----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-09 01:56:49]------------------------- 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 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fmm2 (42) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 10.602125520000000 2.840713825000000 b 2.835673010000000 0.000000000000000 2.840713825000000 c 2.835673010000000 10.602125520000000 0.000000000000000 Atomic positions (fractional): *1 Ba 0.56137533662190 0.92834879353913 0.07165120646087 137.327 *2 Ba 0.74341748344786 0.74341748344786 0.25658251655214 137.327 3 Ba 0.92834879353913 0.56137533662190 0.43862466337810 137.327 *4 Ti 0.13860395107562 0.32872403173511 0.67127596826489 47.867 5 Ti 0.32872403173511 0.13860395107562 0.86139604892438 47.867 *6 O 0.06836448970925 0.44162121277497 0.55837878722503 15.999 *7 O 0.15780595978572 0.85361831081336 0.65329144039204 15.999 8 O 0.85361831081336 0.15780595978573 0.33528428900888 15.999 9 O 0.34670855960796 0.66471571099112 0.84219404021428 15.999 10 O 0.66471571099112 0.34670855960797 0.14638168918664 15.999 *11 O 0.25529719989798 0.25529719989798 0.74470280010202 15.999 12 O 0.44162121277497 0.06836448970925 0.93163551029075 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.671346020000000 0.000000000000000 0.000000000000000 b 0.000000000000000 21.204251039999999 0.000000000000000 c 0.000000000000000 0.000000000000000 5.681427650000000 Atomic positions (fractional): *1 Ba 0.00000000000000 0.31651327154138 0.24486206508052 137.327 > 1 *2 Ba 0.50000000000000 0.00000000000000 0.24341748344786 137.327 > 2 3 Ba 0.50000000000000 0.18348672845862 0.24486206508052 137.327 > 3 4 Ba 0.00000000000000 0.81651327154138 0.74486206508052 137.327 > 1 5 Ba 0.50000000000000 0.50000000000000 0.74341748344786 137.327 > 2 6 Ba 0.50000000000000 0.68348672845862 0.74486206508052 137.327 > 3 7 Ba 0.50000000000000 0.31651327154138 0.74486206508052 137.327 > 1 8 Ba 0.00000000000000 0.00000000000000 0.74341748344786 137.327 > 2 9 Ba 0.00000000000000 0.18348672845862 0.74486206508052 137.327 > 3 10 Ba 0.50000000000000 0.81651327154138 0.24486206508052 137.327 > 1 11 Ba 0.00000000000000 0.50000000000000 0.24341748344786 137.327 > 2 12 Ba 0.00000000000000 0.68348672845862 0.24486206508052 137.327 > 3 *13 Ti 0.00000000000000 0.40493995967025 0.73366399140536 47.867 > 4 14 Ti 0.50000000000000 0.09506004032975 0.73366399140536 47.867 > 5 15 Ti 0.00000000000000 0.90493995967025 0.23366399140537 47.867 > 4 16 Ti 0.50000000000000 0.59506004032975 0.23366399140537 47.867 > 5 17 Ti 0.50000000000000 0.40493995967025 0.23366399140537 47.867 > 4 18 Ti 0.00000000000000 0.09506004032975 0.23366399140537 47.867 > 5 19 Ti 0.50000000000000 0.90493995967025 0.73366399140536 47.867 > 4 20 Ti 0.00000000000000 0.59506004032975 0.73366399140536 47.867 > 5 *21 O 0.00000000000000 0.31337163846714 0.75499285124211 15.999 > 6 *22 O 0.25345487560270 0.40554870008888 0.00571213529954 15.999 > 7 23 O 0.24654512439730 0.09445129991112 0.00571213529954 15.999 > 8 24 O 0.75345487560270 0.09445129991112 0.00571213529954 15.999 > 9 25 O 0.74654512439730 0.40554870008888 0.00571213529954 15.999 > 10 *26 O 0.50000000000000 0.00000000000000 0.75529719989798 15.999 > 11 27 O 0.50000000000000 0.18662836153286 0.75499285124211 15.999 > 12 28 O 0.00000000000000 0.81337163846714 0.25499285124211 15.999 > 6 29 O 0.25345487560270 0.90554870008888 0.50571213529954 15.999 > 7 30 O 0.24654512439730 0.59445129991112 0.50571213529954 15.999 > 8 31 O 0.75345487560270 0.59445129991112 0.50571213529954 15.999 > 9 32 O 0.74654512439730 0.90554870008888 0.50571213529954 15.999 > 10 33 O 0.50000000000000 0.50000000000000 0.25529719989798 15.999 > 11 34 O 0.50000000000000 0.68662836153286 0.25499285124211 15.999 > 12 35 O 0.50000000000000 0.31337163846714 0.25499285124211 15.999 > 6 36 O 0.75345487560270 0.40554870008888 0.50571213529954 15.999 > 7 37 O 0.74654512439730 0.09445129991112 0.50571213529954 15.999 > 8 38 O 0.25345487560270 0.09445129991112 0.50571213529954 15.999 > 9 39 O 0.24654512439730 0.40554870008888 0.50571213529954 15.999 > 10 40 O 0.00000000000000 0.00000000000000 0.25529719989798 15.999 > 11 41 O 0.00000000000000 0.18662836153286 0.25499285124211 15.999 > 12 42 O 0.50000000000000 0.81337163846714 0.75499285124211 15.999 > 6 43 O 0.75345487560270 0.90554870008888 0.00571213529954 15.999 > 7 44 O 0.74654512439730 0.59445129991112 0.00571213529954 15.999 > 8 45 O 0.25345487560270 0.59445129991112 0.00571213529954 15.999 > 9 46 O 0.24654512439730 0.90554870008888 0.00571213529954 15.999 > 10 47 O 0.00000000000000 0.50000000000000 0.75529719989798 15.999 > 11 48 O 0.00000000000000 0.68662836153286 0.75499285124211 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.342692039999999 0.000000000000000 0.000000000000000 b 0.000000000000000 21.204251039999999 0.000000000000000 c 0.000000000000000 0.000000000000000 5.681427650000000 Atomic positions (fractional): *1 Ba 0.00000000000000 0.31651327154138 0.24486206508052 137.327 > 1 2 Ba 0.50000000000000 0.31651327154138 0.24486206508052 137.327 > 1 *3 Ba 0.25000000000000 0.00000000000000 0.24341748344786 137.327 > 2 4 Ba 0.75000000000000 0.00000000000000 0.24341748344786 137.327 > 2 5 Ba 0.25000000000000 0.18348672845862 0.24486206508052 137.327 > 3 6 Ba 0.75000000000000 0.18348672845862 0.24486206508052 137.327 > 3 7 Ba 0.00000000000000 0.81651327154138 0.74486206508052 137.327 > 1 8 Ba 0.50000000000000 0.81651327154138 0.74486206508052 137.327 > 1 9 Ba 0.25000000000000 0.50000000000000 0.74341748344786 137.327 > 2 10 Ba 0.75000000000000 0.50000000000000 0.74341748344786 137.327 > 2 11 Ba 0.25000000000000 0.68348672845862 0.74486206508052 137.327 > 3 12 Ba 0.75000000000000 0.68348672845862 0.74486206508052 137.327 > 3 13 Ba 0.25000000000000 0.31651327154138 0.74486206508052 137.327 > 1 14 Ba 0.75000000000000 0.31651327154138 0.74486206508052 137.327 > 1 15 Ba 0.00000000000000 0.00000000000000 0.74341748344786 137.327 > 2 16 Ba 0.50000000000000 0.00000000000000 0.74341748344786 137.327 > 2 17 Ba 0.00000000000000 0.18348672845862 0.74486206508052 137.327 > 3 18 Ba 0.50000000000000 0.18348672845862 0.74486206508052 137.327 > 3 19 Ba 0.25000000000000 0.81651327154138 0.24486206508052 137.327 > 1 20 Ba 0.75000000000000 0.81651327154138 0.24486206508052 137.327 > 1 21 Ba 0.00000000000000 0.50000000000000 0.24341748344786 137.327 > 2 22 Ba 0.50000000000000 0.50000000000000 0.24341748344786 137.327 > 2 23 Ba 0.00000000000000 0.68348672845862 0.24486206508052 137.327 > 3 24 Ba 0.50000000000000 0.68348672845862 0.24486206508052 137.327 > 3 *25 Ti 0.00000000000000 0.40493995967025 0.73366399140536 47.867 > 4 26 Ti 0.50000000000000 0.40493995967025 0.73366399140536 47.867 > 4 27 Ti 0.25000000000000 0.09506004032975 0.73366399140536 47.867 > 5 28 Ti 0.75000000000000 0.09506004032975 0.73366399140536 47.867 > 5 29 Ti 0.00000000000000 0.90493995967025 0.23366399140537 47.867 > 4 30 Ti 0.50000000000000 0.90493995967025 0.23366399140537 47.867 > 4 31 Ti 0.25000000000000 0.59506004032975 0.23366399140537 47.867 > 5 32 Ti 0.75000000000000 0.59506004032975 0.23366399140537 47.867 > 5 33 Ti 0.25000000000000 0.40493995967025 0.23366399140537 47.867 > 4 34 Ti 0.75000000000000 0.40493995967025 0.23366399140537 47.867 > 4 35 Ti 0.00000000000000 0.09506004032975 0.23366399140537 47.867 > 5 36 Ti 0.50000000000000 0.09506004032975 0.23366399140537 47.867 > 5 37 Ti 0.25000000000000 0.90493995967025 0.73366399140536 47.867 > 4 38 Ti 0.75000000000000 0.90493995967025 0.73366399140536 47.867 > 4 39 Ti 0.00000000000000 0.59506004032975 0.73366399140536 47.867 > 5 40 Ti 0.50000000000000 0.59506004032975 0.73366399140536 47.867 > 5 *41 O 0.00000000000000 0.31337163846714 0.75499285124211 15.999 > 6 42 O 0.50000000000000 0.31337163846714 0.75499285124211 15.999 > 6 *43 O 0.12672743780135 0.40554870008888 0.00571213529954 15.999 > 7 44 O 0.62672743780135 0.40554870008888 0.00571213529954 15.999 > 7 45 O 0.12327256219865 0.09445129991112 0.00571213529954 15.999 > 8 46 O 0.62327256219865 0.09445129991112 0.00571213529954 15.999 > 8 47 O 0.37672743780135 0.09445129991112 0.00571213529954 15.999 > 9 48 O 0.87672743780135 0.09445129991112 0.00571213529954 15.999 > 9 49 O 0.37327256219865 0.40554870008888 0.00571213529954 15.999 > 10 50 O 0.87327256219865 0.40554870008888 0.00571213529954 15.999 > 10 *51 O 0.25000000000000 0.00000000000000 0.75529719989798 15.999 > 11 52 O 0.75000000000000 0.00000000000000 0.75529719989798 15.999 > 11 53 O 0.25000000000000 0.18662836153286 0.75499285124211 15.999 > 12 54 O 0.75000000000000 0.18662836153286 0.75499285124211 15.999 > 12 55 O 0.00000000000000 0.81337163846714 0.25499285124211 15.999 > 6 56 O 0.50000000000000 0.81337163846714 0.25499285124211 15.999 > 6 57 O 0.12672743780135 0.90554870008888 0.50571213529954 15.999 > 7 58 O 0.62672743780135 0.90554870008888 0.50571213529954 15.999 > 7 59 O 0.12327256219865 0.59445129991112 0.50571213529954 15.999 > 8 60 O 0.62327256219865 0.59445129991112 0.50571213529954 15.999 > 8 61 O 0.37672743780135 0.59445129991112 0.50571213529954 15.999 > 9 62 O 0.87672743780135 0.59445129991112 0.50571213529954 15.999 > 9 63 O 0.37327256219865 0.90554870008888 0.50571213529954 15.999 > 10 64 O 0.87327256219865 0.90554870008888 0.50571213529954 15.999 > 10 65 O 0.25000000000000 0.50000000000000 0.25529719989798 15.999 > 11 66 O 0.75000000000000 0.50000000000000 0.25529719989798 15.999 > 11 67 O 0.25000000000000 0.68662836153286 0.25499285124211 15.999 > 12 68 O 0.75000000000000 0.68662836153286 0.25499285124211 15.999 > 12 69 O 0.25000000000000 0.31337163846714 0.25499285124211 15.999 > 6 70 O 0.75000000000000 0.31337163846714 0.25499285124211 15.999 > 6 71 O 0.37672743780135 0.40554870008888 0.50571213529954 15.999 > 7 72 O 0.87672743780135 0.40554870008888 0.50571213529954 15.999 > 7 73 O 0.37327256219865 0.09445129991112 0.50571213529954 15.999 > 8 74 O 0.87327256219865 0.09445129991112 0.50571213529954 15.999 > 8 75 O 0.12672743780135 0.09445129991112 0.50571213529954 15.999 > 9 76 O 0.62672743780135 0.09445129991112 0.50571213529954 15.999 > 9 77 O 0.12327256219865 0.40554870008888 0.50571213529954 15.999 > 10 78 O 0.62327256219865 0.40554870008888 0.50571213529954 15.999 > 10 79 O 0.00000000000000 0.00000000000000 0.25529719989798 15.999 > 11 80 O 0.50000000000000 0.00000000000000 0.25529719989798 15.999 > 11 81 O 0.00000000000000 0.18662836153286 0.25499285124211 15.999 > 12 82 O 0.50000000000000 0.18662836153286 0.25499285124211 15.999 > 12 83 O 0.25000000000000 0.81337163846714 0.75499285124211 15.999 > 6 84 O 0.75000000000000 0.81337163846714 0.75499285124211 15.999 > 6 85 O 0.37672743780135 0.90554870008888 0.00571213529954 15.999 > 7 86 O 0.87672743780135 0.90554870008888 0.00571213529954 15.999 > 7 87 O 0.37327256219865 0.59445129991112 0.00571213529954 15.999 > 8 88 O 0.87327256219865 0.59445129991112 0.00571213529954 15.999 > 8 89 O 0.12672743780135 0.59445129991112 0.00571213529954 15.999 > 9 90 O 0.62672743780135 0.59445129991112 0.00571213529954 15.999 > 9 91 O 0.12327256219865 0.90554870008888 0.00571213529954 15.999 > 10 92 O 0.62327256219865 0.90554870008888 0.00571213529954 15.999 > 10 93 O 0.00000000000000 0.50000000000000 0.75529719989798 15.999 > 11 94 O 0.50000000000000 0.50000000000000 0.75529719989798 15.999 > 11 95 O 0.00000000000000 0.68662836153286 0.75499285124211 15.999 > 12 96 O 0.50000000000000 0.68662836153286 0.75499285124211 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6523704 0.0000000 0.0000000 0.0000000 5.4639112 0.0000000 0.0000000 0.0000000 5.4879980 -------------------------- Born effective charges -------------------------- 1 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 -0.0085192 0.0000000 0.1534610 2.6530512 2 Ba 2.8140003 0.0000000 0.0000000 0.0000000 2.3434788 0.0000000 0.0000000 0.0000000 2.7971548 3 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 0.0085192 0.0000000 -0.1534610 2.6530512 4 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 -0.0256254 0.0000000 -0.1399721 6.1466117 5 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 0.0256254 0.0000000 0.1399721 6.1466117 6 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 0.0941608 0.0000000 0.2111400 -2.1872752 7 O -3.7109130 -0.0135182 -1.5762343 -0.0062200 -1.6919817 0.0048995 -1.4743633 -0.0186746 -3.4824795 8 O -3.7109130 -0.0135182 1.5762343 -0.0062200 -1.6919817 -0.0048995 1.4743633 0.0186746 -3.4824795 9 O -3.7109130 0.0135182 -1.5762343 0.0062200 -1.6919817 -0.0048995 -1.4743633 0.0186746 -3.4824795 10 O -3.7109130 0.0135182 1.5762343 0.0062200 -1.6919817 0.0048995 1.4743633 -0.0186746 -3.4824795 11 O -2.0903566 0.0000000 0.0000000 0.0000000 -4.7113717 0.0000000 0.0000000 0.0000000 -2.0920123 12 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 -0.0941608 0.0000000 -0.2111400 -2.1872752 ---------------------------------------------------------------------------- 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: 6894/6894 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1442 Number of blocks in projector: 1442 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 14 --- Eigsh_solver_block: 1 / 14 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 14 --- Block_size: 220 Use standard eigh solver. --- Eigsh_solver_block: 3 / 14 --- Block_size: 220 Use standard eigh solver. --- Eigsh_solver_block: 4 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 5 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 6 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 7 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 8 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 9 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 10 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 11 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 12 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 13 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 14 / 14 --- Block_size: 1 Use standard eigh solver. Tree of FC basis block matrices: - (1442, 1412), data: False |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (218, 212), data: True |-- (218, 212), data: True |-- (218, 212), data: True |-- (220, 218), data: True |-- (220, 218), data: True |-- (340, 332), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 400 - Time: 1.646 Solver_block: 200 / 400 - Time: 1.635 Solver_block: 300 / 400 - Time: 1.631 Solver_block: 400 / 400 - Time: 1.631 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.580 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 6894/6894 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1442 Number of blocks in projector: 1442 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 14 --- Eigsh_solver_block: 1 / 14 --- Block_size: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 14 --- Block_size: 220 Use standard eigh solver. --- Eigsh_solver_block: 3 / 14 --- Block_size: 220 Use standard eigh solver. --- Eigsh_solver_block: 4 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 5 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 6 / 14 --- Block_size: 218 Use standard eigh solver. --- Eigsh_solver_block: 7 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 8 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 9 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 10 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 11 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 12 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 13 / 14 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 14 / 14 --- Block_size: 1 Use standard eigh solver. Tree of FC basis block matrices: - (1442, 1412), data: False |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (218, 212), data: True |-- (218, 212), data: True |-- (218, 212), data: True |-- (220, 218), data: True |-- (220, 218), data: True |-- (340, 332), data: True Max drift after symmetrization by symfc projector: -0.00000000 (yy) -0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-09 01:57:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 01:57:10]------------------------- 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 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fmm2 (42) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 10.602125520000000 2.840713825000000 b 2.835673010000000 0.000000000000000 2.840713825000000 c 2.835673010000000 10.602125520000000 0.000000000000000 Atomic positions (fractional): 1 Ba 0.56137533662190 0.92834879353913 0.07165120646087 137.327 2 Ba 0.74341748344786 0.74341748344786 0.25658251655214 137.327 3 Ba 0.92834879353913 0.56137533662190 0.43862466337810 137.327 4 Ti 0.13860395107562 0.32872403173511 0.67127596826489 47.867 5 Ti 0.32872403173511 0.13860395107562 0.86139604892438 47.867 6 O 0.06836448970925 0.44162121277497 0.55837878722503 15.999 7 O 0.15780595978572 0.85361831081336 0.65329144039204 15.999 8 O 0.85361831081336 0.15780595978573 0.33528428900888 15.999 9 O 0.34670855960796 0.66471571099112 0.84219404021428 15.999 10 O 0.66471571099112 0.34670855960797 0.14638168918664 15.999 11 O 0.25529719989798 0.25529719989798 0.74470280010202 15.999 12 O 0.44162121277497 0.06836448970925 0.93163551029075 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.342692039999999 0.000000000000000 0.000000000000000 b 0.000000000000000 21.204251039999999 0.000000000000000 c 0.000000000000000 0.000000000000000 5.681427650000000 Atomic positions (fractional): 1 Ba 0.00000000000000 0.31651327154138 0.24486206508052 137.327 > 1 2 Ba 0.50000000000000 0.31651327154138 0.24486206508052 137.327 > 1 3 Ba 0.25000000000000 0.00000000000000 0.24341748344786 137.327 > 3 4 Ba 0.75000000000000 0.00000000000000 0.24341748344786 137.327 > 3 5 Ba 0.25000000000000 0.18348672845862 0.24486206508052 137.327 > 5 6 Ba 0.75000000000000 0.18348672845862 0.24486206508052 137.327 > 5 7 Ba 0.00000000000000 0.81651327154138 0.74486206508052 137.327 > 1 8 Ba 0.50000000000000 0.81651327154138 0.74486206508052 137.327 > 1 9 Ba 0.25000000000000 0.50000000000000 0.74341748344786 137.327 > 3 10 Ba 0.75000000000000 0.50000000000000 0.74341748344786 137.327 > 3 11 Ba 0.25000000000000 0.68348672845862 0.74486206508052 137.327 > 5 12 Ba 0.75000000000000 0.68348672845862 0.74486206508052 137.327 > 5 13 Ba 0.25000000000000 0.31651327154138 0.74486206508052 137.327 > 1 14 Ba 0.75000000000000 0.31651327154138 0.74486206508052 137.327 > 1 15 Ba 0.00000000000000 0.00000000000000 0.74341748344786 137.327 > 3 16 Ba 0.50000000000000 0.00000000000000 0.74341748344786 137.327 > 3 17 Ba 0.00000000000000 0.18348672845862 0.74486206508052 137.327 > 5 18 Ba 0.50000000000000 0.18348672845862 0.74486206508052 137.327 > 5 19 Ba 0.25000000000000 0.81651327154138 0.24486206508052 137.327 > 1 20 Ba 0.75000000000000 0.81651327154138 0.24486206508052 137.327 > 1 21 Ba 0.00000000000000 0.50000000000000 0.24341748344786 137.327 > 3 22 Ba 0.50000000000000 0.50000000000000 0.24341748344786 137.327 > 3 23 Ba 0.00000000000000 0.68348672845862 0.24486206508052 137.327 > 5 24 Ba 0.50000000000000 0.68348672845862 0.24486206508052 137.327 > 5 25 Ti 0.00000000000000 0.40493995967025 0.73366399140536 47.867 > 25 26 Ti 0.50000000000000 0.40493995967025 0.73366399140536 47.867 > 25 27 Ti 0.25000000000000 0.09506004032975 0.73366399140536 47.867 > 27 28 Ti 0.75000000000000 0.09506004032975 0.73366399140536 47.867 > 27 29 Ti 0.00000000000000 0.90493995967025 0.23366399140537 47.867 > 25 30 Ti 0.50000000000000 0.90493995967025 0.23366399140537 47.867 > 25 31 Ti 0.25000000000000 0.59506004032975 0.23366399140537 47.867 > 27 32 Ti 0.75000000000000 0.59506004032975 0.23366399140537 47.867 > 27 33 Ti 0.25000000000000 0.40493995967025 0.23366399140537 47.867 > 25 34 Ti 0.75000000000000 0.40493995967025 0.23366399140537 47.867 > 25 35 Ti 0.00000000000000 0.09506004032975 0.23366399140537 47.867 > 27 36 Ti 0.50000000000000 0.09506004032975 0.23366399140537 47.867 > 27 37 Ti 0.25000000000000 0.90493995967025 0.73366399140536 47.867 > 25 38 Ti 0.75000000000000 0.90493995967025 0.73366399140536 47.867 > 25 39 Ti 0.00000000000000 0.59506004032975 0.73366399140536 47.867 > 27 40 Ti 0.50000000000000 0.59506004032975 0.73366399140536 47.867 > 27 41 O 0.00000000000000 0.31337163846714 0.75499285124211 15.999 > 41 42 O 0.50000000000000 0.31337163846714 0.75499285124211 15.999 > 41 43 O 0.12672743780135 0.40554870008888 0.00571213529954 15.999 > 43 44 O 0.62672743780135 0.40554870008888 0.00571213529954 15.999 > 43 45 O 0.12327256219865 0.09445129991112 0.00571213529954 15.999 > 45 46 O 0.62327256219865 0.09445129991112 0.00571213529954 15.999 > 45 47 O 0.37672743780135 0.09445129991112 0.00571213529954 15.999 > 47 48 O 0.87672743780135 0.09445129991112 0.00571213529954 15.999 > 47 49 O 0.37327256219865 0.40554870008888 0.00571213529954 15.999 > 49 50 O 0.87327256219865 0.40554870008888 0.00571213529954 15.999 > 49 51 O 0.25000000000000 0.00000000000000 0.75529719989798 15.999 > 51 52 O 0.75000000000000 0.00000000000000 0.75529719989798 15.999 > 51 53 O 0.25000000000000 0.18662836153286 0.75499285124211 15.999 > 53 54 O 0.75000000000000 0.18662836153286 0.75499285124211 15.999 > 53 55 O 0.00000000000000 0.81337163846714 0.25499285124211 15.999 > 41 56 O 0.50000000000000 0.81337163846714 0.25499285124211 15.999 > 41 57 O 0.12672743780135 0.90554870008888 0.50571213529954 15.999 > 43 58 O 0.62672743780135 0.90554870008888 0.50571213529954 15.999 > 43 59 O 0.12327256219865 0.59445129991112 0.50571213529954 15.999 > 45 60 O 0.62327256219865 0.59445129991112 0.50571213529954 15.999 > 45 61 O 0.37672743780135 0.59445129991112 0.50571213529954 15.999 > 47 62 O 0.87672743780135 0.59445129991112 0.50571213529954 15.999 > 47 63 O 0.37327256219865 0.90554870008888 0.50571213529954 15.999 > 49 64 O 0.87327256219865 0.90554870008888 0.50571213529954 15.999 > 49 65 O 0.25000000000000 0.50000000000000 0.25529719989798 15.999 > 51 66 O 0.75000000000000 0.50000000000000 0.25529719989798 15.999 > 51 67 O 0.25000000000000 0.68662836153286 0.25499285124211 15.999 > 53 68 O 0.75000000000000 0.68662836153286 0.25499285124211 15.999 > 53 69 O 0.25000000000000 0.31337163846714 0.25499285124211 15.999 > 41 70 O 0.75000000000000 0.31337163846714 0.25499285124211 15.999 > 41 71 O 0.37672743780135 0.40554870008888 0.50571213529954 15.999 > 43 72 O 0.87672743780135 0.40554870008888 0.50571213529954 15.999 > 43 73 O 0.37327256219865 0.09445129991112 0.50571213529954 15.999 > 45 74 O 0.87327256219865 0.09445129991112 0.50571213529954 15.999 > 45 75 O 0.12672743780135 0.09445129991112 0.50571213529954 15.999 > 47 76 O 0.62672743780135 0.09445129991112 0.50571213529954 15.999 > 47 77 O 0.12327256219865 0.40554870008888 0.50571213529954 15.999 > 49 78 O 0.62327256219865 0.40554870008888 0.50571213529954 15.999 > 49 79 O 0.00000000000000 0.00000000000000 0.25529719989798 15.999 > 51 80 O 0.50000000000000 0.00000000000000 0.25529719989798 15.999 > 51 81 O 0.00000000000000 0.18662836153286 0.25499285124211 15.999 > 53 82 O 0.50000000000000 0.18662836153286 0.25499285124211 15.999 > 53 83 O 0.25000000000000 0.81337163846714 0.75499285124211 15.999 > 41 84 O 0.75000000000000 0.81337163846714 0.75499285124211 15.999 > 41 85 O 0.37672743780135 0.90554870008888 0.00571213529954 15.999 > 43 86 O 0.87672743780135 0.90554870008888 0.00571213529954 15.999 > 43 87 O 0.37327256219865 0.59445129991112 0.00571213529954 15.999 > 45 88 O 0.87327256219865 0.59445129991112 0.00571213529954 15.999 > 45 89 O 0.12672743780135 0.59445129991112 0.00571213529954 15.999 > 47 90 O 0.62672743780135 0.59445129991112 0.00571213529954 15.999 > 47 91 O 0.12327256219865 0.90554870008888 0.00571213529954 15.999 > 49 92 O 0.62327256219865 0.90554870008888 0.00571213529954 15.999 > 49 93 O 0.00000000000000 0.50000000000000 0.75529719989798 15.999 > 51 94 O 0.50000000000000 0.50000000000000 0.75529719989798 15.999 > 51 95 O 0.00000000000000 0.68662836153286 0.75499285124211 15.999 > 53 96 O 0.50000000000000 0.68662836153286 0.75499285124211 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.6523704 0.0000000 0.0000000 0.0000000 5.4639112 0.0000000 0.0000000 0.0000000 5.4879980 -------------------------- Born effective charges -------------------------- 1 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 -0.0085192 0.0000000 0.1534610 2.6530512 2 Ba 2.8140003 0.0000000 0.0000000 0.0000000 2.3434788 0.0000000 0.0000000 0.0000000 2.7971548 3 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 0.0085192 0.0000000 -0.1534610 2.6530512 4 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 -0.0256254 0.0000000 -0.1399721 6.1466117 5 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 0.0256254 0.0000000 0.1399721 6.1466117 6 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 0.0941608 0.0000000 0.2111400 -2.1872752 7 O -3.7109130 -0.0135182 -1.5762343 -0.0062200 -1.6919817 0.0048995 -1.4743633 -0.0186746 -3.4824795 8 O -3.7109130 -0.0135182 1.5762343 -0.0062200 -1.6919817 -0.0048995 1.4743633 0.0186746 -3.4824795 9 O -3.7109130 0.0135182 -1.5762343 0.0062200 -1.6919817 -0.0048995 -1.4743633 0.0186746 -3.4824795 10 O -3.7109130 0.0135182 1.5762343 0.0062200 -1.6919817 0.0048995 1.4743633 -0.0186746 -3.4824795 11 O -2.0903566 0.0000000 0.0000000 0.0000000 -4.7113717 0.0000000 0.0000000 0.0000000 -2.0920123 12 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 -0.0941608 0.0000000 -0.2111400 -2.1872752 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 3, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 43, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 51, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000008 (yyy) 0.00000008 (yyy) 0.00000008 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000001 (xz) 0.00000001 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 01:57:25]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-09 01:57:25]------------------------- 