 2.403 4.628 0.049) 5.215 2.682 ( 6.304 5.517 1.383) 8.491 2.888 ( -2.430 9.035 -1.433) 9.465 3.249 ( 8.392 4.810 0.608) 9.692 3.549 ( -1.318 -1.151 1.063) 2.047 3.620 ( 2.984 2.115 -1.334) 3.893 3.725 ( 5.448 -0.871 0.542) 5.544 4.452 ( -1.690 9.845 -1.323) 10.076 4.768 ( 0.948 2.155 1.484) 2.783 5.024 ( -1.711 11.790 -1.048) 11.959 5.352 ( -3.568 11.461 -1.901) 12.153 7.982 ( 0.779 8.034 2.618) 8.485 8.556 ( -4.104 -2.889 -3.272) 5.991 9.139 ( 10.698 -6.573 0.142) 12.557 9.463 ( 4.142 1.280 -1.412) 4.560 9.714 ( 1.083 3.770 0.249) 3.930 9.892 ( 1.070 6.883 -1.808) 7.197 10.311 ( -0.611 8.936 4.849) 10.186 10.689 ( -4.524 -4.093 -3.183) 6.881 11.131 ( -12.067 -7.081 0.390) 13.997 12.513 ( 12.515 3.487 -0.102) 12.992 14.310 ( 0.102 1.780 -2.043) 2.712 14.880 ( -4.675 3.175 2.493) 6.177 ======================= Grid point 1064 (316/344) ======================= q-point: (-0.33 -0.33 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 0.000 2.354 0.412) 2.390 2.583 ( 0.000 3.871 2.987) 4.889 2.659 ( -0.000 2.667 -2.954) 3.980 3.028 ( -0.000 9.489 -2.920) 9.928 3.189 ( 0.000 3.592 4.288) 5.594 3.549 ( 0.000 -1.603 0.482) 1.674 3.625 ( -0.000 -5.198 -0.804) 5.260 3.638 ( -0.000 3.517 -1.787) 3.945 4.554 ( -0.000 7.792 -1.098) 7.869 4.783 ( 0.000 0.841 2.825) 2.948 5.148 ( -0.000 10.457 -2.899) 10.852 5.484 ( -0.000 8.893 -2.242) 9.172 8.055 ( 0.000 6.240 1.944) 6.536 8.574 ( -0.000 -0.864 -4.103) 4.193 8.959 ( 0.000 -7.491 0.631) 7.518 9.443 ( -0.000 1.994 -0.649) 2.097 9.737 ( -0.000 2.922 0.023) 2.922 9.950 ( -0.000 6.625 -0.186) 6.627 10.404 ( 0.000 6.147 2.499) 6.635 10.704 ( -0.000 0.362 -2.395) 2.422 11.168 ( 0.000 -8.425 0.562) 8.444 12.420 ( -0.000 2.818 -0.094) 2.819 14.331 ( -0.000 2.418 -2.087) 3.194 14.955 ( 0.000 2.250 2.566) 3.413 ======================= Grid point 1209 (317/344) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.866 ( 0.000 -0.000 20.629) 20.629 0.866 ( 0.000 -0.000 20.629) 20.629 1.707 ( 0.000 -0.000 48.087) 48.087 1.980 ( -0.000 0.000 -14.168) 14.168 1.980 ( -0.000 0.000 -14.168) 14.168 2.979 ( 0.000 -0.000 9.060) 9.060 2.979 ( 0.000 -0.000 9.060) 9.060 3.277 ( -0.000 0.000 -4.994) 4.994 3.277 ( -0.000 0.000 -4.994) 4.994 3.379 ( -0.000 0.000 -35.617) 35.617 4.337 ( -0.000 0.000 -0.938) 0.938 5.624 ( 0.000 -0.000 7.520) 7.520 8.927 ( 0.000 -0.000 0.483) 0.483 8.927 ( 0.000 -0.000 0.483) 0.483 9.250 ( -0.000 0.000 -0.357) 0.357 9.250 ( -0.000 0.000 -0.357) 0.357 9.388 ( 0.000 -0.000 0.943) 0.943 9.663 ( -0.000 0.000 -1.068) 1.068 10.141 ( 0.000 -0.000 1.589) 1.589 10.141 ( 0.000 -0.000 1.589) 1.589 12.096 ( -0.000 0.000 -1.424) 1.424 12.096 ( -0.000 0.000 -1.424) 1.424 13.887 ( 0.000 -0.000 0.036) 0.036 16.657 ( 0.000 -0.000 0.118) 0.118 ======================= Grid point 1210 (318/344) ======================= q-point: ( 0.40 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 12.402 7.160 15.917) 21.411 1.148 ( 16.958 9.791 18.177) 26.718 1.777 ( 3.608 2.083 8.214) 9.210 2.022 ( 5.408 3.122 -14.155) 15.471 2.269 ( 20.648 11.921 16.639) 29.074 2.978 ( -0.826 -0.477 9.152) 9.202 3.108 ( 6.919 3.995 2.783) 8.461 3.280 ( 0.812 0.469 -4.758) 4.850 3.352 ( 8.329 4.809 -7.330) 12.092 3.432 ( 11.186 6.458 -25.919) 28.959 4.277 ( -4.400 -2.540 -1.545) 5.310 5.569 ( -5.810 -3.354 6.555) 9.379 8.279 ( -33.147 -19.138 18.199) 42.381 8.961 ( 2.301 1.329 -0.215) 2.666 8.963 ( -5.991 -3.459 -9.814) 12.007 9.260 ( 1.386 0.800 0.303) 1.628 9.494 ( -1.804 -1.042 4.532) 4.988 9.731 ( 6.277 3.624 -5.321) 8.992 10.089 ( -4.372 -2.524 1.879) 5.387 10.877 ( 30.450 17.580 -6.498) 35.755 12.057 ( -2.227 -1.286 -3.282) 4.170 12.114 ( 1.513 0.874 -1.684) 2.427 13.984 ( 8.000 4.619 0.110) 9.238 15.851 ( -53.000 -30.600 20.426) 64.518 ======================= Grid point 1211 (319/344) ======================= q-point: ( 0.47 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.436 ( 15.269 8.815 11.210) 20.893 1.583 ( 15.729 9.081 18.159) 25.683 1.977 ( 13.275 7.664 -10.938) 18.831 2.150 ( 7.959 4.595 -13.873) 16.641 2.844 ( 23.859 13.775 19.269) 33.620 2.983 ( -0.419 -0.242 9.021) 9.034 3.277 ( 8.310 4.798 -3.994) 10.393 3.299 ( 1.818 1.049 -4.072) 4.581 3.603 ( 13.521 7.807 -5.196) 16.455 3.749 ( 18.050 10.421 -12.930) 24.527 4.172 ( -2.761 -1.594 -3.341) 4.618 5.407 ( -8.743 -5.048 4.336) 10.987 7.815 ( -11.304 -6.526 7.625) 15.117 8.809 ( -5.381 -3.107 -5.829) 8.520 9.028 ( 3.545 2.047 -1.271) 4.287 9.313 ( 2.856 