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 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fmm2 (42) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 10.602125520000000 2.840713825000000 b 2.835673010000000 0.000000000000000 2.840713825000000 c 2.835673010000000 10.602125520000000 0.000000000000000 Atomic positions (fractional): 1 Ba 0.56137533662190 0.92834879353913 0.07165120646087 137.327 2 Ba 0.74341748344786 0.74341748344786 0.25658251655214 137.327 3 Ba 0.92834879353913 0.56137533662190 0.43862466337810 137.327 4 Ti 0.13860395107562 0.32872403173511 0.67127596826489 47.867 5 Ti 0.32872403173511 0.13860395107562 0.86139604892438 47.867 6 O 0.06836448970925 0.44162121277497 0.55837878722503 15.999 7 O 0.15780595978572 0.85361831081336 0.65329144039204 15.999 8 O 0.85361831081336 0.15780595978573 0.33528428900888 15.999 9 O 0.34670855960796 0.66471571099112 0.84219404021428 15.999 10 O 0.66471571099112 0.34670855960797 0.14638168918664 15.999 11 O 0.25529719989798 0.25529719989798 0.74470280010202 15.999 12 O 0.44162121277497 0.06836448970925 0.93163551029075 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.342692039999999 0.000000000000000 0.000000000000000 b 0.000000000000000 21.204251039999999 0.000000000000000 c 0.000000000000000 0.000000000000000 5.681427650000000 Atomic positions (fractional): 1 Ba 0.00000000000000 0.31651327154138 0.24486206508052 137.327 > 1 2 Ba 0.50000000000000 0.31651327154138 0.24486206508052 137.327 > 1 3 Ba 0.25000000000000 0.00000000000000 0.24341748344786 137.327 > 3 4 Ba 0.75000000000000 0.00000000000000 0.24341748344786 137.327 > 3 5 Ba 0.25000000000000 0.18348672845862 0.24486206508052 137.327 > 5 6 Ba 0.75000000000000 0.18348672845862 0.24486206508052 137.327 > 5 7 Ba 0.00000000000000 0.81651327154138 0.74486206508052 137.327 > 1 8 Ba 0.50000000000000 0.81651327154138 0.74486206508052 137.327 > 1 9 Ba 0.25000000000000 0.50000000000000 0.74341748344786 137.327 > 3 10 Ba 0.75000000000000 0.50000000000000 0.74341748344786 137.327 > 3 11 Ba 0.25000000000000 0.68348672845862 0.74486206508052 137.327 > 5 12 Ba 0.75000000000000 0.68348672845862 0.74486206508052 137.327 > 5 13 Ba 0.25000000000000 0.31651327154138 0.74486206508052 137.327 > 1 14 Ba 0.75000000000000 0.31651327154138 0.74486206508052 137.327 > 1 15 Ba 0.00000000000000 0.00000000000000 0.74341748344786 137.327 > 3 16 Ba 0.50000000000000 0.00000000000000 0.74341748344786 137.327 > 3 17 Ba 0.00000000000000 0.18348672845862 0.74486206508052 137.327 > 5 18 Ba 0.50000000000000 0.18348672845862 0.74486206508052 137.327 > 5 19 Ba 0.25000000000000 0.81651327154138 0.24486206508052 137.327 > 1 20 Ba 0.75000000000000 0.81651327154138 0.24486206508052 137.327 > 1 21 Ba 0.00000000000000 0.50000000000000 0.24341748344786 137.327 > 3 22 Ba 0.50000000000000 0.50000000000000 0.24341748344786 137.327 > 3 23 Ba 0.00000000000000 0.68348672845862 0.24486206508052 137.327 > 5 24 Ba 0.50000000000000 0.68348672845862 0.24486206508052 137.327 > 5 25 Ti 0.00000000000000 0.40493995967025 0.73366399140536 47.867 > 25 26 Ti 0.50000000000000 0.40493995967025 0.73366399140536 47.867 > 25 27 Ti 0.25000000000000 0.09506004032975 0.73366399140536 47.867 > 27 28 Ti 0.75000000000000 0.09506004032975 0.73366399140536 47.867 > 27 29 Ti 0.00000000000000 0.90493995967025 0.23366399140537 47.867 > 25 30 Ti 0.50000000000000 0.90493995967025 0.23366399140537 47.867 > 25 31 Ti 0.25000000000000 0.59506004032975 0.23366399140537 47.867 > 27 32 Ti 0.75000000000000 0.59506004032975 0.23366399140537 47.867 > 27 33 Ti 0.25000000000000 0.40493995967025 0.23366399140537 47.867 > 25 34 Ti 0.75000000000000 0.40493995967025 0.23366399140537 47.867 > 25 35 Ti 0.00000000000000 0.09506004032975 0.23366399140537 47.867 > 27 36 Ti 0.50000000000000 0.09506004032975 0.23366399140537 47.867 > 27 37 Ti 0.25000000000000 0.90493995967025 0.73366399140536 47.867 > 25 38 Ti 0.75000000000000 0.90493995967025 0.73366399140536 47.867 > 25 39 Ti 0.00000000000000 0.59506004032975 0.73366399140536 47.867 > 27 40 Ti 0.50000000000000 0.59506004032975 0.73366399140536 47.867 > 27 41 O 0.00000000000000 0.31337163846714 0.75499285124211 15.999 > 41 42 O 0.50000000000000 0.31337163846714 0.75499285124211 15.999 > 41 43 O 0.12672743780135 0.40554870008888 0.00571213529954 15.999 > 43 44 O 0.62672743780135 0.40554870008888 0.00571213529954 15.999 > 43 45 O 0.12327256219865 0.09445129991112 0.00571213529954 15.999 > 45 46 O 0.62327256219865 0.09445129991112 0.00571213529954 15.999 > 45 47 O 0.37672743780135 0.09445129991112 0.00571213529954 15.999 > 47 48 O 0.87672743780135 0.09445129991112 0.00571213529954 15.999 > 47 49 O 0.37327256219865 0.40554870008888 0.00571213529954 15.999 > 49 50 O 0.87327256219865 0.40554870008888 0.00571213529954 15.999 > 49 51 O 0.25000000000000 0.00000000000000 0.75529719989798 15.999 > 51 52 O 0.75000000000000 0.00000000000000 0.75529719989798 15.999 > 51 53 O 0.25000000000000 0.18662836153286 0.75499285124211 15.999 > 53 54 O 0.75000000000000 0.18662836153286 0.75499285124211 15.999 > 53 55 O 0.00000000000000 0.81337163846714 0.25499285124211 15.999 > 41 56 O 0.50000000000000 0.81337163846714 0.25499285124211 15.999 > 41 57 O 0.12672743780135 0.90554870008888 0.50571213529954 15.999 > 43 58 O 0.62672743780135 0.90554870008888 0.50571213529954 15.999 > 43 59 O 0.12327256219865 0.59445129991112 0.50571213529954 15.999 > 45 60 O 0.62327256219865 0.59445129991112 0.50571213529954 15.999 > 45 61 O 0.37672743780135 0.59445129991112 0.50571213529954 15.999 > 47 62 O 0.87672743780135 0.59445129991112 0.50571213529954 15.999 > 47 63 O 0.37327256219865 0.90554870008888 0.50571213529954 15.999 > 49 64 O 0.87327256219865 0.90554870008888 0.50571213529954 15.999 > 49 65 O 0.25000000000000 0.50000000000000 0.25529719989798 15.999 > 51 66 O 0.75000000000000 0.50000000000000 0.25529719989798 15.999 > 51 67 O 0.25000000000000 0.68662836153286 0.25499285124211 15.999 > 53 68 O 0.75000000000000 0.68662836153286 0.25499285124211 15.999 > 53 69 O 0.25000000000000 0.31337163846714 0.25499285124211 15.999 > 41 70 O 0.75000000000000 0.31337163846714 0.25499285124211 15.999 > 41 71 O 0.37672743780135 0.40554870008888 0.50571213529954 15.999 > 43 72 O 0.87672743780135 0.40554870008888 0.50571213529954 15.999 > 43 73 O 0.37327256219865 0.09445129991112 0.50571213529954 15.999 > 45 74 O 0.87327256219865 0.09445129991112 0.50571213529954 15.999 > 45 75 O 0.12672743780135 0.09445129991112 0.50571213529954 15.999 > 47 76 O 0.62672743780135 0.09445129991112 0.50571213529954 15.999 > 47 77 O 0.12327256219865 0.40554870008888 0.50571213529954 15.999 > 49 78 O 0.62327256219865 0.40554870008888 0.50571213529954 15.999 > 49 79 O 0.00000000000000 0.00000000000000 0.25529719989798 15.999 > 51 80 O 0.50000000000000 0.00000000000000 0.25529719989798 15.999 > 51 81 O 0.00000000000000 0.18662836153286 0.25499285124211 15.999 > 53 82 O 0.50000000000000 0.18662836153286 0.25499285124211 15.999 > 53 83 O 0.25000000000000 0.81337163846714 0.75499285124211 15.999 > 41 84 O 0.75000000000000 0.81337163846714 0.75499285124211 15.999 > 41 85 O 0.37672743780135 0.90554870008888 0.00571213529954 15.999 > 43 86 O 0.87672743780135 0.90554870008888 0.00571213529954 15.999 > 43 87 O 0.37327256219865 0.59445129991112 0.00571213529954 15.999 > 45 88 O 0.87327256219865 0.59445129991112 0.00571213529954 15.999 > 45 89 O 0.12672743780135 0.59445129991112 0.00571213529954 15.999 > 47 90 O 0.62672743780135 0.59445129991112 0.00571213529954 15.999 > 47 91 O 0.12327256219865 0.90554870008888 0.00571213529954 15.999 > 49 92 O 0.62327256219865 0.90554870008888 0.00571213529954 15.999 > 49 93 O 0.00000000000000 0.50000000000000 0.75529719989798 15.999 > 51 94 O 0.50000000000000 0.50000000000000 0.75529719989798 15.999 > 51 95 O 0.00000000000000 0.68662836153286 0.75499285124211 15.999 > 53 96 O 0.50000000000000 0.68662836153286 0.75499285124211 15.999 > 53 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.6523704 0.0000000 0.0000000 0.0000000 5.4639112 0.0000000 0.0000000 0.0000000 5.4879980 -------------------------- Born effective charges -------------------------- 1 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 -0.0085192 0.0000000 0.1534610 2.6530512 2 Ba 2.8140003 0.0000000 0.0000000 0.0000000 2.3434788 0.0000000 0.0000000 0.0000000 2.7971548 3 Ba 2.6582971 0.0000000 0.0000000 0.0000000 3.0563978 0.0085192 0.0000000 -0.1534610 2.6530512 4 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 -0.0256254 0.0000000 -0.1399721 6.1466117 5 Ti 6.5823308 0.0000000 0.0000000 0.0000000 5.5828248 0.0256254 0.0000000 0.1399721 6.1466117 6 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 0.0941608 0.0000000 0.2111400 -2.1872752 7 O -3.7109130 -0.0135182 -1.5762343 -0.0062200 -1.6919817 0.0048995 -1.4743633 -0.0186746 -3.4824795 8 O -3.7109130 -0.0135182 1.5762343 -0.0062200 -1.6919817 -0.0048995 1.4743633 0.0186746 -3.4824795 9 O -3.7109130 0.0135182 -1.5762343 0.0062200 -1.6919817 -0.0048995 -1.4743633 0.0186746 -3.4824795 10 O -3.7109130 0.0135182 1.5762343 0.0062200 -1.6919817 0.0048995 1.4743633 -0.0186746 -3.4824795 11 O -2.0903566 0.0000000 0.0000000 0.0000000 -4.7113717 0.0000000 0.0000000 0.0000000 -2.0920123 12 O -2.1806237 0.0000000 0.0000000 0.0000000 -4.0713128 -0.0941608 0.0000000 -0.2111400 -2.1872752 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000008 (yyy) 0.00000008 (yyy) 0.00000008 (yyy) Max drift of fc2: -0.00000000 (yy) -0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 13 13 13 ] 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: 0.75, Number of G-points: 271, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/343) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.356 ( 0.000 0.000 0.000) 0.000 2.370 ( 0.000 0.000 0.000) 0.000 2.937 ( 0.000 0.000 0.000) 0.000 2.944 ( 0.000 0.000 -0.000) 0.000 3.891 ( 0.000 0.000 0.000) 0.000 4.146 ( 0.000 0.000 -0.000) 0.000 4.793 ( 0.000 0.000 0.000) 0.000 5.051 ( 0.000 0.000 0.000) 0.000 5.191 ( 0.000 0.000 0.000) 0.000 5.275 ( 0.000 0.000 0.000) 0.000 5.489 ( 0.000 0.000 0.000) 0.000 5.506 ( 0.000 0.000 -0.000) 0.000 5.909 ( 0.000 0.000 -0.000) 0.000 6.284 ( 0.000 0.000 -0.000) 0.000 6.755 ( 0.000 0.000 -0.000) 0.000 7.255 ( 0.000 0.000 0.000) 0.000 7.765 ( 0.000 0.000 0.000) 0.000 8.058 ( 0.000 0.000 0.000) 0.000 8.190 ( 0.000 0.000 0.000) 0.000 8.424 ( 0.000 0.000 -0.000) 0.000 9.130 ( 0.000 0.000 0.000) 0.000 9.331 ( 0.000 0.000 0.000) 0.000 9.389 ( 0.000 0.000 0.000) 0.000 9.662 ( 0.000 0.000 0.000) 0.000 9.958 ( 0.000 0.000 0.000) 0.000 13.506 ( 0.000 0.000 0.000) 0.000 13.537 ( 0.000 0.000 0.000) 0.000 13.661 ( 0.000 0.000 0.000) 0.000 14.066 ( 0.000 0.000 0.000) 0.000 14.277 ( 0.000 0.000 0.000) 0.000 14.812 ( 0.000 0.000 -0.000) 0.000 17.529 ( 0.000 0.000 0.000) 0.000 18.144 ( 0.000 0.000 -0.000) 0.000 ======================= Grid point 1 (2/343) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.642 ( -20.041 5.589 25.460) 32.880 0.838 ( -19.640 2.955 39.364) 44.091 1.044 ( -47.355 9.093 23.827) 53.786 2.369 ( -0.952 -3.468 2.503) 4.382 2.451 ( -6.077 -3.512 6.106) 9.303 2.892 ( 7.168 2.170 0.757) 7.528 2.968 ( -1.804 1.662 1.379) 2.814 3.881 ( 0.862 -9.249 0.081) 9.290 4.068 ( 10.348 6.950 -1.724) 12.584 5.024 ( -10.668 -1.163 -2.870) 11.108 5.097 ( -2.352 0.045 -4.158) 4.777 5.357 ( -5.567 -0.590 7.878) 9.664 5.398 ( -9.901 -6.576 7.860) 14.249 5.544 ( -4.397 5.787 1.074) 7.346 6.132 ( -39.250 -0.259 -11.816) 40.990 6.321 ( -24.796 -0.389 18.195) 30.758 6.919 ( -9.951 -0.652 11.132) 14.946 7.120 ( 0.988 -2.152 -6.142) 6.583 7.773 ( -5.201 -2.707 5.355) 7.941 8.047 ( -10.910 -1.432 2.402) 11.262 8.258 ( -9.771 -0.834 -0.357) 9.813 8.484 ( -1.181 -1.608 9.800) 10.001 8.962 ( 8.891 -0.021 -13.140) 15.865 9.279 ( 1.414 -0.460 -0.293) 1.516 9.482 ( -7.696 -4.099 4.800) 9.953 9.619 ( -12.451 -42.552 10.862) 45.648 10.208 ( -17.287 0.278 11.896) 20.987 13.159 ( 4.470 9.790 -6.049) 12.346 13.492 ( 1.585 2.483 -1.325) 3.230 13.665 ( -0.168 -0.454 1.054) 1.160 13.725 ( 8.972 11.680 14.001) 20.321 14.255 ( -2.576 -0.156 -5.124) 5.737 14.552 ( -23.963 3.330 -23.930) 34.028 17.160 ( 19.552 -2.915 -24.538) 31.510 18.369 ( -15.704 2.611 15.171) 21.990 19.390 ( -16.232 -7.759 13.213) 22.322 ======================= Grid point 2 (3/343) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -20.632 2.401 23.821) 31.605 1.591 ( -16.287 2.863 33.524) 37.381 1.962 ( -39.735 9.248 18.352) 44.735 2.446 ( -4.308 -6.280 5.934) 9.655 2.627 ( -5.863 -7.112 8.762) 12.717 2.823 ( 7.142 7.071 3.180) 10.541 3.036 ( -3.042 2.560 2.401) 4.645 3.814 ( 3.457 -10.286 -0.179) 10.853 3.936 ( 8.141 6.706 -1.468) 10.649 5.171 ( -5.514 -1.833 8.128) 9.991 5.215 ( -10.799 0.724 5.476) 12.130 5.545 ( -1.607 -1.099 11.972) 12.130 5.703 ( -20.844 -4.835 8.711) 23.103 5.778 ( -20.726 4.472 5.550) 21.917 6.593 ( -25.047 -0.820 11.536) 27.588 6.820 ( -11.745 -2.808 13.730) 18.285 7.006 ( -2.364 -1.449 -6.898) 7.435 7.248 ( -15.623 -1.573 12.213) 19.893 7.893 ( -2.135 -3.593 5.131) 6.618 8.305 ( -15.840 -2.927 7.858) 17.922 8.411 ( -9.002 -0.584 4.308) 9.996 8.679 ( 6.287 -0.573 -5.246) 8.208 8.714 ( -6.821 0.089 9.798) 11.938 9.280 ( -5.475 -0.225 -4.195) 6.901 9.687 ( -13.771 -1.310 7.981) 15.970 9.920 ( -19.852 -8.580 13.421) 25.453 10.642 ( -19.235 0.944 13.941) 23.775 13.023 ( 4.571 -0.805 -6.936) 8.345 13.434 ( 3.200 2.817 -4.285) 6.044 13.701 ( -1.793 -0.510 2.841) 3.398 13.867 ( 2.313 8.906 12.288) 15.351 14.235 ( -6.616 -0.229 -5.928) 8.887 14.570 ( -14.804 2.375 -13.926) 20.462 16.473 ( 22.053 -4.112 -29.297) 36.899 18.918 ( -24.230 3.026 21.530) 32.554 19.776 ( -16.210 -4.972 12.378) 20.993 ======================= Grid point 3 (4/343) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.846 ( -19.113 -2.122 20.577) 28.165 2.194 ( -11.981 2.420 25.399) 28.187 2.539 ( -7.459 -9.902 6.440) 13.970 2.670 ( -16.159 10.309 10.413) 21.813 2.773 ( -7.917 -2.882 8.717) 12.123 2.893 ( -3.803 6.957 7.206) 10.715 3.127 ( -3.764 2.576 2.644) 5.272 3.720 ( 6.447 -4.150 0.383) 7.677 3.846 ( 5.413 1.186 -1.289) 5.689 5.368 ( -5.765 -3.199 10.645) 12.522 5.464 ( -9.391 3.816 8.055) 12.947 5.764 ( -3.165 -0.650 16.399) 16.715 6.084 ( -16.137 -3.865 7.165) 18.074 6.189 ( -22.988 1.029 6.839) 24.006 6.833 ( 2.004 -3.694 4.775) 6.361 7.015 ( -5.328 -2.626 5.216) 7.905 7.201 ( -26.053 1.697 4.389) 26.475 7.675 ( -14.687 -5.265 18.244) 24.006 7.924 ( 2.156 -5.473 3.833) 7.021 8.536 ( -9.559 -0.902 0.635) 9.623 8.588 ( -6.826 1.213 2.213) 7.278 8.720 ( -10.705 -1.230 11.559) 15.803 8.961 ( -7.165 4.891 9.615) 12.951 9.309 ( -8.606 -0.147 -4.929) 9.919 10.056 ( -18.873 0.056 11.611) 22.159 10.426 ( -25.892 1.147 15.964) 30.439 11.101 ( -19.084 2.461 14.412) 24.041 12.848 ( 4.887 -2.596 -8.290) 9.968 13.311 ( 4.747 3.434 -7.222) 9.300 13.781 ( -2.855 -2.797 4.563) 6.066 14.042 ( 0.136 4.902 11.174) 12.203 14.290 ( -9.691 -0.172 -1.822) 9.862 14.589 ( -11.321 3.201 -11.143) 16.205 15.819 ( 15.369 -5.995 -24.785) 29.774 19.558 ( -25.112 1.904 19.936) 32.119 20.101 ( -12.675 -1.627 8.283) 15.228 ======================= Grid point 4 (5/343) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.296 ( -13.420 -6.667 14.279) 20.698 2.597 ( -6.132 -0.606 14.111) 15.398 2.695 ( -7.956 -3.012 9.641) 12.857 2.816 ( 0.846 5.578 5.506) 7.883 2.999 ( -4.185 -2.999 7.365) 8.986 3.205 ( -6.435 4.778 3.859) 8.896 3.255 ( -14.852 6.003 5.856) 17.056 3.627 ( 6.270 0.563 0.167) 6.297 3.751 ( 5.236 -1.162 -2.066) 5.747 5.580 ( -6.703 -2.781 9.270) 11.773 5.700 ( -6.813 3.330 8.452) 11.356 6.033 ( -3.772 -0.539 14.296) 14.795 6.191 ( 1.443 1.438 -2.316) 3.085 6.535 ( -11.840 -2.625 8.351) 14.725 6.973 ( -11.375 -5.735 7.365) 14.714 7.126 ( -7.908 0.943 0.724) 7.996 7.551 ( -9.398 -4.719 6.534) 12.381 7.936 ( -6.745 -4.417 8.528) 11.736 8.114 ( -11.212 -1.925 14.361) 18.321 8.672 ( -6.803 1.292 3.098) 7.586 8.715 ( -9.227 4.700 -1.878) 10.524 8.986 ( -10.037 -1.310 3.781) 10.806 9.213 ( -5.628 5.006 11.249) 13.538 9.411 ( -10.497 -0.440 1.997) 10.694 10.468 ( -17.745 -1.033 12.117) 21.513 11.004 ( -24.821 4.073 15.190) 29.383 11.563 ( -18.026 5.274 14.235) 23.566 12.650 ( 5.230 -3.298 -9.204) 11.088 13.146 ( 5.326 4.554 -8.773) 11.228 13.853 ( -1.974 -9.146 2.493) 9.683 14.153 ( 0.291 1.684 2.524) 3.048 14.442 ( -7.500 0.381 5.721) 9.440 14.607 ( -8.356 6.768 -7.116) 12.895 15.398 ( 3.218 -6.985 -13.965) 15.942 20.110 ( -20.481 0.483 14.341) 25.007 20.331 ( -8.740 0.842 4.523) 9.877 ======================= Grid point 5 (6/343) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -6.317 -6.617 6.448) 11.192 2.812 ( -1.946 3.784 7.327) 8.473 2.883 ( -5.890 -2.051 4.575) 7.735 2.949 ( -4.110 0.659 10.014) 10.845 3.124 ( -3.666 -1.924 4.676) 6.245 3.288 ( -2.246 1.605 1.764) 3.276 3.440 ( 0.843 -0.905 0.714) 1.428 3.583 ( 5.453 4.279 -1.225) 7.039 3.697 ( -5.237 2.386 0.715) 5.799 5.759 ( -4.461 -2.060 6.116) 7.846 5.881 ( -3.400 1.140 5.281) 6.383 6.087 ( 1.724 2.226 -2.429) 3.718 6.256 ( -2.621 1.077 7.293) 7.824 6.731 ( -0.901 -3.722 10.956) 11.606 7.150 ( -6.726 -1.482 -0.185) 6.890 7.288 ( -12.056 -0.548 2.443) 12.313 7.623 ( 1.869 -6.519 4.078) 7.913 8.200 ( -11.788 1.281 7.873) 14.233 8.418 ( -6.717 -1.390 12.590) 14.338 8.771 ( -9.419 3.727 -6.488) 12.029 8.835 ( -5.604 1.557 2.663) 6.397 9.079 ( -4.627 -0.108 -2.274) 5.157 9.438 ( -3.098 2.875 10.122) 10.969 9.597 ( -7.464 -0.933 4.987) 9.025 10.839 ( -13.810 -0.731 10.492) 17.359 11.505 ( -18.567 2.640 13.086) 22.868 11.993 ( -14.012 8.584 11.612) 20.121 12.439 ( 5.119 -4.207 -8.902) 11.097 12.982 ( 4.115 5.391 -7.533) 10.136 13.763 ( 4.608 -15.555 -7.071) 17.697 14.165 ( -0.548 3.928 0.387) 3.985 14.592 ( -3.623 -0.107 4.270) 5.601 14.712 ( -7.256 7.469 1.893) 10.584 15.277 ( -4.448 -6.368 -4.351) 8.903 20.458 ( -6.512 0.735 3.193) 7.290 20.504 ( -11.536 0.525 6.849) 13.426 ======================= Grid point 6 (7/343) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -2.462 -2.400 1.946) 3.951 2.865 ( 0.987 2.494 1.353) 3.004 3.015 ( -3.058 -1.557 3.085) 4.614 3.102 ( -1.986 -0.544 4.625) 5.063 3.217 ( -4.495 -1.001 2.069) 5.048 3.333 ( -0.542 0.988 1.317) 1.733 3.398 ( 1.577 -1.026 -0.731) 2.019 3.461 ( 6.099 1.239 -3.185) 6.991 3.810 ( -3.533 2.188 1.106) 4.300 5.822 ( 0.632 -0.488 0.957) 1.247 5.941 ( -1.312 -0.110 0.849) 1.566 6.105 ( -1.670 1.127 1.054) 2.274 6.344 ( -0.872 0.322 1.987) 2.194 6.842 ( 1.155 -1.843 6.534) 6.886 7.183 ( -2.606 0.646 -2.426) 3.619 7.438 ( -5.308 -0.326 1.077) 5.426 7.615 ( 1.754 -2.788 1.602) 3.663 8.399 ( -4.541 1.076 3.160) 5.636 8.608 ( -1.073 -0.405 7.293) 7.382 8.792 ( -5.485 1.296 -6.083) 8.293 8.923 ( -2.354 0.236 1.154) 2.632 9.091 ( -1.143 0.073 -1.022) 1.535 9.569 ( -0.698 1.369 4.001) 4.285 9.707 ( -2.334 -0.770 1.800) 3.047 11.083 ( -5.709 -0.204 4.641) 7.361 11.879 ( -11.760 1.033 11.008) 16.141 12.137 ( 5.670 1.643 -7.446) 9.502 12.361 ( -3.901 0.815 2.657) 4.790 12.906 ( 0.037 4.116 -1.653) 4.436 13.524 ( 4.984 -8.832 -6.486) 12.038 14.200 ( -0.767 1.493 0.710) 1.822 14.664 ( -1.425 0.092 1.343) 1.960 14.834 ( -2.621 2.911 1.813) 4.316 15.286 ( -2.570 -2.771 -0.666) 3.837 20.528 ( -1.612 0.653 0.485) 1.806 20.688 ( -4.447 -0.153 2.561) 5.134 ======================= Grid point 14 (8/343) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.778 ( -0.000 -0.000 29.535) 29.535 0.939 ( -0.000 -0.000 33.518) 33.518 1.456 ( -0.000 -0.000 48.498) 48.498 2.453 ( -0.000 -0.000 7.398) 7.398 2.509 ( -0.000 -0.000 9.910) 9.910 2.954 ( -0.000 -0.000 1.319) 1.319 2.982 ( -0.000 -0.000 3.264) 3.264 3.922 ( 0.000 0.000 -0.988) 0.988 4.112 ( 0.000 0.000 -2.278) 2.278 4.672 ( -0.000 -0.000 1.243) 1.243 4.957 ( 0.000 0.000 -4.692) 4.692 5.392 ( -0.000 -0.000 5.439) 5.439 5.567 ( -0.000 -0.000 13.981) 13.981 5.581 ( -0.000 -0.000 10.047) 10.047 6.064 ( -0.000 -0.000 29.356) 29.356 6.522 ( -0.000 -0.000 29.794) 29.794 7.060 ( -0.000 -0.000 15.642) 15.642 7.123 ( 0.000 0.000 -1.267) 1.267 7.823 ( -0.000 -0.000 4.858) 4.858 8.053 ( -0.000 -0.000 13.322) 13.322 8.171 ( -0.000 -0.000 0.586) 0.586 8.704 ( -0.000 -0.000 20.332) 20.332 8.750 ( 0.000 0.000 -20.772) 20.772 9.300 ( 0.000 0.000 -1.381) 1.381 9.540 ( -0.000 -0.000 10.120) 10.120 9.716 ( -0.000 -0.000 5.257) 5.257 10.315 ( -0.000 -0.000 19.524) 19.524 13.114 ( 0.000 0.000 -4.990) 4.990 13.466 ( 0.000 0.000 -3.097) 3.097 13.665 ( -0.000 -0.000 0.883) 0.883 14.007 ( -0.000 -0.000 2.249) 2.249 14.100 ( -0.000 -0.000 2.835) 2.835 14.141 ( 0.000 0.000 -8.146) 8.146 16.841 ( 0.000 0.000 -39.204) 39.204 18.561 ( -0.000 -0.000 27.884) 27.884 19.556 ( -0.000 -0.000 21.160) 21.160 ======================= Grid point 15 (9/343) ======================= q-point: ( 0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -14.475 -4.120 27.767) 31.583 1.503 ( -29.904 10.361 22.529) 38.848 2.096 ( -5.997 1.895 37.614) 38.136 2.553 ( 1.017 -3.305 10.299) 10.864 2.705 ( -5.295 -2.856 11.360) 12.855 2.947 ( 5.579 2.607 3.873) 7.275 3.047 ( -1.206 1.303 4.343) 4.692 3.872 ( 1.662 -7.198 -0.835) 7.435 4.015 ( 8.871 5.415 -1.792) 10.547 4.980 ( -26.404 -1.970 7.310) 27.468 5.106 ( -16.205 1.630 6.206) 17.429 5.528 ( -11.448 -0.682 4.123) 12.187 5.757 ( -0.298 -4.527 17.910) 18.476 5.795 ( 0.463 4.471 18.704) 19.237 6.533 ( -14.115 0.726 19.962) 24.459 6.931 ( -6.032 -1.074 17.633) 18.667 7.048 ( 6.079 -1.870 -0.632) 6.391 7.295 ( -6.962 -0.017 14.793) 16.350 7.951 ( -3.992 -0.515 8.291) 9.216 8.267 ( -5.201 -4.367 7.077) 9.808 8.290 ( -7.978 1.628 6.014) 10.123 8.530 ( -7.261 -0.232 -10.650) 12.892 8.974 ( 4.355 -0.457 21.148) 21.596 9.269 ( 3.022 -0.009 1.653) 3.444 9.723 ( -4.532 0.049 13.968) 14.685 9.919 ( -11.510 -1.903 15.080) 19.066 10.660 ( -10.351 0.178 18.860) 21.515 12.994 ( 4.018 -1.579 -7.502) 8.656 13.394 ( 2.694 2.632 -6.024) 7.105 13.709 ( -2.229 -0.003 3.353) 4.026 14.009 ( 0.406 -1.957 4.499) 4.923 14.076 ( -3.558 4.363 -3.911) 6.855 14.256 ( -10.965 1.643 -0.995) 11.132 16.220 ( 8.880 -2.053 -39.075) 40.124 19.055 ( -9.713 1.075 32.208) 33.658 19.869 ( -4.799 -1.810 18.739) 19.428 ======================= Grid point 16 (10/343) ======================= q-point: ( 0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( -13.188 -3.693 23.846) 27.499 2.192 ( -26.626 7.572 15.228) 31.594 2.607 ( -5.413 -1.899 19.273) 20.108 2.683 ( -2.753 0.505 13.429) 13.718 2.881 ( -1.195 -5.440 9.427) 10.949 2.973 ( 2.908 7.262 7.825) 11.065 3.134 ( -1.695 1.139 4.708) 5.132 3.807 ( 2.845 -7.488 -0.613) 8.033 3.904 ( 7.737 5.386 -0.954) 9.475 5.396 ( -12.037 -2.439 9.916) 15.785 5.440 ( -15.190 1.526 11.799) 19.294 5.829 ( -19.833 -0.030 6.807) 20.969 6.024 ( -7.881 -4.717 14.957) 17.552 6.093 ( -5.008 3.319 16.934) 17.968 6.777 ( -3.274 -0.117 -4.226) 5.347 7.092 ( -1.515 -3.745 8.176) 9.120 7.155 ( -9.462 2.217 14.238) 17.238 7.673 ( -17.506 -1.931 12.306) 21.485 8.038 ( 2.449 -5.841 2.431) 6.784 8.330 ( -11.060 0.868 -2.606) 11.396 8.497 ( -8.034 0.165 7.576) 11.044 8.739 ( -11.578 -2.307 10.894) 16.064 9.148 ( 4.660 3.863 15.441) 16.585 9.301 ( 1.450 0.061 9.115) 9.229 10.067 ( -11.056 0.008 19.120) 22.086 10.376 ( -17.345 2.543 21.507) 27.747 11.079 ( -14.541 1.042 17.233) 22.572 12.811 ( 4.959 -2.945 -8.858) 10.571 13.250 ( 4.518 3.487 -9.201) 10.828 13.792 ( -2.969 -1.783 2.997) 4.581 14.064 ( -6.504 -4.905 -0.011) 8.147 14.168 ( -7.387 6.836 1.052) 10.119 14.398 ( -6.067 2.525 4.543) 7.989 15.613 ( 7.090 -4.140 -30.061) 31.162 19.640 ( -12.542 0.791 29.552) 32.113 20.153 ( -4.057 -0.646 14.739) 15.301 ======================= Grid point 17 (11/343) ======================= q-point: ( 0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -11.137 -7.872 17.170) 21.927 2.671 ( -12.789 3.215 11.633) 17.585 2.730 ( -1.935 -5.572 7.435) 9.491 2.915 ( 2.347 7.877 7.625) 11.211 3.054 ( -3.882 -0.930 7.742) 8.711 3.141 ( -8.704 6.106 11.312) 15.524 3.224 ( -1.818 0.466 4.466) 4.845 3.719 ( 5.981 -3.316 -0.504) 6.858 3.806 ( 6.830 2.108 -1.265) 7.259 5.625 ( -6.467 -1.863 8.856) 11.123 5.766 ( -6.333 0.459 13.218) 14.664 6.128 ( -6.338 -0.096 7.590) 9.889 6.187 ( 0.998 -0.496 0.301) 1.154 6.400 ( -16.525 0.533 5.854) 17.539 6.859 ( -13.787 -1.594 3.589) 14.335 7.192 ( 1.943 -2.033 11.172) 11.520 7.494 ( -14.228 -0.580 4.161) 14.836 7.984 ( -13.208 -5.616 1.278) 14.409 8.060 ( -7.605 -1.165 5.558) 9.491 8.484 ( -10.612 -0.974 1.046) 10.708 8.686 ( -1.250 2.824 10.142) 10.602 8.971 ( -6.435 -1.299 5.824) 8.776 9.339 ( -1.201 5.092 13.730) 14.693 9.505 ( -1.037 0.001 19.834) 19.861 10.489 ( -11.847 -0.773 19.365) 22.715 10.935 ( -18.606 4.411 21.457) 28.741 11.519 ( -15.984 2.962 15.836) 22.695 12.607 ( 5.021 -3.891 -9.233) 11.207 13.063 ( 4.640 4.668 -10.772) 12.624 13.833 ( -3.867 -8.384 -2.385) 9.536 14.087 ( -3.109 2.688 -6.251) 7.481 14.356 ( -10.707 -0.511 5.495) 12.045 14.543 ( -2.254 5.798 5.357) 8.209 15.262 ( -1.316 -5.476 -11.271) 12.600 20.164 ( -10.333 0.018 23.773) 25.921 20.370 ( -1.570 0.865 11.615) 11.752 ======================= Grid point 18 (12/343) ======================= q-point: ( 0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( -2.336 -9.855 9.100) 13.615 2.851 ( -7.919 -5.020 6.485) 11.400 2.907 ( 1.435 5.012 6.103) 8.027 3.028 ( -1.941 4.520 8.056) 9.439 3.145 ( -1.371 -0.897 2.888) 3.320 3.304 ( -1.178 0.010 4.080) 4.247 3.421 ( -8.556 4.562 4.355) 10.629 3.620 ( 5.994 1.706 -0.925) 6.300 3.704 ( 5.830 1.029 -0.321) 5.929 5.805 ( -4.816 -2.619 7.221) 9.066 5.966 ( 1.653 -1.401 8.111) 8.395 6.061 ( 2.099 0.882 -3.148) 3.885 6.300 ( -2.195 3.454 4.717) 6.245 6.621 ( -14.031 -1.234 -5.172) 15.005 7.116 ( -14.051 -2.008 3.395) 14.594 7.326 ( 4.865 -0.412 15.224) 15.988 7.600 ( -7.308 -3.122 -6.079) 10.005 8.176 ( -15.718 -3.238 0.056) 16.048 8.275 ( -13.441 1.800 2.054) 13.715 8.618 ( -7.064 -2.175 1.626) 7.568 8.835 ( 2.089 1.864 11.785) 12.113 9.096 ( -1.653 0.105 6.017) 6.241 9.551 ( -0.977 4.198 11.001) 11.816 9.783 ( 3.362 -0.586 21.204) 21.477 10.881 ( -8.789 -0.887 17.094) 19.242 11.460 ( -16.627 3.179 17.808) 24.570 11.943 ( -13.876 5.601 12.987) 19.813 12.403 ( 4.486 -5.180 -8.351) 10.802 12.890 ( 2.555 6.319 -9.431) 11.636 13.712 ( 0.696 -13.851 -12.420) 18.617 14.072 ( -3.952 8.229 -4.374) 10.123 14.510 ( -6.846 -3.694 -0.614) 7.803 14.695 ( -6.085 4.491 7.195) 10.439 15.266 ( -3.085 -3.794 5.595) 7.431 20.513 ( 0.679 0.734 10.581) 10.628 20.556 ( -4.488 0.226 16.812) 17.402 ======================= Grid point 19 (13/343) ======================= q-point: ( 0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( 0.785 -5.945 4.271) 7.362 2.926 ( 4.589 2.731 2.735) 6.000 2.999 ( -4.602 -2.826 1.932) 5.735 3.129 ( 0.439 1.555 0.440) 1.674 3.198 ( -3.265 -2.221 3.429) 5.229 3.361 ( 0.112 -0.107 3.107) 3.111 3.450 ( 4.547 -2.362 0.258) 5.130 3.522 ( 7.529 2.852 -1.346) 8.163 3.743 ( -5.056 6.623 1.239) 8.424 5.881 ( 3.754 -3.265 -0.108) 4.977 5.932 ( -2.372 -1.645 1.588) 3.295 6.129 ( 0.288 0.859 5.404) 5.479 6.367 ( 0.934 3.827 2.157) 4.491 6.636 ( -9.058 0.029 -14.129) 16.784 7.271 ( -7.385 0.023 -1.712) 7.581 7.448 ( 5.420 0.549 12.270) 13.425 7.578 ( -3.965 -1.713 -6.120) 7.491 8.318 ( -14.746 -3.350 -8.096) 17.152 8.467 ( -12.070 -0.001 -2.058) 12.244 8.702 ( -1.382 -1.483 3.519) 4.061 8.965 ( 2.823 -0.476 11.677) 12.023 9.192 ( 2.281 0.569 8.534) 8.852 9.662 ( 5.126 3.067 7.154) 9.320 9.950 ( 11.198 -0.372 17.860) 21.083 11.145 ( -1.486 -0.860 10.479) 10.619 11.877 ( -12.330 1.094 13.423) 18.260 12.114 ( 4.467 -0.276 -5.368) 6.988 12.340 ( -5.477 -1.315 3.667) 6.720 12.830 ( -3.488 7.317 -2.706) 8.545 13.472 ( 0.907 -8.046 -11.230) 13.844 14.108 ( -4.862 5.915 -4.024) 8.650 14.541 ( -7.778 -2.259 -7.151) 10.805 14.871 ( -2.313 -2.154 8.064) 8.661 15.376 ( 2.357 0.219 9.047) 9.352 20.607 ( 4.101 0.504 8.650) 9.586 20.777 ( 2.052 -0.091 12.260) 12.431 ======================= Grid point 20 (14/343) ======================= q-point: (-0.46 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( 4.061 -1.558 0.706) 4.406 2.887 ( 4.212 -1.420 0.078) 4.446 2.983 ( 2.066 0.322 -5.438) 5.826 3.073 ( 3.843 1.888 -4.286) 6.059 3.240 ( 2.182 -2.022 -1.102) 3.173 3.362 ( 2.860 -2.850 0.966) 4.151 3.409 ( -0.308 -0.968 1.262) 1.620 3.467 ( 1.848 1.651 2.389) 3.442 3.814 ( -0.672 4.563 -0.401) 4.629 5.838 ( 0.756 -3.211 0.501) 3.337 5.949 ( 1.438 -1.387 -0.306) 2.022 6.151 ( 4.170 -0.298 2.157) 4.705 6.343 ( 4.659 2.539 -3.213) 6.203 6.541 ( -8.604 3.013 -15.477) 17.962 7.283 ( -2.382 2.835 -6.452) 7.439 7.494 ( 4.122 1.288 2.953) 5.232 7.535 ( 0.350 -0.181 -3.154) 3.178 8.325 ( -6.533 -4.407 -10.734) 13.316 8.516 ( -8.235 -2.827 -9.504) 12.890 8.737 ( 5.261 0.051 4.740) 7.082 9.053 ( 4.200 -1.876 8.161) 9.368 9.266 ( 5.893 0.703 10.227) 11.824 9.631 ( 11.340 0.270 4.522) 12.211 9.961 ( 17.609 0.857 12.810) 21.792 11.165 ( 9.024 -0.943 0.478) 9.086 11.906 ( 9.995 -2.369 -7.671) 12.820 12.165 ( -7.107 -1.296 8.560) 11.201 12.376 ( 1.771 -3.383 -1.844) 4.240 12.901 ( -4.427 -0.183 1.017) 4.546 13.448 ( -8.771 8.127 0.975) 11.997 14.124 ( -3.807 2.978 -4.697) 6.740 14.512 ( -7.295 -1.331 -11.130) 13.374 14.942 ( 3.812 -7.044 6.409) 10.258 15.432 ( 7.646 4.341 8.141) 11.983 20.640 ( 7.156 -0.758 7.520) 10.409 20.825 ( 10.488 0.259 7.211) 12.731 ======================= Grid point 21 (15/343) ======================= q-point: (-0.38 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( 9.579 2.722 -3.211) 10.463 2.775 ( 5.833 -2.775 -8.868) 10.971 2.842 ( 3.758 -0.807 -6.361) 7.432 2.943 ( 7.268 1.949 -3.848) 8.452 3.119 ( 6.580 0.873 -5.003) 8.312 3.330 ( 3.077 -3.364 0.821) 4.633 3.424 ( 0.115 1.289 0.284) 1.325 3.525 ( -5.761 -2.710 0.281) 6.373 3.782 ( 5.889 1.640 -0.020) 6.113 5.789 ( 7.530 -1.281 -1.286) 7.746 5.885 ( 3.577 -2.142 -3.390) 5.374 6.101 ( 2.664 -1.046 -2.036) 3.512 6.185 ( 3.044 0.269 -8.422) 8.959 6.503 ( -5.885 5.557 -8.205) 11.525 7.180 ( 4.017 5.360 -10.348) 12.326 7.427 ( 4.970 0.868 -2.669) 5.707 7.490 ( 0.478 2.256 -3.480) 4.175 8.160 ( 3.151 -2.504 -14.936) 15.468 8.441 ( 0.185 -3.745 -7.456) 8.346 8.661 ( 9.636 0.490 -0.975) 9.697 9.037 ( 6.861 -3.010 0.940) 7.552 9.298 ( 10.768 1.620 8.768) 13.981 9.509 ( 14.780 -4.188 6.535) 16.694 9.839 ( 20.715 1.458 7.891) 22.215 10.942 ( 16.254 -0.662 -5.902) 17.305 11.615 ( 16.701 -2.700 -7.758) 18.612 12.063 ( 12.704 -10.746 -10.257) 19.547 12.466 ( -6.305 4.008 8.491) 11.310 13.015 ( -6.767 -3.724 5.751) 9.630 13.660 ( -9.290 13.833 0.380) 16.667 14.114 ( -3.323 -1.528 -4.450) 5.761 14.451 ( -5.340 3.150 -9.132) 11.038 14.909 ( 7.705 -10.482 6.200) 14.411 15.440 ( 8.680 6.812 7.775) 13.498 20.603 ( 11.282 -1.333 5.329) 12.548 20.685 ( 19.248 -0.053 2.001) 19.352 ======================= Grid point 22 (16/343) ======================= q-point: (-0.31 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( 16.617 4.400 -8.984) 19.395 2.489 ( 9.165 -2.262 -16.020) 18.595 2.670 ( 7.421 0.028 -7.008) 10.207 2.819 ( 5.658 -1.459 -2.021) 6.182 2.964 ( 6.469 4.388 -5.858) 9.768 3.267 ( 4.905 -4.356 -0.020) 6.560 3.383 ( 7.331 -1.694 -2.973) 8.090 3.561 ( -3.229 -3.174 -1.828) 4.882 3.729 ( 1.087 1.472 1.493) 2.361 5.597 ( 12.526 0.815 -5.315) 13.631 5.729 ( 7.808 -3.698 -5.299) 10.135 5.889 ( 6.355 1.859 -15.014) 16.409 6.206 ( -3.072 -1.778 3.762) 5.172 6.483 ( -0.207 6.096 -5.577) 8.265 6.923 ( 9.874 6.704 -15.288) 19.395 7.288 ( 12.952 0.592 -1.661) 13.071 7.474 ( -6.883 2.270 -5.816) 9.292 7.857 ( 6.709 2.848 -17.310) 18.782 8.272 ( 19.586 -2.468 3.016) 19.969 8.498 ( 0.710 -0.008 -9.988) 10.013 8.855 ( 10.587 -2.334 -8.387) 13.707 9.170 ( 19.134 2.979 1.317) 19.409 9.401 ( 17.437 -7.407 10.020) 21.431 9.672 ( 17.675 0.020 8.164) 19.469 10.596 ( 19.766 0.266 -8.028) 21.335 11.210 ( 25.663 -4.471 -8.056) 27.267 11.652 ( 18.205 -7.145 -12.527) 23.225 12.682 ( -6.018 3.620 8.413) 10.959 13.183 ( -6.846 -3.744 6.495) 10.152 13.740 ( -4.047 8.334 -6.722) 11.446 14.042 ( -2.629 -7.060 -10.406) 12.847 14.467 ( 1.581 9.504 1.541) 9.757 14.872 ( 6.133 -10.058 9.394) 15.067 15.511 ( -0.039 7.468 10.251) 12.682 20.331 ( 28.787 -0.818 -3.770) 29.045 20.486 ( 15.161 -0.942 2.291) 15.362 ======================= Grid point 23 (17/343) ======================= q-point: (-0.23 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 23.544 1.931 -12.889) 26.911 2.051 ( 15.898 -5.300 -21.505) 27.264 2.521 ( 5.590 7.406 -3.617) 9.959 2.694 ( 6.534 0.837 -4.248) 7.838 2.815 ( 7.153 1.402 -4.945) 8.808 3.066 ( 24.135 -9.582 -4.627) 26.376 3.183 ( 6.060 -4.149 -0.905) 7.400 3.606 ( -6.762 1.549 -1.223) 7.044 3.783 ( -5.137 0.726 0.167) 5.191 5.345 ( 12.260 2.593 -6.896) 14.303 5.517 ( 10.620 -3.158 -6.766) 12.982 5.622 ( 4.751 0.312 -10.881) 11.877 6.173 ( 12.740 3.546 -5.335) 14.260 6.340 ( 13.626 2.678 -6.800) 15.462 6.668 ( -0.194 6.035 -10.140) 11.802 7.056 ( 11.550 2.025 -5.812) 13.088 7.486 ( 0.236 -1.829 -3.685) 4.121 7.603 ( 7.490 7.039 -7.415) 12.674 8.007 ( 25.206 1.690 7.248) 26.282 8.421 ( -8.297 -0.689 -8.240) 11.714 8.552 ( 9.988 -0.803 -12.454) 15.985 8.855 ( 23.835 6.731 -6.539) 25.616 9.219 ( 21.456 -8.643 7.505) 24.318 9.589 ( 14.425 -0.443 9.660) 17.367 10.213 ( 20.947 0.797 -7.295) 22.195 10.675 ( 33.460 -4.396 -8.377) 34.772 11.210 ( 20.316 -2.959 -11.013) 23.298 12.878 ( -5.160 3.403 7.302) 9.567 13.335 ( -5.618 -2.417 4.691) 7.708 13.699 ( -2.182 2.633 -7.329) 8.087 13.891 ( -1.720 -10.091 -10.232) 14.474 14.449 ( 8.504 4.269 3.175) 10.031 14.902 ( 8.056 -3.378 10.816) 13.903 15.829 ( -17.832 7.054 14.675) 24.147 19.796 ( 35.922 -2.755 -8.377) 36.989 20.259 ( 19.820 1.813 -1.107) 19.933 ======================= Grid point 24 (18/343) ======================= q-point: (-0.15 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 28.312 -1.573 -11.163) 30.473 1.465 ( 23.690 -6.529 -20.599) 32.065 2.396 ( 34.447 -0.391 -4.339) 34.721 2.463 ( 12.964 1.244 -3.095) 13.387 2.572 ( 5.406 9.199 -5.377) 11.948 2.767 ( 1.662 -10.138 -2.160) 10.498 3.083 ( 4.899 -4.266 -0.714) 6.535 3.708 ( -7.284 5.897 -0.341) 9.378 3.865 ( -7.036 -1.991 0.133) 7.314 5.123 ( 8.590 3.414 -5.782) 10.903 5.267 ( 10.002 -0.608 -5.828) 11.592 5.475 ( 3.290 -1.850 -3.975) 5.482 5.821 ( 20.493 6.033 -9.406) 23.342 5.975 ( 21.126 -1.875 -7.500) 22.496 6.641 ( 0.266 5.316 -2.841) 6.033 6.854 ( 11.048 3.603 -5.022) 12.659 7.337 ( 15.594 3.829 0.747) 16.075 7.408 ( 21.070 -0.711 3.226) 21.327 7.900 ( 5.604 1.320 5.421) 7.908 8.303 ( 3.640 2.719 -9.409) 10.448 8.432 ( 20.476 7.272 -9.200) 23.597 8.530 ( -14.431 -0.127 -1.984) 14.567 8.961 ( 25.163 -1.519 3.120) 25.402 9.500 ( 14.178 0.836 5.347) 15.176 9.860 ( 20.028 0.057 -3.218) 20.285 10.098 ( 32.959 3.182 -7.063) 33.857 10.789 ( 22.182 -0.856 -7.168) 23.327 13.044 ( -4.701 3.182 5.534) 7.928 13.436 ( -3.748 -1.260 1.455) 4.213 13.638 ( -2.395 -2.806 -5.765) 6.844 13.763 ( -0.813 -12.278 -4.803) 13.209 14.389 ( 7.240 0.908 2.890) 7.848 14.911 ( 9.045 -0.584 9.152) 12.881 16.382 ( -29.579 5.850 13.023) 32.844 19.156 ( 37.438 -4.404 -8.289) 38.597 19.939 ( 24.557 6.042 -3.187) 25.490 ======================= Grid point 25 (19/343) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( 31.127 -4.478 0.000) 31.448 0.889 ( 30.195 -6.630 0.000) 30.914 1.653 ( 53.651 -12.053 0.000) 54.988 2.381 ( 5.353 7.260 -0.000) 9.020 2.480 ( 7.617 8.029 -0.000) 11.067 2.782 ( -8.564 -6.434 0.000) 10.712 3.005 ( 3.538 -3.306 0.000) 4.843 3.819 ( -3.615 12.175 -0.000) 12.700 3.965 ( -10.100 -8.080 0.000) 12.935 5.007 ( 2.851 2.608 -0.000) 3.864 5.131 ( 3.332 -0.567 0.000) 3.380 5.385 ( 5.531 -1.377 0.000) 5.700 5.511 ( 17.109 7.185 -0.000) 18.556 5.666 ( 13.416 -4.583 0.000) 14.177 6.555 ( 12.553 2.807 -0.000) 12.863 6.598 ( 23.582 1.678 -0.000) 23.642 7.073 ( 22.264 1.725 -0.000) 22.331 7.245 ( 7.580 0.873 -0.000) 7.630 7.895 ( 9.302 0.787 -0.000) 9.336 8.087 ( 11.385 9.693 -0.000) 14.953 8.269 ( -2.407 0.673 -0.000) 2.499 8.625 ( 24.838 3.339 -0.000) 25.062 8.794 ( -21.396 0.082 -0.000) 21.396 9.366 ( 11.077 2.863 -0.000) 11.441 9.593 ( 18.668 10.946 -0.000) 21.641 9.688 ( 24.362 18.789 -0.000) 30.766 10.423 ( 23.284 -0.249 0.000) 23.285 13.166 ( -5.915 -1.335 0.000) 6.064 13.470 ( -2.001 -1.823 0.000) 2.707 13.601 ( -2.205 -10.542 0.000) 10.770 13.696 ( 0.487 -8.501 0.000) 8.515 14.335 ( 4.391 -0.004 0.000) 4.391 14.891 ( 5.623 0.210 -0.000) 5.626 16.936 ( -32.257 4.688 -0.000) 32.595 18.603 ( 30.357 -4.801 0.000) 30.735 19.585 ( 26.464 10.072 -0.000) 28.316 ======================= Grid point 28 (20/343) ======================= q-point: ( 0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -0.000 -0.000 25.639) 25.639 1.785 ( -0.000 -0.000 28.321) 28.321 2.519 ( -0.000 -0.000 28.957) 28.957 2.741 ( -0.000 -0.000 12.824) 12.824 2.819 ( -0.000 -0.000 11.066) 11.066 3.047 ( -0.000 -0.000 5.860) 5.860 3.106 ( -0.000 -0.000 5.681) 5.681 3.875 ( 0.000 0.000 -2.181) 2.181 4.039 ( 0.000 0.000 -2.747) 2.747 4.999 ( -0.000 -0.000 21.450) 21.450 5.107 ( -0.000 -0.000 14.596) 14.596 5.527 ( -0.000 -0.000 5.544) 5.544 6.019 ( -0.000 -0.000 17.107) 17.107 6.077 ( -0.000 -0.000 21.562) 21.562 6.656 ( -0.000 -0.000 10.004) 10.004 7.061 ( 0.000 0.000 -3.271) 3.271 7.090 ( -0.000 -0.000 9.494) 9.494 7.432 ( -0.000 -0.000 14.018) 14.018 7.999 ( 0.000 0.000 -1.972) 1.972 8.294 ( 0.000 0.000 -0.513) 0.513 8.350 ( -0.000 -0.000 12.402) 12.402 8.510 ( -0.000 -0.000 18.436) 18.436 9.275 ( -0.000 -0.000 15.940) 15.940 9.350 ( -0.000 -0.000 7.527) 7.527 9.884 ( -0.000 -0.000 14.867) 14.867 10.120 ( -0.000 -0.000 27.127) 27.127 10.856 ( -0.000 -0.000 19.661) 19.661 12.909 ( 0.000 0.000 -9.700) 9.700 13.310 ( 0.000 0.000 -9.024) 9.024 13.764 ( -0.000 -0.000 7.608) 7.608 13.957 ( 0.000 0.000 -3.825) 3.825 14.075 ( -0.000 -0.000 1.567) 1.567 14.251 ( -0.000 -0.000 8.950) 8.950 15.740 ( 0.000 0.000 -38.351) 38.351 19.462 ( -0.000 -0.000 35.716) 35.716 20.108 ( -0.000 -0.000 19.213) 19.213 ======================= Grid point 29 (21/343) ======================= q-point: ( 0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -19.090 -0.397 18.085) 26.299 2.190 ( -6.184 4.190 23.702) 24.851 2.840 ( 0.928 -3.406 15.894) 16.282 2.871 ( 2.397 1.046 13.396) 13.649 2.988 ( -3.044 -1.967 8.843) 9.556 3.118 ( 3.343 2.139 8.592) 9.465 3.193 ( -0.301 1.183 6.172) 6.291 3.835 ( 0.573 -4.760 -1.557) 5.041 3.971 ( 5.642 3.752 -1.469) 6.933 5.414 ( -12.030 -3.293 19.788) 23.391 5.437 ( -11.062 2.958 18.257) 21.551 5.677 ( -11.779 0.271 6.907) 13.657 6.207 ( -0.411 -2.576 10.636) 10.951 6.318 ( 4.092 1.456 15.525) 16.121 6.707 ( -0.404 0.394 -3.649) 3.693 7.087 ( -9.559 -2.533 1.363) 9.983 7.189 ( -4.130 0.773 3.139) 5.245 7.684 ( -4.602 0.087 16.276) 16.914 7.894 ( -6.304 -0.136 -14.285) 15.615 8.437 ( 2.854 -0.831 19.501) 19.726 8.556 ( -4.969 -0.056 11.607) 12.626 8.788 ( -6.736 -4.790 13.803) 16.089 9.411 ( 7.203 4.826 13.125) 15.730 9.508 ( 0.795 0.222 18.028) 18.047 10.178 ( -10.144 0.054 17.613) 20.326 10.577 ( -5.293 2.075 31.645) 32.151 11.168 ( -7.481 0.077 18.235) 19.711 12.747 ( 2.747 -2.182 -10.140) 10.730 13.149 ( 2.810 2.287 -12.091) 12.622 13.840 ( 2.860 -2.723 4.181) 5.751 14.018 ( -5.988 -6.954 3.556) 9.842 14.079 ( -2.554 9.537 0.406) 9.882 14.436 ( -4.289 0.556 10.886) 11.714 15.266 ( -0.302 -1.964 -27.780) 27.851 19.967 ( -3.748 0.125 33.435) 33.645 20.360 ( 0.394 0.027 17.845) 17.849 ======================= Grid point 30 (22/343) ======================= q-point: ( 0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( -15.614 -6.858 12.891) 21.378 2.613 ( -11.552 9.708 15.992) 21.987 2.902 ( 5.443 -7.791 8.772) 12.934 3.035 ( 2.574 5.388 8.602) 10.472 3.114 ( -1.476 -0.228 6.174) 6.352 3.224 ( 0.352 2.629 9.056) 9.436 3.283 ( -0.366 0.015 6.047) 6.058 3.780 ( 2.313 -5.851 -1.046) 6.378 3.886 ( 7.319 4.561 -0.277) 8.628 5.676 ( -4.551 -0.619 9.335) 10.403 5.846 ( -8.740 -0.197 14.888) 17.265 6.017 ( -17.863 -0.004 6.716) 19.084 6.272 ( 4.492 -5.277 0.724) 6.968 6.350 ( 1.177 4.836 0.976) 5.072 6.770 ( -9.564 0.671 4.558) 10.616 7.242 ( -12.330 -6.583 -0.442) 13.984 7.321 ( -10.527 1.993 -1.191) 10.781 7.850 ( -13.144 0.032 -10.623) 16.900 7.944 ( -1.201 0.748 15.089) 15.156 8.662 ( 4.334 -3.632 21.068) 21.814 8.775 ( -6.145 0.303 8.783) 10.724 9.006 ( -4.940 -4.020 10.178) 12.007 9.536 ( 5.510 8.187 15.676) 18.523 9.815 ( -0.390 -0.162 25.778) 25.781 10.592 ( -13.048 0.463 18.643) 22.760 11.085 ( -7.249 3.012 28.383) 29.448 11.540 ( -12.009 1.053 16.439) 20.385 12.559 ( 3.752 -4.190 -9.117) 10.712 12.942 ( 3.518 4.418 -13.187) 14.345 13.797 ( 0.685 -12.366 -5.072) 13.384 13.967 ( 1.950 9.798 -5.223) 11.273 14.352 ( -10.491 -1.904 13.357) 17.091 14.545 ( 1.202 2.906 -0.279) 3.157 15.110 ( -9.643 -2.841 -1.904) 10.232 20.438 ( -3.071 -0.245 28.488) 28.654 20.573 ( 2.727 0.760 16.480) 16.722 ======================= Grid point 31 (23/343) ======================= q-point: ( 0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( -7.977 -10.404 9.305) 16.076 2.893 ( 1.426 -4.081 5.943) 7.349 2.964 ( -4.902 4.054 8.572) 10.674 3.105 ( 3.188 6.626 5.524) 9.197 3.184 ( 1.344 3.093 3.856) 5.123 3.352 ( -3.156 2.330 4.480) 5.955 3.367 ( -1.795 0.176 4.953) 5.271 3.696 ( 5.232 -4.646 -0.962) 7.063 3.797 ( 8.029 3.780 0.511) 8.890 5.839 ( -4.597 -1.392 6.150) 7.803 5.979 ( 0.565 1.186 -5.454) 5.610 6.171 ( 0.466 -5.241 6.270) 8.185 6.280 ( -4.359 2.113 2.660) 5.527 6.424 ( -5.925 2.138 0.143) 6.301 6.976 ( -12.649 0.942 -0.280) 12.687 7.332 ( -10.415 -4.041 -6.421) 12.885 7.434 ( -12.432 -0.850 -4.583) 13.277 7.942 ( -19.165 -0.478 -10.173) 21.703 8.135 ( 3.255 1.062 15.096) 15.479 8.852 ( 5.679 -4.490 19.194) 20.514 8.955 ( -4.195 -0.306 7.721) 8.792 9.197 ( -1.542 -0.181 12.792) 12.886 9.735 ( 3.823 6.718 17.533) 19.161 10.154 ( 3.033 -1.117 25.259) 25.465 11.002 ( -10.035 0.578 17.021) 19.767 11.544 ( -8.356 2.339 21.895) 23.551 11.929 ( -12.659 3.049 13.693) 18.895 12.375 ( 3.722 -6.472 -7.203) 10.374 12.754 ( 1.672 7.092 -11.250) 13.403 13.580 ( 1.720 -11.034 -15.373) 19.001 13.958 ( -1.014 7.866 -1.460) 8.064 14.434 ( -0.191 -3.064 -4.923) 5.802 14.719 ( -8.679 1.089 13.325) 15.939 15.311 ( -7.956 -1.373 9.733) 12.646 20.735 ( 5.322 0.776 15.547) 16.451 20.809 ( 0.458 -0.165 23.040) 23.045 ======================= Grid point 32 (24/343) ======================= q-point: ( 0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.809 ( 4.119 -8.597 5.564) 11.038 2.959 ( -4.211 -5.579 1.829) 7.225 3.048 ( 5.154 3.909 3.662) 7.434 3.130 ( 1.982 2.218 -0.357) 2.996 3.243 ( 0.683 0.792 4.838) 4.950 3.416 ( 0.635 -0.333 3.378) 3.454 3.479 ( -3.291 3.791 1.302) 5.187 3.588 ( 6.296 -0.984 -0.863) 6.431 3.729 ( 4.673 5.085 1.261) 7.020 5.862 ( -0.023 -2.493 -5.981) 6.479 5.956 ( -2.612 -1.515 3.404) 4.551 6.229 ( -1.151 0.618 1.283) 1.831 6.327 ( -2.507 -0.269 -3.237) 4.103 6.464 ( 3.368 3.085 1.269) 4.740 7.068 ( -10.206 1.508 -9.315) 13.900 7.364 ( -8.839 -2.210 -5.880) 10.844 7.507 ( -11.295 0.815 -9.104) 14.530 8.047 ( -19.300 -2.455 -12.798) 23.288 8.272 ( 4.445 -1.423 12.406) 13.255 8.999 ( 7.092 -2.897 17.306) 18.926 9.095 ( -1.360 -1.352 7.381) 7.626 9.380 ( 3.415 1.309 15.043) 15.481 9.912 ( 8.444 3.831 16.844) 19.228 10.373 ( 10.676 -1.254 20.657) 23.287 11.285 ( -1.673 -0.099 11.106) 11.231 11.908 ( -8.660 1.141 13.219) 15.844 12.120 ( 3.126 -2.498 -2.012) 4.479 12.325 ( -6.066 -3.163 4.540) 8.211 12.697 ( -5.272 9.583 -2.964) 11.332 13.324 ( -0.490 -6.281 -13.908) 15.268 13.983 ( -2.722 5.229 -2.487) 6.399 14.357 ( -3.303 -2.177 -8.623) 9.487 14.977 ( -3.780 -2.844 11.731) 12.649 15.511 ( -1.518 0.918 9.467) 9.632 20.850 ( 7.927 0.372 14.421) 16.461 21.046 ( 5.852 -0.075 18.134) 19.056 ======================= Grid point 33 (25/343) ======================= q-point: (-0.46 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( 5.846 -4.786 2.516) 7.963 2.934 ( 3.130 -4.343 -4.391) 6.924 2.998 ( 7.536 1.446 0.835) 7.718 3.083 ( 4.702 3.833 -1.239) 6.191 3.270 ( 1.083 -3.749 0.849) 3.993 3.406 ( 1.774 -4.214 -1.811) 4.918 3.465 ( 4.042 -3.006 2.792) 5.760 3.535 ( 5.077 4.785 1.035) 7.053 3.767 ( -1.902 9.777 1.142) 10.026 5.822 ( -3.735 -4.214 -1.716) 5.886 5.989 ( 1.610 -1.696 0.633) 2.423 6.211 ( -3.858 2.414 -13.171) 13.935 6.272 ( 5.167 -0.538 1.591) 5.433 6.417 ( 7.346 4.336 1.739) 8.706 7.049 ( -8.419 2.721 -12.206) 15.075 7.367 ( -4.814 -0.391 -7.790) 9.166 7.503 ( -7.878 2.446 -11.028) 13.772 8.097 ( -16.866 -3.479 -14.168) 22.300 8.310 ( 7.241 -5.357 5.305) 10.453 9.097 ( 11.625 -0.637 15.933) 19.733 9.170 ( 2.963 -2.069 5.955) 6.966 9.508 ( 7.492 1.646 13.931) 15.903 9.976 ( 15.222 -0.118 15.567) 21.773 10.406 ( 19.024 -0.510 14.697) 24.045 11.309 ( 9.168 -1.474 0.621) 9.307 11.959 ( 7.126 -4.572 -3.727) 9.250 12.181 ( -6.592 1.860 7.514) 10.168 12.388 ( 0.203 -6.362 -0.725) 6.406 12.827 ( -7.494 3.373 1.655) 8.383 13.272 ( -10.434 6.945 -2.969) 12.881 14.000 ( -3.618 3.283 -3.448) 5.980 14.269 ( -5.067 -1.090 -11.464) 12.582 15.109 ( 1.827 -6.439 8.268) 10.638 15.610 ( 4.591 3.697 7.241) 9.337 20.908 ( 10.680 -0.686 12.690) 16.601 21.133 ( 13.073 0.310 13.200) 18.580 ======================= Grid point 34 (26/343) ======================= q-point: (-0.38 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( 9.817 -1.273 -0.508) 9.912 2.746 ( 8.210 -3.371 -9.068) 12.688 2.886 ( 8.285 -1.635 -1.260) 8.538 2.999 ( 7.490 4.612 -0.792) 8.832 3.161 ( 8.227 -1.778 -4.103) 9.364 3.382 ( -1.067 -4.356 -0.116) 4.486 3.445 ( 1.398 -3.275 1.303) 3.792 3.494 ( 3.291 2.217 -0.240) 3.976 3.824 ( 1.571 8.063 1.127) 8.292 5.862 ( -2.797 -3.822 0.386) 4.751 5.908 ( 6.972 -2.785 -2.466) 7.902 6.028 ( 3.571 1.923 -12.516) 13.157 6.220 ( 6.596 0.211 2.264) 6.977 6.374 ( 0.681 6.087 -1.967) 6.433 6.996 ( -5.209 4.210 -11.805) 13.572 7.275 ( -0.700 0.590 -10.650) 10.689 7.456 ( -4.705 3.837 -9.492) 11.268 8.103 ( -10.865 -4.192 -11.754) 16.546 8.157 ( 10.710 -6.048 -5.468) 13.461 9.082 ( 19.295 0.544 12.552) 23.025 9.146 ( 10.792 -1.722 4.419) 11.788 9.557 ( 10.765 2.399 9.432) 14.512 9.938 ( 18.714 -5.549 15.412) 24.870 10.267 ( 24.210 0.163 9.199) 25.899 11.089 ( 15.347 -2.143 -5.801) 16.546 11.762 ( 13.570 -3.250 -2.733) 14.219 12.131 ( 10.141 -11.545 -8.737) 17.676 12.463 ( -7.288 4.976 6.957) 11.237 12.984 ( -9.040 -1.242 4.550) 10.196 13.453 ( -11.477 10.280 -2.691) 15.641 13.999 ( -3.099 -1.890 -6.036) 7.044 14.232 ( -8.871 6.916 -5.516) 12.528 15.118 ( 5.420 -10.063 5.709) 12.776 15.625 ( 7.833 6.116 5.615) 11.415 20.890 ( 14.126 -1.452 9.744) 17.222 21.043 ( 21.746 0.235 7.937) 23.150 ======================= Grid point 35 (27/343) ======================= q-point: (-0.31 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( 15.331 -2.441 -9.097) 17.993 2.483 ( 13.606 -1.437 -5.691) 14.818 2.725 ( 10.178 -1.356 -2.950) 10.683 2.898 ( 8.427 3.028 -0.449) 8.966 2.989 ( 8.531 3.127 -3.722) 9.819 3.355 ( 3.486 -3.651 0.654) 5.090 3.413 ( 3.531 -0.821 -0.514) 3.661 3.486 ( -4.463 -2.182 -2.359) 5.500 3.805 ( 6.198 3.735 0.975) 7.302 5.723 ( 8.879 -2.387 -5.412) 10.669 5.779 ( 11.669 0.026 -4.342) 12.451 5.828 ( 8.177 0.861 -5.957) 10.153 6.235 ( -2.292 -1.097 5.259) 5.841 6.381 ( -1.749 8.040 -2.692) 8.657 6.837 ( 8.821 6.162 -12.872) 16.777 7.174 ( -8.160 -0.612 -10.340) 13.186 7.413 ( -0.364 4.655 -4.784) 6.685 7.795 ( 17.434 -5.095 -10.545) 21.003 8.119 ( -11.819 -3.069 -9.456) 15.445 8.920 ( 25.590 0.814 8.233) 26.894 8.972 ( 21.538 -0.309 3.220) 21.779 9.436 ( 19.725 4.174 0.006) 20.161 9.863 ( 19.158 -9.873 14.303) 25.867 10.049 ( 21.448 -0.803 7.298) 22.670 10.755 ( 18.512 -1.275 -7.698) 20.089 11.485 ( 21.210 -4.474 -1.691) 21.742 11.764 ( 17.077 -8.667 -10.610) 21.893 12.679 ( -7.333 5.371 6.600) 11.233 13.160 ( -8.327 -1.549 4.028) 9.380 13.534 ( -8.047 3.052 -7.259) 11.259 13.905 ( -1.646 -5.841 -8.389) 10.353 14.409 ( -8.657 15.345 3.157) 17.899 15.077 ( 3.846 -12.657 5.271) 14.239 15.624 ( 5.163 7.603 5.117) 10.519 20.745 ( 29.136 -0.656 3.427) 29.344 20.783 ( 20.137 -1.227 5.027) 20.791 ======================= Grid point 36 (28/343) ======================= q-point: (-0.23 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( 19.595 -5.565 -9.015) 22.275 2.155 ( 22.680 -0.854 -5.420) 23.335 2.560 ( 8.298 1.789 -1.608) 8.639 2.765 ( 11.848 8.171 -1.733) 14.497 2.862 ( 6.439 0.252 -1.364) 6.586 3.273 ( 6.873 -5.632 0.136) 8.887 3.322 ( 10.756 -2.149 -1.135) 11.027 3.508 ( -4.452 -1.154 -1.540) 4.850 3.747 ( 2.016 0.562 0.043) 2.093 5.492 ( 17.630 1.691 -2.138) 17.840 5.563 ( 9.221 1.941 -5.915) 11.125 5.628 ( 9.121 -3.044 -3.164) 10.122 6.301 ( 10.254 2.521 2.643) 10.885 6.376 ( 4.024 8.468 -2.376) 9.671 6.543 ( 5.320 6.739 -9.416) 12.743 7.139 ( 7.301 0.824 -5.666) 9.279 7.315 ( -2.834 -5.223 -5.211) 7.904 7.551 ( -0.619 4.249 -3.909) 5.806 8.168 ( -10.974 -2.134 -4.197) 11.941 8.628 ( 25.750 0.290 1.299) 25.785 8.676 ( 31.947 0.771 6.934) 32.700 9.073 ( 26.456 8.450 -8.084) 28.925 9.678 ( 23.591 -12.100 7.382) 27.522 9.909 ( 15.179 -1.274 6.504) 16.563 10.397 ( 19.557 0.409 -5.613) 20.351 11.088 ( 31.535 -7.932 -1.248) 32.541 11.366 ( 19.372 -2.306 -7.123) 20.769 12.868 ( -6.172 5.524 4.558) 9.454 13.297 ( -6.716 -0.250 1.455) 6.877 13.539 ( -6.857 -3.659 -5.530) 9.539 13.809 ( -1.134 -7.609 -4.463) 8.894 14.542 ( 2.843 11.237 1.936) 11.751 15.087 ( 0.812 -7.773 4.832) 9.188 15.735 ( -9.290 7.695 4.945) 13.038 20.270 ( 39.396 -2.546 -0.974) 39.490 20.555 ( 22.064 0.766 1.863) 22.156 ======================= Grid point 37 (29/343) ======================= q-point: (-0.15 0.15 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 24.115 -6.505 0.000) 24.977 1.751 ( 28.908 -2.007 0.000) 28.978 2.482 ( 4.571 7.255 -0.000) 8.575 2.616 ( 11.727 9.381 -0.000) 15.017 2.753 ( 9.224 -3.023 0.000) 9.707 2.999 ( 27.611 -9.507 0.000) 29.202 3.173 ( 6.376 -5.252 0.000) 8.260 3.583 ( -7.668 2.064 -0.000) 7.940 3.778 ( -5.377 0.115 -0.000) 5.378 5.247 ( 16.233 3.994 -0.000) 16.717 5.375 ( 12.260 1.776 -0.000) 12.388 5.510 ( 4.011 -4.096 0.000) 5.733 6.033 ( 23.204 5.501 -0.000) 23.847 6.207 ( 19.303 3.517 -0.000) 19.620 6.565 ( -4.636 6.473 -0.000) 7.962 6.939 ( 10.052 2.523 -0.000) 10.364 7.380 ( -5.195 1.270 -0.000) 5.348 7.565 ( 0.713 -0.093 0.000) 0.719 8.262 ( 32.746 0.554 0.000) 32.751 8.302 ( -12.498 -0.820 0.000) 12.525 8.352 ( 14.619 -0.132 0.000) 14.620 8.665 ( 27.715 12.605 -0.000) 30.447 9.355 ( 25.379 -8.238 0.000) 26.683 9.745 ( 15.593 -0.088 0.000) 15.594 10.097 ( 19.266 0.565 -0.000) 19.275 10.566 ( 38.194 -5.874 0.000) 38.643 11.039 ( 21.203 -0.404 0.000) 21.206 13.000 ( -5.209 5.701 -0.000) 7.723 13.384 ( -5.228 -0.387 0.000) 5.242 13.563 ( -5.100 -6.308 0.000) 8.112 13.762 ( -0.928 -9.734 0.000) 9.778 14.501 ( 7.468 3.879 -0.000) 8.415 15.068 ( 5.362 -1.553 0.000) 5.582 16.051 ( -25.461 6.977 -0.000) 26.399 19.679 ( 42.716 -4.153 0.000) 42.918 20.250 ( 25.104 3.804 -0.000) 25.390 ======================= Grid point 42 (30/343) ======================= q-point: ( 0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( -0.000 -0.000 18.017) 18.017 2.448 ( -0.000 -0.000 20.399) 20.399 3.042 ( -0.000 -0.000 11.692) 11.692 3.052 ( -0.000 -0.000 6.001) 6.001 3.087 ( -0.000 -0.000 12.046) 12.046 3.253 ( -0.000 -0.000 8.009) 8.009 3.275 ( -0.000 -0.000 6.534) 6.534 3.828 ( 0.000 0.000 -1.031) 1.031 3.978 ( 0.000 0.000 -1.672) 1.672 5.612 ( -0.000 -0.000 19.625) 19.625 5.669 ( -0.000 -0.000 23.593) 23.593 5.683 ( -0.000 -0.000 5.455) 5.455 6.286 ( -0.000 -0.000 1.574) 1.574 6.496 ( -0.000 -0.000 2.961) 2.961 6.612 ( 0.000 0.000 -9.194) 9.194 7.063 ( -0.000 -0.000 8.206) 8.206 7.137 ( 0.000 0.000 -3.722) 3.722 7.646 ( 0.000 0.000 -14.570) 14.570 7.957 ( -0.000 -0.000 24.561) 24.561 8.652 ( -0.000 -0.000 7.852) 7.852 8.755 ( -0.000 -0.000 22.574) 22.574 8.945 ( -0.000 -0.000 13.221) 13.221 9.642 ( -0.000 -0.000 14.624) 14.624 9.807 ( -0.000 -0.000 25.594) 25.594 10.339 ( -0.000 -0.000 18.374) 18.374 10.990 ( -0.000 -0.000 32.727) 32.727 11.361 ( -0.000 -0.000 17.364) 17.364 12.630 ( 0.000 0.000 -9.983) 9.983 12.980 ( 0.000 0.000 -14.727) 14.727 13.942 ( -0.000 -0.000 1.763) 1.763 13.971 ( 0.000 0.000 -11.702) 11.702 14.116 ( -0.000 -0.000 18.188) 18.188 14.600 ( -0.000 -0.000 16.530) 16.530 14.926 ( 0.000 0.000 -19.574) 19.574 20.396 ( -0.000 -0.000 32.303) 32.303 20.616 ( -0.000 -0.000 18.728) 18.728 ======================= Grid point 43 (31/343) ======================= q-point: ( 0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( -10.510 0.457 13.141) 16.833 2.724 ( -3.698 2.139 15.747) 16.316 3.099 ( 2.925 -2.398 5.146) 6.387 3.159 ( 1.948 0.975 6.931) 7.265 3.213 ( 2.160 -2.372 8.736) 9.306 3.339 ( 1.837 1.784 6.667) 7.142 3.368 ( 0.192 1.037 6.560) 6.645 3.806 ( 0.714 -3.926 -0.582) 4.033 3.941 ( 3.549 3.075 -0.670) 4.744 5.750 ( -1.139 -0.183 6.049) 6.158 5.925 ( -4.571 -1.755 6.786) 8.368 5.944 ( -8.398 1.952 11.481) 14.357 6.273 ( -1.405 -0.937 -3.534) 3.917 6.389 ( 4.796 0.794 -2.088) 5.290 6.616 ( -11.246 0.746 -4.933) 12.303 7.108 ( -7.894 -1.299 -8.680) 11.805 7.209 ( 0.119 -2.049 7.837) 8.101 7.528 ( -10.038 0.167 -11.215) 15.052 8.278 ( 4.157 1.129 25.339) 25.702 8.782 ( -5.138 -0.193 6.533) 8.313 9.027 ( 4.095 -1.988 20.182) 20.689 9.135 ( -3.258 -2.724 14.541) 15.148 9.829 ( 5.692 5.779 18.599) 20.291 10.187 ( 0.163 0.086 29.157) 29.157 10.666 ( -10.193 0.470 17.876) 20.583 11.422 ( -1.245 0.986 28.585) 28.629 11.630 ( -6.462 0.139 15.574) 16.862 12.491 ( 1.469 -3.342 -7.897) 8.700 12.767 ( 1.442 3.364 -15.252) 15.685 13.727 ( 2.584 -7.851 -16.776) 18.701 13.954 ( 3.599 6.659 1.725) 7.763 14.448 ( -7.827 -0.221 19.738) 21.234 14.599 ( 10.098 -0.423 -3.476) 10.688 14.994 ( -14.385 -0.534 10.185) 17.634 20.812 ( 0.007 -0.314 28.447) 28.449 20.853 ( 2.739 0.528 18.653) 18.860 ======================= Grid point 44 (32/343) ======================= q-point: ( 0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( -11.104 -2.879 8.454) 14.250 2.975 ( -4.393 4.302 10.052) 11.784 3.092 ( 5.296 -5.266 4.615) 8.779 3.194 ( 3.445 0.561 3.994) 5.304 3.268 ( 3.552 3.973 5.453) 7.625 3.390 ( 2.701 1.704 4.117) 5.211 3.451 ( 0.635 -0.323 6.310) 6.350 3.757 ( 2.739 -5.556 -0.932) 6.264 3.886 ( 6.022 4.179 0.134) 7.331 5.849 ( -3.921 -0.783 2.863) 4.918 5.884 ( 0.193 -0.151 -9.063) 9.067 6.118 ( -3.235 2.444 -2.508) 4.767 6.289 ( -6.365 -6.161 0.971) 8.912 6.417 ( -4.190 5.139 1.672) 6.838 6.749 ( -11.862 0.495 -0.663) 11.891 7.093 ( -13.965 -1.599 -14.804) 20.414 7.205 ( -1.123 -1.507 -5.528) 5.839 7.609 ( -12.662 -1.638 -2.846) 13.081 8.513 ( 9.680 1.698 21.921) 24.024 8.969 ( -6.753 -0.842 9.218) 11.458 9.174 ( 3.817 -4.463 13.521) 14.741 9.414 ( -0.859 0.240 20.639) 20.659 10.047 ( 5.615 6.710 20.968) 22.720 10.551 ( 2.996 -1.199 26.853) 27.046 11.057 ( -12.193 1.547 15.206) 19.552 11.779 ( -1.030 0.298 20.508) 20.536 11.947 ( -10.121 1.656 13.114) 16.648 12.354 ( 2.007 -8.080 -5.440) 9.945 12.585 ( 0.584 8.315 -11.100) 13.881 13.424 ( 2.948 -6.796 -17.341) 18.857 13.950 ( 2.697 4.513 0.918) 5.337 14.414 ( 6.484 -1.565 -5.804) 8.842 14.818 ( -7.400 -0.164 17.893) 19.363 15.331 ( -10.661 -0.238 12.458) 16.398 21.042 ( 5.852 0.487 17.827) 18.769 21.154 ( 2.277 -0.177 23.877) 23.986 ======================= Grid point 45 (33/343) ======================= q-point: ( 0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( -5.983 -7.477 5.178) 10.886 3.017 ( 6.767 -4.960 2.881) 8.871 3.122 ( 1.997 1.093 3.041) 3.799 3.188 ( 4.601 1.848 2.577) 5.588 3.330 ( 2.362 8.536 5.483) 10.416 3.400 ( -0.426 2.027 0.604) 2.158 3.512 ( 1.416 -0.504 4.515) 4.758 3.670 ( 5.023 -4.890 -0.745) 7.049 3.815 ( 7.238 4.639 0.560) 8.616 5.765 ( -2.196 -2.521 -7.379) 8.102 5.934 ( -4.992 -0.924 -0.100) 5.078 6.087 ( -1.933 4.862 -6.923) 8.678 6.334 ( -3.689 -6.777 -1.302) 7.825 6.500 ( -4.196 6.455 -3.179) 8.329 6.869 ( -2.705 -0.498 2.130) 3.478 7.082 ( -17.727 -0.347 -17.980) 25.251 7.146 ( -9.484 -0.454 -11.538) 14.943 7.723 ( -10.420 -2.481 -3.002) 11.124 8.619 ( 12.223 0.071 15.313) 19.593 9.187 ( -2.673 -1.574 12.927) 13.294 9.284 ( 3.072 -2.705 11.865) 12.551 9.677 ( 3.777 0.838 19.866) 20.239 10.263 ( 7.329 4.193 19.701) 21.434 10.795 ( 8.867 -2.136 21.221) 23.098 11.370 ( -6.001 1.414 9.438) 11.274 11.971 ( -1.960 -0.836 4.251) 4.755 12.163 ( 0.288 -1.992 3.498) 4.036 12.325 ( -5.642 -4.878 5.784) 9.438 12.565 ( -5.044 10.074 0.534) 11.279 13.154 ( 1.312 -4.070 -14.010) 14.648 13.937 ( 1.141 3.177 -1.125) 3.558 14.247 ( 3.055 -1.629 -8.553) 9.227 15.106 ( -3.466 -1.689 13.623) 14.158 15.589 ( -4.841 0.698 9.641) 10.811 21.177 ( 8.611 0.241 16.268) 18.408 21.389 ( 6.208 -0.056 19.118) 20.100 ======================= Grid point 46 (34/343) ======================= q-point: (-0.46 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( 7.936 -5.521 2.048) 9.883 2.960 ( 3.224 -7.766 -0.337) 8.415 3.096 ( 4.414 0.930 0.779) 4.577 3.151 ( 6.824 4.047 1.911) 8.160 3.327 ( 3.935 -1.440 1.584) 4.480 3.418 ( 2.214 -3.514 -2.738) 4.974 3.538 ( 1.254 6.625 1.056) 6.825 3.605 ( 4.412 -1.031 2.984) 5.425 3.762 ( 3.956 7.544 1.220) 8.605 5.741 ( -6.008 -4.599 -2.428) 7.947 5.963 ( -4.562 -1.344 -5.377) 7.179 6.030 ( 0.898 5.152 -4.948) 7.200 6.317 ( -0.204 -3.004 -2.164) 3.708 6.485 ( -0.410 4.399 -5.858) 7.337 6.860 ( 3.209 0.331 -1.667) 3.631 7.081 ( -17.159 0.125 -16.660) 23.916 7.163 ( -12.119 1.654 -9.715) 15.620 7.789 ( -8.851 -2.587 -4.953) 10.467 8.592 ( 14.468 -3.307 7.819) 16.774 9.339 ( 4.454 -2.538 11.404) 12.503 9.398 ( 3.760 0.342 12.090) 12.666 9.838 ( 9.321 0.759 16.286) 18.779 10.389 ( 11.710 -0.337 16.740) 20.432 10.857 ( 16.970 -2.008 14.664) 22.517 11.415 ( 6.646 -1.148 -1.955) 7.022 12.010 ( -0.986 -5.632 0.226) 5.722 12.178 ( -0.518 5.637 2.256) 6.094 12.426 ( 0.321 -8.769 2.499) 9.124 12.743 ( -8.057 4.202 4.037) 9.943 13.061 ( -8.224 7.231 -4.207) 11.731 13.919 ( -1.160 2.174 -2.346) 3.402 14.089 ( -0.062 -1.192 -10.566) 10.633 15.261 ( 1.259 -4.010 8.584) 9.558 15.726 ( 1.116 2.326 6.232) 6.745 21.245 ( 11.271 -0.490 13.527) 17.614 21.494 ( 11.845 0.292 14.104) 18.421 ======================= Grid point 47 (35/343) ======================= q-point: (-0.38 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 9.014 -5.396 -3.532) 11.084 2.827 ( 10.360 -5.071 0.169) 11.535 3.012 ( 9.332 -0.763 0.435) 9.373 3.090 ( 8.063 5.947 1.227) 10.094 3.236 ( 8.505 -3.464 -3.212) 9.729 3.348 ( -2.790 -5.182 -1.231) 6.013 3.506 ( 5.815 3.641 -0.447) 6.876 3.579 ( 5.333 -1.605 2.350) 6.045 3.806 ( -0.687 11.438 1.344) 11.537 5.805 ( -5.570 -3.439 -0.973) 6.618 5.900 ( -0.568 -1.049 -5.703) 5.827 5.972 ( 2.611 0.894 -2.140) 3.492 6.273 ( 1.260 1.165 -2.250) 2.830 6.403 ( 3.891 3.058 -3.983) 6.353 6.785 ( -0.935 0.473 -6.159) 6.248 7.101 ( -10.996 1.679 -9.885) 14.881 7.174 ( -6.226 3.895 -8.633) 11.334 7.823 ( -9.255 -2.884 -5.893) 11.344 8.403 ( 19.795 -5.693 0.940) 20.618 9.355 ( 11.188 -2.494 7.455) 13.674 9.472 ( 9.397 3.240 9.943) 14.060 9.863 ( 14.494 0.414 10.577) 17.948 10.403 ( 15.140 -6.519 14.554) 21.989 10.722 ( 24.369 -1.445 8.451) 25.833 11.201 ( 12.725 -2.299 -7.173) 14.787 11.926 ( 10.370 -3.693 0.820) 11.039 12.180 ( 5.382 -9.515 -6.001) 12.471 12.427 ( -5.077 5.065 3.831) 8.131 12.924 ( -8.522 1.086 4.942) 9.911 13.219 ( -11.958 8.542 -2.825) 14.964 13.899 ( -0.655 -2.061 -5.718) 6.114 14.025 ( -8.437 6.385 -3.667) 11.198 15.285 ( 4.651 -7.142 4.523) 9.649 15.757 ( 5.388 4.367 3.615) 7.821 21.226 ( 14.303 -1.226 9.429) 17.175 21.442 ( 19.206 0.410 8.703) 21.090 ======================= Grid point 48 (36/343) ======================= q-point: (-0.31 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( 13.564 -7.222 -4.274) 15.951 2.651 ( 13.949 -1.866 -0.669) 14.090 2.863 ( 11.785 -1.925 -0.342) 11.946 3.006 ( 9.631 6.405 0.786) 11.593 3.061 ( 9.172 0.962 -2.591) 9.579 3.373 ( -3.761 -5.251 -0.109) 6.460 3.432 ( 3.535 2.778 -1.404) 4.710 3.509 ( 6.527 -3.765 0.876) 7.585 3.852 ( 2.200 8.876 0.639) 9.167 5.732 ( 5.038 -0.414 -4.237) 6.596 5.832 ( 5.723 0.741 -3.467) 6.732 5.942 ( 4.824 -2.879 1.776) 5.892 6.259 ( -2.340 1.983 0.479) 3.104 6.335 ( 2.154 4.952 -0.549) 5.428 6.728 ( -2.539 -0.794 -6.771) 7.275 7.037 ( 5.196 3.050 -4.818) 7.714 7.215 ( -11.690 5.361 -5.613) 14.032 7.879 ( -10.884 -3.036 -4.013) 11.991 8.053 ( 25.887 -6.500 -2.420) 26.800 9.208 ( 18.755 -1.853 2.339) 18.991 9.428 ( 16.973 6.054 7.726) 19.607 9.710 ( 22.065 0.359 1.830) 22.143 10.332 ( 16.849 -12.262 11.381) 23.744 10.448 ( 25.465 -1.831 3.639) 25.789 10.894 ( 16.357 -0.909 -6.976) 17.806 11.752 ( 15.570 -2.820 1.728) 15.917 11.895 ( 14.883 -11.307 -7.084) 19.988 12.615 ( -8.707 8.153 3.480) 12.426 13.094 ( -7.186 2.353 2.821) 8.070 13.324 ( -10.488 -1.548 -4.667) 11.583 13.818 ( -0.809 -3.657 -4.361) 5.749 14.223 ( -13.962 14.638 1.390) 20.277 15.227 ( 4.875 -10.864 2.104) 12.092 15.727 ( 6.661 6.444 1.893) 9.459 21.099 ( 17.734 -1.358 4.497) 18.345 21.207 ( 27.603 -0.176 3.439) 27.817 ======================= Grid point 49 (37/343) ======================= q-point: (-0.23 0.23 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 17.383 -7.912 0.000) 19.099 2.416 ( 19.111 -0.253 0.000) 19.113 2.688 ( 11.695 -1.321 0.000) 11.770 2.890 ( 12.472 10.372 -0.000) 16.222 2.942 ( 6.634 -0.069 0.000) 6.635 3.362 ( 2.834 -1.554 0.000) 3.232 3.406 ( 5.862 -2.869 0.000) 6.526 3.445 ( -4.298 -2.728 0.000) 5.091 3.818 ( 6.547 3.800 -0.000) 7.570 5.617 ( 6.901 -0.154 0.000) 6.903 5.692 ( 11.257 0.069 0.000) 11.257 5.787 ( 15.653 0.210 0.000) 15.655 6.337 ( -2.430 7.657 -0.000) 8.034 6.370 ( -3.941 3.202 -0.000) 5.078 6.598 ( 14.835 3.540 -0.000) 15.251 7.011 ( -8.772 -2.312 0.000) 9.071 7.329 ( -5.115 6.060 -0.000) 7.930 7.647 ( 23.834 -6.132 0.000) 24.611 7.993 ( -11.426 -2.653 0.000) 11.730 8.925 ( 22.807 -1.146 0.000) 22.835 9.274 ( 21.266 9.689 -0.000) 23.369 9.298 ( 35.415 -0.693 0.000) 35.422 10.099 ( 22.804 -13.068 0.000) 26.283 10.179 ( 16.828 -3.866 0.000) 17.266 10.605 ( 18.130 0.931 -0.000) 18.154 11.509 ( 24.483 -11.439 0.000) 27.023 11.561 ( 16.922 -0.678 0.000) 16.935 12.783 ( -7.648 7.467 -0.000) 10.688 13.210 ( -6.518 2.268 -0.000) 6.901 13.409 ( -9.558 -6.579 0.000) 11.603 13.786 ( -1.153 -5.292 0.000) 5.417 14.464 ( -8.779 17.328 -0.000) 19.425 15.155 ( 0.963 -12.813 0.000) 12.849 15.696 ( 2.689 7.861 -0.000) 8.308 20.791 ( 35.305 -1.345 0.000) 35.331 20.864 ( 20.849 -0.658 0.000) 20.859 ======================= Grid point 56 (38/343) ======================= q-point: ( 0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( -0.000 -0.000 12.122) 12.122 2.890 ( -0.000 -0.000 12.501) 12.501 3.160 ( -0.000 -0.000 2.452) 2.452 3.248 ( -0.000 -0.000 4.234) 4.234 3.375 ( -0.000 -0.000 9.098) 9.098 3.445 ( -0.000 -0.000 5.813) 5.813 3.446 ( -0.000 -0.000 6.757) 6.757 3.811 ( 0.000 0.000 -0.638) 0.638 3.948 ( 0.000 0.000 -0.697) 0.697 5.795 ( -0.000 -0.000 2.372) 2.372 5.889 ( 0.000 0.000 -10.262) 10.262 6.038 ( -0.000 -0.000 10.595) 10.595 6.187 ( 0.000 0.000 -6.788) 6.788 6.317 ( 0.000 0.000 -11.148) 11.148 6.546 ( -0.000 -0.000 6.438) 6.438 6.904 ( 0.000 0.000 -13.873) 13.873 7.271 ( 0.000 0.000 -11.921) 11.921 7.404 ( -0.000 -0.000 12.392) 12.392 8.659 ( -0.000 -0.000 25.892) 25.892 8.850 ( -0.000 -0.000 9.035) 9.035 9.260 ( -0.000 -0.000 10.343) 10.343 9.376 ( -0.000 -0.000 22.820) 22.820 10.122 ( -0.000 -0.000 19.997) 19.997 10.593 ( -0.000 -0.000 29.694) 29.694 10.830 ( -0.000 -0.000 16.947) 16.947 11.773 ( -0.000 -0.000 23.335) 23.335 11.784 ( -0.000 -0.000 13.701) 13.701 12.421 ( 0.000 0.000 -4.620) 4.620 12.561 ( 0.000 0.000 -14.487) 14.487 13.502 ( 0.000 0.000 -19.136) 19.136 13.996 ( -0.000 -0.000 1.280) 1.280 14.595 ( 0.000 0.000 -8.942) 8.942 14.688 ( -0.000 -0.000 22.403) 22.403 15.100 ( -0.000 -0.000 19.129) 19.129 21.126 ( -0.000 -0.000 18.593) 18.593 21.184 ( -0.000 -0.000 25.568) 25.568 ======================= Grid point 57 (39/343) ======================= q-point: ( 0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( -6.109 0.532 8.885) 10.796 3.051 ( -1.839 1.106 8.504) 8.771 3.177 ( 1.358 -0.921 1.836) 2.462 3.281 ( 2.017 1.538 2.675) 3.686 3.427 ( 5.681 -5.734 6.654) 10.461 3.497 ( 4.140 4.344 5.114) 7.885 3.541 ( 0.040 0.160 5.837) 5.839 3.786 ( 1.196 -3.298 -1.011) 3.651 3.929 ( 2.417 2.566 -0.360) 3.543 5.721 ( -1.513 0.566 -13.324) 13.422 5.825 ( -2.317 -0.286 -0.280) 2.352 6.057 ( 1.358 -2.007 -5.069) 5.618 6.192 ( -5.822 -2.804 -6.759) 9.351 6.240 ( -8.420 5.731 -2.135) 10.407 6.648 ( -8.481 -0.227 -1.747) 8.662 6.732 ( -6.276 -0.995 -17.260) 18.393 7.139 ( 3.135 0.205 -3.434) 4.654 7.568 ( -2.854 -1.669 7.667) 8.349 8.905 ( 8.200 0.538 17.028) 18.907 9.069 ( -5.181 -0.080 18.109) 18.836 9.373 ( 1.741 -2.096 9.236) 9.629 9.688 ( -1.164 0.347 21.179) 21.214 10.373 ( 3.585 3.735 19.870) 20.533 10.957 ( 2.668 -0.842 25.706) 25.858 11.105 ( -8.164 0.785 13.971) 16.200 11.984 ( -0.314 -1.559 6.954) 7.134 12.000 ( -4.634 1.513 9.752) 10.903 12.357 ( 0.772 -8.599 -0.150) 8.635 12.453 ( 0.018 8.939 -1.412) 9.050 13.244 ( 1.685 -2.470 -15.738) 16.020 13.986 ( 2.460 1.411 -0.297) 2.851 14.419 ( 6.308 -0.673 -8.954) 10.974 15.005 ( -3.028 -0.051 19.627) 19.859 15.399 ( -6.472 0.017 15.664) 16.949 21.346 ( 3.476 0.194 17.164) 17.514 21.492 ( 1.666 -0.087 21.256) 21.322 ======================= Grid point 58 (40/343) ======================= q-point: ( 0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.919 ( -6.872 -1.914 5.620) 9.082 3.120 ( 2.964 -2.551 1.229) 4.099 3.206 ( 0.385 1.087 4.559) 4.703 3.281 ( 4.239 3.007 2.364) 5.709 3.395 ( 5.578 -1.863 3.909) 7.062 3.491 ( 7.062 3.986 3.232) 8.730 3.589 ( 1.867 -1.518 2.539) 3.498 3.736 ( 2.855 -3.723 0.482) 4.716 3.888 ( 4.965 3.685 -0.034) 6.183 5.616 ( -5.196 -0.158 -8.506) 9.968 5.836 ( -3.969 -0.632 -4.543) 6.065 5.979 ( -2.590 -2.908 -5.491) 6.732 6.162 ( -6.611 4.567 -8.801) 11.917 6.364 ( -8.757 0.166 -1.702) 8.922 6.612 ( -11.526 -1.102 -16.909) 20.493 6.714 ( -14.866 0.128 -11.920) 19.055 7.091 ( 6.471 0.466 5.363) 8.417 7.669 ( -2.098 -2.024 3.497) 4.552 8.961 ( 11.497 0.130 11.280) 16.107 9.384 ( -2.169 -0.655 19.497) 19.629 9.457 ( 1.822 -1.885 7.929) 8.351 9.961 ( 0.585 0.554 17.587) 17.606 10.585 ( 4.707 3.645 17.154) 18.158 11.190 ( 6.814 -2.896 18.992) 20.384 11.387 ( -7.388 2.268 8.558) 11.531 11.916 ( -1.495 -1.711 -9.380) 9.651 12.213 ( -4.108 0.282 6.623) 7.798 12.372 ( -2.257 -2.918 4.887) 6.123 12.558 ( -0.674 3.559 9.564) 10.227 13.028 ( 3.240 -0.558 -9.612) 10.159 13.938 ( 2.695 1.304 -2.078) 3.644 14.198 ( 6.318 -1.039 -10.082) 11.943 15.267 ( -1.321 -0.539 14.057) 14.129 15.657 ( -4.560 0.282 10.575) 11.520 21.494 ( 6.621 0.126 14.528) 15.966 21.706 ( 4.446 -0.032 16.376) 16.969 ======================= Grid point 59 (41/343) ======================= q-point: (-0.46 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.021 ( 1.615 -6.388 1.620) 6.785 3.061 ( 1.760 -5.211 1.651) 5.743 3.188 ( 7.959 -1.714 1.965) 8.375 3.252 ( 6.067 4.298 1.912) 7.677 3.404 ( 1.204 -0.021 -0.466) 1.291 3.439 ( 6.502 4.698 2.353) 8.360 3.542 ( 3.482 1.847 -1.342) 4.164 3.712 ( 3.490 -2.353 3.104) 5.230 3.826 ( 6.158 4.773 0.281) 7.796 5.632 ( -8.159 -3.067 -1.856) 8.912 5.815 ( -4.681 -0.447 -6.165) 7.754 5.951 ( -3.931 0.017 -5.275) 6.579 6.160 ( -6.766 4.198 -7.559) 10.979 6.407 ( -0.927 -1.464 -1.527) 2.310 6.604 ( -18.859 0.385 -13.875) 23.416 6.735 ( -12.857 0.245 -12.623) 18.019 7.098 ( 6.005 1.640 7.014) 9.378 7.710 ( -1.465 -1.769 0.265) 2.312 8.898 ( 15.002 -1.585 6.291) 16.344 9.523 ( 1.910 -0.884 6.396) 6.733 9.620 ( 2.807 -1.198 15.236) 15.538 10.133 ( 4.801 0.381 12.432) 13.333 10.721 ( 6.661 0.106 12.947) 14.560 11.258 ( 12.666 -3.798 11.985) 17.847 11.449 ( 4.645 0.608 -3.532) 5.867 11.924 ( -11.326 -0.159 -0.805) 11.355 12.228 ( 5.709 1.603 0.653) 5.965 12.523 ( -1.750 -6.879 6.435) 9.581 12.673 ( -6.644 -2.357 1.935) 7.310 12.942 ( 1.444 11.659 0.554) 11.761 13.879 ( 0.810 0.646 -2.958) 3.134 13.985 ( 3.911 -1.241 -9.616) 10.455 15.407 ( 2.052 -1.767 7.974) 8.421 15.804 ( -0.475 1.057 5.791) 5.906 21.556 ( 9.458 -0.280 10.618) 14.223 21.807 ( 8.535 0.217 11.056) 13.969 ======================= Grid point 60 (42/343) ======================= q-point: (-0.38 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( 8.842 -6.867 -0.906) 11.232 3.002 ( 9.626 -7.586 1.269) 12.322 3.123 ( 4.153 -1.524 0.974) 4.529 3.199 ( 8.056 6.785 1.573) 10.649 3.315 ( 5.904 -4.441 -3.182) 8.044 3.356 ( 5.576 -1.708 0.184) 5.834 3.540 ( 2.512 8.840 -0.241) 9.193 3.686 ( 4.546 -2.342 1.910) 5.459 3.788 ( 2.611 8.536 0.526) 8.942 5.733 ( -6.449 -4.298 0.810) 7.792 5.816 ( -5.669 -1.086 -1.880) 6.071 5.932 ( -2.378 2.363 -4.092) 5.290 6.168 ( -6.336 0.659 -5.637) 8.506 6.363 ( 2.600 0.486 -1.520) 3.050 6.716 ( -7.945 -0.058 -6.661) 10.368 6.744 ( -15.740 2.267 -6.137) 17.046 7.112 ( 3.289 3.231 2.464) 5.228 7.715 ( -2.018 -1.853 -1.296) 3.031 8.710 ( 19.269 -3.840 1.832) 19.733 9.557 ( 4.117 -0.255 3.893) 5.672 9.692 ( 9.083 0.338 7.373) 11.704 10.160 ( 10.431 -0.226 6.423) 12.252 10.755 ( 8.535 -6.527 9.028) 14.034 11.138 ( 19.968 -3.633 4.979) 20.898 11.268 ( 10.995 0.260 -5.418) 12.260 12.061 ( -0.666 -4.348 2.674) 5.148 12.154 ( 0.826 1.310 -2.986) 3.364 12.457 ( 6.733 -3.989 0.810) 7.867 12.866 ( -12.186 -0.338 4.113) 12.866 13.023 ( -3.963 12.886 -0.892) 13.511 13.842 ( 1.397 -1.092 -5.061) 5.363 13.873 ( -4.987 2.175 -1.761) 5.719 15.422 ( 4.794 -3.942 3.065) 6.922 15.842 ( 3.284 2.432 2.244) 4.662 21.517 ( 12.369 -0.856 5.537) 13.579 21.767 ( 14.211 0.449 5.375) 15.200 ======================= Grid point 61 (43/343) ======================= q-point: (-0.31 0.31 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.727 ( 11.793 -7.789 0.000) 14.133 2.836 ( 11.989 -4.642 0.000) 12.856 3.024 ( 10.106 -2.302 0.000) 10.365 3.123 ( 10.023 10.263 -0.000) 14.345 3.163 ( 8.673 -4.208 0.000) 9.640 3.335 ( -2.908 -4.777 0.000) 5.592 3.491 ( 6.721 4.803 -0.000) 8.261 3.616 ( 5.919 -3.476 0.000) 6.864 3.825 ( -0.528 11.622 -0.000) 11.634 5.751 ( 1.104 -0.137 0.000) 1.112 5.858 ( 0.832 -0.694 0.000) 1.084 5.964 ( -4.660 -1.996 0.000) 5.069 6.196 ( -4.557 -1.027 0.000) 4.671 6.332 ( 1.000 3.366 -0.000) 3.511 6.685 ( 1.763 -0.914 0.000) 1.986 6.957 ( -16.939 3.981 -0.000) 17.401 7.085 ( 5.228 4.529 -0.000) 6.917 7.746 ( -6.129 -2.563 0.000) 6.643 8.408 ( 23.945 -5.464 0.000) 24.561 9.469 ( 13.585 -2.280 0.000) 13.775 9.612 ( 9.816 5.603 -0.000) 11.303 10.015 ( 17.301 -0.894 0.000) 17.324 10.660 ( 11.343 -13.128 0.000) 17.349 10.839 ( 26.259 -2.590 0.000) 26.386 11.047 ( 14.719 1.211 -0.000) 14.769 11.959 ( 12.147 -0.377 0.000) 12.153 12.060 ( 8.693 -13.937 0.000) 16.426 12.490 ( -7.072 9.083 -0.000) 11.511 13.030 ( -4.175 6.643 -0.000) 7.846 13.134 ( -12.762 -1.288 0.000) 12.827 13.793 ( 0.140 -1.804 0.000) 1.810 14.002 ( -12.040 8.897 -0.000) 14.971 15.347 ( 5.711 -7.164 0.000) 9.162 15.806 ( 5.754 4.371 -0.000) 7.226 21.362 ( 15.343 -1.294 0.000) 15.398 21.565 ( 21.088 0.352 0.000) 21.091 ======================= Grid point 70 (44/343) ======================= q-point: ( 0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.799 ( -0.000 -0.000 7.339) 7.339 3.135 ( -0.000 -0.000 5.640) 5.640 3.212 ( -0.000 -0.000 1.927) 1.927 3.324 ( -0.000 -0.000 2.227) 2.227 3.577 ( -0.000 -0.000 5.820) 5.820 3.579 ( -0.000 -0.000 3.865) 3.865 3.604 ( -0.000 -0.000 3.853) 3.853 3.789 ( 0.000 0.000 -0.295) 0.295 3.932 ( 0.000 0.000 -0.527) 0.527 5.513 ( 0.000 0.000 -13.393) 13.393 5.790 ( 0.000 0.000 -2.948) 2.948 6.013 ( 0.000 0.000 -10.250) 10.250 6.020 ( 0.000 0.000 -4.045) 4.045 6.133 ( 0.000 0.000 -6.180) 6.180 6.479 ( 0.000 0.000 -11.717) 11.717 6.501 ( 0.000 0.000 -9.921) 9.921 7.178 ( -0.000 -0.000 4.038) 4.038 7.660 ( -0.000 -0.000 6.522) 6.522 9.150 ( -0.000 -0.000 11.590) 11.590 9.325 ( -0.000 -0.000 22.788) 22.788 9.495 ( -0.000 -0.000 6.739) 6.739 9.947 ( -0.000 -0.000 18.200) 18.200 10.638 ( -0.000 -0.000 16.261) 16.261 11.221 ( -0.000 -0.000 11.470) 11.470 11.295 ( -0.000 -0.000 20.461) 20.461 11.917 ( 0.000 0.000 -12.715) 12.715 12.092 ( -0.000 -0.000 8.827) 8.827 12.392 ( -0.000 -0.000 1.405) 1.405 12.551 ( -0.000 -0.000 14.437) 14.437 13.085 ( 0.000 0.000 -9.340) 9.340 13.983 ( 0.000 0.000 -2.279) 2.279 14.321 ( 0.000 0.000 -11.681) 11.681 15.242 ( -0.000 -0.000 17.184) 17.184 15.569 ( -0.000 -0.000 14.459) 14.459 21.586 ( -0.000 -0.000 14.505) 14.505 21.763 ( -0.000 -0.000 16.831) 16.831 ======================= Grid point 71 (45/343) ======================= q-point: ( 0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.914 ( -4.186 0.508 4.706) 6.319 3.178 ( 1.520 -1.834 1.541) 2.837 3.246 ( -0.576 0.789 2.931) 3.089 3.342 ( 2.380 2.815 2.076) 4.231 3.560 ( 5.911 -7.038 2.899) 9.637 3.604 ( 5.747 4.126 2.380) 7.464 3.636 ( 1.343 0.069 0.887) 1.611 3.788 ( 1.094 -1.371 1.851) 2.550 3.920 ( 1.681 1.935 -0.292) 2.580 5.404 ( -6.378 1.783 -8.794) 11.009 5.739 ( -0.719 -0.924 -4.845) 4.984 5.879 ( -3.042 -13.044 -7.042) 15.133 6.011 ( 0.121 14.194 -2.537) 14.420 6.078 ( -12.149 -0.021 -12.620) 17.517 6.376 ( -8.914 -0.113 -11.730) 14.733 6.442 ( -1.629 -1.865 -1.924) 3.136 7.224 ( 2.318 0.644 4.756) 5.330 7.722 ( 0.759 -1.053 3.590) 3.817 9.234 ( 8.099 -0.195 8.831) 11.984 9.563 ( 0.703 -1.052 4.934) 5.093 9.627 ( -1.494 0.301 18.515) 18.578 10.167 ( -0.423 0.382 13.042) 13.054 10.813 ( 1.888 2.119 11.183) 11.537 11.391 ( -4.738 -0.403 6.841) 8.331 11.501 ( 3.339 -0.371 13.563) 13.973 11.740 ( -1.596 -0.510 -12.171) 12.285 12.231 ( -5.089 0.046 5.949) 7.829 12.394 ( 0.401 -0.353 -0.562) 0.775 12.731 ( 1.606 -2.511 12.231) 12.589 13.005 ( 3.515 3.093 0.269) 4.690 13.930 ( 1.782 -0.059 -3.389) 3.829 14.127 ( 4.115 -0.340 -11.643) 12.353 15.440 ( 0.322 -0.048 11.584) 11.589 15.751 ( -1.935 0.039 9.451) 9.647 21.733 ( 3.390 0.042 10.565) 11.096 21.942 ( 2.135 -0.010 11.587) 11.782 ======================= Grid point 72 (46/343) ======================= q-point: (-0.46 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.028 ( -5.454 -1.664 2.242) 6.127 3.133 ( 4.458 -4.471 0.146) 6.316 3.288 ( 1.019 1.250 1.449) 2.168 3.333 ( 4.841 5.593 1.382) 7.525 3.465 ( 7.262 -5.559 1.038) 9.204 3.543 ( 7.046 3.978 0.281) 8.097 3.589 ( 5.297 -0.929 -0.376) 5.391 3.791 ( 2.072 -1.438 1.873) 3.141 3.886 ( 4.320 3.126 -0.050) 5.333 5.464 ( -12.151 2.648 -2.564) 12.698 5.692 ( -3.203 -3.851 -3.963) 6.387 5.816 ( -5.528 -10.175 -4.602) 12.460 6.024 ( -0.356 13.356 -2.774) 13.646 6.161 ( -18.268 0.703 -6.318) 19.342 6.404 ( -13.505 0.161 -6.984) 15.205 6.438 ( -0.919 -3.235 -0.616) 3.418 7.242 ( 4.184 1.727 3.406) 5.665 7.731 ( 1.545 -1.436 1.048) 2.355 9.171 ( 13.589 -0.637 4.124) 14.216 9.602 ( 0.804 -0.269 2.706) 2.836 9.837 ( 0.909 -1.473 10.859) 10.997 10.299 ( 1.208 0.509 6.619) 6.748 10.906 ( 2.222 1.001 5.812) 6.302 11.429 ( 3.301 -1.066 -2.571) 4.317 11.561 ( 7.862 -1.284 6.300) 10.156 11.741 ( -12.124 1.110 -0.951) 12.211 12.293 ( 3.301 -0.143 -0.335) 3.321 12.463 ( -11.845 -0.220 1.616) 11.957 12.771 ( 6.000 -11.698 4.410) 13.866 13.007 ( 7.288 14.827 4.826) 17.212 13.853 ( 1.652 -2.686 -3.629) 4.808 13.934 ( 4.323 0.726 -6.597) 7.921 15.535 ( 2.431 -0.485 5.197) 5.758 15.862 ( -0.690 0.305 4.034) 4.103 21.777 ( 6.486 -0.113 5.635) 8.592 22.013 ( 5.003 0.110 5.895) 7.732 ======================= Grid point 73 (47/343) ======================= q-point: (-0.38 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.032 ( 6.877 -6.438 0.000) 9.421 3.097 ( -2.996 -6.464 0.000) 7.125 3.215 ( 9.375 -2.402 0.000) 9.678 3.287 ( 6.945 7.956 -0.000) 10.561 3.380 ( 4.496 -4.886 0.000) 6.640 3.469 ( 8.552 2.669 -0.000) 8.959 3.521 ( 1.689 6.603 -0.000) 6.816 3.762 ( 3.430 -1.853 0.000) 3.899 3.829 ( 5.611 4.609 -0.000) 7.261 5.651 ( -13.779 2.501 -0.000) 14.004 5.696 ( -4.578 -5.974 0.000) 7.526 5.833 ( -5.972 -5.605 0.000) 8.190 6.059 ( -1.694 10.049 -0.000) 10.191 6.369 ( -11.303 -2.380 0.000) 11.551 6.432 ( -7.517 0.248 -0.000) 7.521 6.547 ( -13.205 0.582 -0.000) 13.218 7.204 ( 6.343 2.704 -0.000) 6.895 7.712 ( 0.932 -1.557 0.000) 1.814 8.983 ( 16.982 -2.027 0.000) 17.103 9.609 ( 1.140 0.468 -0.000) 1.232 9.860 ( 5.792 -1.956 0.000) 6.113 10.306 ( 4.888 0.198 -0.000) 4.892 10.910 ( 3.281 -3.577 0.000) 4.854 11.322 ( 7.814 -0.304 0.000) 7.820 11.451 ( 13.902 -2.209 0.000) 14.076 11.933 ( -14.157 1.761 -0.000) 14.266 12.219 ( 6.309 -0.457 0.000) 6.325 12.621 ( 8.472 -7.410 0.000) 11.255 12.684 ( -13.869 -3.481 0.000) 14.299 13.007 ( 6.071 16.882 -0.000) 17.941 13.799 ( -0.761 -3.274 0.000) 3.361 13.853 ( 2.537 1.150 -0.000) 2.785 15.517 ( 4.254 -1.681 0.000) 4.574 15.885 ( 1.343 1.041 -0.000) 1.699 21.706 ( 9.509 -0.446 0.000) 9.520 21.960 ( 9.072 0.313 -0.000) 9.077 ======================= Grid point 84 (48/343) ======================= q-point: ( 0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.934 ( -0.000 -0.000 2.530) 2.530 3.209 ( -0.000 -0.000 0.895) 0.895 3.270 ( -0.000 -0.000 1.457) 1.457 3.379 ( -0.000 -0.000 1.526) 1.526 3.623 ( 0.000 0.000 -1.015) 1.015 3.649 ( -0.000 -0.000 1.314) 1.314 3.687 ( -0.000 -0.000 2.136) 2.136 3.823 ( -0.000 -0.000 1.594) 1.594 3.921 ( 0.000 0.000 -0.250) 0.250 5.252 ( 0.000 0.000 -5.149) 5.149 5.693 ( 0.000 0.000 -2.558) 2.558 5.807 ( 0.000 0.000 -4.242) 4.242 5.832 ( 0.000 0.000 -8.690) 8.690 5.968 ( 0.000 0.000 -0.607) 0.607 6.185 ( 0.000 0.000 -6.823) 6.823 6.428 ( -0.000 -0.000 0.092) 0.092 7.284 ( -0.000 -0.000 2.320) 2.320 7.770 ( -0.000 -0.000 1.906) 1.906 9.390 ( -0.000 -0.000 4.971) 4.971 9.617 ( -0.000 -0.000 2.244) 2.244 9.828 ( -0.000 -0.000 11.939) 11.939 10.300 ( -0.000 -0.000 6.958) 6.958 10.923 ( -0.000 -0.000 4.232) 4.232 11.434 ( -0.000 -0.000 4.056) 4.056 11.586 ( 0.000 0.000 -7.723) 7.723 11.666 ( -0.000 -0.000 7.065) 7.065 12.255 ( -0.000 -0.000 3.069) 3.069 12.371 ( 0.000 0.000 -2.720) 2.720 12.894 ( -0.000 -0.000 7.912) 7.912 13.078 ( -0.000 -0.000 5.617) 5.617 13.899 ( 0.000 0.000 -2.782) 2.782 14.006 ( 0.000 0.000 -9.229) 9.229 15.568 ( -0.000 -0.000 6.297) 6.297 15.842 ( -0.000 -0.000 5.264) 5.264 21.866 ( -0.000 -0.000 5.528) 5.528 22.075 ( -0.000 -0.000 5.940) 5.940 ======================= Grid point 85 (49/343) ======================= q-point: (-0.46 0.46 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.979 ( -3.752 0.507 -0.000) 3.786 3.196 ( 2.319 -2.564 0.000) 3.457 3.287 ( -0.787 0.968 -0.000) 1.248 3.379 ( 2.655 3.437 -0.000) 4.344 3.581 ( 4.314 -3.706 0.000) 5.687 3.624 ( 4.197 -4.712 0.000) 6.310 3.659 ( 5.890 4.951 -0.000) 7.694 3.827 ( 0.886 -0.623 0.000) 1.083 3.915 ( 1.365 1.608 -0.000) 2.109 5.281 ( -8.470 2.318 -0.000) 8.781 5.656 ( 0.097 -2.440 0.000) 2.442 5.771 ( -2.252 -9.686 0.000) 9.945 5.874 ( -11.892 1.042 -0.000) 11.938 5.988 ( -0.554 11.013 -0.000) 11.027 6.198 ( -8.598 0.220 -0.000) 8.601 6.434 ( -1.189 -2.586 0.000) 2.846 7.293 ( 1.288 0.952 -0.000) 1.601 7.769 ( 1.676 -0.804 0.000) 1.859 9.360 ( 8.878 -0.264 0.000) 8.882 9.628 ( 0.454 -0.235 0.000) 0.511 9.920 ( -0.727 -0.547 0.000) 0.910 10.349 ( -0.036 0.377 -0.000) 0.379 10.950 ( 0.309 1.453 -0.000) 1.485 11.450 ( 2.036 0.021 0.000) 2.036 11.587 ( -7.803 0.024 -0.000) 7.803 11.690 ( 3.367 -1.080 0.000) 3.536 12.307 ( -2.199 0.079 -0.000) 2.200 12.354 ( -3.288 -0.589 0.000) 3.341 12.914 ( 3.069 -8.349 0.000) 8.895 13.100 ( 6.323 10.710 -0.000) 12.437 13.860 ( 1.352 -4.274 0.000) 4.482 13.924 ( 2.528 2.493 -0.000) 3.551 15.601 ( 1.480 -0.039 0.000) 1.480 15.882 ( -0.564 0.034 -0.000) 0.565 21.882 ( 3.260 -0.018 0.000) 3.261 22.101 ( 2.187 0.028 0.000) 2.187 ======================= Grid point 170 (50/343) ======================= q-point: ( 0.08 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.219 ( -0.000 30.090 -0.000) 30.090 0.220 ( -0.000 30.147 -0.000) 30.147 0.429 ( -0.000 58.855 -0.000) 58.855 2.331 ( 0.000 -6.780 0.000) 6.780 2.345 ( 0.000 -6.975 0.000) 6.975 2.949 ( -0.000 3.226 -0.000) 3.226 2.956 ( -0.000 3.279 -0.000) 3.279 3.846 ( 0.000 -11.660 0.000) 11.660 4.280 ( -0.000 6.000 -0.000) 6.000 4.788 ( 0.000 -1.405 0.000) 1.405 5.046 ( 0.000 -1.384 0.000) 1.384 5.193 ( -0.000 0.447 -0.000) 0.447 5.282 ( -0.000 1.183 -0.000) 1.183 5.491 ( -0.000 0.474 -0.000) 0.474 5.911 ( -0.000 0.661 -0.000) 0.661 6.065 ( 0.000 -8.298 0.000) 8.298 6.293 ( -0.000 1.997 -0.000) 1.997 6.760 ( 0.000 -0.154 0.000) 0.154 7.273 ( -0.000 4.703 -0.000) 4.703 7.771 ( -0.000 1.759 -0.000) 1.759 8.065 ( -0.000 1.770 -0.000) 1.770 8.184 ( 0.000 -1.668 0.000) 1.668 8.439 ( 0.000 -1.396 0.000) 1.396 9.129 ( 0.000 -0.149 0.000) 0.149 9.330 ( 0.000 -0.139 0.000) 0.139 9.387 ( 0.000 -0.393 0.000) 0.393 9.960 ( -0.000 0.359 -0.000) 0.359 13.383 ( 0.000 -16.317 0.000) 16.317 13.641 ( -0.000 17.253 -0.000) 17.253 13.662 ( -0.000 0.171 -0.000) 0.171 14.066 ( 0.000 -0.089 0.000) 0.089 14.269 ( -0.000 0.082 -0.000) 0.082 14.811 ( 0.000 -0.178 0.000) 0.178 17.480 ( 0.000 -11.985 0.000) 11.985 17.961 ( -0.000 11.797 -0.000) 11.797 19.028 ( 0.000 -1.419 0.000) 1.419 ======================= Grid point 171 (51/343) ======================= q-point: ( 0.15 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.707 ( -18.095 11.117 23.826) 31.917 0.884 ( -18.025 9.793 36.907) 42.225 1.174 ( -41.682 25.855 20.058) 52.993 2.322 ( -0.842 -9.050 2.742) 9.494 2.403 ( -5.918 -9.256 6.387) 12.708 2.919 ( 6.475 5.061 0.912) 8.269 2.990 ( -1.798 4.073 1.186) 4.607 3.782 ( 0.165 -16.545 0.472) 16.553 4.134 ( 11.147 9.597 -2.184) 14.870 5.008 ( -12.386 -3.300 -3.779) 13.364 5.097 ( -1.796 -0.114 -3.494) 3.930 5.314 ( -9.229 -10.465 8.147) 16.157 5.374 ( -8.126 0.692 7.463) 11.055 5.594 ( -3.113 6.933 2.977) 8.162 6.127 ( -38.086 -1.426 -10.559) 39.548 6.315 ( -24.100 -1.085 17.869) 30.021 6.910 ( -9.542 -2.194 9.953) 13.961 7.082 ( -1.682 -9.092 -3.563) 9.909 7.729 ( -5.355 -9.662 9.484) 14.560 8.029 ( -12.533 -3.082 2.757) 13.197 8.246 ( -9.826 -2.420 -0.084) 10.120 8.459 ( -1.751 -5.203 11.229) 12.499 8.960 ( 8.444 -1.581 -12.091) 14.832 9.128 ( -33.674 -60.244 38.036) 78.803 9.287 ( -1.004 -2.424 1.274) 2.916 9.495 ( -9.849 -1.389 5.940) 11.586 10.211 ( -17.390 0.442 11.944) 21.101 13.196 ( 6.251 -2.831 -8.668) 11.055 13.558 ( 7.163 13.879 -4.117) 16.152 13.669 ( 0.045 2.060 0.635) 2.156 13.850 ( 10.263 19.735 8.261) 23.728 14.253 ( -2.996 -0.380 -5.424) 6.208 14.596 ( -17.895 8.109 -22.487) 29.860 17.121 ( 18.626 -7.637 -23.198) 30.715 18.405 ( -15.940 7.271 15.295) 23.257 19.299 ( -18.215 -15.242 16.149) 28.721 ======================= Grid point 172 (52/343) ======================= q-point: ( 0.23 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -18.372 5.543 22.195) 29.341 1.622 ( -15.954 5.767 32.541) 36.698 2.046 ( -36.022 12.368 16.872) 41.656 2.396 ( -5.579 -6.008 6.898) 10.715 2.564 ( -5.572 -9.822 9.385) 14.683 2.881 ( 5.531 8.165 3.449) 10.448 3.060 ( -3.088 3.887 1.942) 5.330 3.732 ( 0.800 -12.505 0.736) 12.553 3.980 ( 9.986 5.316 -1.896) 11.471 5.156 ( -4.896 -2.306 8.304) 9.912 5.220 ( -12.456 0.584 5.377) 13.579 5.531 ( -4.897 -3.010 11.692) 13.028 5.675 ( -17.613 -2.654 10.144) 20.498 5.804 ( -19.805 2.452 4.399) 20.435 6.583 ( -22.811 -2.098 13.000) 26.339 6.792 ( -10.454 -4.699 12.296) 16.810 6.990 ( -6.844 -2.946 -4.873) 8.903 7.231 ( -13.647 -3.012 11.843) 18.319 7.856 ( -2.628 -6.244 4.681) 8.235 8.282 ( -14.476 -2.900 7.993) 16.789 8.403 ( -9.614 -1.403 4.986) 10.920 8.674 ( 2.376 -0.736 -1.180) 2.753 8.714 ( -4.730 -0.095 7.226) 8.637 9.277 ( -5.568 -0.434 -3.925) 6.826 9.672 ( -17.458 -2.747 11.285) 20.968 9.846 ( -23.700 -10.365 17.101) 31.010 10.650 ( -19.591 1.296 14.165) 24.210 13.007 ( 4.656 -3.681 -7.483) 9.551 13.467 ( 4.861 6.160 -4.237) 8.918 13.702 ( -0.951 0.683 2.546) 2.802 13.946 ( 2.262 11.885 8.350) 14.700 14.233 ( -6.438 -0.251 -5.740) 8.629 14.595 ( -13.233 4.558 -13.259) 19.279 16.431 ( 22.136 -7.280 -29.320) 37.452 18.950 ( -23.612 5.468 20.490) 31.737 19.726 ( -17.926 -8.250 14.517) 24.497 ======================= Grid point 173 (53/343) ======================= q-point: ( 0.31 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.833 ( -17.468 -1.169 19.012) 25.845 2.217 ( -11.641 3.737 24.364) 27.259 2.462 ( -7.891 -10.887 7.540) 15.415 2.720 ( -3.551 -3.949 9.196) 10.619 2.776 ( -17.984 10.926 10.945) 23.719 2.955 ( -5.448 9.547 6.644) 12.844 3.149 ( -3.896 3.179 2.010) 5.415 3.683 ( 3.396 -6.011 1.029) 6.980 3.855 ( 7.406 1.099 -1.310) 7.601 5.348 ( -5.739 -2.142 10.535) 12.186 5.490 ( -10.218 3.032 8.042) 13.352 5.759 ( -3.211 -0.692 16.265) 16.593 6.051 ( -17.214 -5.072 8.288) 19.767 6.192 ( -21.850 -0.231 6.500) 22.797 6.799 ( 2.540 -5.535 5.598) 8.272 6.996 ( -6.800 -2.603 6.270) 9.609 7.214 ( -24.011 1.984 3.581) 24.358 7.630 ( -13.399 -6.702 18.069) 23.472 7.881 ( -0.134 -6.269 3.129) 7.008 8.534 ( -11.341 0.186 2.139) 11.542 8.594 ( -7.155 0.464 2.774) 7.688 8.712 ( -8.536 -0.795 12.137) 14.859 8.997 ( -9.245 4.554 9.896) 14.287 9.308 ( -8.763 -0.225 -5.190) 10.187 10.055 ( -18.148 -0.216 11.356) 21.409 10.436 ( -27.954 1.630 17.655) 33.103 11.123 ( -19.784 3.467 14.814) 24.958 12.825 ( 4.602 -3.722 -8.425) 10.296 13.344 ( 5.322 5.357 -6.820) 10.175 13.760 ( -1.420 -2.941 3.538) 4.815 14.079 ( -1.106 4.710 6.820) 8.361 14.290 ( -7.989 0.391 0.183) 8.000 14.619 ( -11.091 5.138 -10.237) 15.944 15.764 ( 15.244 -8.949 -24.860) 30.504 19.574 ( -24.681 2.639 19.087) 31.312 20.087 ( -13.694 -2.148 9.539) 16.827 ======================= Grid point 174 (54/343) ======================= q-point: ( 0.38 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.248 ( -12.932 -6.279 12.900) 19.316 2.587 ( -7.081 -2.378 11.919) 14.066 2.680 ( -8.900 -0.801 12.044) 14.997 2.851 ( 0.081 3.453 6.450) 7.316 2.980 ( -2.554 -1.839 7.423) 8.063 3.233 ( -3.761 3.013 1.712) 5.114 3.309 ( -14.220 8.093 6.442) 17.584 3.633 ( 3.435 1.309 1.168) 3.857 3.742 ( 5.994 -1.317 -1.938) 6.436 5.566 ( -6.933 -1.113 9.047) 11.452 5.717 ( -7.008 1.160 7.497) 10.328 6.031 ( -3.544 0.008 14.757) 15.177 6.201 ( -0.132 0.955 -1.284) 1.606 6.514 ( -10.529 -3.084 8.546) 13.907 6.929 ( -11.165 -6.256 7.877) 15.028 7.130 ( -8.502 0.286 1.217) 8.594 7.514 ( -6.710 -5.115 5.529) 10.087 7.912 ( -9.541 -1.922 10.594) 14.386 8.093 ( -13.011 -3.640 13.067) 18.796 8.682 ( -6.830 1.549 3.239) 7.716 8.747 ( -9.855 3.896 -1.278) 10.674 8.977 ( -9.343 -1.115 5.165) 10.733 9.251 ( -5.941 5.221 9.504) 12.364 9.407 ( -10.226 -0.839 2.148) 10.483 10.460 ( -17.817 -1.250 12.051) 21.546 11.035 ( -24.513 4.444 15.179) 29.172 11.609 ( -19.136 7.341 14.726) 25.238 12.624 ( 5.129 -3.635 -9.471) 11.368 13.184 ( 5.644 5.952 -8.386) 11.731 13.781 ( 0.168 -10.399 0.130) 10.401 14.162 ( -1.459 0.770 1.191) 2.035 14.446 ( -5.562 0.539 7.185) 9.102 14.664 ( -9.052 8.936 -6.207) 14.153 15.338 ( 2.683 -9.592 -13.885) 17.088 20.114 ( -20.210 0.528 13.823) 24.491 20.338 ( -9.142 1.088 5.023) 10.488 ======================= Grid point 175 (55/343) ======================= q-point: ( 0.46 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( -7.952 -5.752 6.341) 11.685 2.828 ( -7.196 0.197 8.953) 11.488 2.878 ( -1.639 1.033 3.542) 4.037 2.953 ( -2.384 0.422 8.816) 9.142 3.110 ( -4.221 -1.606 5.299) 6.962 3.300 ( -2.486 1.577 0.990) 3.106 3.434 ( 1.973 -0.930 0.399) 2.217 3.601 ( 6.696 0.688 -2.547) 7.197 3.729 ( -5.532 5.858 2.907) 8.566 5.750 ( -5.035 -0.403 5.544) 7.500 5.881 ( -4.001 -1.324 4.379) 6.077 6.106 ( 1.795 2.921 -2.208) 4.077 6.262 ( -1.911 0.588 7.686) 7.941 6.704 ( -0.667 -3.409 11.593) 12.102 7.143 ( -7.651 -0.385 2.025) 7.924 7.279 ( -11.724 -1.949 1.715) 12.008 7.577 ( 1.126 -6.212 4.519) 7.764 8.214 ( -11.823 2.677 8.202) 14.636 8.403 ( -8.846 -2.667 11.411) 14.683 8.797 ( -8.169 3.289 -4.921) 10.087 8.846 ( -6.163 1.380 0.274) 6.322 9.078 ( -4.414 -0.070 -1.783) 4.761 9.460 ( -3.063 3.310 9.373) 10.401 9.588 ( -6.736 -1.564 5.548) 8.866 10.833 ( -14.258 -0.805 10.386) 17.658 11.524 ( -17.865 2.418 12.642) 22.019 12.065 ( -14.592 11.107 11.481) 21.636 12.409 ( 5.113 -3.987 -9.279) 11.320 13.023 ( 4.727 5.751 -7.247) 10.389 13.649 ( 4.487 -15.658 -6.962) 17.714 14.187 ( 0.233 2.151 1.569) 2.673 14.592 ( -4.011 0.031 4.054) 5.703 14.771 ( -6.843 8.710 -0.087) 11.077 15.224 ( -5.248 -8.105 -3.223) 10.180 20.465 ( -7.543 1.086 3.998) 8.606 20.507 ( -10.369 0.250 5.838) 11.903 ======================= Grid point 176 (56/343) ======================= q-point: ( 0.54 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( -4.554 -2.101 2.098) 5.437 2.881 ( 2.279 1.724 0.410) 2.887 3.009 ( -3.819 -0.065 3.659) 5.289 3.092 ( -2.419 -2.128 4.942) 5.899 3.216 ( -4.931 0.505 1.803) 5.275 3.339 ( -0.798 0.776 0.726) 1.329 3.390 ( 1.470 -1.369 -0.865) 2.187 3.467 ( 6.181 0.588 -3.004) 6.897 3.828 ( -0.593 2.545 1.591) 3.060 5.821 ( -0.440 0.330 0.179) 0.579 5.938 ( -2.103 -0.760 0.530) 2.298 6.110 ( -0.940 0.340 0.545) 1.138 6.345 ( 0.118 0.124 2.724) 2.729 6.831 ( 1.160 -1.085 8.090) 8.244 7.193 ( -2.387 2.050 -2.926) 4.297 7.430 ( -5.074 -2.086 2.232) 5.923 7.596 ( -0.176 -2.489 2.345) 3.424 8.409 ( -4.217 1.604 2.226) 5.031 8.603 ( -3.270 -0.910 5.936) 6.838 8.801 ( -4.114 1.211 -6.218) 7.554 8.924 ( -2.838 0.151 0.445) 2.876 9.091 ( -1.051 -0.023 -0.980) 1.438 9.580 ( 0.522 1.453 3.809) 4.110 9.700 ( -2.437 -1.113 2.539) 3.691 11.082 ( -6.153 -0.277 4.447) 7.597 11.886 ( -11.667 0.772 10.581) 15.769 12.142 ( 6.792 -0.206 -9.543) 11.715 12.385 ( -3.709 5.713 2.523) 7.264 12.926 ( 2.293 1.113 -2.548) 3.604 13.465 ( 1.101 -7.173 -2.427) 7.652 14.208 ( 1.463 0.774 1.717) 2.385 14.665 ( -2.218 0.146 0.472) 2.272 14.855 ( -2.837 2.563 -1.589) 4.140 15.265 ( -3.093 -2.699 1.859) 4.507 20.533 ( -1.289 0.735 0.115) 1.488 20.687 ( -4.524 -0.270 2.662) 5.256 ======================= Grid point 177 (57/343) ======================= q-point: (-0.38 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.651 ( 0.131 2.225 -1.684) 2.794 2.846 ( 0.521 -2.517 -2.218) 3.395 3.030 ( 2.268 2.442 -2.796) 4.350 3.100 ( 1.606 -1.115 -3.951) 4.408 3.230 ( 4.440 2.458 -2.729) 5.763 3.325 ( 0.016 -1.300 -1.903) 2.305 3.404 ( -2.438 0.614 1.071) 2.732 3.450 ( -5.079 -1.656 2.981) 6.118 3.797 ( 6.147 -1.369 -0.569) 6.324 5.828 ( -1.934 1.061 -1.568) 2.706 5.940 ( 1.009 -0.335 -1.471) 1.815 6.094 ( 2.079 -1.687 -1.332) 2.990 6.341 ( 1.944 -0.313 -1.259) 2.337 6.857 ( -0.982 2.051 -4.891) 5.393 7.183 ( 2.700 0.477 1.863) 3.315 7.435 ( 5.176 -1.112 -0.208) 5.298 7.635 ( -3.432 2.478 -0.761) 4.301 8.394 ( 4.946 -0.393 -3.699) 6.189 8.609 ( -1.266 -0.201 -9.203) 9.292 8.783 ( 7.058 -1.020 6.209) 9.456 8.921 ( 1.962 -0.253 -1.862) 2.716 9.090 ( 1.211 -0.132 1.091) 1.635 9.560 ( 1.711 -1.065 -4.149) 4.613 9.711 ( 2.379 0.388 -1.139) 2.666 11.085 ( 5.281 0.095 -4.813) 7.146 11.871 ( 11.775 -1.037 -11.415) 16.432 12.121 ( -3.796 -2.328 4.833) 6.571 12.370 ( 3.477 2.816 -2.341) 5.050 12.870 ( 1.167 -5.265 1.773) 5.677 13.588 ( -8.121 8.165 9.744) 15.086 14.187 ( 3.134 -1.948 0.067) 3.691 14.664 ( 0.597 -0.014 -2.269) 2.346 14.814 ( 2.495 -2.573 -4.519) 5.768 15.304 ( 2.080 2.223 2.619) 4.016 20.524 ( 1.898 -0.453 -0.803) 2.110 20.689 ( 4.393 0.033 -2.496) 5.052 ======================= Grid point 178 (58/343) ======================= q-point: (-0.31 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.583 ( 4.508 6.367 -6.510) 10.161 2.779 ( 0.491 -4.846 -6.025) 7.747 2.901 ( 7.126 2.760 -6.103) 9.779 2.944 ( 5.046 -0.962 -10.220) 11.438 3.137 ( 3.495 1.651 -4.175) 5.690 3.278 ( 1.985 -1.270 -2.528) 3.456 3.447 ( 1.386 0.939 -1.350) 2.150 3.546 ( -3.905 -5.345 0.551) 6.642 3.690 ( 3.258 -0.056 1.095) 3.438 5.779 ( 3.778 3.363 -6.594) 8.311 5.865 ( 3.195 -3.170 -6.104) 7.584 6.074 ( -1.901 -1.278 2.820) 3.634 6.248 ( 3.414 -0.918 -7.039) 7.877 6.756 ( 1.291 2.910 -10.359) 10.837 7.162 ( 6.233 1.680 2.134) 6.799 7.288 ( 11.796 -0.520 -3.394) 12.285 7.667 ( -2.765 5.238 -3.601) 6.932 8.195 ( 12.064 -0.107 -6.905) 13.901 8.423 ( 4.179 0.170 -14.425) 15.020 8.745 ( 11.160 -3.170 7.568) 13.852 8.825 ( 5.198 -1.156 -4.273) 6.828 9.080 ( 4.798 0.105 2.740) 5.526 9.420 ( 3.169 -1.990 -10.805) 11.435 9.602 ( 8.049 0.456 -4.520) 9.243 10.843 ( 13.422 0.498 -10.567) 17.090 11.488 ( 19.194 -2.070 -13.526) 23.573 11.943 ( 13.674 -5.122 -11.750) 18.743 12.467 ( -5.117 3.387 8.467) 10.457 12.947 ( -3.812 -4.058 8.023) 9.766 13.871 ( -5.180 14.001 7.492) 16.703 14.129 ( 1.590 -6.134 0.284) 6.344 14.594 ( 3.282 0.373 -4.156) 5.309 14.665 ( 7.648 -5.374 -3.621) 10.024 15.315 ( 3.864 4.052 5.026) 7.524 20.454 ( 5.656 -0.373 -2.466) 6.182 20.500 ( 12.501 -0.522 -7.744) 14.715 ======================= Grid point 179 (59/343) ======================= q-point: (-0.23 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.339 ( 13.779 4.748 -15.596) 21.346 2.598 ( 6.067 -0.140 -15.187) 16.354 2.719 ( 4.954 3.180 -8.097) 10.011 2.777 ( 0.987 -4.834 -5.173) 7.148 3.019 ( 4.446 2.262 -6.707) 8.358 3.167 ( 13.057 -4.756 -6.710) 15.432 3.226 ( 10.320 -2.261 -4.124) 11.341 3.624 ( -7.793 -0.199 0.325) 7.803 3.758 ( -4.722 0.684 2.134) 5.227 5.605 ( 6.527 4.023 -9.436) 12.158 5.671 ( 6.624 -4.506 -9.058) 12.093 6.038 ( 4.153 0.551 -14.233) 14.837 6.182 ( -2.604 -1.058 3.270) 4.312 6.551 ( 12.856 1.499 -8.276) 15.363 7.008 ( 12.309 3.492 -7.116) 14.641 7.118 ( 6.546 -0.938 -0.297) 6.619 7.579 ( 11.630 2.722 -7.382) 14.041 7.971 ( 4.517 4.605 -5.861) 8.716 8.121 ( 9.312 0.123 -16.427) 18.883 8.665 ( 7.148 -0.567 -2.122) 7.478 8.683 ( 8.756 -3.720 1.851) 9.692 8.995 ( 10.688 1.005 -2.263) 10.971 9.182 ( 5.345 -3.234 -13.293) 14.688 9.414 ( 10.688 0.179 -1.841) 10.847 10.474 ( 17.715 0.579 -12.167) 21.499 10.979 ( 24.997 -2.428 -15.209) 29.361 11.534 ( 17.421 -2.664 -13.997) 22.505 12.670 ( -5.285 2.015 8.941) 10.580 13.119 ( -5.155 -2.540 9.127) 10.785 13.909 ( 4.317 5.978 -4.100) 8.437 14.139 ( -2.768 -1.893 -4.228) 5.396 14.440 ( 10.146 -0.145 -3.296) 10.669 14.568 ( 6.963 -3.719 7.096) 10.614 15.437 ( -3.612 3.670 14.078) 14.990 20.107 ( 20.696 -0.293 -14.739) 25.410 20.326 ( 8.426 -0.450 -4.132) 9.396 ======================= Grid point 180 (60/343) ======================= q-point: (-0.15 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( 19.951 1.091 -21.493) 29.346 2.182 ( 12.081 -0.824 -25.935) 28.623 2.591 ( 16.330 2.347 -8.352) 18.491 2.621 ( 10.199 -1.324 -7.653) 12.819 2.776 ( 3.988 -1.249 -7.523) 8.605 2.862 ( 5.179 -1.537 -8.259) 9.868 3.114 ( 3.684 -1.038 -3.072) 4.907 3.741 ( -8.838 1.586 -0.066) 8.980 3.839 ( -3.523 -0.596 1.272) 3.792 5.392 ( 5.648 2.889 -11.490) 13.125 5.437 ( 8.965 -3.114 -7.284) 11.963 5.768 ( 3.188 0.258 -16.451) 16.759 6.105 ( 14.561 1.822 -5.985) 15.849 6.180 ( 24.632 -0.950 -7.613) 25.799 6.851 ( -1.556 1.225 -4.403) 4.828 7.030 ( 3.669 1.203 -4.161) 5.677 7.191 ( 27.915 -0.753 -5.280) 28.420 7.702 ( 15.748 1.976 -18.335) 24.251 7.954 ( -3.621 2.281 -4.477) 6.193 8.545 ( 7.234 1.059 0.678) 7.342 8.578 ( 7.670 -1.087 -1.843) 7.963 8.727 ( 12.474 0.717 -10.886) 16.572 8.933 ( 5.398 -2.336 -9.876) 11.495 9.310 ( 8.516 0.050 4.798) 9.775 10.055 ( 19.345 -0.070 -11.768) 22.644 10.420 ( 24.615 -0.407 -14.949) 28.801 11.089 ( 18.767 -0.887 -14.257) 23.585 12.861 ( -4.998 0.918 8.090) 9.553 13.294 ( -4.444 -1.156 7.542) 8.830 13.797 ( 3.940 1.315 -4.757) 6.315 14.015 ( -0.841 -2.227 -13.847) 14.050 14.291 ( 10.539 0.141 2.801) 10.906 14.573 ( 11.363 -1.085 11.568) 16.251 15.848 ( -15.465 2.104 24.789) 29.293 19.548 ( 25.341 -0.694 -20.404) 32.542 20.110 ( 12.095 0.609 -7.560) 14.276 ======================= Grid point 181 (61/343) ======================= q-point: (-0.08 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( 21.525 0.000 -24.467) 32.587 1.580 ( 16.379 0.000 -33.833) 37.590 1.927 ( 40.585 0.000 -18.719) 44.694 2.471 ( 4.546 0.000 -5.771) 7.346 2.656 ( 6.954 0.000 -8.775) 11.196 2.793 ( -8.923 -0.000 -2.798) 9.351 3.026 ( 3.026 0.000 -2.587) 3.982 3.881 ( -1.186 -0.000 0.860) 1.465 3.883 ( -10.686 -0.000 0.951) 10.728 5.179 ( 6.136 0.000 -8.084) 10.149 5.212 ( 9.776 0.000 -5.512) 11.223 5.549 ( 0.775 0.000 -12.152) 12.177 5.740 ( 19.827 0.000 -9.248) 21.878 5.742 ( 22.883 0.000 -4.784) 23.377 6.596 ( 25.728 0.000 -11.073) 28.009 6.830 ( 12.476 0.000 -14.378) 19.036 7.011 ( 0.608 -0.000 7.786) 7.810 7.254 ( 16.444 0.000 -12.435) 20.617 7.906 ( 2.025 0.000 -5.370) 5.739 8.316 ( 16.594 0.000 -7.936) 18.394 8.412 ( 8.614 0.000 -3.934) 9.469 8.682 ( -7.965 -0.000 7.087) 10.662 8.713 ( 7.719 0.000 -11.011) 13.447 9.280 ( 5.451 0.000 4.272) 6.926 9.692 ( 12.844 0.000 -7.129) 14.690 9.954 ( 17.166 0.000 -10.862) 20.314 10.638 ( 19.122 0.000 -13.883) 23.630 13.024 ( -4.183 -0.000 6.268) 7.536 13.424 ( -2.640 -0.000 4.607) 5.309 13.705 ( 2.330 0.000 -2.524) 3.435 13.832 ( -2.333 0.000 -14.367) 14.555 14.236 ( 6.661 0.000 5.952) 8.933 14.561 ( 15.338 0.000 14.120) 20.848 16.488 ( -22.038 -0.000 29.314) 36.674 18.907 ( 24.446 0.000 -21.900) 32.821 19.794 ( 15.518 0.000 -11.515) 19.323 ======================= Grid point 182 (62/343) ======================= q-point: ( 0.00 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.856 ( 32.922 0.000 -0.000) 32.922 0.870 ( 30.323 0.000 -0.000) 30.323 1.608 ( 55.573 0.000 -0.000) 55.573 2.408 ( 5.515 0.000 -0.000) 5.515 2.513 ( 8.678 0.000 -0.000) 8.678 2.755 ( -10.155 -0.000 0.000) 10.155 2.993 ( 3.515 0.000 -0.000) 3.515 3.893 ( -1.632 -0.000 0.000) 1.632 3.905 ( -12.418 -0.000 0.000) 12.418 5.018 ( 3.034 0.000 -0.000) 3.034 5.129 ( 3.395 0.000 -0.000) 3.395 5.380 ( 5.416 0.000 -0.000) 5.416 5.544 ( 16.467 0.000 -0.000) 16.467 5.644 ( 13.914 0.000 -0.000) 13.914 6.565 ( 12.585 0.000 -0.000) 12.585 6.604 ( 24.321 0.000 -0.000) 24.321 7.080 ( 22.965 0.000 -0.000) 22.965 7.247 ( 6.780 0.000 -0.000) 6.780 7.896 ( 6.561 0.000 -0.000) 6.561 8.124 ( 13.847 0.000 -0.000) 13.847 8.271 ( -2.853 -0.000 0.000) 2.853 8.638 ( 24.308 0.000 -0.000) 24.308 8.794 ( -21.579 -0.000 0.000) 21.579 9.374 ( 10.903 0.000 -0.000) 10.903 9.617 ( 14.149 0.000 -0.000) 14.149 9.791 ( 13.557 0.000 -0.000) 13.557 10.422 ( 23.285 0.000 -0.000) 23.285 13.151 ( -2.469 -0.000 0.000) 2.469 13.487 ( -1.389 -0.000 0.000) 1.389 13.533 ( -0.544 -0.000 0.000) 0.544 13.672 ( 0.571 0.000 -0.000) 0.571 14.335 ( 4.459 0.000 -0.000) 4.459 14.891 ( 5.617 0.000 -0.000) 5.617 16.954 ( -32.623 -0.000 0.000) 32.623 18.585 ( 30.759 0.000 -0.000) 30.759 19.624 ( 24.480 0.000 -0.000) 24.480 ======================= Grid point 184 (63/343) ======================= q-point: ( 0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.807 ( -0.000 7.850 28.422) 29.486 1.004 ( -0.000 16.727 31.145) 35.353 1.475 ( -0.000 5.705 47.593) 47.934 2.427 ( 0.000 -6.876 7.363) 10.074 2.489 ( 0.000 -5.227 10.177) 11.440 2.965 ( -0.000 2.893 1.217) 3.139 2.995 ( -0.000 3.408 3.322) 4.759 3.859 ( 0.000 -14.576 -0.183) 14.577 4.158 ( -0.000 10.050 -2.981) 10.483 4.665 ( 0.000 -1.813 1.124) 2.133 4.963 ( -0.000 1.580 -4.501) 4.770 5.379 ( 0.000 -3.488 5.844) 6.805 5.522 ( 0.000 -5.385 14.684) 15.641 5.634 ( -0.000 7.758 8.799) 11.730 6.069 ( -0.000 1.361 29.519) 29.550 6.518 ( -0.000 -1.099 29.497) 29.518 7.041 ( 0.000 -5.143 11.767) 12.842 7.122 ( 0.000 -0.567 2.966) 3.020 7.829 ( -0.000 1.601 4.849) 5.107 8.030 ( 0.000 -6.428 13.608) 15.050 8.166 ( 0.000 -1.265 0.675) 1.433 8.695 ( -0.000 -2.504 20.440) 20.593 8.751 ( 0.000 0.041 -20.758) 20.758 9.298 ( 0.000 -0.739 -1.242) 1.445 9.539 ( -0.000 -0.282 10.148) 10.152 9.595 ( 0.000 -29.108 18.343) 34.406 10.315 ( -0.000 0.071 19.484) 19.484 13.119 ( 0.000 -0.174 -7.855) 7.857 13.498 ( -0.000 9.257 -3.994) 10.082 13.666 ( -0.000 0.143 0.875) 0.887 14.041 ( -0.000 6.663 -3.225) 7.402 14.100 ( -0.000 -0.061 2.843) 2.843 14.171 ( -0.000 9.537 -6.348) 11.456 16.825 ( 0.000 -4.127 -38.950) 39.168 18.576 ( -0.000 4.097 27.308) 27.614 19.523 ( 0.000 -8.484 22.937) 24.456 ======================= Grid point 185 (64/343) ======================= q-point: ( 0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.416 ( -16.538 1.247 25.331) 30.278 1.601 ( -24.157 15.717 23.347) 37.090 2.124 ( -6.692 5.719 36.433) 37.481 2.509 ( 0.529 -8.237 10.376) 13.258 2.668 ( -4.642 -6.614 11.828) 14.325 2.978 ( 4.021 5.421 3.869) 7.779 3.065 ( -0.554 3.285 4.271) 5.417 3.795 ( 0.794 -12.894 0.179) 12.919 4.066 ( 9.449 7.520 -2.328) 12.298 4.957 ( -25.920 -4.151 7.388) 27.271 5.125 ( -16.059 3.268 6.376) 17.585 5.518 ( -11.274 -1.898 5.637) 12.747 5.725 ( -1.695 -4.036 16.226) 16.806 5.826 ( 1.429 3.736 18.594) 19.019 6.543 ( -13.839 2.173 19.988) 24.408 6.916 ( -5.442 -3.205 17.433) 18.542 7.021 ( 4.121 -5.370 0.630) 6.798 7.294 ( -5.971 -0.241 14.217) 15.421 7.942 ( -1.580 -2.033 8.345) 8.733 8.228 ( -6.009 -5.975 7.561) 11.357 8.294 ( -9.466 -0.223 6.145) 11.288 8.527 ( -7.199 -0.359 -11.891) 13.905 8.967 ( 3.635 -1.268 22.353) 22.682 9.269 ( 3.040 -0.048 1.912) 3.592 9.723 ( -4.818 0.165 14.729) 15.498 9.894 ( -12.039 -4.372 20.418) 24.103 10.662 ( -10.702 0.431 18.806) 21.643 12.972 ( 3.501 -4.454 -8.261) 10.016 13.431 ( 3.754 7.121 -6.455) 10.318 13.709 ( -2.062 0.178 3.099) 3.727 13.992 ( -2.709 -2.210 -2.511) 4.304 14.120 ( -0.512 6.347 2.017) 6.679 14.283 ( -10.479 6.334 -2.360) 12.470 16.191 ( 8.963 -5.762 -39.135) 40.560 19.070 ( -9.572 3.028 31.469) 33.032 19.844 ( -5.279 -4.881 20.307) 21.542 ======================= Grid point 186 (65/343) ======================= q-point: ( 0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -12.718 -2.239 21.798) 25.336 2.254 ( -22.224 8.734 16.917) 29.264 2.567 ( -1.200 -8.318 12.790) 15.304 2.716 ( -9.818 8.027 18.903) 22.763 2.842 ( -1.845 -5.116 10.482) 11.809 3.027 ( 2.940 7.397 7.093) 10.662 3.145 ( -1.375 1.816 4.255) 4.827 3.748 ( 1.115 -8.748 0.115) 8.819 3.940 ( 8.900 4.485 -1.119) 10.029 5.377 ( -13.682 -2.715 10.344) 17.366 5.450 ( -13.947 1.282 11.268) 17.976 5.829 ( -18.548 -0.069 7.755) 20.104 5.988 ( -9.874 -5.221 13.212) 17.301 6.113 ( -4.140 2.048 17.980) 18.564 6.776 ( -2.248 -0.149 -3.890) 4.495 7.060 ( -3.575 -4.865 7.834) 9.891 7.172 ( -8.732 2.258 14.664) 17.216 7.654 ( -16.558 -3.473 12.672) 21.138 7.983 ( 3.488 -8.916 3.099) 10.064 8.339 ( -11.264 1.576 -2.574) 11.661 8.499 ( -8.992 0.186 7.756) 11.876 8.719 ( -13.120 -2.794 9.443) 16.405 9.181 ( 4.297 4.772 17.441) 18.585 9.302 ( 1.755 0.079 9.315) 9.479 10.067 ( -10.982 -0.209 18.508) 21.521 10.402 ( -16.991 4.485 23.627) 29.445 11.089 ( -15.231 1.939 17.246) 23.090 12.782 ( 4.372 -4.748 -9.183) 11.225 13.286 ( 5.087 6.013 -9.122) 12.052 13.774 ( -2.207 -3.136 1.555) 4.138 14.033 ( -7.735 -3.732 -0.390) 8.597 14.217 ( -5.779 6.159 1.005) 8.506 14.427 ( -6.340 5.526 4.422) 9.502 15.570 ( 7.135 -7.708 -30.009) 31.794 19.648 ( -12.376 1.381 28.940) 31.506 20.147 ( -4.523 -1.088 15.715) 16.390 ======================= Grid point 187 (66/343) ======================= q-point: ( 0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.323 ( -9.910 -7.222 15.780) 19.984 2.655 ( -4.771 -6.518 8.914) 12.029 2.726 ( -8.851 3.166 11.719) 15.023 2.958 ( 1.152 3.126 8.136) 8.792 3.058 ( -1.431 2.799 7.799) 8.409 3.195 ( -10.400 8.722 10.046) 16.886 3.229 ( -2.041 0.832 3.940) 4.515 3.694 ( 3.311 -3.516 -0.377) 4.845 3.820 ( 8.497 1.755 -0.875) 8.720 5.611 ( -5.987 -1.691 9.019) 10.956 5.767 ( -6.823 -0.608 12.303) 14.082 6.126 ( -4.949 -0.376 7.177) 8.726 6.185 ( -3.704 -0.182 1.563) 4.024 6.403 ( -14.247 0.070 6.057) 15.482 6.843 ( -12.416 -2.919 4.004) 13.368 7.178 ( 0.126 -1.571 10.555) 10.672 7.488 ( -11.984 -1.218 3.849) 12.645 7.942 ( -11.773 -5.591 3.025) 13.379 8.047 ( -9.590 -2.385 7.946) 12.681 8.479 ( -11.266 -0.472 -0.925) 11.313 8.707 ( -2.724 2.668 9.332) 10.080 8.961 ( -7.646 -1.445 5.663) 9.624 9.380 ( 0.458 5.612 14.663) 15.707 9.505 ( -1.065 -0.047 19.452) 19.481 10.482 ( -11.679 -1.085 19.448) 22.711 10.974 ( -17.790 6.032 21.599) 28.625 11.548 ( -16.971 4.922 15.987) 23.829 12.574 ( 4.649 -4.846 -9.740) 11.830 13.104 ( 4.858 6.383 -10.434) 13.161 13.763 ( -2.373 -10.596 -5.050) 11.975 14.106 ( -3.921 2.237 -1.916) 4.904 14.354 ( -9.817 0.120 2.018) 10.023 14.593 ( -2.891 7.810 5.611) 10.042 15.211 ( -1.621 -8.514 -10.566) 13.666 20.164 ( -10.210 0.011 23.404) 25.534 20.378 ( -1.805 1.239 11.989) 12.188 ======================= Grid point 188 (67/343) ======================= q-point: ( 0.46 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( -3.427 -9.005 8.981) 13.172 2.817 ( -8.380 -4.243 6.141) 11.222 2.940 ( 0.277 3.870 6.632) 7.683 3.056 ( 0.824 3.295 7.932) 8.629 3.138 ( -0.908 -1.032 3.220) 3.501 3.304 ( -1.346 0.035 3.731) 3.966 3.448 ( -4.514 2.529 3.072) 6.018 3.639 ( 3.194 3.605 -1.377) 5.009 3.716 ( 4.613 2.450 1.179) 5.355 5.786 ( -4.437 -2.279 7.169) 8.734 5.948 ( 1.770 -3.437 6.647) 7.689 6.075 ( 0.666 2.566 -2.937) 3.956 6.323 ( -2.001 2.870 5.507) 6.524 6.610 ( -13.775 -1.527 -4.681) 14.629 7.097 ( -14.047 -3.087 4.642) 15.113 7.327 ( 3.814 0.756 14.412) 14.927 7.575 ( -6.234 -3.573 -4.432) 8.442 8.156 ( -16.285 -2.230 -0.342) 16.440 8.283 ( -13.198 0.488 3.067) 13.558 8.603 ( -7.927 -1.818 0.459) 8.146 8.848 ( 1.720 1.595 10.180) 10.447 9.096 ( -1.921 -0.167 6.259) 6.550 9.584 ( 0.155 4.740 11.468) 12.410 9.777 ( 3.141 -1.103 20.902) 21.165 10.873 ( -8.684 -1.086 17.294) 19.382 11.485 ( -15.569 3.620 17.296) 23.551 11.994 ( -14.515 8.353 12.688) 21.011 12.364 ( 4.253 -5.307 -8.934) 11.228 12.939 ( 2.693 6.960 -8.920) 11.630 13.608 ( 0.700 -14.641 -11.568) 18.672 14.128 ( -3.418 7.287 -3.503) 8.779 14.485 ( -7.867 -3.331 -1.108) 8.615 14.725 ( -5.229 3.735 4.159) 7.654 15.235 ( -3.541 -4.579 7.727) 9.654 20.519 ( -0.019 0.987 11.539) 11.581 20.558 ( -3.717 0.168 15.670) 16.106 ======================= Grid point 189 (68/343) ======================= q-point: ( 0.54 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( -1.118 -5.656 4.474) 7.298 2.934 ( 1.405 -0.726 1.180) 1.973 2.994 ( -1.432 1.655 3.043) 3.748 3.134 ( 0.983 -0.219 1.262) 1.615 3.186 ( -2.867 -0.992 2.666) 4.039 3.360 ( -0.030 -0.222 2.864) 2.873 3.430 ( 4.321 -2.908 -0.758) 5.264 3.540 ( 7.938 2.009 -0.490) 8.203 3.795 ( -3.869 7.527 1.599) 8.612 5.858 ( 3.259 -3.064 -0.208) 4.478 5.920 ( -2.571 -1.676 1.194) 3.293 6.135 ( 0.417 0.913 4.850) 4.952 6.391 ( 1.541 2.624 2.763) 4.111 6.638 ( -9.787 0.560 -13.555) 16.728 7.273 ( -7.609 0.546 -0.315) 7.635 7.451 ( 4.409 0.275 11.407) 12.233 7.565 ( -3.064 -1.885 -4.366) 5.657 8.295 ( -14.807 -2.742 -8.968) 17.527 8.463 ( -12.222 -1.000 -3.668) 12.800 8.692 ( -1.844 -1.183 3.867) 4.445 8.962 ( 2.796 -0.297 10.761) 11.122 9.194 ( 2.419 0.200 8.847) 9.174 9.684 ( 6.003 3.001 6.893) 9.621 9.946 ( 10.699 -0.604 17.979) 20.931 11.138 ( -1.533 -1.010 10.464) 10.623 11.885 ( -11.678 1.116 13.172) 17.638 12.106 ( 5.221 -1.913 -7.930) 9.685 12.348 ( -5.283 3.636 3.723) 7.415 12.876 ( -2.185 4.866 -3.053) 6.146 13.415 ( -2.177 -7.453 -7.503) 10.797 14.153 ( -3.589 6.098 -4.197) 8.227 14.523 ( -8.327 -2.652 -7.202) 11.325 14.852 ( -1.879 -3.031 5.790) 6.800 15.378 ( 1.691 0.455 10.688) 10.831 20.611 ( 4.413 0.605 8.288) 9.409 20.776 ( 1.950 -0.173 12.370) 12.524 ======================= Grid point 190 (69/343) ======================= q-point: (-0.38 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.658 ( 1.764 -1.630 0.868) 2.553 2.875 ( 5.166 -1.748 -1.031) 5.551 2.989 ( 1.774 1.236 -5.296) 5.720 3.084 ( 3.895 1.114 -3.193) 5.158 3.232 ( 1.169 -0.155 -1.219) 1.696 3.337 ( 2.413 -3.745 -0.181) 4.459 3.400 ( -1.351 -1.189 1.190) 2.157 3.480 ( 3.605 1.631 2.443) 4.650 3.846 ( 1.874 4.188 0.421) 4.607 5.816 ( -0.024 -2.667 -0.113) 2.670 5.939 ( 1.124 -1.194 -0.543) 1.727 6.147 ( 4.829 -0.820 2.048) 5.309 6.359 ( 5.023 1.813 -3.391) 6.326 6.566 ( -8.900 3.569 -14.301) 17.219 7.307 ( -2.153 3.877 -4.968) 6.660 7.499 ( 3.750 -0.019 2.850) 4.710 7.532 ( -0.186 -0.770 -2.566) 2.685 8.297 ( -7.538 -3.258 -11.866) 14.430 8.494 ( -8.208 -3.216 -10.146) 13.441 8.737 ( 5.065 -0.103 4.921) 7.062 9.040 ( 4.426 -1.514 7.557) 8.888 9.271 ( 6.052 0.471 10.701) 12.303 9.632 ( 12.405 -0.060 3.654) 12.932 9.967 ( 16.977 0.762 12.876) 21.321 11.158 ( 8.735 -0.985 0.228) 8.793 11.888 ( 9.318 -2.516 -8.112) 12.608 12.151 ( -4.447 -2.276 6.483) 8.184 12.370 ( 1.358 1.090 -1.532) 2.319 12.889 ( -2.772 -2.723 0.461) 3.913 13.510 ( -12.181 8.556 4.133) 15.449 14.144 ( -2.255 2.528 -5.241) 6.240 14.504 ( -7.781 -1.020 -10.400) 13.029 14.891 ( 4.310 -6.869 4.941) 9.496 15.461 ( 6.790 3.650 8.979) 11.834 20.635 ( 7.462 -0.611 7.209) 10.394 20.827 ( 10.446 0.134 7.282) 12.734 ======================= Grid point 191 (70/343) ======================= q-point: (-0.31 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( 7.484 2.805 -3.317) 8.653 2.753 ( 5.392 -3.105 -7.145) 9.474 2.838 ( 4.487 -0.347 -8.732) 9.824 2.955 ( 8.137 1.200 -3.950) 9.124 3.129 ( 5.487 1.935 -4.440) 7.318 3.305 ( 2.806 -3.277 0.317) 4.325 3.431 ( -1.119 0.564 -0.174) 1.265 3.508 ( -3.705 -2.022 0.439) 4.243 3.793 ( 7.697 1.320 0.877) 7.859 5.784 ( 6.001 -0.220 -1.422) 6.171 5.867 ( 3.953 -2.751 -3.946) 6.226 6.096 ( 2.246 -0.529 0.120) 2.311 6.186 ( 4.507 0.031 -10.232) 11.181 6.541 ( -5.866 4.851 -7.458) 10.656 7.220 ( 4.128 5.689 -9.621) 11.915 7.430 ( 7.190 -0.208 -0.243) 7.197 7.501 ( -3.000 0.816 -5.652) 6.450 8.148 ( 0.749 -0.806 -15.638) 15.677 8.413 ( 0.186 -3.765 -7.546) 8.435 8.664 ( 10.001 0.215 -0.365) 10.010 9.016 ( 7.383 -2.694 1.115) 7.938 9.311 ( 10.680 1.917 9.644) 14.517 9.478 ( 15.634 -4.296 4.826) 16.917 9.849 ( 20.555 1.120 7.524) 21.917 10.937 ( 15.661 -0.595 -6.156) 16.838 11.596 ( 16.857 -2.551 -8.186) 18.913 11.998 ( 12.898 -7.124 -10.274) 17.963 12.495 ( -6.184 3.629 8.543) 11.153 12.989 ( -6.188 -3.435 6.039) 9.305 13.757 ( -10.061 12.481 -0.915) 16.057 14.095 ( -1.988 -3.675 -6.030) 7.336 14.481 ( -5.769 5.032 -5.297) 9.309 14.834 ( 8.102 -9.852 4.886) 13.659 15.483 ( 7.967 4.873 8.078) 12.348 20.595 ( 11.089 -0.889 5.394) 12.363 20.684 ( 19.643 -0.263 1.759) 19.724 ======================= Grid point 192 (71/343) ======================= q-point: (-0.23 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 16.165 4.073 -9.908) 19.393 2.475 ( 9.338 -1.687 -17.320) 19.749 2.665 ( 4.939 -1.148 -6.064) 7.904 2.810 ( 7.148 -0.748 -1.623) 7.368 2.996 ( 6.380 4.176 -5.292) 9.281 3.237 ( 5.107 -3.879 -0.600) 6.441 3.370 ( 10.434 -1.877 -3.284) 11.099 3.543 ( -4.301 -1.695 -0.885) 4.708 3.738 ( 0.842 0.983 1.321) 1.850 5.608 ( 11.940 2.041 -5.301) 13.222 5.700 ( 8.037 -4.112 -5.577) 10.612 5.902 ( 6.682 1.543 -14.781) 16.295 6.194 ( -3.815 -1.459 4.552) 6.116 6.521 ( 0.637 4.315 -5.004) 6.638 6.967 ( 9.731 5.244 -15.114) 18.725 7.290 ( 13.837 -0.031 -0.457) 13.845 7.486 ( -8.389 1.062 -8.315) 11.860 7.882 ( 3.784 3.777 -17.419) 18.221 8.252 ( 17.953 -2.669 3.100) 18.413 8.500 ( 2.649 0.283 -8.677) 9.076 8.839 ( 10.581 -2.056 -7.725) 13.261 9.196 ( 18.855 4.279 2.780) 19.533 9.344 ( 17.716 -8.098 8.322) 21.182 9.672 ( 17.799 0.018 7.615) 19.359 10.598 ( 19.145 0.181 -8.143) 20.806 11.180 ( 26.041 -3.486 -8.566) 27.635 11.611 ( 17.530 -4.216 -11.809) 21.553 12.706 ( -5.753 2.773 8.540) 10.664 13.159 ( -6.658 -2.701 6.974) 10.013 13.802 ( -3.332 8.639 -9.139) 13.010 13.987 ( -2.252 -7.916 -11.209) 13.906 14.537 ( 4.940 9.586 2.974) 11.187 14.801 ( 3.105 -9.601 9.855) 14.104 15.555 ( -0.520 4.782 10.357) 11.420 20.326 ( 29.225 -0.613 -4.232) 29.536 20.480 ( 14.698 -0.626 2.699) 14.957 ======================= Grid point 193 (72/343) ======================= q-point: (-0.15 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.924 ( 24.367 2.406 -13.544) 27.981 2.018 ( 15.972 -3.656 -22.710) 28.004 2.567 ( 1.414 4.805 -3.401) 6.054 2.684 ( 7.651 -2.156 -2.143) 8.233 2.838 ( 8.216 3.642 -5.723) 10.654 3.007 ( 27.060 -6.282 -4.563) 28.152 3.157 ( 6.235 -2.733 -1.399) 6.950 3.615 ( -8.082 0.740 -0.974) 8.174 3.787 ( -4.877 0.409 -0.038) 4.894 5.365 ( 12.167 2.570 -6.623) 14.089 5.493 ( 10.012 -3.187 -5.555) 11.885 5.626 ( 5.416 0.536 -11.953) 13.134 6.194 ( 10.963 2.090 -4.139) 11.904 6.352 ( 15.828 0.942 -6.878) 17.284 6.703 ( 0.177 3.521 -10.072) 10.671 7.069 ( 10.541 1.484 -5.370) 11.922 7.474 ( 0.289 -1.407 -3.769) 4.033 7.647 ( 7.233 4.608 -9.317) 12.663 8.018 ( 23.704 1.074 7.846) 24.992 8.417 ( -8.073 -0.287 -7.882) 11.287 8.547 ( 9.320 -0.556 -12.264) 15.414 8.907 ( 24.934 7.075 -5.326) 26.460 9.154 ( 18.980 -8.551 7.660) 22.182 9.586 ( 14.228 -0.297 9.608) 17.171 10.217 ( 20.988 0.432 -7.358) 22.245 10.648 ( 32.211 -2.617 -8.632) 33.450 11.193 ( 20.026 -1.562 -10.340) 22.592 12.898 ( -4.979 1.912 7.633) 9.312 13.322 ( -5.485 -1.170 5.432) 7.808 13.724 ( -1.859 4.408 -10.008) 11.093 13.822 ( -0.582 -8.553 -10.232) 13.348 14.474 ( 10.406 2.349 3.021) 11.088 14.883 ( 6.811 -1.882 11.536) 13.528 15.869 ( -18.118 3.832 14.677) 23.630 19.780 ( 36.430 -1.579 -8.875) 37.529 20.270 ( 18.835 1.085 -0.434) 18.871 ======================= Grid point 194 (73/343) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( 30.181 0.400 -11.244) 32.209 1.429 ( 23.265 -2.959 -21.595) 31.880 2.360 ( 41.806 -3.794 -6.242) 42.440 2.512 ( 8.782 5.666 -1.307) 10.532 2.631 ( 2.012 7.421 -3.948) 8.643 2.695 ( 2.939 -9.289 -3.020) 10.200 3.060 ( 4.814 -1.760 -0.916) 5.207 3.738 ( -10.360 2.316 -0.076) 10.616 3.853 ( -4.771 -1.031 -0.104) 4.883 5.143 ( 8.780 1.655 -5.507) 10.496 5.261 ( 10.011 -0.716 -5.216) 11.312 5.466 ( 2.977 -0.598 -4.581) 5.496 5.856 ( 19.607 3.131 -9.352) 21.947 5.960 ( 22.703 -1.693 -7.311) 23.911 6.666 ( 0.448 1.769 -2.702) 3.261 6.873 ( 11.032 1.387 -5.034) 12.205 7.354 ( 16.874 0.884 5.881) 17.891 7.407 ( 19.073 0.186 -2.186) 19.199 7.906 ( 5.848 0.383 4.221) 7.222 8.315 ( 1.775 0.841 -9.078) 9.288 8.474 ( 20.507 3.485 -6.939) 21.928 8.530 ( -12.329 0.127 -2.412) 12.563 8.951 ( 22.203 -0.878 3.787) 22.541 9.504 ( 13.710 0.313 5.778) 14.881 9.860 ( 19.823 0.010 -3.092) 20.062 10.116 ( 27.740 1.400 -6.674) 28.566 10.785 ( 22.148 -0.341 -6.822) 23.177 13.058 ( -3.998 0.758 5.955) 7.212 13.436 ( -3.260 0.820 2.562) 4.226 13.615 ( -2.597 -2.854 -10.785) 11.454 13.703 ( 1.203 -3.752 -2.698) 4.775 14.393 ( 7.704 0.296 2.822) 8.210 14.909 ( 9.034 -0.198 9.572) 13.163 16.411 ( -29.658 2.114 13.032) 32.463 19.134 ( 37.998 -1.576 -8.620) 38.995 19.970 ( 22.925 2.270 -2.466) 23.169 ======================= Grid point 198 (74/343) ======================= q-point: ( 0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( -0.000 4.148 25.420) 25.757 1.813 ( -0.000 7.631 27.576) 28.612 2.525 ( -0.000 1.841 28.611) 28.670 2.713 ( 0.000 -7.226 12.721) 14.630 2.809 ( 0.000 -2.583 11.588) 11.873 3.053 ( -0.000 1.547 5.538) 5.750 3.122 ( -0.000 4.005 5.829) 7.073 3.835 ( 0.000 -9.761 -1.498) 9.876 4.070 ( -0.000 6.858 -3.201) 7.568 4.986 ( 0.000 -2.995 21.126) 21.337 5.119 ( -0.000 3.032 14.925) 15.230 5.527 ( -0.000 0.083 5.672) 5.673 5.989 ( 0.000 -6.476 17.993) 19.123 6.099 ( -0.000 4.162 20.401) 20.821 6.661 ( -0.000 1.238 9.802) 9.880 7.048 ( 0.000 -3.641 -2.939) 4.679 7.086 ( 0.000 -1.332 9.781) 9.872 7.433 ( -0.000 0.278 14.005) 14.008 8.001 ( -0.000 0.730 -2.282) 2.396 8.294 ( -0.000 0.092 -0.443) 0.452 8.348 ( -0.000 -0.327 12.534) 12.538 8.475 ( 0.000 -9.006 17.673) 19.835 9.284 ( -0.000 2.149 17.525) 17.656 9.354 ( -0.000 0.979 7.855) 7.916 9.884 ( -0.000 -0.022 14.906) 14.906 10.134 ( -0.000 3.755 27.816) 28.069 10.856 ( -0.000 -0.145 19.641) 19.642 12.893 ( 0.000 -4.311 -9.704) 10.618 13.329 ( -0.000 5.006 -9.284) 10.548 13.764 ( -0.000 0.074 7.598) 7.599 13.922 ( 0.000 -7.324 -3.997) 8.344 14.124 ( -0.000 11.006 0.766) 11.032 14.251 ( -0.000 0.003 8.959) 8.959 15.725 ( 0.000 -3.985 -38.336) 38.543 19.466 ( -0.000 1.035 35.459) 35.474 20.102 ( -0.000 -1.417 19.723) 19.773 ======================= Grid point 199 (75/343) ======================= q-point: ( 0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.011 ( -14.994 0.855 18.698) 23.983 2.243 ( -8.683 9.838 22.249) 25.830 2.797 ( 4.196 -8.181 12.651) 15.639 2.880 ( -2.242 0.936 16.175) 16.357 2.971 ( -1.982 -1.914 9.828) 10.207 3.138 ( 1.229 2.724 7.797) 8.350 3.211 ( 1.305 3.733 6.278) 7.420 3.782 ( 0.098 -8.987 -0.940) 9.037 4.009 ( 5.928 5.922 -1.820) 8.574 5.390 ( -12.592 -3.352 20.984) 24.700 5.457 ( -9.924 2.432 16.835) 19.693 5.681 ( -12.074 0.809 6.997) 13.978 6.176 ( 0.322 -5.482 12.461) 13.618 6.332 ( 2.933 2.139 13.995) 14.458 6.712 ( -0.288 1.244 -3.473) 3.700 7.055 ( -8.041 -5.892 0.977) 10.016 7.196 ( -6.078 0.865 2.923) 6.800 7.685 ( -4.005 0.278 16.864) 17.336 7.892 ( -5.741 -0.420 -13.758) 14.914 8.424 ( 3.746 -2.695 19.041) 19.592 8.556 ( -4.975 -0.127 11.884) 12.884 8.732 ( -8.938 -9.466 13.049) 18.433 9.467 ( 7.314 9.047 15.002) 18.985 9.513 ( 1.322 1.421 18.232) 18.335 10.179 ( -10.035 0.129 17.910) 20.530 10.606 ( -5.218 6.001 31.310) 32.304 11.170 ( -7.844 0.265 18.219) 19.837 12.718 ( 2.516 -5.366 -10.258) 11.847 13.179 ( 3.009 5.747 -12.067) 13.700 13.803 ( 2.523 -7.100 0.316) 7.542 13.980 ( -6.834 -3.482 6.822) 10.265 14.151 ( -0.410 10.023 0.070) 10.032 14.445 ( -5.150 1.798 10.690) 12.001 15.238 ( -0.255 -5.647 -27.617) 28.190 19.969 ( -3.709 0.342 33.138) 33.346 20.360 ( 0.285 0.083 18.300) 18.302 ======================= Grid point 200 (76/343) ======================= q-point: ( 0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.406 ( -11.762 -4.826 13.768) 18.740 2.684 ( -11.767 9.182 14.706) 20.953 2.840 ( 4.661 -8.673 8.967) 13.317 3.061 ( -0.150 0.682 7.482) 7.515 3.129 ( -1.763 5.138 8.134) 9.781 3.246 ( 0.436 3.221 8.101) 8.729 3.285 ( 0.703 0.680 5.835) 5.916 3.734 ( 1.362 -6.650 -0.867) 6.843 3.918 ( 7.795 4.118 -0.383) 8.824 5.670 ( -4.187 -1.035 9.307) 10.257 5.843 ( -9.186 -0.656 15.758) 18.251 6.018 ( -17.610 0.172 5.850) 18.557 6.235 ( 4.276 -4.741 1.024) 6.466 6.382 ( 1.080 3.754 1.166) 4.077 6.776 ( -8.816 0.907 5.177) 10.263 7.190 ( -12.555 -7.245 0.326) 14.499 7.327 ( -11.492 -0.465 -3.583) 12.047 7.851 ( -12.620 0.242 -9.495) 15.795 7.951 ( -0.725 1.234 15.776) 15.841 8.626 ( 3.956 -5.983 20.254) 21.487 8.777 ( -6.153 0.339 8.670) 10.637 8.975 ( -7.013 -4.054 10.965) 13.633 9.608 ( 7.131 10.613 16.226) 20.658 9.814 ( 0.066 -0.269 25.427) 25.428 10.597 ( -12.583 0.798 19.265) 23.024 11.117 ( -7.078 5.684 27.513) 28.972 11.552 ( -12.789 2.336 16.558) 21.052 12.520 ( 3.479 -6.274 -9.704) 12.068 12.984 ( 3.675 6.759 -12.681) 14.832 13.703 ( 0.471 -13.232 -7.451) 15.193 14.033 ( 1.841 8.387 -2.357) 8.905 14.336 ( -7.727 -2.356 11.185) 13.797 14.572 ( -0.873 4.176 -0.471) 4.292 15.080 ( -9.897 -5.155 -0.459) 11.169 20.435 ( -3.023 -0.392 28.278) 28.442 20.581 ( 2.627 1.304 16.667) 16.923 ======================= Grid point 201 (77/343) ======================= q-point: ( 0.46 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.663 ( -5.587 -8.956 9.613) 14.277 2.853 ( 0.955 -5.929 6.101) 8.560 2.998 ( -4.445 4.447 8.021) 10.191 3.133 ( 0.682 1.530 3.445) 3.830 3.220 ( 4.851 6.041 6.115) 9.870 3.358 ( -0.143 -0.478 5.284) 5.307 3.388 ( -6.529 5.279 3.807) 9.219 3.667 ( 3.618 -3.147 -1.248) 4.955 3.821 ( 8.340 2.674 0.775) 8.792 5.826 ( -4.369 -2.034 6.217) 7.866 5.987 ( 1.743 0.910 -7.185) 7.449 6.138 ( 0.656 -3.525 9.460) 10.117 6.288 ( -8.531 0.121 -0.038) 8.532 6.441 ( -3.546 2.406 1.552) 4.558 6.983 ( -11.830 0.735 0.791) 11.879 7.300 ( -11.097 -4.219 -5.880) 13.249 7.424 ( -13.866 -1.739 -5.130) 14.886 7.938 ( -18.712 -0.386 -10.848) 21.632 8.144 ( 4.330 1.312 15.526) 16.172 8.814 ( 4.228 -5.659 18.694) 19.984 8.953 ( -4.094 -0.447 7.315) 8.394 9.197 ( -2.090 0.296 13.588) 13.751 9.789 ( 5.670 7.700 17.323) 19.788 10.143 ( 2.886 -1.791 24.938) 25.168 11.007 ( -9.216 0.808 17.577) 19.863 11.566 ( -8.070 3.519 20.843) 22.626 11.959 ( -13.089 5.387 13.498) 19.559 12.324 ( 3.346 -7.082 -7.904) 11.128 12.810 ( 1.692 7.985 -10.407) 13.226 13.490 ( 0.869 -13.289 -13.934) 19.274 14.018 ( -0.418 8.583 -2.596) 8.976 14.407 ( -0.670 -4.054 -3.865) 5.641 14.726 ( -7.927 0.501 11.098) 13.647 15.300 ( -8.216 -1.671 10.927) 13.773 20.742 ( 5.280 1.152 15.599) 16.508 20.807 ( 0.532 -0.293 22.843) 22.851 ======================= Grid point 202 (78/343) ======================= q-point: ( 0.54 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.745 ( 2.359 -8.732 5.894) 10.796 2.923 ( -3.662 -4.211 1.790) 5.860 3.077 ( 4.801 3.930 3.156) 6.961 3.143 ( 1.661 1.571 -0.240) 2.299 3.245 ( 3.267 -0.152 4.379) 5.465 3.410 ( 0.764 -1.046 3.056) 3.319 3.484 ( 1.436 -2.201 0.460) 2.668 3.609 ( 3.424 5.807 -0.041) 6.741 3.767 ( 2.252 5.540 1.979) 6.299 5.844 ( 0.591 -2.592 -6.572) 7.089 5.941 ( -2.493 -2.586 3.790) 5.222 6.240 ( 0.796 2.222 5.317) 5.818 6.326 ( -6.092 -0.189 -8.214) 10.228 6.483 ( 3.932 1.900 2.845) 5.212 7.080 ( -10.538 1.649 -9.162) 14.061 7.348 ( -9.131 -2.054 -4.936) 10.581 7.513 ( -12.396 0.715 -9.155) 15.426 8.028 ( -18.845 -2.445 -13.231) 23.155 8.260 ( 6.067 -2.019 11.829) 13.447 8.975 ( 5.686 -3.493 17.356) 18.595 9.085 ( -1.143 -1.327 7.147) 7.359 9.390 ( 3.530 1.632 15.360) 15.844 9.940 ( 9.619 3.743 16.032) 19.067 10.362 ( 10.104 -1.637 20.498) 22.911 11.284 ( -0.904 -0.181 11.196) 11.233 11.919 ( -8.245 1.671 12.506) 15.072 12.095 ( 3.528 -4.361 -3.795) 6.773 12.320 ( -5.711 1.895 4.687) 7.627 12.761 ( -4.749 7.556 -2.980) 9.409 13.275 ( -2.988 -6.851 -10.829) 13.158 14.025 ( -2.302 6.201 -3.545) 7.505 14.338 ( -3.559 -2.875 -8.327) 9.501 14.952 ( -2.919 -3.957 10.946) 11.999 15.519 ( -2.137 1.249 10.236) 10.531 20.853 ( 8.190 0.468 14.113) 16.324 21.046 ( 5.738 -0.116 18.252) 19.133 ======================= Grid point 203 (79/343) ======================= q-point: (-0.38 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.733 ( 3.976 -5.291 2.696) 7.146 2.905 ( 2.452 -3.524 -4.339) 6.104 3.010 ( 8.388 1.732 -0.439) 8.576 3.111 ( 4.530 3.582 -0.275) 5.781 3.247 ( 1.334 -2.567 0.681) 2.972 3.372 ( 2.511 -4.643 -2.585) 5.878 3.446 ( 3.552 -2.403 2.986) 5.225 3.567 ( 6.198 3.900 1.125) 7.409 3.836 ( -1.454 8.998 1.769) 9.284 5.793 ( -3.489 -3.752 -1.935) 5.477 5.973 ( 1.606 -2.468 0.687) 3.024 6.226 ( -3.542 1.592 -14.509) 15.020 6.277 ( 5.747 1.936 3.834) 7.175 6.444 ( 5.861 2.901 1.300) 6.667 7.069 ( -9.412 2.801 -12.516) 15.908 7.367 ( -4.770 0.400 -6.986) 8.469 7.519 ( -8.454 1.854 -10.858) 13.885 8.071 ( -16.586 -3.510 -14.163) 22.091 8.268 ( 8.020 -6.059 4.758) 11.120 9.091 ( 10.855 -0.878 16.470) 19.745 9.156 ( 3.130 -1.932 5.808) 6.875 9.521 ( 7.553 1.776 14.085) 16.081 9.974 ( 16.199 -0.681 14.022) 21.435 10.402 ( 18.303 -0.554 14.568) 23.400 11.298 ( 9.415 -1.630 0.244) 9.558 11.925 ( 6.165 -4.576 -3.872) 8.598 12.189 ( -3.869 0.306 6.774) 7.807 12.361 ( 0.197 -1.042 -0.951) 1.424 12.836 ( -6.096 -0.586 0.309) 6.132 13.329 ( -13.287 8.368 0.052) 15.702 14.024 ( -2.936 3.039 -4.551) 6.210 14.263 ( -5.926 -0.601 -10.427) 12.008 15.059 ( 2.988 -7.103 7.836) 10.990 15.637 ( 3.707 3.599 7.639) 9.222 20.903 ( 10.992 -0.660 12.436) 16.611 21.135 ( 13.012 0.253 13.277) 18.592 ======================= Grid point 204 (80/343) ======================= q-point: (-0.31 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( 7.633 -1.572 -0.616) 7.818 2.725 ( 7.907 -2.596 -9.723) 12.798 2.875 ( 9.091 -1.330 -1.524) 9.313 3.026 ( 8.060 2.365 -0.986) 8.457 3.158 ( 7.141 1.184 -3.134) 7.888 3.349 ( -2.099 -4.471 0.036) 4.939 3.423 ( 2.085 -2.956 1.039) 3.764 3.512 ( 4.208 2.476 -0.357) 4.896 3.875 ( 3.478 6.124 1.527) 7.206 5.836 ( -3.016 -3.071 1.236) 4.478 5.887 ( 6.579 -2.745 -3.392) 7.895 6.044 ( 3.450 2.368 -12.229) 12.926 6.221 ( 8.143 0.084 2.575) 8.540 6.416 ( -0.689 5.199 -1.924) 5.586 7.026 ( -6.916 3.894 -12.629) 14.916 7.283 ( 0.113 1.677 -10.088) 10.227 7.480 ( -5.019 2.548 -8.854) 10.492 8.071 ( -5.965 -4.351 -10.004) 12.433 8.113 ( 5.137 -5.825 -7.368) 10.706 9.087 ( 17.769 0.668 11.265) 21.049 9.134 ( 12.344 -1.729 6.604) 14.106 9.576 ( 10.284 2.701 9.738) 14.418 9.895 ( 19.620 -6.259 13.393) 24.566 10.268 ( 23.841 0.074 8.788) 25.409 11.073 ( 15.028 -2.032 -6.033) 16.321 11.737 ( 13.243 -3.409 -2.850) 13.969 12.060 ( 11.263 -7.819 -8.848) 16.318 12.500 ( -7.150 5.025 7.799) 11.713 12.969 ( -8.687 -2.659 4.639) 10.201 13.526 ( -11.076 9.550 -4.694) 15.359 13.980 ( -1.783 -3.073 -7.680) 8.462 14.289 ( -11.171 8.558 -1.966) 14.209 15.044 ( 6.784 -10.125 5.254) 13.272 15.666 ( 6.935 4.998 5.789) 10.325 20.881 ( 14.221 -1.197 9.704) 17.258 21.044 ( 21.932 0.045 7.842) 23.292 ======================= Grid point 205 (81/343) ======================= q-point: (-0.23 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( 13.623 -2.706 -12.150) 18.453 2.481 ( 14.447 0.440 -4.383) 15.103 2.712 ( 9.470 -1.907 -2.618) 10.008 2.908 ( 8.114 0.247 0.015) 8.118 3.024 ( 8.661 6.002 -2.827) 10.910 3.324 ( 4.413 -4.467 0.783) 6.328 3.403 ( 0.824 -1.614 -1.062) 2.101 3.479 ( -2.028 0.128 -2.155) 2.962 3.826 ( 8.023 2.195 1.022) 8.380 5.708 ( 7.966 -1.856 -5.488) 9.850 5.779 ( 12.303 -0.011 -1.658) 12.414 5.836 ( 7.910 1.196 -8.094) 11.380 6.227 ( -2.194 -1.122 5.967) 6.455 6.436 ( -2.439 6.755 -2.261) 7.529 6.880 ( 7.499 5.377 -13.313) 16.198 7.174 ( -7.951 0.402 -11.032) 13.605 7.439 ( 1.515 2.391 -3.759) 4.706 7.761 ( 14.340 -4.081 -11.367) 18.749 8.098 ( -11.982 -2.764 -9.256) 15.391 8.925 ( 21.401 0.554 3.803) 21.744 8.971 ( 25.957 0.097 8.639) 27.357 9.473 ( 19.039 5.883 0.810) 19.943 9.784 ( 19.001 -11.833 12.279) 25.531 10.044 ( 21.497 -0.684 6.836) 22.568 10.746 ( 17.910 -1.033 -7.525) 19.454 11.452 ( 21.887 -4.385 -2.452) 22.457 11.714 ( 16.406 -4.992 -9.459) 19.584 12.717 ( -6.663 4.857 7.258) 10.985 13.145 ( -8.420 -2.467 4.729) 9.967 13.559 ( -7.370 3.581 -10.483) 13.305 13.865 ( -0.455 -4.980 -7.995) 9.430 14.522 ( -8.590 15.768 4.430) 18.494 14.982 ( 3.706 -13.514 4.979) 14.871 15.672 ( 4.470 5.493 5.244) 8.812 20.741 ( 29.900 -0.367 3.071) 30.060 20.774 ( 19.529 -1.190 5.315) 20.274 ======================= Grid point 206 (82/343) ======================= q-point: (-0.15 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.021 ( 19.244 -3.648 -10.613) 22.277 2.153 ( 23.721 0.117 -5.008) 24.244 2.570 ( 6.049 0.832 -1.568) 6.304 2.799 ( 9.696 1.424 0.396) 9.808 2.885 ( 9.380 5.375 -2.496) 11.096 3.232 ( 7.155 -5.128 0.040) 8.803 3.307 ( 13.377 -1.823 -1.135) 13.549 3.502 ( -5.434 -0.497 -1.471) 5.652 3.750 ( 2.139 0.159 -0.130) 2.149 5.509 ( 15.866 2.781 -2.015) 16.233 5.571 ( 9.183 -0.253 -3.886) 9.974 5.608 ( 10.689 -1.962 -4.817) 11.888 6.316 ( 8.203 1.537 3.631) 9.101 6.429 ( 5.296 5.782 -2.072) 8.110 6.589 ( 5.538 5.561 -9.530) 12.345 7.151 ( 7.934 2.523 -6.007) 10.266 7.274 ( -4.003 -6.078 -5.987) 9.424 7.579 ( -2.369 3.300 -4.003) 5.703 8.154 ( -11.260 -1.609 -3.956) 12.043 8.630 ( 22.050 0.147 -2.189) 22.159 8.682 ( 35.620 0.690 9.950) 36.990 9.143 ( 25.961 10.527 -6.595) 28.780 9.581 ( 21.712 -13.908 6.662) 26.631 9.900 ( 14.857 -1.016 6.238) 16.145 10.400 ( 19.259 0.267 -5.352) 19.991 11.038 ( 31.486 -5.538 -2.189) 32.044 11.354 ( 19.060 -1.172 -5.908) 19.989 12.905 ( -5.745 4.369 5.325) 8.969 13.294 ( -6.897 -0.535 2.407) 7.325 13.516 ( -6.328 -2.524 -8.432) 10.840 13.763 ( 0.421 -4.857 -4.070) 6.351 14.615 ( 7.301 8.633 1.716) 11.436 15.035 ( -3.388 -6.441 5.331) 9.021 15.782 ( -9.574 5.076 4.987) 11.929 20.254 ( 40.116 -1.865 -1.240) 40.178 20.560 ( 21.104 0.632 2.156) 21.223 ======================= Grid point 207 (83/343) ======================= q-point: (-0.08 0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 24.250 -3.322 0.000) 24.477 1.742 ( 30.120 -0.695 0.000) 30.128 2.523 ( 0.755 3.949 -0.000) 4.020 2.659 ( 11.643 2.597 -0.000) 11.929 2.751 ( 10.441 2.162 -0.000) 10.662 2.940 ( 31.739 -6.223 0.000) 32.343 3.140 ( 6.344 -3.614 0.000) 7.301 3.594 ( -9.154 0.966 -0.000) 9.205 3.778 ( -5.118 0.066 -0.000) 5.118 5.275 ( 16.138 3.481 -0.000) 16.509 5.380 ( 12.664 -0.256 0.000) 12.666 5.486 ( 3.582 -2.262 0.000) 4.237 6.066 ( 22.320 3.418 -0.000) 22.580 6.224 ( 21.791 1.320 -0.000) 21.830 6.603 ( -4.911 3.667 -0.000) 6.129 6.956 ( 8.753 1.897 -0.000) 8.957 7.382 ( -9.942 -0.226 0.000) 9.945 7.569 ( 4.795 0.743 -0.000) 4.853 8.265 ( 32.924 0.280 0.000) 32.925 8.297 ( -13.116 -0.418 0.000) 13.123 8.352 ( 13.896 -0.091 0.000) 13.896 8.752 ( 27.983 10.317 -0.000) 29.825 9.295 ( 21.478 -7.469 0.000) 22.740 9.743 ( 14.816 -0.213 0.000) 14.818 10.100 ( 19.429 0.243 0.000) 19.430 10.532 ( 36.377 -3.394 0.000) 36.535 11.037 ( 21.228 -0.224 0.000) 21.230 13.034 ( -5.040 3.470 -0.000) 6.119 13.390 ( -4.812 1.891 -0.000) 5.170 13.513 ( -4.729 -6.805 0.000) 8.287 13.711 ( 0.806 -4.371 0.000) 4.445 14.522 ( 9.182 1.996 -0.000) 9.397 15.060 ( 4.100 -0.846 0.000) 4.187 16.091 ( -25.668 3.867 -0.000) 25.957 19.655 ( 43.449 -2.339 0.000) 43.512 20.272 ( 23.524 2.224 -0.000) 23.628 ======================= Grid point 210 (84/343) ======================= q-point: ( 0.15 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( 12.430 0.000 25.358) 28.241 2.161 ( 29.129 0.000 13.810) 32.237 2.608 ( 7.652 -0.000 23.637) 24.845 2.688 ( -0.360 -0.000 9.284) 9.291 2.918 ( 4.011 0.000 9.268) 10.099 2.929 ( -6.093 -0.000 7.993) 10.051 3.130 ( 1.805 -0.000 4.908) 5.229 3.850 ( -1.708 -0.000 -1.489) 2.266 3.869 ( -9.056 -0.000 -0.266) 9.060 5.407 ( 10.162 0.000 9.212) 13.716 5.432 ( 16.904 0.000 12.521) 21.037 5.829 ( 20.263 0.000 6.487) 21.276 6.050 ( 6.863 -0.000 16.883) 18.224 6.073 ( 5.642 -0.000 15.246) 16.256 6.777 ( 3.614 0.000 -4.339) 5.647 7.108 ( -1.124 -0.000 7.923) 8.002 7.144 ( 11.692 0.000 14.490) 18.619 7.681 ( 17.830 0.000 12.155) 21.579 8.060 ( -1.810 -0.000 2.187) 2.839 8.327 ( 10.919 0.000 -2.712) 11.251 8.497 ( 7.578 0.000 7.575) 10.715 8.748 ( 10.845 0.000 11.578) 15.863 9.133 ( -4.725 -0.000 14.504) 15.254 9.301 ( -1.346 -0.000 9.056) 9.155 10.067 ( 11.086 0.000 19.385) 22.331 10.367 ( 17.475 0.000 20.719) 27.104 11.075 ( 14.303 0.000 17.250) 22.409 12.822 ( -5.210 -0.000 -8.697) 10.138 13.237 ( -4.266 -0.000 -9.275) 10.209 13.799 ( 3.250 0.000 3.485) 4.766 14.093 ( 3.592 0.000 0.271) 3.602 14.132 ( 10.468 0.000 1.047) 10.520 14.389 ( 5.937 0.000 4.516) 7.460 15.628 ( -7.081 0.000 -30.092) 30.914 19.637 ( 12.599 -0.000 29.770) 32.327 20.156 ( 3.890 -0.000 14.383) 14.899 ======================= Grid point 212 (85/343) ======================= q-point: ( 0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.144 ( -0.000 3.092 17.916) 18.181 2.463 ( -0.000 4.129 20.104) 20.523 3.026 ( 0.000 -2.761 9.334) 9.734 3.055 ( 0.000 -7.983 11.790) 14.239 3.071 ( -0.000 3.308 8.431) 9.057 3.251 ( -0.000 -0.408 7.919) 7.930 3.297 ( -0.000 5.148 6.841) 8.562 3.798 ( 0.000 -7.087 -0.839) 7.136 4.000 ( -0.000 5.223 -1.821) 5.531 5.611 ( -0.000 -0.205 20.210) 20.211 5.669 ( -0.000 0.018 22.965) 22.965 5.683 ( -0.000 -0.001 5.396) 5.396 6.283 ( 0.000 -0.666 2.026) 2.133 6.492 ( 0.000 -1.109 2.934) 3.136 6.618 ( -0.000 1.669 -8.947) 9.101 7.049 ( 0.000 -3.738 7.860) 8.704 7.131 ( 0.000 -1.722 -4.050) 4.400 7.648 ( 0.000 0.505 -14.473) 14.482 7.963 ( -0.000 1.660 24.807) 24.862 