1.649 1.480) 3.615 9.483 ( -0.204 -0.118 8.727) 8.731 9.856 ( 5.858 3.382 -9.005) 11.262 9.955 ( -7.393 -4.268 2.056) 8.780 11.208 ( 1.291 0.746 4.295) 4.547 11.951 ( -6.623 -3.824 -8.939) 11.764 12.156 ( 2.383 1.376 -1.926) 3.359 14.208 ( 9.483 5.475 -0.125) 10.950 14.882 ( -29.728 -17.164 17.654) 38.601 ======================= Grid point 1212 (320/344) ======================= q-point: ( 0.53 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( 12.966 7.486 8.165) 17.054 1.947 ( 13.060 7.540 12.705) 19.719 2.285 ( 14.359 8.290 -10.515) 19.634 2.309 ( 7.977 4.606 -12.595) 15.604 3.003 ( 0.643 0.371 7.679) 7.714 3.351 ( 3.367 1.944 -2.734) 4.753 3.385 ( 18.422 10.636 9.426) 23.267 3.467 ( 8.034 4.639 -2.534) 9.617 3.905 ( 10.714 6.186 -2.570) 12.635 4.042 ( 9.117 5.264 1.517) 10.637 4.309 ( 17.808 10.281 -10.046) 22.885 5.213 ( -7.993 -4.615 2.626) 9.596 7.707 ( 0.038 0.022 -0.993) 0.994 8.702 ( -3.345 -1.931 -0.296) 3.874 9.112 ( 3.845 2.220 -2.449) 5.070 9.390 ( 3.056 1.764 3.385) 4.890 9.525 ( 2.197 1.269 8.857) 9.213 9.771 ( -8.296 -4.790 1.232) 9.659 9.970 ( 6.019 3.475 -9.785) 12.002 11.106 ( -9.014 -5.204 9.560) 14.133 11.735 ( -9.161 -5.289 -8.139) 13.347 12.214 ( 2.960 1.709 -1.792) 3.859 14.287 ( -3.185 -1.839 3.310) 4.948 14.632 ( 3.316 1.915 3.695) 5.321 ======================= Grid point 1213 (321/344) ======================= q-point: ( 0.60 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 8.453 4.880 5.302) 11.108 2.247 ( 10.919 6.304 6.939) 14.392 2.455 ( 6.662 3.846 -8.628) 11.559 2.569 ( 11.743 6.780 -5.441) 14.611 3.049 ( 2.194 1.267 4.184) 4.892 3.440 ( 4.548 2.626 -0.921) 5.332 3.589 ( 2.277 1.315 -2.577) 3.681 3.668 ( 5.331 3.078 2.153) 6.522 4.105 ( 10.391 5.999 -0.165) 12.000 4.378 ( 16.098 9.294 4.900) 19.223 4.716 ( 15.914 9.188 -7.979) 20.033 5.095 ( -1.062 -0.613 2.920) 3.167 7.771 ( 5.385 3.109 -4.255) 7.535 8.640 ( -2.586 -1.493 3.999) 4.991 9.177 ( 1.566 0.904 -3.321) 3.782 9.430 ( -1.748 -1.009 6.486) 6.793 9.630 ( 5.476 3.162 6.353) 8.964 9.632 ( -1.754 -1.013 -1.612) 2.589 10.098 ( 6.934 4.004 -8.608) 11.756 10.909 ( -8.679 -5.011 7.554) 12.550 11.522 ( -8.056 -4.651 -4.019) 10.134 12.283 ( 3.246 1.874 -1.221) 3.942 14.245 ( -0.200 -0.116 2.633) 2.643 14.774 ( 6.309 3.643 -0.796) 7.328 ======================= Grid point 1214 (322/344) ======================= q-point: ( 0.67 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 4.351 2.512 1.958) 5.392 2.468 ( 7.057 4.074 1.679) 8.320 2.576 ( 4.744 2.739 -2.240) 5.919 2.811 ( 10.027 5.789 -0.679) 11.598 3.118 ( 3.262 1.884 -0.550) 3.807 3.547 ( 4.453 2.571 0.726) 5.192 3.584 ( -1.279 -0.738 -1.706) 2.256 3.704 ( -1.679 -0.969 0.736) 2.074 4.354 ( 10.141 5.855 0.370) 11.716 4.700 ( 8.750 5.052 1.806) 10.264 4.935 ( 7.446 4.299 -1.886) 8.802 5.249 ( 11.266 6.504 1.935) 13.152 7.911 ( 7.046 4.068 -4.040) 9.084 8.597 ( -2.067 -1.193 5.522) 6.015 9.119 ( -6.022 -3.477 -1.515) 7.117 9.405 ( 0.479 0.276 2.859) 2.912 9.668 ( 3.198 1.846 -0.671) 3.753 9.793 ( 7.144 4.124 3.025) 8.786 10.252 ( 7.687 4.438 -6.212) 10.834 10.760 ( -5.250 -3.031 4.898) 7.794 11.339 ( -7.375 -4.258 -1.402) 8.631 12.355 ( 3.118 1.800 -0.469) 3.630 14.276 ( 2.003 1.156 2.087) 3.115 14.891 ( 4.089 2.361 -2.072) 5.157 ======================= Grid point 1225 (323/344) ======================= q-point: ( 0.40 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( 0.000 14.052 15.305) 20.777 1.194 ( 0.000 19.818 16.138) 25.558 1.821 ( 0.000 4.249 1.423) 4.481 1.961 ( -0.000 4.328 -11.304) 12.104 2.314 ( 0.000 24.119 21.497) 32.308 3.044 ( 0.000 1.769 7.025) 7.245 3.080 ( 0.000 6.455 3.244) 7.224 3.243 ( -0.000 -0.532 -4.728) 4.758 3.322 ( -0.000 10.012 -21.215) 23.459 3.389 ( -0.000 12.053 -10.771) 16.165 4.275 ( -0.000 -5.004 -1.435) 5.205 5.583 ( 0.000 -6.728 5.759) 8.856 8.310 ( 0.000 -40.536 16.839) 43.894 8.924 ( -0.000 -7.333 -8.109) 10.933 8.940 ( 0.000 1.590 0.935) 1.844 9.279 ( -0.000 2.589 -0.726) 2.689 9.529 ( 0.000 2.552 2.982) 3.924 9.698 ( -0.000 3.307 -3.928) 5.135 10.104 ( 0.000 -4.589 1.059) 4.710 10.898 ( -0.000 40.289 -8.028) 41.081 12.026 ( -0.000 -7.617 -0.426) 7.629 12.100 ( -0.000 1.310 -0.938) 1.611 13.982 ( -0.000 8.866 0.250) 8.869 15.906 ( 0.000 -57.732 15.550) 59.790 ======================= Grid point 1226 (324/344) ======================= q-point: ( 0.47 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 9.393 16.663 10.921) 22.026 1.520 ( 9.368 17.111 16.915) 25.820 1.894 ( 3.680 10.268 -10.857) 15.390 2.063 ( 6.278 7.001 -11.324) 14.719 2.735 ( 12.878 21.926 22.370) 33.867 3.059 ( -1.950 4.466 7.681) 9.096 3.193 ( 4.555 5.314 -5.746) 9.056 3.264 ( 3.423 1.783 -4.957) 6.282 3.508 ( 8.821 13.031 -6.832) 17.155 3.579 ( 9.610 15.283 -10.693) 20.982 4.191 ( -2.736 -4.179 -2.299) 5.499 5.471 ( -4.964 -8.383 4.024) 10.541 7.903 ( -9.272 -18.867 9.793) 23.191 8.816 ( -2.417 -5.731 -5.098) 8.042 8.997 ( 3.058 2.719 0.248) 4.099 9.315 ( 0.940 3.870 -0.085) 3.983 9.547 ( -2.869 3.363 7.351) 8.578 9.731 ( 3.508 -0.732 -7.740) 8.530 10.049 ( -1.840 -2.717 1.095) 3.459 11.231 ( 2.064 13.723 -3.050) 14.208 11.873 ( -3.836 -14.838 -1.731) 15.423 12.176 ( 3.963 5.047 -1.903) 6.693 14.145 ( 6.457 10.272 0.301) 12.137 15.149 ( -23.792 -38.114 14.575) 47.236 ======================= Grid point 1227 (325/344) ======================= q-point: ( 0.53 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.748 ( 9.422 17.007 7.508) 20.842 1.872 ( 9.902 11.712 14.810) 21.320 2.116 ( 11.700 10.725 -12.247) 20.047 2.234 ( 6.376 9.220 -11.030) 15.727 3.067 ( -0.703 5.689 8.513) 10.263 3.243 ( 11.888 13.980 9.943) 20.872 3.295 ( 6.603 3.686 -2.360) 7.922 3.403 ( 6.308 8.359 -3.882) 11.168 3.798 ( 10.180 13.109 -2.182) 16.740 3.912 ( 12.067 7.258 -4.002) 14.640 4.171 ( 5.889 6.354 -5.519) 10.272 5.287 ( -6.829 -7.927 2.237) 10.700 7.705 ( -2.124 -4.812 1.512) 5.473 8.724 ( -2.234 -2.931 -1.472) 3.969 9.089 ( 3.140 4.618 -1.174) 5.706 9.388 ( 2.124 4.834 1.255) 5.427 9.542 ( -1.638 0.871 8.965) 9.155 9.756 ( 2.898 -3.793 -5.825) 7.531 10.000 ( -3.371 3.508 -2.182) 5.332 11.225 ( -7.814 -2.622 7.404) 11.079 11.627 ( -1.470 -20.037 -7.157) 21.328 12.281 ( 0.414 8.518 -2.042) 8.770 14.344 ( 2.091 7.578 0.339) 7.868 14.617 ( -7.252 -12.934 6.978) 16.388 ======================= Grid point 1228 (326/344) ======================= q-point: ( 0.60 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.059 ( 5.542 15.510 5.330) 17.312 2.168 ( 9.223 9.530 8.490) 15.747 2.397 ( 7.609 9.007 -7.928) 14.208 2.419 ( 10.082 8.548 -7.751) 15.323 3.116 ( -2.293 7.359 6.372) 10.001 3.386 ( 5.328 3.168 -3.180) 6.967 3.565 ( 3.390 5.598 -2.118) 6.878 3.598 ( 8.434 6.850 2.655) 11.185 4.000 ( 6.952 4.317 -0.113) 8.184 4.214 ( 15.456 11.015 3.685) 19.334 4.517 ( 16.758 13.553 -7.093) 22.690 5.117 ( -4.241 -5.650 1.960) 7.331 7.707 ( 3.592 1.652 -2.745) 4.814 8.666 ( -1.915 -2.238 1.975) 3.546 9.182 ( 1.612 5.841 -2.424) 6.527 9.477 ( 0.806 4.969 3.577) 6.175 9.565 ( 2.679 -1.301 4.645) 5.518 9.714 ( -3.988 0.977 1.719) 4.452 10.026 ( 3.027 4.652 -7.607) 9.416 11.016 ( -9.716 -8.137 8.257) 15.126 11.425 ( 1.498 -18.082 -5.735) 19.028 12.360 ( -1.579 10.560 -1.150) 10.739 14.303 ( -5.211 1.697 2.546) 6.043 14.658 ( 8.798 0.204 -0.313) 8.806 ======================= Grid point 1229 (327/344) ======================= q-point: ( 0.67 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 0.409 13.812 2.855) 14.110 2.411 ( 6.857 7.269 4.329) 10.890 2.555 ( 3.712 9.024 -5.747) 11.325 2.675 ( 10.773 5.621 -2.073) 12.327 3.171 ( -1.468 8.290 2.866) 8.894 3.505 ( 4.343 3.912 -1.582) 6.055 3.602 ( -1.265 1.030 -0.591) 1.735 3.721 ( 1.276 2.828 -0.563) 3.153 4.222 ( 11.191 5.369 0.537) 12.424 4.590 ( 12.897 9.409 4.151) 16.495 4.836 ( 7.943 5.429 -5.927) 11.300 5.114 ( 8.635 1.324 2.963) 9.225 7.824 ( 6.541 4.359 -3.699) 8.687 8.612 ( -1.712 -3.625 3.912) 5.602 9.226 ( -3.745 5.653 -2.476) 7.219 9.472 ( -5.274 2.711 4.433) 7.404 9.629 ( 3.876 2.155 -0.878) 4.521 9.749 ( 3.468 5.103 4.592) 7.691 10.146 ( 7.206 4.139 -7.237) 11.020 10.812 ( -5.877 -7.668 5.118) 10.934 11.273 ( 1.177 -15.862 -1.995) 16.030 12.437 ( -2.303 11.897 -0.414) 12.125 14.280 ( -0.716 2.046 2.045) 2.980 14.795 ( 7.109 -0.720 -1.875) 7.387 ======================= Grid point 1241 (328/344) ======================= q-point: ( 0.47 0.47 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 0.000 18.320 8.444) 20.172 1.677 ( 0.000 19.805 15.866) 25.377 1.969 ( -0.000 13.438 -17.193) 21.822 2.038 ( -0.000 6.803 -5.649) 8.842 2.924 ( 0.000 24.598 20.648) 32.116 3.102 ( 0.000 1.589 0.213) 1.603 3.230 ( -0.000 1.258 -0.178) 1.271 3.242 ( -0.000 11.308 -5.909) 12.759 3.554 ( -0.000 17.522 -5.764) 18.445 3.677 ( -0.000 19.359 -4.527) 19.881 4.168 ( -0.000 -3.322 -2.732) 4.301 5.427 ( 0.000 -10.144 2.682) 10.493 7.807 ( 0.000 -16.506 8.289) 18.470 8.773 ( -0.000 -4.817 -2.521) 5.437 8.996 ( 0.000 3.314 1.540) 3.655 9.344 ( -0.000 4.251 -1.281) 4.440 9.626 ( 0.000 5.086 0.959) 5.175 9.722 ( -0.000 1.631 -2.104) 2.662 9.973 ( 0.000 -8.645 0.558) 8.663 11.352 ( -0.000 9.430 -9.793) 13.595 11.803 ( 0.000 -13.749 5.747) 14.902 12.138 ( -0.000 2.684 -0.435) 2.719 14.196 ( 0.000 10.387 1.112) 10.447 14.982 ( 0.000 -34.996 7.861) 35.868 ======================= Grid point 1242 (329/344) ======================= q-point: ( 0.53 0.47 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( 8.906 17.573 4.787) 20.274 1.928 ( 3.526 15.872 12.731) 20.650 2.079 ( 3.211 13.370 -11.588) 17.982 2.191 ( 7.176 9.486 -7.188) 13.898 3.139 ( 2.637 5.900 1.656) 6.671 3.219 ( 2.774 4.926 1.873) 5.956 3.292 ( 4.723 13.983 8.969) 17.271 3.391 ( 4.184 11.532 -4.349) 13.015 3.793 ( 7.402 15.922 -1.556) 17.627 3.887 ( 1.871 15.767 -1.156) 15.920 4.162 ( 1.843 6.424 -3.850) 7.713 5.294 ( -3.736 -9.637 1.154) 10.400 7.686 ( -1.359 -5.875 4.092) 7.287 8.721 ( -1.094 -2.593 -0.993) 2.984 9.072 ( 3.636 4.246 1.206) 5.719 9.404 ( 1.862 5.056 -0.918) 5.465 9.644 ( -6.685 -1.450 1.616) 7.029 9.684 ( 1.778 4.015 -3.037) 5.339 9.980 ( 5.776 -4.184 1.139) 7.223 11.331 ( -2.713 -2.872 -7.818) 8.760 11.535 ( -13.172 -15.440 5.978) 21.157 12.270 ( 7.729 4.604 -0.508) 9.011 14.339 ( 5.914 6.152 1.093) 8.604 14.644 ( -8.998 -13.779 3.031) 16.734 ======================= Grid point 1243 (330/344) ======================= q-point: ( 0.60 0.47 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( 8.902 15.901 3.260) 18.512 2.171 ( 6.025 14.076 4.606) 15.989 2.291 ( 8.166 11.066 -4.609) 14.505 2.401 ( 6.512 10.201 -4.415) 12.882 3.253 ( -1.848 8.177 6.520) 10.621 3.294 ( 7.509 2.493 -5.649) 9.722 3.551 ( 6.552 9.005 3.205) 11.589 3.567 ( 4.006 8.467 -1.465) 9.480 3.966 ( 2.025 3.684 -0.369) 4.220 4.123 ( 9.607 17.268 1.270) 19.802 4.418 ( 10.902 17.743 -2.881) 21.023 5.131 ( -4.648 -7.613 0.494) 8.933 7.674 ( 1.692 1.632 0.524) 2.409 8.675 ( -1.595 -2.255 0.182) 2.768 9.197 ( 4.122 6.196 -0.065) 7.443 9.499 ( 2.716 5.288 0.278) 5.952 9.553 ( -1.598 -0.802 1.243) 2.177 9.748 ( 1.526 3.371 -0.888) 3.805 10.028 ( 1.679 0.481 -0.482) 1.812 11.149 ( -14.588 -11.668 6.671) 19.836 11.211 ( -0.169 -12.877 -6.680) 14.508 12.435 ( 4.379 7.372 -0.476) 8.588 14.430 ( -3.739 -4.879 1.177) 6.259 14.516 ( 4.426 6.221 0.196) 7.637 ======================= Grid point 1244 (331/344) ======================= q-point: ( 0.67 0.47 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( 6.484 10.947 2.505) 12.967 2.425 ( 2.186 16.696 1.482) 16.904 2.549 ( 10.528 7.645 -1.637) 13.113 2.590 ( 4.500 11.388 -2.861) 12.575 3.290 ( -1.896 4.982 3.445) 6.347 3.461 ( 5.595 6.157 -2.437) 8.669 3.640 ( -0.368 2.516 -0.216) 2.552 3.720 ( 3.742 6.577 -0.693) 7.599 4.106 ( 7.958 6.381 0.264) 10.204 4.478 ( 12.433 13.132 2.009) 18.195 4.766 ( 9.228 13.095 -3.270) 16.350 5.016 ( 0.489 -5.056 1.772) 5.380 7.768 ( 4.681 5.368 -1.424) 7.263 8.611 ( -2.243 -4.306 1.265) 5.018 9.319 ( 1.176 8.357 -1.186) 8.522 9.563 ( 2.285 1.575 -0.043) 2.775 9.606 ( 0.776 6.148 2.031) 6.521 9.790 ( -0.539 3.679 3.088) 4.833 10.074 ( 3.340 3.201 -4.451) 6.419 10.844 ( -7.975 -11.622 3.360) 14.490 11.073 ( 0.783 -13.931 -2.015) 14.097 12.575 ( 1.435 10.928 -0.199) 11.024 14.351 ( -3.731 1.570 1.394) 4.281 14.650 ( 6.866 -0.367 -1.262) 6.990 ======================= Grid point 1257 (332/344) ======================= q-point: ( 0.53 0.53 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -0.000 15.695 -0.479) 15.702 2.076 ( 0.000 14.155 2.518) 14.377 2.180 ( 0.000 7.982 4.332) 9.082 2.206 ( -0.000 16.886 -7.520) 18.485 3.098 ( -0.000 0.144 -6.189) 6.191 3.307 ( 0.000 4.882 3.652) 6.097 3.386 ( 0.000 13.620 9.017) 16.335 3.483 ( -0.000 13.785 -3.915) 14.330 3.889 ( -0.000 13.653 -0.148) 13.654 4.050 ( 0.000 16.388 0.715) 16.404 4.243 ( -0.000 16.766 -1.564) 16.839 5.233 ( 0.000 -8.898 -0.157) 8.899 7.666 ( 0.000 -1.751 4.852) 5.158 8.707 ( -0.000 -1.660 -0.949) 1.913 9.079 ( 0.000 3.937 2.233) 4.526 9.430 ( -0.000 4.875 -2.409) 5.437 9.658 ( -0.000 1.843 -10.745) 10.902 9.777 ( 0.000 -10.559 0.464) 10.569 9.837 ( 0.000 6.925 9.943) 12.117 11.238 ( -0.000 -11.975 -9.348) 15.192 11.629 ( 0.000 -7.525 7.040) 10.304 12.201 ( -0.000 3.572 0.019) 3.572 14.304 ( 0.000 -1.717 0.582) 1.813 14.655 ( 0.000 -0.098 0.603) 0.610 ======================= Grid point 1258 (333/344) ======================= q-point: ( 0.60 0.53 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( 9.761 12.582 -3.096) 16.223 2.214 ( 2.497 11.983 -3.998) 12.876 2.349 ( 5.803 11.021 6.021) 13.834 2.386 ( 2.574 13.662 0.952) 13.935 3.158 ( 7.472 0.995 -6.234) 9.782 3.362 ( -0.517 6.901 4.101) 8.044 3.547 ( 3.977 6.707 3.450) 8.527 3.608 ( 1.178 8.860 -0.838) 8.977 4.002 ( 0.288 8.665 -0.659) 8.695 4.233 ( 1.487 19.825 -1.777) 19.960 4.483 ( 4.128 20.627 2.769) 21.218 5.128 ( -2.961 -6.035 -1.150) 6.820 7.686 ( 0.472 3.437 3.638) 5.027 8.678 ( -1.236 -1.916 -1.587) 2.778 9.166 ( 4.646 4.063 2.139) 6.532 9.498 ( 3.082 4.407 -2.763) 6.046 9.590 ( -3.907 -1.234 -2.566) 4.834 9.733 ( 3.030 -0.512 -4.000) 5.044 9.976 ( 4.021 3.952 7.445) 9.338 11.068 ( -2.656 -13.717 -6.947) 15.603 11.390 ( -16.345 -6.141 4.542) 18.042 12.355 ( 10.018 4.055 0.245) 10.811 14.316 ( 4.080 -3.503 -1.111) 5.491 14.653 ( -4.399 7.087 1.250) 8.435 ======================= Grid point 1273 (334/344) ======================= q-point: (-0.40 -0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.090 ( -0.000 8.876 -5.204) 10.289 2.298 ( -0.000 11.036 -7.907) 13.576 2.394 ( 0.000 9.242 9.295) 13.108 2.535 ( 0.000 14.749 4.634) 15.460 3.081 ( -0.000 1.214 -5.185) 5.325 3.431 ( 0.000 5.936 1.716) 6.179 3.571 ( 0.000 3.053 2.763) 4.117 3.674 ( -0.000 5.370 0.199) 5.374 4.108 ( -0.000 12.064 -1.144) 12.118 4.410 ( -0.000 18.896 -4.335) 19.387 4.666 ( 0.000 18.499 6.818) 19.716 5.114 ( -0.000 -0.702 -2.605) 2.698 7.740 ( 0.000 6.017 4.980) 7.811 8.666 ( -0.000 -1.964 -3.674) 4.166 9.156 ( 0.000 1.749 2.958) 3.437 9.471 ( -0.000 -1.775 -5.710) 5.979 9.618 ( 0.000 -2.347 2.486) 3.418 9.678 ( -0.000 5.072 -7.813) 9.315 10.039 ( 0.000 8.648 9.049) 12.516 10.957 ( -0.000 -10.980 -6.429) 12.724 11.497 ( 0.000 -8.100 3.116) 8.679 12.277 ( 0.000 3.893 0.342) 3.908 14.260 ( -0.000 -0.336 -1.798) 1.830 14.766 ( 0.000 6.783 1.553) 6.959 ======================= Grid point 1451 (335/344) ======================= q-point: ( 0.40 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.986 ( 0.000 -0.000 14.925) 14.925 0.986 ( 0.000 -0.000 14.925) 14.925 1.895 ( -0.000 0.000 -10.988) 10.988 1.895 ( -0.000 0.000 -10.988) 10.988 2.013 ( 0.000 -0.000 42.510) 42.510 3.034 ( 0.000 -0.000 7.326) 7.326 3.034 ( 0.000 -0.000 7.326) 7.326 3.138 ( -0.000 0.000 -35.463) 35.463 3.243 ( -0.000 0.000 -4.879) 4.879 3.243 ( -0.000 0.000 -4.879) 4.879 4.332 ( -0.000 0.000 -0.688) 0.688 5.667 ( 0.000 -0.000 5.099) 5.099 8.930 ( 0.000 -0.000 0.319) 0.319 8.930 ( 0.000 -0.000 0.319) 0.319 9.248 ( -0.000 0.000 -0.235) 0.235 9.248 ( -0.000 0.000 -0.235) 0.235 9.394 ( 0.000 -0.000 0.743) 0.743 9.656 ( -0.000 0.000 -0.853) 0.853 10.150 ( 0.000 -0.000 1.087) 1.087 10.150 ( 0.000 -0.000 1.087) 1.087 12.088 ( -0.000 0.000 -0.976) 0.976 12.088 ( -0.000 0.000 -0.976) 0.976 13.887 ( 0.000 -0.000 0.025) 0.025 16.658 ( 0.000 -0.000 0.081) 0.081 ======================= Grid point 1452 (336/344) ======================= q-point: ( 0.47 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( 11.456 6.614 10.666) 16.992 1.255 ( 17.479 10.091 12.937) 23.973 1.786 ( -0.420 -0.242 -2.630) 2.674 1.938 ( 5.140 2.967 -10.304) 11.891 2.426 ( 20.469 11.818 26.866) 35.783 3.034 ( -0.628 -0.363 7.518) 7.553 3.077 ( 4.827 2.787 -14.486) 15.522 3.248 ( 0.911 0.526 -4.755) 4.870 3.270 ( 13.256 7.653 -10.659) 18.652 3.337 ( 9.732 5.619 -5.022) 12.309 4.269 ( -4.689 -2.707 -0.829) 5.477 5.605 ( -6.011 -3.470 3.911) 7.967 8.378 ( -34.217 -19.755 11.081) 41.035 8.904 ( -5.329 -3.076 -7.364) 9.596 8.958 ( 2.055 1.186 -0.623) 2.453 9.264 ( 1.636 0.944 0.617) 1.987 9.521 ( 0.405 0.234 3.534) 3.565 9.700 ( 4.326 2.498 -3.912) 6.345 10.100 ( -4.235 -2.445 1.386) 5.083 10.848 ( 31.178 18.000 -2.382) 36.079 12.039 ( -3.673 -2.121 -2.134) 4.748 12.104 ( 1.387 0.801 -1.245) 2.028 13.985 ( 7.980 4.607 0.025) 9.214 15.952 ( -49.012 -28.297 10.228) 57.511 ======================= Grid point 1453 (337/344) ======================= q-point: ( 0.53 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 14.776 8.531 7.182) 18.512 1.705 ( 15.943 9.205 17.832) 25.629 1.896 ( 11.493 6.636 -12.657) 18.339 2.069 ( 7.667 4.427 -9.933) 13.306 2.975 ( 21.339 12.320 18.549) 30.842 3.039 ( -0.379 -0.219 7.698) 7.711 3.226 ( 9.887 5.709 -10.543) 15.540 3.271 ( 2.092 1.208 -4.375) 4.998 3.568 ( 14.374 8.299 -4.995) 17.333 3.683 ( 19.123 11.041 -6.445) 23.003 4.157 ( -3.468 -2.002 -1.128) 4.160 5.429 ( -9.106 -5.257 2.304) 10.764 7.849 ( -13.629 -7.869 2.459) 15.929 8.777 ( -4.246 -2.451 -3.328) 5.926 9.018 ( 3.270 1.888 -1.650) 4.121 9.323 ( 3.216 1.857 1.686) 4.079 9.542 ( 0.517 0.298 8.822) 8.842 9.797 ( 5.113 2.952 -8.573) 10.410 9.966 ( -7.397 -4.271 1.401) 8.655 11.244 ( 4.003 2.311 6.397) 7.892 11.894 ( -7.930 -4.579 -7.961) 12.134 12.145 ( 2.329 1.344 -1.337) 3.003 14.206 ( 9.475 5.470 -0.450) 10.950 14.973 ( -31.434 -18.148 9.328) 37.476 ======================= Grid point 1454 (338/344) ======================= q-point: ( 0.60 0.40 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.839 ( 12.699 7.332 5.975) 15.834 2.032 ( 11.094 6.405 12.137) 17.646 2.219 ( 15.849 9.150 -8.356) 20.118 2.231 ( 8.063 4.655 -10.237) 13.837 3.053 ( 0.182 0.105 7.186) 7.189 3.331 ( 3.879 2.239 -3.359) 5.599 3.430 ( 12.360 7.136 -1.152) 14.319 3.451 ( 11.982 6.918 2.648) 14.087 3.892 ( 11.550 6.668 -1.208) 13.391 4.050 ( 11.804 6.815 0.703) 13.649 4.256 ( 16.605 9.587 -5.394) 19.919 5.227 ( -7.998 -4.617 1.545) 9.363 7.693 ( -1.094 -0.631 -3.182) 3.423 8.702 ( -2.120 -1.224 0.408) 2.482 9.095 ( 3.585 2.070 -2.487) 4.830 9.412 ( 3.731 2.154 3.057) 5.283 9.588 ( 1.764 1.019 10.034) 10.238 9.777 ( -8.750 -5.052 0.468) 10.114 9.903 ( 6.086 3.514 -9.990) 12.214 11.172 ( -9.317 -5.379 10.053) 14.724 11.680 ( -7.987 -4.611 -8.119) 12.288 12.204 ( 3.018 1.742 -1.000) 3.625 14.302 ( -2.285 -1.319 1.272) 2.929 14.651 ( 1.012 0.584 1.828) 2.169 ======================= Grid point 1467 (339/344) ======================= q-point: ( 0.47 0.47 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( 0.000 13.203 8.387) 15.641 1.282 ( 0.000 20.467 9.496) 22.563 1.797 ( -0.000 0.215 -5.575) 5.580 1.902 ( -0.000 4.843 -5.637) 7.431 2.484 ( 0.000 22.975 24.952) 33.918 3.037 ( -0.000 6.082 -16.815) 17.881 3.079 ( 0.000 0.985 2.695) 2.869 3.218 ( -0.000 -0.025 -2.119) 2.120 3.222 ( -0.000 13.464 -3.016) 13.797 3.346 ( -0.000 11.600 -4.616) 12.484 4.268 ( -0.000 -5.370 -0.684) 5.413 5.612 ( 0.000 -6.945 2.813) 7.493 8.397 ( 0.000 -41.113 8.789) 42.042 8.881 ( -0.000 -5.875 -4.389) 7.333 8.947 ( 0.000 1.789 0.990) 2.045 9.274 ( -0.000 2.427 -0.822) 2.563 9.543 ( 0.000 3.704 0.853) 3.801 9.680 ( -0.000 2.091 -1.401) 2.517 10.108 ( 0.000 -4.635 0.232) 4.641 10.858 ( -0.000 38.476 -3.943) 38.677 12.025 ( 0.000 -6.638 0.131) 6.639 12.097 ( -0.000 1.360 -0.200) 1.375 13.984 ( -0.000 9.026 0.174) 9.027 15.978 ( 0.000 -54.824 6.236) 55.178 ======================= Grid point 1468 (340/344) ======================= q-point: ( 0.53 0.47 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 9.102 16.069 4.413) 18.987 1.618 ( 10.824 18.684 10.498) 24.010 1.822 ( 2.800 6.598 -8.594) 11.191 2.008 ( 5.165 7.415 -4.648) 10.162 2.876 ( 11.445 19.754 16.257) 28.027 3.100 ( -0.011 3.703 3.859) 5.348 3.131 ( 5.127 8.722 -10.367) 14.485 3.229 ( 2.428 1.406 -3.761) 4.693 3.474 ( 9.592 14.304 -2.458) 17.397 3.538 ( 8.454 15.279 -2.693) 17.668 4.181 ( -2.824 -4.697 -0.754) 5.533 5.489 ( -5.084 -8.730 1.434) 10.204 7.948 ( -10.896 -19.868 3.501) 22.928 8.792 ( -2.401 -4.654 -1.898) 5.570 8.998 ( 2.325 3.114 0.087) 3.887 9.315 ( 1.586 3.544 -0.029) 3.883 9.591 ( -0.567 4.176 4.776) 6.370 9.686 ( 1.726 -1.664 -4.919) 5.472 10.054 ( -1.789 -2.905 0.391) 3.434 11.218 ( 5.591 13.067 -0.933) 14.244 11.865 ( -6.303 -13.638 -0.661) 15.039 12.168 ( 3.330 5.164 -0.633) 6.177 14.146 ( 6.219 10.468 0.106) 12.176 15.214 ( -23.377 -39.465 4.837) 46.123 ======================= Grid point 1469 (341/344) ======================= q-point: ( 0.60 0.47 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 1688 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 9.753 16.502 2.522) 19.334 1.964 ( 8.000 8.763 9.839) 15.414 2.039 ( 13.918 12.722 -8.167) 20.549 2.181 ( 5.417 9.905 -4.002) 11.978 3.117 ( -0.715 5.382 6.272) 8.296 3.247 ( 5.448 2.517 -4.840) 7.710 3.325 ( 11.558 12.773 4.692) 17.854 3.370 ( 7.193 9.790 -3.461) 12.632 3.789 ( 10.289 14.266 -0.482) 17.596 3.891 ( 13.781 9.414 -2.177) 16.831 4.151 ( 4.492 4.795 -0.608) 6.598 5.296 ( -6.781 -8.137 0.601) 10.610 7.705 ( -3.635 -4.892 -1.411) 6.256 8.718 ( -1.721 -2.271 -0.214) 2.858 9.080 ( 2.449 4.941 -1.289) 5.663 9.397 ( 2.862 4.492 1.192) 5.458 9.603 ( -1.508 -0.557 8.915) 9.059 9.713 ( 4.807 -2.332 -6.760) 8.617 9.988 ( -5.325 3.117 -1.453) 6.339 11.277 ( -4.981 -2.852 8.066) 9.900 11.579 ( -3.433 -19.683 -6.981) 21.164 12.271 ( 0.337 8.766 -0.809) 8.810 14.344 ( 2.547 7.976 -0.404) 8.383 14.648 ( -8.179 -14.496 2.074) 16.772 ======================= Grid point 1483 (342/344) ======================= q-point: ( 0.53 0.53 0.40) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( -0.000 17.403 0.441) 17.409 1.770 ( 0.000 22.551 8.077) 23.954 1.860 ( -0.000 9.134 -11.544) 14.720 2.026 ( 0.000 7.935 2.436) 8.301 3.035 ( 0.000 22.725 7.257) 23.856 3.083 ( -0.000 0.040 -5.199) 5.199 3.187 ( -0.000 13.147 -5.149) 14.119 3.243 ( 0.000 2.351 3.530) 4.241 3.542 ( 0.000 17.777 1.849) 17.872 3.662 ( -0.000 20.644 0.150) 20.645 4.156 ( -0.000 -3.980 -0.848) 4.069 5.436 ( 0.000 -10.529 0.215) 10.532 7.846 ( 0.000 -16.972 3.232) 17.277 8.765 ( 0.000 -4.383 0.255) 4.390 9.007 ( 0.000 3.509 1.720) 3.908 9.334 ( -0.000 4.040 -1.591) 4.342 9.598 ( -0.000 2.164 -7.540) 7.845 9.744 ( 0.000 4.420 6.797) 8.108 9.973 ( -0.000 -8.577 -0.472) 8.590 11.292 ( -0.000 7.328 -8.106) 10.927 11.845 ( 0.000 -11.268 6.765) 13.143 12.138 ( 0.000 2.665 0.498) 2.711 14.202 ( 0.000 10.747 0.784) 10.776 15.006 ( 0.000 -36.452 -0.707) 36.459 ======================= Grid point 1694 (343/344) ======================= q-point: ( 0.47 0.47 0.47) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 344 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( 0.000 -0.000 5.692) 5.692 1.057 ( 0.000 -0.000 5.692) 5.692 1.841 ( -0.000 0.000 -4.368) 4.368 1.841 ( -0.000 0.000 -4.368) 4.368 2.246 ( 0.000 -0.000 22.786) 22.786 2.936 ( -0.000 0.000 -20.528) 20.528 3.072 ( 0.000 -0.000 3.366) 3.366 3.072 ( 0.000 -0.000 3.366) 3.366 3.217 ( -0.000 0.000 -2.550) 2.550 3.217 ( -0.000 0.000 -2.550) 2.550 4.328 ( -0.000 0.000 -0.241) 0.241 5.690 ( 0.000 -0.000 1.801) 1.801 8.931 ( 0.000 -0.000 0.111) 0.111 8.931 ( 0.000 -0.000 0.111) 0.111 9.247 ( -0.000 0.000 -0.081) 0.081 9.247 ( -0.000 0.000 -0.081) 0.081 9.398 ( 0.000 -0.000 0.286) 0.286 9.652 ( -0.000 0.000 -0.330) 0.330 10.155 ( 0.000 -0.000 0.386) 0.386 10.155 ( 0.000 -0.000 0.386) 0.386 12.083 ( -0.000 0.000 -0.347) 0.347 12.083 ( -0.000 0.000 -0.347) 0.347 13.888 ( 0.000 -0.000 0.009) 0.009 16.658 ( 0.000 -0.000 0.029) 0.029 ======================= Grid point 1695 (344/344) ======================= q-point: ( 0.53 0.47 0.47) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 5.98e-04 5.98e-04 0.00e+00 0.00e+00 5.20e-05 5.20e-05 Number of triplets: 904 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( 11.169 6.448 1.698) 13.008 1.308 ( 18.172 10.491 2.247) 21.103 1.774 ( -1.100 -0.635 0.514) 1.370 1.892 ( 4.699 2.713 -2.916) 6.160 2.564 ( 19.363 11.179 7.387) 23.547 2.974 ( 6.378 3.683 -6.528) 9.842 3.074 ( -0.135 -0.078 3.925) 3.928 3.221 ( 0.700 0.404 -2.817) 2.930 3.234 ( 11.669 6.737 -3.457) 13.910 3.325 ( 9.931 5.734 1.170) 11.527 4.266 ( -4.765 -2.751 -0.073) 5.502 5.620 ( -6.078 -3.509 0.600) 7.044 8.421 ( -35.456 -20.471 1.580) 40.972 8.872 ( -4.556 -2.630 -1.974) 5.619 8.953 ( 1.787 1.032 -0.889) 2.247 9.268 ( 1.890 1.091 0.792) 2.322 9.540 ( 2.444 1.411 1.757) 3.324 9.681 ( 2.456 1.418 -1.664) 3.288 10.107 ( -4.107 -2.371 0.637) 4.785 10.843 ( 32.089 18.527 0.776) 37.061 12.029 ( -4.814 -2.779 -1.039) 5.655 12.098 ( 1.267 0.732 -0.576) 1.573 13.985 ( 7.919 4.572 -0.076) 9.144 15.992 ( -47.121 -27.205 1.857) 54.442 =================== 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 3/81000 10.0 1514.315 1514.315 5744.295 -0.000 0.000 -0.000 3/81000 20.0 489.069 489.069 370.104 -0.000 0.000 -0.000 3/81000 30.0 182.244 182.244 99.894 -0.000 0.000 -0.000 3/81000 40.0 103.043 103.043 50.944 -0.000 0.000 -0.000 3/81000 50.0 71.949 71.949 33.985 -0.000 0.000 -0.000 3/81000 60.0 55.546 55.546 25.656 -0.000 0.000 -0.000 3/81000 70.0 45.171 45.171 20.646 -0.000 0.000 -0.000 3/81000 80.0 37.910 37.910 17.258 -0.000 0.000 -0.000 3/81000 90.0 32.530 32.530 14.801 -0.000 0.000 -0.000 3/81000 100.0 28.396 28.396 12.938 -0.000 0.000 -0.000 3/81000 110.0 25.137 25.137 11.479 -0.000 0.000 -0.000 3/81000 120.0 22.515 22.515 10.309 -0.000 0.000 -0.000 3/81000 130.0 20.370 20.370 9.353 -0.000 0.000 -0.000 3/81000 140.0 18.588 18.588 8.558 -0.000 0.000 -0.000 3/81000 150.0 17.089 17.089 7.887 -0.000 0.000 -0.000 3/81000 160.0 15.813 15.813 7.315 -0.000 0.000 -0.000 3/81000 170.0 14.715 14.715 6.822 -0.000 0.000 -0.000 3/81000 180.0 13.761 13.761 6.392 -0.000 0.000 -0.000 3/81000 190.0 12.925 12.925 6.014 -0.000 0.000 -0.000 3/81000 200.0 12.186 12.186 5.679 -0.000 0.000 -0.000 3/81000 210.0 11.530 11.530 5.381 -0.000 0.000 -0.000 3/81000 220.0 10.942 10.942 5.113 -0.000 0.000 -0.000 3/81000 230.0 10.413 10.413 4.872 -0.000 0.000 -0.000 3/81000 240.0 9.934 9.934 4.653 -0.000 0.000 -0.000 3/81000 250.0 9.499 9.499 4.453 -0.000 0.000 -0.000 3/81000 260.0 9.101 9.101 4.270 -0.000 0.000 -0.000 3/81000 270.0 8.736 8.736 4.102 -0.000 0.000 -0.000 3/81000 280.0 8.400 8.400 3.947 -0.000 0.000 -0.000 3/81000 290.0 8.090 8.090 3.804 -0.000 0.000 -0.000 3/81000 300.0 7.803 7.803 3.671 -0.000 0.000 -0.000 3/81000 310.0 7.536 7.536 3.547 -0.000 0.000 -0.000 3/81000 320.0 7.287 7.287 3.432 -0.000 0.000 -0.000 3/81000 330.0 7.054 7.054 3.324 -0.000 0.000 -0.000 3/81000 340.0 6.836 6.836 3.223 -0.000 0.000 -0.000 3/81000 350.0 6.632 6.632 3.128 -0.000 0.000 -0.000 3/81000 360.0 6.440 6.440 3.038 -0.000 0.000 -0.000 3/81000 370.0 6.259 6.259 2.954 -0.000 0.000 -0.000 3/81000 380.0 6.088 6.088 2.874 -0.000 0.000 -0.000 3/81000 390.0 5.926 5.926 2.798 -0.000 0.000 -0.000 3/81000 400.0 5.773 5.773 2.727 -0.000 0.000 -0.000 3/81000 410.0 5.628 5.628 2.659 -0.000 0.000 -0.000 3/81000 420.0 5.490 5.490 2.594 -0.000 0.000 -0.000 3/81000 430.0 5.359 5.359 2.533 -0.000 0.000 -0.000 3/81000 440.0 5.234 5.234 2.474 -0.000 0.000 -0.000 3/81000 450.0 5.114 5.114 2.418 -0.000 0.000 -0.000 3/81000 460.0 5.001 5.001 2.365 -0.000 0.000 -0.000 3/81000 470.0 4.892 4.892 2.314 -0.000 0.000 -0.000 3/81000 480.0 4.788 4.788 2.265 -0.000 0.000 -0.000 3/81000 490.0 4.688 4.688 2.218 -0.000 0.000 -0.000 3/81000 500.0 4.593 4.593 2.173 -0.000 0.000 -0.000 3/81000 510.0 4.501 4.501 2.130 -0.000 0.000 -0.000 3/81000 520.0 4.413 4.413 2.089 -0.000 0.000 -0.000 3/81000 530.0 4.329 4.329 2.049 -0.000 0.000 -0.000 3/81000 540.0 4.248 4.248 2.011 -0.000 0.000 -0.000 3/81000 550.0 4.169 4.169 1.974 -0.000 0.000 -0.000 3/81000 560.0 4.094 4.094 1.939 -0.000 0.000 -0.000 3/81000 570.0 4.021 4.021 1.904 -0.000 0.000 -0.000 3/81000 580.0 3.951 3.951 1.871 -0.000 0.000 -0.000 3/81000 590.0 3.884 3.884 1.839 -0.000 0.000 -0.000 3/81000 600.0 3.818 3.818 1.809 -0.000 0.000 -0.000 3/81000 610.0 3.755 3.755 1.779 -0.000 0.000 -0.000 3/81000 620.0 3.694 3.694 1.750 -0.000 0.000 -0.000 3/81000 630.0 3.635 3.635 1.722 -0.000 0.000 -0.000 3/81000 640.0 3.578 3.578 1.695 -0.000 0.000 -0.000 3/81000 650.0 3.522 3.522 1.669 -0.000 0.000 -0.000 3/81000 660.0 3.468 3.468 1.644 -0.000 0.000 -0.000 3/81000 670.0 3.416 3.416 1.619 -0.000 0.000 -0.000 3/81000 680.0 3.366 3.366 1.595 -0.000 0.000 -0.000 3/81000 690.0 3.317 3.317 1.572 -0.000 0.000 -0.000 3/81000 700.0 3.269 3.269 1.549 -0.000 0.000 -0.000 3/81000 710.0 3.223 3.223 1.527 -0.000 0.000 -0.000 3/81000 720.0 3.178 3.178 1.506 -0.000 0.000 -0.000 3/81000 730.0 3.134 3.134 1.486 -0.000 0.000 -0.000 3/81000 740.0 3.092 3.092 1.465 -0.000 0.000 -0.000 3/81000 750.0 3.050 3.050 1.446 -0.000 0.000 -0.000 3/81000 760.0 3.010 3.010 1.427 -0.000 0.000 -0.000 3/81000 770.0 2.971 2.971 1.408 -0.000 0.000 -0.000 3/81000 780.0 2.933 2.933 1.390 -0.000 0.000 -0.000 3/81000 790.0 2.895 2.895 1.373 -0.000 0.000 -0.000 3/81000 800.0 2.859 2.859 1.356 -0.000 0.000 -0.000 3/81000 810.0 2.824 2.824 1.339 -0.000 0.000 -0.000 3/81000 820.0 2.789 2.789 1.322 -0.000 0.000 -0.000 3/81000 830.0 2.756 2.756 1.307 -0.000 0.000 -0.000 3/81000 840.0 2.723 2.723 1.291 -0.000 0.000 -0.000 3/81000 850.0 2.691 2.691 1.276 -0.000 0.000 -0.000 3/81000 860.0 2.659 2.659 1.261 -0.000 0.000 -0.000 3/81000 870.0 2.629 2.629 1.246 -0.000 0.000 -0.000 3/81000 880.0 2.599 2.599 1.232 -0.000 0.000 -0.000 3/81000 890.0 2.570 2.570 1.219 -0.000 0.000 -0.000 3/81000 900.0 2.541 2.541 1.205 -0.000 0.000 -0.000 3/81000 910.0 2.513 2.513 1.192 -0.000 0.000 -0.000 3/81000 920.0 2.486 2.486 1.179 -0.000 0.000 -0.000 3/81000 930.0 2.459 2.459 1.166 -0.000 0.000 -0.000 3/81000 940.0 2.433 2.433 1.154 -0.000 0.000 -0.000 3/81000 950.0 2.407 2.407 1.142 -0.000 0.000 -0.000 3/81000 960.0 2.382 2.382 1.130 -0.000 0.000 -0.000 3/81000 970.0 2.358 2.358 1.118 -0.000 0.000 -0.000 3/81000 980.0 2.334 2.334 1.107 -0.000 0.000 -0.000 3/81000 990.0 2.310 2.310 1.096 -0.000 0.000 -0.000 3/81000 1000.0 2.287 2.287 1.085 -0.000 0.000 -0.000 3/81000 Thermal conductivity related properties were written into "kappa-m151515.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 10:50:17]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|