8.652 ( -0.000 0.017 7.798) 7.798 8.755 ( -0.000 0.032 22.646) 22.646 8.899 ( 0.000 -11.331 13.509) 17.632 9.686 ( -0.000 10.595 14.965) 18.336 9.813 ( -0.000 1.929 25.553) 25.626 10.340 ( -0.000 0.205 18.391) 18.393 11.001 ( -0.000 3.181 32.449) 32.605 11.360 ( -0.000 -0.229 17.361) 17.362 12.612 ( 0.000 -4.609 -10.207) 11.200 12.998 ( -0.000 4.696 -14.521) 15.262 13.845 ( 0.000 -15.196 -5.069) 16.019 14.065 ( -0.000 14.267 -5.243) 15.200 14.116 ( -0.000 0.021 18.184) 18.184 14.600 ( -0.000 0.048 16.533) 16.533 14.913 ( 0.000 -3.398 -19.424) 19.719 20.395 ( -0.000 -0.169 32.210) 32.210 20.618 ( -0.000 0.586 18.838) 18.847 ======================= Grid point 213 (86/343) ======================= q-point: ( 0.38 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.440 ( -8.670 1.734 13.227) 15.910 2.753 ( -4.569 5.622 15.191) 16.830 3.067 ( 5.159 -6.059 6.835) 10.490 3.156 ( 1.126 -3.047 6.360) 7.141 3.204 ( -0.947 1.716 7.694) 7.940 3.347 ( 0.404 -0.036 6.669) 6.682 3.390 ( 2.671 4.729 6.624) 8.566 3.762 ( 0.409 -7.453 -0.431) 7.477 3.973 ( 3.729 4.939 -0.837) 6.245 5.748 ( -1.018 -0.572 5.960) 6.073 5.913 ( -6.612 -1.586 5.761) 8.912 5.960 ( -6.517 2.131 13.398) 15.051 6.261 ( 0.200 -2.311 -4.165) 4.767 6.400 ( 3.545 2.002 -1.782) 4.444 6.627 ( -11.346 2.239 -4.914) 12.565 7.090 ( -7.861 -3.778 -8.363) 12.083 7.180 ( -0.442 -5.644 7.859) 9.686 7.531 ( -9.760 0.515 -11.711) 15.254 8.293 ( 4.317 3.038 25.548) 26.088 8.780 ( -5.027 -0.528 6.379) 8.139 8.992 ( 4.050 -7.848 17.727) 19.805 9.111 ( -4.087 -2.604 18.258) 18.890 9.901 ( 6.524 12.802 18.186) 23.177 10.188 ( 0.850 0.440 28.771) 28.787 10.673 ( -10.613 1.425 17.996) 20.941 11.437 ( -1.040 3.033 27.957) 28.140 11.632 ( -6.954 0.573 15.742) 17.219 12.450 ( 1.396 -7.286 -8.886) 11.576 12.809 ( 1.472 7.343 -14.306) 16.148 13.641 ( 2.023 -14.239 -13.756) 19.901 14.023 ( 4.307 10.776 -1.392) 11.688 14.445 ( -6.718 -0.616 19.055) 20.214 14.593 ( 8.614 -1.360 -3.589) 9.430 14.986 ( -14.166 -1.373 11.066) 18.028 20.808 ( 0.079 -0.647 28.112) 28.120 20.859 ( 2.655 1.240 18.944) 19.169 ======================= Grid point 214 (87/343) ======================= q-point: ( 0.46 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( -8.030 -2.937 8.926) 12.360 3.007 ( -1.939 2.751 8.056) 8.731 3.051 ( 3.788 -4.487 6.569) 8.811 3.192 ( 1.988 -1.006 3.554) 4.195 3.311 ( -0.397 7.445 4.916) 8.930 3.404 ( 3.827 1.993 4.617) 6.319 3.449 ( 1.524 0.011 6.048) 6.238 3.712 ( 2.255 -6.275 -0.798) 6.716 3.916 ( 6.098 3.795 0.072) 7.183 5.841 ( -3.705 -1.345 2.499) 4.667 5.883 ( 0.335 -0.057 -9.178) 9.184 6.139 ( -3.660 2.615 -2.078) 4.955 6.245 ( -5.017 -4.966 1.129) 7.149 6.453 ( -4.719 4.522 3.041) 7.209 6.754 ( -11.996 0.963 -2.178) 12.230 7.076 ( -14.615 -2.908 -14.340) 20.681 7.189 ( -1.049 -2.982 -3.895) 5.016 7.593 ( -13.054 -2.422 -4.063) 13.884 8.531 ( 10.219 2.979 21.657) 24.131 8.960 ( -6.514 -1.426 9.204) 11.365 9.130 ( 2.588 -7.257 14.132) 16.096 9.418 ( -0.897 1.061 21.077) 21.122 10.110 ( 7.252 10.035 20.073) 23.585 10.539 ( 3.151 -2.269 26.405) 26.689 11.073 ( -11.967 2.951 15.464) 19.775 11.783 ( -1.191 0.737 19.422) 19.472 11.965 ( -10.203 3.420 13.169) 17.006 12.290 ( 1.582 -8.857 -6.243) 10.951 12.652 ( 0.675 9.436 -9.973) 13.746 13.358 ( 2.230 -11.211 -15.606) 19.344 13.992 ( 3.082 6.747 -0.665) 7.448 14.398 ( 6.358 -2.800 -5.439) 8.823 14.816 ( -7.090 -0.515 17.410) 18.806 15.328 ( -10.715 -0.308 12.891) 16.765 21.047 ( 5.875 0.886 17.733) 18.702 21.152 ( 2.267 -0.338 23.873) 23.983 ======================= Grid point 215 (88/343) ======================= q-point: ( 0.54 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.866 ( -3.163 -7.571 5.730) 10.008 2.979 ( 5.928 -5.243 2.891) 8.425 3.129 ( 1.562 0.614 1.737) 2.415 3.203 ( 3.605 2.068 3.220) 5.257 3.377 ( 7.671 3.679 4.348) 9.555 3.424 ( -2.632 3.855 0.587) 4.705 3.515 ( -0.167 1.679 4.847) 5.132 3.642 ( 3.731 -2.104 -0.215) 4.289 3.845 ( 6.668 3.561 0.783) 7.600 5.746 ( -1.424 -2.430 -7.901) 8.388 5.924 ( -5.191 -1.869 -0.350) 5.528 6.121 ( -2.286 3.662 -6.397) 7.717 6.299 ( -3.536 -2.342 -0.640) 4.289 6.540 ( -4.002 4.463 -3.311) 6.848 6.863 ( -3.334 -1.038 1.734) 3.899 7.079 ( -17.757 -0.537 -17.250) 24.762 7.142 ( -10.055 -0.610 -11.111) 14.998 7.701 ( -10.649 -3.182 -3.063) 11.529 8.619 ( 13.450 0.115 14.604) 19.854 9.174 ( -2.354 -2.031 12.965) 13.332 9.259 ( 1.884 -3.954 12.689) 13.424 9.685 ( 3.766 1.609 19.712) 20.133 10.297 ( 8.953 4.834 18.594) 21.196 10.776 ( 8.360 -3.042 20.890) 22.705 11.383 ( -4.795 2.082 9.337) 10.701 11.963 ( -1.935 -1.448 2.134) 3.224 12.141 ( 0.156 -3.579 5.014) 6.163 12.309 ( -5.220 0.569 5.815) 7.835 12.634 ( -5.008 8.621 -0.550) 9.985 13.118 ( -0.601 -5.719 -11.204) 12.594 13.964 ( 1.322 4.274 -2.125) 4.953 14.233 ( 2.953 -2.347 -8.343) 9.156 15.091 ( -2.725 -2.588 13.472) 13.986 15.596 ( -5.253 1.068 9.923) 11.279 21.179 ( 8.790 0.341 16.047) 18.300 21.389 ( 6.111 -0.084 19.222) 20.170 ======================= Grid point 216 (89/343) ======================= q-point: (-0.38 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.872 ( 6.190 -8.039 3.479) 10.725 2.914 ( 3.661 -4.740 -1.973) 6.306 3.099 ( 4.202 0.220 0.253) 4.216 3.181 ( 6.058 3.738 2.064) 7.412 3.319 ( 6.255 -0.992 1.505) 6.510 3.390 ( 3.820 -3.253 -3.051) 5.873 3.557 ( 3.878 -1.417 3.509) 5.418 3.627 ( 3.067 6.520 0.873) 7.258 3.818 ( 1.196 7.872 1.751) 8.152 5.709 ( -5.676 -3.867 -2.714) 7.385 5.951 ( -4.618 -1.952 -5.068) 7.129 6.058 ( 1.554 2.232 -5.006) 5.697 6.312 ( -1.344 1.804 -2.180) 3.132 6.510 ( -0.162 2.491 -6.156) 6.643 6.862 ( 2.581 0.155 -1.695) 3.092 7.084 ( -17.144 0.681 -16.129) 23.548 7.175 ( -13.084 1.461 -9.457) 16.210 7.768 ( -8.613 -2.944 -4.630) 10.212 8.564 ( 15.745 -4.218 7.423) 17.911 9.322 ( 4.328 -2.257 11.273) 12.284 9.397 ( 2.984 -0.646 13.070) 13.422 9.846 ( 9.318 1.349 15.918) 18.494 10.384 ( 13.129 -1.242 15.121) 20.064 10.841 ( 16.190 -2.346 14.382) 21.782 11.406 ( 7.545 -1.257 -2.379) 8.011 11.971 ( 0.126 -5.166 0.345) 5.179 12.217 ( -0.726 4.873 2.993) 5.765 12.377 ( 1.131 -4.399 1.678) 4.842 12.756 ( -7.543 -0.151 1.779) 7.752 13.122 ( -10.445 8.891 -0.672) 13.733 13.936 ( -0.952 2.171 -3.136) 3.931 14.081 ( -0.832 -0.980 -10.038) 10.120 15.228 ( 2.412 -4.981 8.554) 10.189 15.745 ( 0.383 2.697 6.358) 6.917 21.241 ( 11.536 -0.559 13.344) 17.648 21.497 ( 11.765 0.314 14.183) 18.430 ======================= Grid point 217 (90/343) ======================= q-point: (-0.31 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.750 ( 9.153 -4.402 -4.680) 11.183 2.787 ( 8.177 -5.871 0.533) 10.081 3.006 ( 9.763 -0.640 0.121) 9.785 3.123 ( 7.548 2.106 0.613) 7.860 3.224 ( 7.820 0.998 -1.661) 8.056 3.318 ( -1.170 -3.000 -0.951) 3.358 3.517 ( 6.016 -0.946 1.534) 6.280 3.577 ( 6.210 1.275 0.074) 6.340 3.884 ( -0.437 9.964 1.483) 10.083 5.784 ( -6.699 -2.403 0.431) 7.130 5.889 ( -0.127 -1.832 -6.009) 6.283 5.973 ( 3.565 -0.327 -2.936) 4.630 6.290 ( 0.543 3.485 -2.944) 4.594 6.421 ( 3.343 1.905 -3.873) 5.459 6.788 ( -1.171 0.301 -6.856) 6.962 7.118 ( -11.259 2.994 -9.109) 14.789 7.201 ( -6.804 3.264 -8.190) 11.137 7.801 ( -8.938 -3.133 -5.685) 11.046 8.357 ( 20.294 -6.658 0.996) 21.381 9.338 ( 11.198 -2.022 7.439) 13.595 9.494 ( 8.620 2.760 11.238) 14.430 9.868 ( 14.172 0.954 9.980) 17.360 10.349 ( 16.274 -8.220 12.368) 22.032 10.711 ( 23.717 -1.552 8.038) 25.091 11.184 ( 12.985 -2.095 -6.786) 14.800 11.896 ( 9.550 -4.339 1.091) 10.546 12.120 ( 9.134 -6.721 -6.877) 13.263 12.473 ( -6.743 7.279 5.652) 11.419 12.916 ( -9.336 -2.720 4.944) 10.908 13.285 ( -9.637 8.954 -4.542) 13.917 13.882 ( 0.180 -2.461 -6.352) 6.815 14.076 ( -11.482 7.573 -1.833) 13.876 15.230 ( 6.220 -7.786 4.477) 10.925 15.788 ( 4.442 4.191 3.647) 7.113 21.217 ( 14.486 -1.194 9.373) 17.295 21.444 ( 19.301 0.320 8.685) 21.167 ======================= Grid point 218 (91/343) ======================= q-point: (-0.23 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.504 ( 13.880 -5.417 -4.965) 15.705 2.636 ( 12.258 -2.208 -0.807) 12.482 2.848 ( 11.917 -1.836 -0.507) 12.069 3.016 ( 7.536 -1.491 -0.117) 7.683 3.106 ( 10.264 9.057 -0.576) 13.701 3.340 ( -3.837 -3.821 -0.276) 5.422 3.447 ( 4.684 0.182 0.064) 4.688 3.484 ( 6.305 -2.158 -0.644) 6.695 3.908 ( 4.014 6.644 0.693) 7.793 5.728 ( 5.459 -0.620 -3.944) 6.763 5.839 ( 5.719 0.933 -3.674) 6.861 5.923 ( 3.170 -2.230 2.302) 4.508 6.272 ( -1.661 1.660 0.962) 2.538 6.371 ( 0.247 4.830 -0.853) 4.911 6.722 ( -3.847 -0.949 -8.129) 9.044 7.063 ( 7.028 4.020 -4.285) 9.161 7.252 ( -12.492 4.620 -5.302) 14.335 7.856 ( -10.947 -3.102 -3.918) 12.034 8.003 ( 25.865 -7.017 -2.388) 26.906 9.196 ( 18.473 -1.523 2.419) 18.693 9.473 ( 17.589 6.353 9.676) 21.057 9.716 ( 20.648 1.552 0.518) 20.712 10.231 ( 16.794 -15.152 9.138) 24.395 10.436 ( 25.415 -1.530 3.309) 25.675 10.889 ( 16.317 -0.555 -5.810) 17.330 11.722 ( 16.080 -5.153 1.475) 16.950 11.835 ( 14.702 -5.074 -6.502) 16.858 12.676 ( -7.798 8.400 4.247) 12.223 13.093 ( -8.313 -2.464 3.997) 9.547 13.323 ( -7.874 1.179 -7.496) 10.935 13.794 ( 0.039 -3.059 -4.113) 5.126 14.331 ( -16.395 14.669 2.052) 22.095 15.145 ( 6.641 -11.354 1.984) 13.302 15.770 ( 5.658 5.306 1.924) 7.992 21.089 ( 17.605 -1.115 4.539) 18.215 21.205 ( 28.023 -0.334 3.358) 28.225 ======================= Grid point 219 (92/343) ======================= q-point: (-0.15 0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 17.785 -5.473 0.000) 18.608 2.415 ( 18.589 -0.031 0.000) 18.589 2.678 ( 10.810 -1.244 0.000) 10.882 2.916 ( 7.056 -0.694 0.000) 7.090 2.986 ( 11.645 9.799 -0.000) 15.219 3.337 ( 4.159 -4.626 0.000) 6.221 3.390 ( 3.318 -2.161 0.000) 3.960 3.436 ( -2.716 0.112 -0.000) 2.719 3.839 ( 8.614 2.158 -0.000) 8.880 5.613 ( 6.560 -0.761 0.000) 6.604 5.697 ( 10.925 1.015 -0.000) 10.972 5.788 ( 15.747 0.162 0.000) 15.748 6.374 ( -6.087 2.640 -0.000) 6.635 6.407 ( -1.576 6.541 -0.000) 6.728 6.622 ( 11.100 2.899 -0.000) 11.473 7.000 ( -6.393 -0.582 0.000) 6.420 7.367 ( -3.100 4.364 -0.000) 5.354 7.602 ( 21.381 -5.933 0.000) 22.189 7.974 ( -11.736 -2.381 0.000) 11.975 8.918 ( 22.679 -0.914 0.000) 22.697 9.293 ( 35.107 -0.573 0.000) 35.112 9.354 ( 20.917 12.057 -0.000) 24.143 9.983 ( 20.758 -17.751 0.000) 27.312 10.161 ( 17.520 -1.582 0.000) 17.591 10.611 ( 18.123 0.724 -0.000) 18.137 11.436 ( 24.417 -8.245 0.000) 25.772 11.559 ( 17.036 -0.129 0.000) 17.036 12.837 ( -6.811 7.290 -0.000) 9.977 13.217 ( -6.944 -0.664 0.000) 6.976 13.369 ( -8.365 -4.014 0.000) 9.278 13.753 ( 0.031 -3.755 0.000) 3.755 14.590 ( -7.608 17.423 -0.000) 19.012 15.058 ( -0.126 -14.011 0.000) 14.012 15.746 ( 1.962 5.730 -0.000) 6.057 20.782 ( 36.054 -1.211 0.000) 36.074 20.860 ( 20.216 -0.441 0.000) 20.221 ======================= Grid point 223 (93/343) ======================= q-point: ( 0.15 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 11.129 4.302 18.933) 22.379 2.641 ( 16.500 -3.196 10.184) 19.651 2.777 ( -0.113 5.830 6.798) 8.957 2.859 ( -2.064 -6.410 7.738) 10.258 3.063 ( 3.075 1.213 6.525) 7.315 3.108 ( 8.459 -2.723 12.898) 15.663 3.222 ( 1.733 -0.167 4.832) 5.136 3.739 ( -8.750 1.801 -0.148) 8.935 3.792 ( -4.487 -1.373 -1.848) 5.043 5.635 ( 6.923 0.843 8.542) 11.028 5.763 ( 5.812 -0.374 13.924) 15.093 6.128 ( 7.541 -0.026 7.733) 10.801 6.191 ( -4.527 0.299 -0.279) 4.545 6.397 ( 18.386 -0.306 5.782) 19.277 6.866 ( 14.411 0.464 3.275) 14.786 7.204 ( -3.068 0.918 11.707) 12.137 7.497 ( 15.676 0.149 4.196) 16.229 8.016 ( 17.365 2.766 0.724) 17.599 8.064 ( 3.415 -0.047 3.210) 4.687 8.491 ( 10.251 0.630 2.445) 10.558 8.670 ( -0.102 -1.372 10.901) 10.987 8.978 ( 5.469 0.559 5.897) 8.062 9.312 ( 2.676 -2.129 13.178) 13.614 9.505 ( 0.990 -0.004 20.005) 20.029 10.493 ( 11.942 0.279 19.332) 22.725 10.913 ( 19.034 -1.602 21.404) 28.688 11.505 ( 15.491 -0.974 15.813) 22.158 12.627 ( -5.266 1.538 -8.860) 10.421 13.039 ( -4.475 -1.772 -11.090) 12.089 13.879 ( 5.039 3.542 0.459) 6.176 14.071 ( 2.382 -1.510 -10.345) 10.722 14.360 ( 11.400 0.418 8.549) 14.255 14.512 ( 1.604 -2.289 4.362) 5.181 15.289 ( 1.149 1.889 -11.623) 11.831 20.163 ( 10.411 -0.009 24.001) 26.161 20.366 ( 1.428 -0.309 11.381) 11.474 ======================= Grid point 224 (94/343) ======================= q-point: ( 0.23 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.487 ( 20.493 0.000 10.620) 23.081 2.565 ( 7.812 -0.000 18.415) 20.003 2.938 ( -5.412 -0.000 8.651) 10.204 3.007 ( -3.597 -0.000 8.851) 9.554 3.117 ( 0.969 -0.000 5.440) 5.525 3.213 ( 0.156 -0.000 9.589) 9.590 3.283 ( 0.561 -0.000 6.151) 6.176 3.808 ( -2.128 -0.000 -1.275) 2.481 3.863 ( -7.650 -0.000 -0.063) 7.650 5.678 ( 4.690 0.000 9.319) 10.432 5.846 ( 8.563 0.000 14.581) 16.909 6.017 ( 17.939 0.000 7.038) 19.270 6.306 ( -9.631 -0.000 -0.459) 9.642 6.318 ( 3.868 0.000 2.027) 4.367 6.767 ( 9.770 0.000 4.322) 10.684 7.273 ( 13.794 0.000 -2.621) 14.041 7.307 ( 8.680 0.000 1.612) 8.828 7.850 ( 13.421 0.000 -11.176) 17.465 7.941 ( 1.314 -0.000 14.938) 14.995 8.675 ( -4.379 -0.000 21.389) 21.833 8.773 ( 6.214 0.000 8.712) 10.701 9.023 ( 3.735 -0.000 9.911) 10.591 9.504 ( -4.593 -0.000 15.540) 16.205 9.816 ( 0.520 -0.000 25.886) 25.891 10.590 ( 13.213 0.000 18.427) 22.675 11.074 ( 7.276 -0.000 28.704) 29.612 11.537 ( 11.751 0.000 16.413) 20.186 12.575 ( -3.869 -0.000 -8.818) 9.629 12.925 ( -3.439 0.000 -13.469) 13.901 13.868 ( -0.210 -0.000 2.420) 2.429 13.905 ( -2.517 0.000 -12.854) 13.098 14.360 ( 11.888 0.000 14.360) 18.642 14.534 ( -2.390 -0.000 -0.532) 2.448 15.120 ( 9.560 0.000 -2.367) 9.849 20.439 ( 3.094 -0.000 28.578) 28.745 20.570 ( -2.768 -0.000 16.398) 16.630 ======================= Grid point 226 (95/343) ======================= q-point: ( 0.38 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( -0.000 2.503 12.061) 12.318 2.900 ( -0.000 2.539 12.321) 12.580 3.156 ( 0.000 -1.142 2.457) 2.709 3.256 ( -0.000 2.266 4.343) 4.899 3.333 ( 0.000 -8.903 8.613) 12.387 3.443 ( -0.000 -0.768 6.698) 6.742 3.478 ( -0.000 6.355 6.320) 8.962 3.785 ( 0.000 -6.228 -0.488) 6.247 3.967 ( -0.000 4.447 -0.824) 4.522 5.793 ( 0.000 -0.502 2.274) 2.329 5.886 ( 0.000 -0.733 -8.804) 8.834 6.048 ( -0.000 2.830 9.479) 9.892 6.174 ( 0.000 -3.170 -8.300) 8.885 6.331 ( -0.000 3.668 -9.434) 10.122 6.546 ( -0.000 0.057 6.094) 6.095 6.894 ( 0.000 -2.654 -13.802) 14.055 7.274 ( 0.000 0.857 -11.948) 11.979 7.387 ( 0.000 -4.456 12.544) 13.311 8.668 ( -0.000 2.349 25.807) 25.914 8.848 ( -0.000 -0.594 8.968) 8.988 9.234 ( 0.000 -6.832 11.175) 13.098 9.378 ( -0.000 0.646 22.878) 22.887 10.160 ( -0.000 9.815 19.436) 21.773 10.594 ( -0.000 0.278 29.479) 29.480 10.831 ( -0.000 0.226 16.938) 16.939 11.778 ( -0.000 1.507 23.138) 23.187 11.784 ( -0.000 -0.216 13.708) 13.709 12.381 ( 0.000 -8.736 -6.449) 10.859 12.600 ( -0.000 8.664 -12.666) 15.346 13.472 ( 0.000 -7.848 -18.045) 19.677 14.016 ( -0.000 5.267 0.144) 5.269 14.588 ( 0.000 -1.915 -8.753) 8.960 14.688 ( -0.000 0.017 22.405) 22.405 15.100 ( -0.000 0.045 19.127) 19.127 21.127 ( -0.000 0.416 18.666) 18.670 21.183 ( -0.000 -0.104 25.467) 25.467 ======================= Grid point 227 (96/343) ======================= q-point: ( 0.46 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.737 ( -4.870 1.759 8.870) 10.271 3.064 ( -1.966 2.276 7.569) 8.144 3.168 ( 1.593 -1.273 2.334) 3.099 3.298 ( 2.741 2.089 3.561) 4.955 3.379 ( 2.959 -6.175 5.801) 8.975 3.518 ( 1.892 0.326 5.706) 6.021 3.554 ( 3.091 3.884 5.206) 7.194 3.749 ( 1.030 -6.248 -0.531) 6.354 3.956 ( 2.485 4.187 -0.561) 4.901 5.729 ( -0.590 1.505 -12.499) 12.603 5.821 ( -2.449 -0.768 -0.515) 2.618 6.031 ( -2.156 -4.860 -9.307) 10.719 6.180 ( -4.395 -0.225 0.153) 4.404 6.291 ( -6.612 7.801 -5.292) 11.514 6.644 ( -8.509 -0.665 -1.924) 8.749 6.718 ( -6.656 -2.759 -16.922) 18.392 7.141 ( 3.420 0.442 -3.298) 4.772 7.545 ( -3.312 -4.543 7.897) 9.694 8.912 ( 7.902 1.349 16.087) 17.974 9.068 ( -4.726 -0.075 18.613) 19.203 9.345 ( 1.493 -5.376 10.318) 11.730 9.693 ( -1.089 1.026 21.234) 21.286 10.423 ( 4.438 9.650 18.953) 21.726 10.945 ( 3.112 -2.274 24.989) 25.284 11.116 ( -8.776 2.146 14.317) 16.929 11.972 ( -0.568 -1.748 7.305) 7.533 12.011 ( -4.474 1.286 7.644) 8.950 12.292 ( 0.482 -8.131 2.350) 8.477 12.524 ( 0.181 9.872 -2.667) 10.228 13.210 ( 1.487 -6.944 -14.372) 16.031 14.005 ( 2.479 3.573 -1.200) 4.511 14.410 ( 6.286 -1.796 -8.746) 10.919 15.004 ( -2.888 -0.159 19.610) 19.822 15.399 ( -6.490 0.061 15.709) 16.997 21.349 ( 3.494 0.544 17.082) 17.444 21.490 ( 1.652 -0.250 21.285) 21.351 ======================= Grid point 228 (97/343) ======================= q-point: ( 0.54 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( -4.434 -2.130 5.718) 7.543 3.095 ( 3.626 -3.903 0.554) 5.356 3.213 ( 2.252 0.189 4.607) 5.131 3.296 ( 4.697 0.505 3.621) 5.952 3.397 ( 0.303 2.923 2.194) 3.668 3.524 ( 7.502 4.753 3.649) 9.602 3.576 ( 1.865 -1.707 1.974) 3.207 3.707 ( 2.577 -3.904 1.554) 4.929 3.916 ( 4.737 3.659 -0.130) 5.987 5.613 ( -3.341 -0.520 -8.043) 8.725 5.828 ( -3.846 -1.515 -4.494) 6.107 5.958 ( -7.795 -2.287 -9.045) 12.157 6.199 ( -2.291 5.068 -3.624) 6.638 6.367 ( -8.680 1.102 -4.017) 9.628 6.601 ( -12.586 -1.654 -16.898) 21.135 6.714 ( -14.959 0.038 -11.844) 19.080 7.095 ( 6.645 0.542 5.913) 8.911 7.649 ( -2.577 -3.472 3.786) 5.747 8.962 ( 11.753 0.251 10.763) 15.938 9.378 ( -1.764 -1.148 19.336) 19.450 9.437 ( 1.431 -3.266 8.793) 9.488 9.967 ( 0.720 1.139 17.553) 17.604 10.620 ( 6.153 5.732 16.085) 18.150 11.163 ( 6.332 -4.436 18.268) 19.836 11.409 ( -6.695 3.510 8.730) 11.548 11.898 ( -1.783 -3.063 -8.890) 9.571 12.214 ( -4.293 -0.084 7.178) 8.364 12.354 ( -1.464 -1.423 6.209) 6.536 12.588 ( -1.070 4.204 4.874) 6.525 13.021 ( 2.098 -1.772 -5.901) 6.509 13.951 ( 2.670 2.207 -2.843) 4.481 14.187 ( 6.368 -1.722 -9.955) 11.943 15.261 ( -0.881 -1.006 14.069) 14.133 15.660 ( -4.784 0.534 10.620) 11.661 21.495 ( 6.719 0.221 14.396) 15.889 21.706 ( 4.380 -0.057 16.449) 17.022 ======================= Grid point 229 (98/343) ======================= q-point: (-0.38 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.974 ( 1.812 -6.185 1.797) 6.691 3.018 ( 4.639 -6.109 1.198) 7.764 3.172 ( 6.340 -2.550 1.525) 7.002 3.280 ( 5.393 2.507 2.366) 6.400 3.402 ( 3.035 0.302 -1.505) 3.401 3.460 ( 9.261 1.224 1.425) 9.450 3.583 ( -0.593 8.718 0.614) 8.760 3.694 ( 3.359 -2.421 3.208) 5.238 3.860 ( 5.083 4.457 0.355) 6.770 5.607 ( -6.730 -3.830 -1.829) 7.957 5.808 ( -5.099 -1.454 -5.997) 8.005 5.956 ( -7.492 1.541 -7.638) 10.810 6.190 ( -2.319 3.633 -4.638) 6.331 6.396 ( -2.890 -1.179 -3.316) 4.554 6.609 ( -19.022 1.161 -13.176) 23.169 6.737 ( -12.831 0.227 -12.550) 17.949 7.111 ( 5.844 1.792 7.660) 9.800 7.695 ( -1.721 -2.338 0.445) 2.937 8.884 ( 15.915 -2.363 5.957) 17.157 9.516 ( 1.905 -1.009 7.347) 7.657 9.608 ( 2.049 -2.118 14.696) 14.988 10.137 ( 5.051 0.817 12.301) 13.323 10.719 ( 8.419 -0.781 11.434) 14.220 11.227 ( 11.814 -4.434 11.380) 16.992 11.454 ( 5.925 0.470 -3.346) 6.820 11.921 ( -10.245 -0.639 0.379) 10.272 12.244 ( 4.515 2.791 -0.011) 5.308 12.475 ( 1.535 -5.782 5.965) 8.448 12.663 ( -8.625 -0.895 0.300) 8.677 13.024 ( -0.569 10.230 3.993) 10.997 13.885 ( 0.445 0.977 -3.808) 3.957 13.975 ( 3.877 -1.627 -9.375) 10.274 15.391 ( 2.863 -2.565 8.022) 8.895 15.813 ( -0.960 1.499 5.799) 6.066 21.553 ( 9.646 -0.383 10.508) 14.269 21.808 ( 8.447 0.290 11.118) 13.966 ======================= Grid point 230 (99/343) ======================= q-point: (-0.31 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.856 ( 9.138 -5.956 -1.344) 10.990 2.941 ( 7.882 -8.784 1.295) 11.872 3.113 ( 4.440 -1.282 0.440) 4.643 3.228 ( 6.377 -0.711 1.383) 6.564 3.306 ( 7.500 3.627 -2.188) 8.614 3.348 ( 6.995 -0.405 0.375) 7.017 3.598 ( 4.796 6.702 -0.052) 8.242 3.666 ( 4.642 -2.832 1.456) 5.629 3.854 ( 0.123 9.264 0.713) 9.293 5.704 ( -8.047 -3.753 1.491) 9.003 5.804 ( -4.624 -2.100 -2.739) 5.771 5.949 ( -2.764 2.320 -4.627) 5.868 6.171 ( -3.968 0.040 -4.962) 6.354 6.369 ( 0.357 0.971 -2.225) 2.453 6.716 ( -6.379 0.163 -6.540) 9.137 6.763 ( -17.249 3.147 -5.687) 18.433 7.137 ( 2.846 3.491 2.846) 5.328 7.701 ( -1.811 -2.123 -1.255) 3.060 8.678 ( 20.000 -5.100 1.775) 20.716 9.555 ( 5.245 -0.056 4.561) 6.952 9.693 ( 6.444 -0.085 7.140) 9.619 10.159 ( 10.771 0.115 6.245) 12.451 10.698 ( 10.292 -8.946 7.045) 15.349 11.111 ( 19.260 -3.470 4.763) 20.141 11.270 ( 11.537 0.097 -4.390) 12.344 12.026 ( 0.461 -5.006 2.609) 5.664 12.157 ( 5.502 -0.435 -3.976) 6.802 12.456 ( 1.584 3.488 2.549) 4.601 12.854 ( -12.811 -2.880 3.847) 13.683 13.115 ( -1.646 11.684 -1.067) 11.848 13.832 ( 1.639 -1.509 -4.519) 5.038 13.893 ( -7.533 3.286 -2.012) 8.461 15.389 ( 6.044 -4.839 3.101) 8.341 15.862 ( 2.529 2.799 2.231) 4.383 21.510 ( 12.576 -0.974 5.493) 13.758 21.770 ( 14.203 0.477 5.391) 15.199 ======================= Grid point 231 (100/343) ======================= q-point: (-0.23 0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( 12.229 -6.274 0.000) 13.745 2.797 ( 9.964 -5.866 0.000) 11.562 3.010 ( 10.374 -1.513 0.000) 10.484 3.128 ( 7.692 -4.057 0.000) 8.696 3.203 ( 9.515 10.342 -0.000) 14.053 3.307 ( -1.314 -2.849 0.000) 3.138 3.524 ( 7.563 4.016 -0.000) 8.563 3.586 ( 6.101 -4.587 0.000) 7.633 3.905 ( -0.212 10.178 -0.000) 10.180 5.750 ( 0.798 0.112 -0.000) 0.806 5.853 ( -1.667 -0.631 0.000) 1.782 5.946 ( -2.190 -2.968 0.000) 3.689 6.194 ( -5.681 0.212 -0.000) 5.685 6.354 ( 0.215 2.844 -0.000) 2.852 6.679 ( 2.721 -0.713 0.000) 2.813 6.987 ( -17.434 4.296 -0.000) 17.955 7.120 ( 4.955 4.920 -0.000) 6.983 7.726 ( -5.822 -2.851 0.000) 6.483 8.364 ( 24.253 -6.564 0.000) 25.126 9.454 ( 14.189 -1.698 0.000) 14.290 9.653 ( 7.528 5.860 -0.000) 9.540 10.009 ( 17.617 -0.637 0.000) 17.628 10.554 ( 12.531 -15.613 0.000) 20.020 10.820 ( 25.743 -2.374 0.000) 25.852 11.055 ( 14.786 0.982 -0.000) 14.818 11.946 ( 10.272 -4.887 0.000) 11.376 11.982 ( 12.151 -5.718 0.000) 13.430 12.560 ( -7.556 10.291 -0.000) 12.768 13.036 ( -9.382 -4.445 0.000) 10.382 13.153 ( -5.032 5.936 -0.000) 7.782 13.780 ( 0.774 -1.870 0.000) 2.024 14.072 ( -15.481 9.925 -0.000) 18.389 15.292 ( 7.420 -7.856 0.000) 10.806 15.837 ( 4.774 4.213 -0.000) 6.368 21.352 ( 15.446 -1.259 0.000) 15.498 21.567 ( 21.273 0.252 0.000) 21.275 ======================= Grid point 236 (101/343) ======================= q-point: ( 0.15 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( 0.765 8.399 9.146) 12.441 2.867 ( -1.907 -4.964 7.065) 8.843 2.891 ( 7.473 4.956 6.226) 10.917 2.991 ( 4.902 -5.289 7.282) 10.248 3.151 ( 1.743 0.545 2.643) 3.213 3.304 ( 1.073 -0.060 4.230) 4.364 3.390 ( 10.312 -3.369 5.020) 11.953 3.613 ( -8.733 -0.338 -0.203) 8.742 3.699 ( -5.332 -0.415 -1.378) 5.523 5.822 ( 5.368 1.832 6.919) 8.947 5.969 ( -1.188 -0.198 8.800) 8.882 6.061 ( -4.151 0.527 -2.175) 4.716 6.277 ( 2.674 -2.532 3.708) 5.226 6.628 ( 14.263 0.698 -5.499) 15.303 7.126 ( 14.318 0.834 2.581) 14.572 7.330 ( -6.037 0.578 15.758) 16.885 7.619 ( 8.305 1.963 -7.338) 11.255 8.202 ( 15.424 3.843 -0.379) 15.900 8.257 ( 13.364 -3.035 1.926) 13.839 8.633 ( 6.504 1.671 2.120) 7.042 8.822 ( -2.594 -1.457 13.634) 13.955 9.095 ( 1.475 -0.175 5.726) 5.915 9.526 ( 2.045 -2.509 10.562) 11.047 9.786 ( -3.530 0.232 21.441) 21.731 10.886 ( 8.848 0.492 16.941) 19.119 11.441 ( 17.366 -1.829 18.251) 25.259 11.913 ( 13.455 -2.716 13.190) 19.036 12.435 ( -4.632 3.452 -7.683) 9.613 12.851 ( -2.493 -4.030 -10.126) 11.180 13.805 ( -1.352 11.311 -14.156) 18.170 14.011 ( 4.970 -8.262 -3.744) 10.343 14.536 ( 5.450 3.208 -1.318) 6.460 14.663 ( 7.372 -3.808 10.068) 13.046 15.288 ( 2.765 2.129 4.333) 5.564 20.509 ( -1.079 -0.389 9.975) 10.041 20.555 ( 4.938 -0.154 17.546) 18.229 ======================= Grid point 237 (102/343) ======================= q-point: ( 0.23 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.809 ( 10.191 10.071 8.255) 16.536 2.881 ( 4.886 -6.974 8.603) 12.105 2.967 ( -1.064 3.842 7.360) 8.370 3.051 ( -5.010 -6.407 6.274) 10.272 3.173 ( -0.307 -0.507 2.500) 2.569 3.340 ( 3.161 -0.876 4.389) 5.480 3.369 ( 0.684 0.167 5.320) 5.366 3.732 ( -6.068 4.894 -0.573) 7.816 3.767 ( -7.660 -4.524 0.200) 8.899 5.846 ( 4.774 0.498 6.091) 7.755 5.973 ( -0.226 -0.513 -4.569) 4.603 6.209 ( 3.129 4.625 1.720) 5.843 6.258 ( -2.132 -3.425 7.704) 8.697 6.413 ( 8.153 -0.811 -1.315) 8.298 6.971 ( 13.080 -0.410 -0.739) 13.107 7.354 ( 10.140 1.732 -7.445) 12.698 7.437 ( 11.565 0.149 -3.748) 12.159 7.944 ( 19.525 0.220 -9.790) 21.843 8.130 ( -2.736 -0.417 14.892) 15.147 8.875 ( -6.836 1.748 19.648) 20.876 8.957 ( 4.629 0.098 7.693) 8.978 9.199 ( 0.843 0.205 12.377) 12.407 9.699 ( -2.405 -2.765 17.705) 18.081 10.159 ( -3.112 0.374 25.445) 25.637 10.999 ( 10.482 -0.206 16.719) 19.734 11.533 ( 8.493 -0.801 22.522) 24.083 11.914 ( 12.396 -0.973 13.753) 18.541 12.411 ( -3.957 2.943 -6.315) 8.013 12.714 ( -1.615 -3.162 -12.206) 12.712 13.642 ( -2.702 4.996 -17.458) 18.359 13.912 ( 1.870 -3.884 0.445) 4.333 14.450 ( -0.202 1.186 -5.878) 6.000 14.713 ( 9.209 -0.568 14.941) 17.560 15.319 ( 7.813 0.530 9.065) 11.978 20.731 ( -5.342 -0.274 15.518) 16.414 20.809 ( -0.419 0.053 23.152) 23.156 ======================= Grid point 238 (103/343) ======================= q-point: ( 0.31 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.740 ( 12.654 0.000 8.135) 15.043 2.957 ( 4.025 -0.000 10.665) 11.399 3.114 ( -4.108 -0.000 3.699) 5.528 3.189 ( -4.644 -0.000 4.587) 6.528 3.254 ( -5.486 -0.000 5.703) 7.913 3.383 ( -1.876 -0.000 3.931) 4.356 3.452 ( -0.492 -0.000 6.375) 6.394 3.781 ( -2.679 -0.000 -1.062) 2.882 3.867 ( -6.200 -0.000 0.250) 6.205 5.852 ( 4.100 0.000 3.255) 5.235 5.884 ( -0.275 0.000 -9.266) 9.270 6.108 ( 3.216 0.000 -2.854) 4.300 6.318 ( 7.768 0.000 1.722) 7.957 6.392 ( 2.951 0.000 0.563) 3.005 6.747 ( 11.800 0.000 -0.140) 11.801 7.098 ( 13.737 0.000 -14.962) 20.311 7.210 ( 1.207 0.000 -6.129) 6.247 7.615 ( 12.489 0.000 -2.411) 12.720 8.507 ( -9.484 -0.000 22.027) 23.982 8.972 ( 6.843 0.000 9.226) 11.487 9.191 ( -4.337 -0.000 13.289) 13.979 9.413 ( 0.841 -0.000 20.366) 20.384 10.021 ( -4.938 -0.000 21.418) 21.980 10.556 ( -2.940 -0.000 27.018) 27.178 11.051 ( 12.260 0.000 15.116) 19.463 11.778 ( 0.985 -0.000 20.916) 20.939 11.941 ( 10.061 0.000 13.012) 16.448 12.389 ( -2.309 -0.000 -4.076) 4.684 12.549 ( -0.383 0.000 -12.521) 12.527 13.450 ( -3.263 0.000 -18.225) 18.515 13.933 ( -2.485 -0.000 1.724) 3.025 14.420 ( -6.537 -0.000 -5.942) 8.834 14.819 ( 7.503 -0.000 18.094) 19.588 15.331 ( 10.645 0.000 12.295) 16.263 21.040 ( -5.846 -0.000 17.858) 18.791 21.155 ( -2.279 -0.000 23.881) 23.990 ======================= Grid point 240 (104/343) ======================= q-point: ( 0.46 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.807 ( -0.000 2.157 7.305) 7.617 3.136 ( -0.000 -0.147 4.943) 4.945 3.209 ( 0.000 -0.426 2.287) 2.326 3.339 ( -0.000 3.820 2.521) 4.577 3.520 ( 0.000 -8.653 5.170) 10.080 3.597 ( 0.000 -2.018 3.474) 4.018 3.627 ( -0.000 6.116 4.495) 7.590 3.772 ( 0.000 -4.130 0.260) 4.138 3.947 ( -0.000 3.557 -0.695) 3.624 5.526 ( -0.000 3.429 -13.131) 13.571 5.786 ( 0.000 -1.069 -2.981) 3.167 5.916 ( 0.000 -13.216 -9.164) 16.082 6.122 ( -0.000 14.716 -5.065) 15.564 6.133 ( 0.000 -0.128 -6.131) 6.133 6.469 ( 0.000 -2.661 -11.416) 11.722 6.498 ( 0.000 -0.727 -10.573) 10.598 7.181 ( -0.000 0.788 4.132) 4.206 7.649 ( 0.000 -2.887 6.737) 7.330 9.148 ( -0.000 -0.731 11.603) 11.626 9.327 ( -0.000 0.494 22.281) 22.286 9.488 ( 0.000 -1.789 7.453) 7.665 9.950 ( -0.000 0.817 18.201) 18.219 10.661 ( -0.000 6.229 15.821) 17.003 11.222 ( -0.000 0.128 11.455) 11.456 11.290 ( -0.000 -1.279 20.261) 20.301 11.910 ( 0.000 -1.834 -12.643) 12.775 12.091 ( -0.000 -0.157 8.836) 8.837 12.382 ( 0.000 -2.269 3.226) 3.944 12.564 ( -0.000 3.209 11.818) 12.246 13.079 ( 0.000 -1.786 -8.127) 8.321 13.988 ( -0.000 1.227 -2.620) 2.893 14.318 ( 0.000 -0.937 -11.599) 11.636 15.242 ( -0.000 0.034 17.186) 17.187 15.569 ( -0.000 0.018 14.455) 14.455 21.587 ( -0.000 0.245 14.465) 14.467 21.762 ( -0.000 -0.119 16.851) 16.852 ======================= Grid point 241 (105/343) ======================= q-point: ( 0.54 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( -3.143 1.651 4.698) 5.889 3.154 ( 1.867 -4.166 0.878) 4.649 3.259 ( -0.922 2.747 3.133) 4.267 3.376 ( 2.353 5.652 2.510) 6.616 3.505 ( 5.487 -7.928 3.106) 10.130 3.602 ( 1.140 -3.362 -0.152) 3.553 3.656 ( 5.435 4.470 2.608) 7.504 3.773 ( 1.052 -2.470 2.562) 3.711 3.941 ( 1.630 3.429 -0.484) 3.827 5.429 ( -5.515 4.934 -8.272) 11.099 5.719 ( -1.519 -5.628 -6.849) 8.994 5.791 ( -3.292 -9.034 -5.531) 11.093 6.076 ( -11.952 -0.112 -11.974) 16.919 6.124 ( 0.978 15.277 -2.837) 15.569 6.373 ( -8.799 -0.690 -10.734) 13.896 6.417 ( -2.471 -4.597 -3.404) 6.231 7.233 ( 2.323 1.677 5.034) 5.793 7.707 ( 0.598 -2.963 3.839) 4.886 9.231 ( 7.912 -0.538 8.747) 11.807 9.550 ( -0.014 -2.492 6.171) 6.656 9.630 ( -0.362 0.456 17.397) 17.407 10.172 ( -0.352 1.060 13.036) 13.084 10.842 ( 2.683 5.616 10.559) 12.257 11.385 ( -3.295 -1.188 7.356) 8.147 11.496 ( 1.543 -0.932 12.697) 12.824 11.733 ( -1.615 -1.419 -11.617) 11.814 12.232 ( -5.299 0.091 6.002) 8.007 12.390 ( 0.480 -0.559 -0.639) 0.975 12.704 ( 2.120 -4.251 8.858) 10.051 13.040 ( 2.792 5.443 4.356) 7.510 13.930 ( 1.729 -0.007 -4.310) 4.644 14.122 ( 4.183 -0.882 -11.343) 12.122 15.439 ( 0.468 -0.138 11.592) 11.603 15.752 ( -2.013 0.114 9.448) 9.661 21.734 ( 3.426 0.115 10.505) 11.050 21.942 ( 2.108 -0.028 11.623) 11.813 ======================= Grid point 242 (106/343) ======================= q-point: (-0.38 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.014 ( -3.032 -1.887 2.348) 4.273 3.096 ( 4.480 -5.366 -0.212) 6.993 3.292 ( 3.389 -0.816 1.338) 3.734 3.376 ( 5.368 3.989 2.208) 7.043 3.429 ( 4.413 -2.539 -0.029) 5.092 3.562 ( 1.470 1.602 -0.684) 2.280 3.597 ( 8.636 3.543 1.056) 9.394 3.778 ( 2.183 -2.114 2.036) 3.658 3.911 ( 3.939 3.423 -0.140) 5.220 5.488 ( -9.923 3.324 -1.146) 10.528 5.648 ( -5.676 -7.300 -6.298) 11.188 5.766 ( -5.451 -3.866 -3.931) 7.753 6.102 ( -5.152 6.277 -5.408) 9.756 6.180 ( -11.905 5.259 -3.176) 13.397 6.396 ( -6.528 -3.720 -3.560) 8.314 6.417 ( -9.159 -0.429 -4.410) 10.175 7.259 ( 4.161 2.789 3.696) 6.225 7.717 ( 1.274 -2.579 1.142) 3.095 9.164 ( 13.963 -1.166 3.991) 14.569 9.599 ( 0.464 -0.388 3.048) 3.108 9.822 ( 1.164 -2.745 10.534) 10.948 10.305 ( 1.425 0.963 6.604) 6.824 10.914 ( 4.012 1.035 5.014) 6.504 11.419 ( 3.920 -1.521 -0.715) 4.265 11.549 ( 7.367 -1.999 4.247) 8.735 11.751 ( -12.705 1.584 -0.261) 12.806 12.293 ( 3.414 0.172 -0.746) 3.499 12.460 ( -12.154 -0.624 1.923) 12.321 12.700 ( 7.044 -7.666 3.402) 10.952 13.111 ( 5.937 13.092 7.120) 16.042 13.830 ( 1.218 -3.268 -5.910) 6.863 13.938 ( 4.453 0.218 -5.341) 6.957 15.530 ( 2.850 -0.889 5.214) 6.008 15.865 ( -0.937 0.561 4.027) 4.172 21.776 ( 6.593 -0.198 5.590) 8.646 22.015 ( 4.935 0.191 5.923) 7.712 ======================= Grid point 243 (107/343) ======================= q-point: (-0.31 0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.985 ( 7.236 -6.244 0.000) 9.558 3.047 ( 0.325 -7.033 0.000) 7.040 3.194 ( 7.866 -3.186 0.000) 8.486 3.330 ( 4.875 -3.421 0.000) 5.956 3.358 ( 6.229 5.975 -0.000) 8.631 3.479 ( 10.123 0.906 -0.000) 10.164 3.588 ( -0.489 10.669 -0.000) 10.680 3.745 ( 3.544 -2.793 0.000) 4.512 3.865 ( 4.304 4.854 -0.000) 6.488 5.640 ( -7.555 -8.301 0.000) 11.224 5.674 ( -10.474 2.923 -0.000) 10.874 5.811 ( -7.166 -0.738 0.000) 7.204 6.118 ( 0.187 5.910 -0.000) 5.913 6.342 ( -7.431 -4.660 0.000) 8.772 6.445 ( -12.815 3.353 -0.000) 13.246 6.552 ( -12.989 0.997 -0.000) 13.027 7.227 ( 6.283 3.459 -0.000) 7.172 7.698 ( 0.702 -2.154 0.000) 2.266 8.965 ( 17.739 -3.080 0.000) 18.005 9.614 ( 0.926 0.961 -0.000) 1.335 9.841 ( 4.950 -3.334 0.000) 5.968 10.309 ( 5.256 0.505 -0.000) 5.280 10.876 ( 5.723 -5.609 0.000) 8.014 11.320 ( 8.565 -0.292 0.000) 8.570 11.432 ( 12.800 -2.716 0.000) 13.085 11.945 ( -12.875 1.251 -0.000) 12.935 12.217 ( 6.121 0.173 -0.000) 6.123 12.571 ( 9.759 -5.160 0.000) 11.039 12.675 ( -15.863 -0.114 -0.000) 15.864 13.121 ( 6.501 13.945 -0.000) 15.386 13.777 ( -2.618 -2.627 0.000) 3.709 13.858 ( 2.814 0.078 -0.000) 2.815 15.502 ( 5.056 -2.428 0.000) 5.609 15.894 ( 0.858 1.471 -0.000) 1.703 21.702 ( 9.686 -0.607 0.000) 9.705 21.963 ( 8.999 0.416 -0.000) 9.009 ======================= Grid point 249 (108/343) ======================= q-point: ( 0.15 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( -2.857 5.033 3.840) 6.946 2.902 ( -4.022 -3.391 3.755) 6.463 3.027 ( 3.779 4.484 1.429) 6.036 3.113 ( 0.101 -2.688 0.445) 2.726 3.216 ( 4.461 2.492 3.845) 6.395 3.361 ( -0.286 -0.211 3.219) 3.238 3.460 ( -4.330 0.025 0.248) 4.337 3.504 ( -7.330 -1.695 -1.068) 7.599 3.703 ( 5.599 -4.184 0.522) 7.009 5.902 ( -3.939 2.306 -0.768) 4.629 5.944 ( 2.257 1.578 2.645) 3.818 6.124 ( -1.063 -0.544 6.295) 6.407 6.339 ( 0.189 -3.653 1.128) 3.828 6.637 ( 8.589 0.264 -14.422) 16.788 7.272 ( 8.020 0.215 -3.377) 8.705 7.443 ( -7.182 -0.817 13.279) 15.119 7.590 ( 4.597 1.490 -7.515) 8.934 8.341 ( 14.909 2.997 -7.710) 17.050 8.464 ( 11.593 -0.773 -0.218) 11.620 8.712 ( 1.221 1.310 2.904) 3.412 8.969 ( -3.036 0.466 12.817) 13.180 9.187 ( -2.083 -0.685 8.204) 8.492 9.642 ( -4.295 -2.324 7.221) 8.717 9.952 ( -11.584 0.161 17.840) 21.272 11.150 ( 1.434 0.549 10.482) 10.594 11.870 ( 12.775 -0.800 13.644) 18.709 12.112 ( -3.219 -0.656 -2.653) 4.223 12.362 ( 5.204 4.258 3.526) 7.593 12.776 ( 3.952 -7.220 -3.454) 8.926 13.526 ( -3.173 6.357 -14.098) 15.787 14.069 ( 6.044 -4.581 -3.500) 8.353 14.555 ( 7.356 1.547 -7.200) 10.409 14.883 ( 2.798 1.105 10.071) 10.511 15.375 ( -2.971 -0.019 7.597) 8.158 20.604 ( -3.837 -0.321 8.933) 9.727 20.777 ( -2.142 0.025 12.187) 12.374 ======================= Grid point 250 (109/343) ======================= q-point: ( 0.23 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.864 ( -6.295 5.999 4.837) 9.951 2.997 ( 2.458 2.787 2.826) 4.669 3.029 ( -3.197 0.847 3.232) 4.624 3.108 ( -1.594 -3.839 0.202) 4.161 3.234 ( 2.604 -1.321 5.280) 6.034 3.411 ( 0.525 -1.736 2.192) 2.845 3.451 ( 2.812 -2.432 2.090) 4.265 3.612 ( -7.695 4.485 -0.195) 8.909 3.693 ( -5.484 -4.917 0.268) 7.371 5.878 ( 0.351 1.740 -5.317) 5.605 5.962 ( 2.855 0.244 2.935) 4.102 6.230 ( 4.061 0.646 -3.938) 5.693 6.329 ( -3.159 0.039 4.985) 5.902 6.442 ( -1.349 -2.507 -2.205) 3.601 7.059 ( 9.976 -0.904 -9.368) 13.715 7.378 ( 8.675 1.451 -6.644) 11.023 7.502 ( 10.448 -0.561 -9.084) 13.856 8.062 ( 19.699 1.555 -12.668) 23.473 8.280 ( -3.456 0.694 12.993) 13.462 9.015 ( -8.338 1.599 17.330) 19.298 9.103 ( 1.800 0.939 7.335) 7.611 9.372 ( -3.511 -0.723 14.960) 15.384 9.888 ( -7.421 -2.487 17.431) 19.107 10.380 ( -11.064 0.662 20.796) 23.565 11.286 ( 2.194 0.039 11.050) 11.265 11.902 ( 8.794 -0.569 13.608) 16.212 12.131 ( -2.083 0.726 0.067) 2.207 12.360 ( 5.848 5.541 4.618) 9.286 12.630 ( 5.185 -8.278 -4.126) 10.604 13.362 ( -1.061 3.789 -16.022) 16.498 13.952 ( 3.135 -3.093 -1.569) 4.675 14.369 ( 3.136 1.179 -8.813) 9.429 14.993 ( 4.403 1.430 12.389) 13.226 15.506 ( 1.040 -0.462 8.861) 8.934 20.848 ( -7.737 -0.204 14.635) 16.555 21.047 ( -5.938 0.035 18.056) 19.007 ======================= Grid point 251 (110/343) ======================= q-point: ( 0.31 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.966 ( 8.033 3.918 4.469) 9.992 3.042 ( -6.249 1.303 3.157) 7.122 3.123 ( -2.664 1.639 3.356) 4.588 3.173 ( -5.629 -2.423 2.919) 6.788 3.276 ( -0.479 -4.599 5.356) 7.075 3.391 ( -1.344 -0.496 0.883) 1.683 3.516 ( -1.699 0.350 4.658) 4.970 3.704 ( -4.981 3.730 -1.260) 6.349 3.782 ( -7.866 -3.522 0.641) 8.642 5.779 ( 2.747 1.183 -7.007) 7.618 5.938 ( 4.667 0.164 0.234) 4.675 6.060 ( 2.012 -2.037 -7.595) 8.117 6.389 ( 3.316 7.786 -1.384) 8.575 6.448 ( 4.502 -7.499 -3.192) 9.311 6.871 ( 2.384 0.131 2.297) 3.313 7.084 ( 17.766 0.121 -18.423) 25.594 7.148 ( 9.169 0.170 -11.777) 14.927 7.735 ( 10.267 0.938 -2.996) 10.736 8.618 ( -11.550 -0.025 15.714) 19.502 9.195 ( 2.908 0.597 12.901) 13.238 9.297 ( -3.853 0.949 11.351) 12.025 9.673 ( -3.787 -0.216 19.929) 20.287 10.241 ( -6.322 -1.683 20.398) 21.421 10.806 ( -9.161 0.760 21.440) 23.328 11.363 ( 6.653 -0.492 9.484) 11.595 11.975 ( 1.844 0.259 5.203) 5.526 12.171 ( 0.411 0.437 3.547) 3.597 12.370 ( 5.460 5.915 5.316) 9.646 12.497 ( 4.699 -7.346 0.841) 8.760 13.175 ( -2.240 1.471 -15.591) 15.820 13.920 ( -0.986 -1.181 -0.505) 1.619 14.256 ( -3.125 0.580 -8.646) 9.212 15.115 ( 3.872 0.579 13.737) 14.284 15.586 ( 4.602 -0.238 9.466) 10.528 21.176 ( -8.509 -0.087 16.393) 18.470 21.389 ( -6.264 0.020 19.059) 20.062 ======================= Grid point 252 (111/343) ======================= q-point: ( 0.38 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.927 ( 7.947 0.000 5.563) 9.700 3.129 ( -2.595 -0.000 1.937) 3.238 3.203 ( 0.089 -0.000 4.136) 4.137 3.267 ( -4.030 -0.000 1.856) 4.437 3.407 ( -8.895 -0.000 4.818) 10.116 3.474 ( -5.675 -0.000 2.762) 6.311 3.595 ( -1.840 -0.000 2.870) 3.409 3.752 ( -2.901 -0.000 -0.080) 2.902 3.872 ( -5.112 -0.000 0.096) 5.113 5.616 ( 5.971 0.000 -8.769) 10.609 5.838 ( 3.976 0.000 -4.556) 6.047 5.991 ( -0.899 0.000 -2.656) 2.804 6.143 ( 9.850 0.000 -12.222) 15.697 6.363 ( 8.668 0.000 -0.816) 8.706 6.616 ( 11.114 0.000 -16.881) 20.211 6.713 ( 14.833 0.000 -11.927) 19.033 7.089 ( -6.414 -0.000 5.160) 8.232 7.677 ( 1.934 0.000 3.381) 3.895 8.960 ( -11.403 -0.000 11.465) 16.171 9.387 ( 2.321 -0.000 19.547) 19.684 9.464 ( -1.994 -0.000 7.609) 7.866 9.959 ( -0.520 -0.000 17.589) 17.597 10.571 ( -4.188 -0.000 17.559) 18.052 11.201 ( -7.149 -0.000 19.427) 20.700 11.379 ( 7.798 0.000 8.326) 11.408 11.922 ( 1.395 0.000 -9.542) 9.643 12.212 ( 4.079 0.000 6.540) 7.707 12.385 ( 2.672 0.000 3.344) 4.281 12.543 ( 0.344 -0.000 12.291) 12.295 13.030 ( -3.620 0.000 -11.071) 11.648 13.933 ( -2.695 -0.000 -1.777) 3.228 14.202 ( -6.310 -0.000 -10.124) 11.929 15.269 ( 1.476 -0.000 14.055) 14.132 15.656 ( 4.480 -0.000 10.557) 11.469 21.493 ( -6.586 -0.000 14.575) 15.994 21.706 ( -4.469 -0.000 16.351) 16.950 ======================= Grid point 254 (112/343) ======================= q-point: ( 0.54 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.941 ( -0.000 1.998 2.520) 3.216 3.194 ( 0.000 -3.871 0.700) 3.934 3.275 ( -0.000 1.709 1.531) 2.294 3.401 ( -0.000 5.357 1.698) 5.620 3.607 ( 0.000 -4.155 -1.158) 4.314 3.613 ( -0.000 -7.324 1.715) 7.522 3.713 ( 0.000 4.586 1.710) 4.895 3.818 ( 0.000 -1.264 1.772) 2.176 3.932 ( -0.000 2.736 -0.343) 2.757 5.270 ( 0.000 4.746 -5.050) 6.930 5.670 ( -0.000 -8.193 -3.530) 8.921 5.751 ( 0.000 -8.167 -2.877) 8.659 5.832 ( 0.000 0.100 -8.695) 8.696 6.049 ( -0.000 16.917 -0.995) 16.946 6.184 ( -0.000 -0.159 -6.792) 6.794 6.409 ( 0.000 -5.198 -0.071) 5.198 7.290 ( -0.000 1.595 2.397) 2.879 7.764 ( -0.000 -1.785 1.984) 2.669 9.388 ( 0.000 -0.631 4.980) 5.020 9.613 ( -0.000 -1.025 2.465) 2.670 9.828 ( -0.000 0.039 11.667) 11.667 10.303 ( -0.000 0.792 6.955) 7.000 10.938 ( -0.000 3.989 4.070) 5.699 11.434 ( 0.000 0.042 4.049) 4.049 11.583 ( -0.000 -0.953 -7.101) 7.164 11.659 ( 0.000 -1.777 6.494) 6.733 12.254 ( -0.000 -0.112 3.073) 3.075 12.367 ( 0.000 -0.851 -2.784) 2.911 12.857 ( 0.000 -7.834 6.788) 10.365 13.127 ( 0.000 10.815 7.398) 13.104 13.886 ( 0.000 -3.184 -4.203) 5.273 14.010 ( -0.000 0.911 -8.325) 8.375 15.568 ( 0.000 0.048 6.298) 6.299 15.842 ( -0.000 -0.004 5.263) 5.263 21.866 ( 0.000 0.030 5.513) 5.513 22.075 ( 0.000 0.007 5.950) 5.950 ======================= Grid point 255 (113/343) ======================= q-point: (-0.38 0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.987 ( -2.792 1.657 -0.000) 3.247 3.165 ( 2.513 -5.273 0.000) 5.841 3.301 ( -0.860 2.608 -0.000) 2.746 3.420 ( 2.569 7.117 -0.000) 7.567 3.538 ( 5.454 -7.365 0.000) 9.165 3.588 ( 1.755 -4.972 0.000) 5.273 3.693 ( 6.173 4.348 -0.000) 7.550 3.820 ( 0.958 -1.427 0.000) 1.719 3.934 ( 1.264 2.983 -0.000) 3.240 5.314 ( -8.094 6.726 -0.000) 10.524 5.604 ( -1.184 -12.176 0.000) 12.234 5.711 ( -1.336 -4.503 0.000) 4.697 5.876 ( -12.529 -0.177 -0.000) 12.530 6.094 ( 0.775 15.397 -0.000) 15.417 6.204 ( -8.648 1.718 -0.000) 8.817 6.397 ( -1.683 -7.165 0.000) 7.360 7.306 ( 1.222 2.494 -0.000) 2.777 7.758 ( 1.605 -2.295 0.000) 2.800 9.356 ( 8.845 -0.732 0.000) 8.875 9.625 ( 0.262 -0.612 0.000) 0.666 9.912 ( -0.236 -1.547 0.000) 1.564 10.354 ( 0.031 1.037 -0.000) 1.038 10.969 ( 1.264 3.664 -0.000) 3.876 11.450 ( 2.016 0.214 -0.000) 2.027 11.587 ( -7.741 0.057 -0.000) 7.741 11.675 ( 2.750 -2.998 0.000) 4.068 12.309 ( -1.948 0.402 -0.000) 1.989 12.347 ( -3.683 -1.394 0.000) 3.938 12.844 ( 4.217 -9.141 0.000) 10.066 13.202 ( 5.241 15.347 -0.000) 16.217 13.816 ( 1.064 -7.011 0.000) 7.091 13.943 ( 2.618 2.209 -0.000) 3.425 15.600 ( 1.616 -0.113 0.000) 1.620 15.883 ( -0.644 0.098 -0.000) 0.651 21.881 ( 3.299 -0.050 0.000) 3.299 22.102 ( 2.158 0.076 -0.000) 2.159 ======================= Grid point 262 (114/343) ======================= q-point: ( 0.15 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( -6.189 1.177 0.495) 6.319 2.894 ( -2.915 0.546 1.165) 3.187 2.986 ( -2.835 0.907 -5.712) 6.441 3.058 ( -3.953 -2.150 -5.029) 6.748 3.260 ( -3.385 3.510 -1.126) 5.004 3.377 ( -2.583 1.475 1.832) 3.493 3.408 ( -2.151 -1.578 1.516) 3.068 3.461 ( 0.759 0.433 2.748) 2.884 3.782 ( 3.365 -3.929 -1.574) 5.408 5.861 ( -1.311 3.025 1.074) 3.467 5.959 ( -2.044 1.364 -0.095) 2.459 6.150 ( -3.857 -0.393 2.511) 4.619 6.323 ( -3.654 -2.739 -3.103) 5.521 6.524 ( 8.216 -1.728 -16.696) 18.688 7.266 ( 3.132 -1.800 -8.330) 9.079 7.483 ( -6.341 -1.770 5.066) 8.307 7.535 ( 0.356 -0.074 -5.284) 5.297 8.357 ( 5.852 4.241 -9.918) 12.272 8.534 ( 7.885 1.852 -8.349) 11.632 8.736 ( -5.281 -0.095 4.176) 6.734 9.067 ( -4.171 1.796 8.800) 9.902 9.261 ( -5.639 -0.796 9.823) 11.354 9.629 ( -10.265 -0.493 5.253) 11.542 9.955 ( -18.235 -0.743 12.780) 22.280 11.171 ( -9.285 0.696 0.718) 9.339 11.921 ( -10.594 1.687 -7.191) 12.915 12.169 ( 8.469 -0.236 9.584) 12.792 12.419 ( -1.334 7.887 -1.207) 8.089 12.889 ( 7.105 -3.458 2.279) 8.224 13.398 ( 4.856 -5.626 -2.744) 7.922 14.103 ( 5.015 -2.640 -4.380) 7.163 14.522 ( 6.956 1.202 -11.477) 13.475 14.990 ( -3.062 5.933 7.858) 10.312 15.400 ( -8.749 -4.141 7.108) 12.009 20.646 ( -6.826 0.725 7.836) 10.417 20.823 ( -10.569 -0.317 7.123) 12.749 ======================= Grid point 263 (115/343) ======================= q-point: ( 0.23 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( -7.569 3.357 2.202) 8.568 2.964 ( -4.781 3.640 -4.360) 7.424 2.990 ( -6.051 -0.723 2.041) 6.427 3.057 ( -4.907 -3.158 -2.285) 6.267 3.303 ( -0.395 5.240 1.141) 5.377 3.423 ( -2.069 -0.473 0.110) 2.125 3.483 ( -3.063 -0.027 2.022) 3.670 3.512 ( -4.203 1.655 0.947) 4.615 3.697 ( 1.900 -9.298 -0.017) 9.490 5.852 ( 3.815 3.782 -1.218) 5.508 5.995 ( -1.200 0.151 0.077) 1.211 6.196 ( 4.772 -1.545 -12.594) 13.556 6.284 ( -6.037 2.581 0.751) 6.608 6.382 ( -8.031 -5.243 1.859) 9.770 7.031 ( 7.671 -1.960 -11.987) 14.366 7.372 ( 4.848 0.729 -8.332) 9.667 7.486 ( 7.284 -2.123 -11.215) 13.540 8.119 ( 17.064 2.504 -14.306) 22.408 8.343 ( -6.644 3.620 5.771) 9.515 9.100 ( -12.268 0.354 15.631) 19.873 9.184 ( -2.765 1.618 5.820) 6.643 9.498 ( -7.563 -1.170 13.923) 15.887 9.976 ( -14.333 -0.220 16.828) 22.106 10.410 ( -19.612 0.346 14.811) 24.579 11.318 ( -8.986 0.995 0.961) 9.091 11.988 ( -8.495 3.398 -3.530) 9.807 12.166 ( 8.281 -2.169 7.235) 11.208 12.449 ( 0.656 10.028 0.494) 10.061 12.786 ( 9.501 -7.566 3.155) 12.548 13.232 ( 7.540 -3.951 -6.091) 10.467 13.979 ( 3.995 -2.459 -2.817) 5.472 14.277 ( 4.611 0.940 -11.992) 12.883 15.149 ( -0.754 4.542 8.700) 9.843 15.585 ( -5.540 -2.873 6.829) 9.251 20.913 ( -10.391 0.529 12.912) 16.582 21.130 ( -13.154 -0.266 13.125) 18.584 ======================= Grid point 264 (116/343) ======================= q-point: ( 0.31 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.955 ( -8.279 3.669 1.485) 9.176 3.015 ( -5.012 6.716 0.183) 8.382 3.081 ( -4.877 -3.136 0.713) 5.842 3.130 ( -6.681 -1.500 2.111) 7.165 3.343 ( -0.696 3.042 1.941) 3.675 3.421 ( 2.046 -3.713 -0.263) 4.248 3.500 ( -3.492 -1.746 -1.288) 4.111 3.623 ( -5.066 3.289 2.655) 6.598 3.710 ( -6.013 -6.531 1.030) 8.937 5.773 ( 6.437 3.860 -1.943) 7.753 5.970 ( 4.612 0.536 -6.107) 7.672 5.992 ( -0.497 -4.633 -4.619) 6.561 6.349 ( -1.489 5.368 -2.150) 5.972 6.448 ( 1.200 -5.480 -5.642) 7.957 6.857 ( -3.592 -0.264 -1.642) 3.958 7.081 ( 17.452 0.091 -17.147) 24.466 7.152 ( 11.241 -1.078 -9.833) 14.973 7.804 ( 8.952 1.499 -5.185) 10.453 8.611 ( -13.616 1.798 8.062) 15.926 9.357 ( -4.509 2.335 11.850) 12.892 9.392 ( -4.345 -1.189 11.013) 11.899 9.834 ( -9.354 -0.280 16.549) 19.012 10.390 ( -10.625 -0.073 17.862) 20.783 10.869 ( -17.560 1.133 14.896) 23.055 11.422 ( -6.008 0.681 -1.588) 6.252 12.051 ( 3.171 5.358 0.489) 6.246 12.137 ( -1.572 -5.355 1.091) 5.686 12.499 ( 1.204 10.903 3.576) 11.538 12.695 ( 7.931 -8.513 6.189) 13.179 13.022 ( 6.774 -3.620 -7.536) 10.760 13.906 ( 1.170 -1.291 -1.909) 2.584 14.097 ( -0.311 0.746 -10.780) 10.810 15.284 ( -0.418 2.232 8.633) 8.926 15.712 ( -1.716 -1.358 6.126) 6.505 21.248 ( -11.070 0.288 13.661) 17.586 21.493 ( -11.916 -0.178 14.042) 18.418 ======================= Grid point 265 (117/343) ======================= q-point: ( 0.38 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.063 ( -1.483 4.948 1.669) 5.429 3.083 ( -0.116 0.145 1.919) 1.928 3.197 ( -8.635 1.021 2.132) 8.953 3.227 ( -5.506 -2.154 1.139) 6.021 3.392 ( -0.151 -2.681 2.510) 3.675 3.416 ( -6.265 -0.804 0.871) 6.377 3.543 ( -5.784 0.752 -2.241) 6.248 3.727 ( -3.435 1.468 2.721) 4.621 3.797 ( -6.814 -2.664 0.408) 7.327 5.648 ( 9.732 1.213 -2.229) 10.058 5.816 ( 3.901 -0.042 -6.041) 7.191 5.953 ( -0.067 0.381 -2.400) 2.431 6.136 ( 11.207 -1.916 -10.764) 15.656 6.415 ( -0.263 0.625 -0.487) 0.835 6.602 ( 18.670 -0.071 -14.150) 23.427 6.734 ( 12.890 -0.103 -12.650) 18.060 7.089 ( -6.100 -0.658 6.663) 9.057 7.719 ( 1.327 0.655 0.148) 1.488 8.906 ( -14.516 0.555 6.463) 15.899 9.528 ( -1.883 0.351 5.819) 6.126 9.625 ( -3.295 0.371 15.571) 15.920 10.132 ( -4.636 -0.094 12.492) 13.325 10.719 ( -5.637 -0.165 13.791) 14.899 11.278 ( -13.514 1.525 12.686) 18.598 11.446 ( -3.542 -0.313 -3.908) 5.284 11.924 ( 11.841 -0.011 -1.613) 11.951 12.221 ( -6.439 -0.491 1.003) 6.535 12.562 ( 7.373 3.025 6.061) 10.013 12.698 ( 1.894 3.461 7.414) 8.398 12.867 ( -2.541 -7.334 -5.223) 9.356 13.876 ( -1.059 -0.213 -2.425) 2.654 13.992 ( -3.921 0.455 -9.766) 10.533 15.416 ( -1.595 0.627 7.952) 8.134 15.798 ( 0.187 -0.380 5.784) 5.800 21.557 ( -9.348 0.103 10.682) 14.195 21.805 ( -8.589 -0.080 11.020) 13.972 ======================= Grid point 266 (118/343) ======================= q-point: ( 0.46 -0.46 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.035 ( 6.479 -0.000 2.204) 6.844 3.152 ( -4.387 -0.000 0.324) 4.399 3.283 ( -0.324 0.000 1.455) 1.491 3.310 ( -4.941 -0.000 1.184) 5.081 3.497 ( -9.812 0.000 1.721) 9.962 3.516 ( -6.713 -0.000 0.191) 6.715 3.595 ( -4.686 -0.000 -0.847) 4.762 3.797 ( -2.011 -0.000 1.748) 2.665 3.873 ( -4.477 0.000 0.028) 4.477 5.454 ( 12.758 -0.000 -2.953) 13.095 5.705 ( 2.873 -0.000 -3.405) 4.455 5.885 ( 6.620 -0.000 -5.560) 8.645 5.944 ( -1.037 0.000 -1.600) 1.907 6.159 ( 18.753 -0.000 -6.797) 19.947 6.403 ( 13.774 -0.000 -7.147) 15.518 6.450 ( 0.236 -0.000 -0.317) 0.395 7.236 ( -4.196 -0.000 3.303) 5.340 7.737 ( -1.634 -0.000 1.009) 1.920 9.173 ( -13.462 -0.000 4.170) 14.093 9.603 ( -0.920 -0.000 2.586) 2.745 9.843 ( -0.838 -0.000 10.970) 11.002 10.297 ( -1.118 -0.000 6.622) 6.716 10.902 ( -1.571 -0.000 6.100) 6.299 11.433 ( -3.068 -0.000 -3.283) 4.493 11.566 ( -8.066 -0.000 7.163) 10.788 11.736 ( 11.908 0.000 -1.284) 11.977 12.294 ( -3.247 -0.000 -0.169) 3.251 12.464 ( 11.632 -0.000 1.513) 11.730 12.840 ( -2.998 0.000 6.823) 7.452 12.927 ( -10.264 -0.000 1.942) 10.446 13.863 ( -1.848 -0.000 -2.305) 2.954 13.931 ( -4.261 0.000 -7.561) 8.679 15.536 ( -2.282 -0.000 5.191) 5.671 15.861 ( 0.601 -0.000 4.036) 4.080 21.777 ( -6.447 -0.000 5.651) 8.573 22.013 ( -5.028 -0.000 5.884) 7.740 ======================= Grid point 276 (119/343) ======================= q-point: ( 0.15 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( -11.342 -2.213 -3.122) 11.970 2.793 ( -6.622 2.240 -10.106) 12.289 2.849 ( -3.713 0.841 -4.761) 6.096 2.928 ( -5.494 -2.314 -3.615) 6.972 3.117 ( -8.091 0.398 -5.309) 9.686 3.353 ( -3.205 2.896 1.273) 4.504 3.413 ( -0.452 -1.768 0.373) 1.863 3.545 ( 6.198 2.704 1.072) 6.846 3.770 ( -3.229 -1.601 -1.541) 3.919 5.802 ( -8.603 2.342 -1.097) 8.983 5.896 ( -4.207 0.662 -2.762) 5.076 6.111 ( -2.738 1.640 -4.007) 5.123 6.181 ( -1.659 -0.819 -6.556) 6.812 6.464 ( 6.142 -4.822 -9.279) 12.128 7.144 ( -3.749 -4.266 -11.573) 12.891 7.419 ( -4.963 -1.319 -2.780) 5.839 7.470 ( -1.829 -2.975 -3.261) 4.778 8.182 ( -5.043 3.310 -14.557) 15.757 8.466 ( -1.138 2.971 -6.614) 7.339 8.657 ( -8.824 -0.610 -1.839) 9.035 9.058 ( -6.608 2.642 0.718) 7.152 9.288 ( -10.539 -1.210 8.199) 13.407 9.536 ( -14.066 3.286 7.786) 16.409 9.828 ( -20.957 -1.491 8.333) 22.602 10.947 ( -16.862 0.562 -5.632) 17.786 11.633 ( -16.609 2.171 -7.377) 18.303 12.150 ( -12.837 12.784 -10.194) 20.788 12.438 ( 6.423 -3.587 8.359) 11.135 13.041 ( 7.911 3.160 5.524) 10.153 13.560 ( 8.856 -13.351 1.756) 16.117 14.118 ( 4.267 -0.270 -3.298) 5.400 14.435 ( 5.116 -1.208 -12.057) 13.153 14.985 ( -7.259 10.332 7.151) 14.512 15.386 ( -9.741 -8.125 7.362) 14.667 20.614 ( -11.349 1.631 5.320) 12.639 20.685 ( -18.964 -0.328 2.201) 19.094 ======================= Grid point 277 (120/343) ======================= q-point: ( 0.23 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.679 ( -11.659 0.772 -0.476) 11.694 2.773 ( -8.329 4.125 -8.009) 12.269 2.895 ( -8.464 0.291 -1.800) 8.658 2.965 ( -6.532 -4.382 -0.825) 7.909 3.180 ( -9.413 3.161 -4.422) 10.870 3.402 ( -1.649 0.682 -0.112) 1.788 3.469 ( -2.414 2.249 1.851) 3.784 3.491 ( 1.080 3.190 -0.256) 3.377 3.760 ( 0.422 -9.447 0.443) 9.467 5.890 ( 1.994 3.814 -0.618) 4.348 5.926 ( -6.545 2.036 -1.318) 6.980 6.018 ( -3.429 -1.010 -12.960) 13.444 6.219 ( -5.824 0.101 2.044) 6.173 6.329 ( -1.632 -6.070 -1.930) 6.575 6.967 ( 3.862 -3.473 -11.238) 12.380 7.274 ( 1.271 0.286 -10.954) 11.031 7.428 ( 4.231 -3.887 -9.934) 11.476 8.130 ( 13.101 3.150 -12.764) 18.560 8.197 ( -13.458 4.869 -4.544) 15.016 9.079 ( -20.161 -0.393 13.194) 24.098 9.158 ( -9.881 1.419 2.971) 10.415 9.542 ( -11.082 -1.808 9.380) 14.631 9.973 ( -18.074 3.938 16.977) 25.107 10.266 ( -24.594 -0.221 9.526) 26.375 11.103 ( -15.688 1.727 -5.533) 16.724 11.782 ( -14.002 2.374 -2.748) 14.465 12.223 ( -8.988 13.346 -8.131) 18.028 12.430 ( 6.843 -4.170 5.790) 9.886 12.984 ( 10.085 -1.227 4.194) 10.991 13.382 ( 11.967 -8.670 -0.543) 14.787 14.007 ( 4.500 0.275 -3.657) 5.805 14.192 ( 6.720 -3.995 -9.478) 12.287 15.187 ( -4.084 8.681 6.059) 11.347 15.579 ( -9.092 -6.205 5.414) 12.267 20.901 ( -13.957 1.385 9.794) 17.107 21.040 ( -21.647 -0.381 8.015) 23.086 ======================= Grid point 278 (121/343) ======================= q-point: ( 0.31 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( -9.110 5.166 -1.688) 10.608 2.860 ( -11.975 4.099 -0.861) 12.686 3.006 ( -9.484 -3.667 0.240) 10.171 3.055 ( -8.199 -2.329 0.950) 8.576 3.266 ( -8.986 4.508 -3.521) 10.652 3.390 ( 3.288 5.590 -1.223) 6.600 3.476 ( -3.464 -3.691 -1.064) 5.173 3.593 ( -5.067 1.900 3.010) 6.192 3.722 ( 0.145 -11.267 1.279) 11.340 5.832 ( 3.705 3.944 -2.992) 6.183 5.905 ( 1.599 0.471 -4.217) 4.534 5.959 ( -0.822 -2.578 -1.860) 3.284 6.274 ( -2.949 1.471 -1.691) 3.704 6.378 ( -3.901 -3.683 -4.043) 6.717 6.782 ( 0.712 -0.424 -5.529) 5.591 7.094 ( 11.603 -0.336 -10.890) 15.917 7.147 ( 5.055 -3.446 -8.648) 10.593 7.841 ( 9.419 1.990 -6.072) 11.382 8.438 ( -19.437 3.744 0.845) 19.812 9.374 ( -11.328 2.808 7.591) 13.922 9.447 ( -9.748 -3.358 8.860) 13.594 9.861 ( -14.764 -0.103 11.070) 18.454 10.441 ( -14.309 3.982 16.100) 21.905 10.731 ( -25.017 0.965 8.788) 26.534 11.216 ( -12.585 1.790 -7.372) 14.694 11.948 ( -11.436 2.352 0.190) 11.677 12.246 ( 2.959 7.349 -2.343) 8.262 12.408 ( -1.806 0.481 -0.278) 1.890 12.898 ( 8.118 -5.647 4.266) 10.770 13.169 ( 14.462 -5.084 -0.685) 15.345 13.911 ( 2.147 1.338 -4.014) 4.745 13.986 ( 5.246 -4.129 -6.288) 9.171 15.331 ( -3.292 5.153 4.554) 7.624 15.727 ( -6.421 -3.478 3.587) 8.136 21.234 ( -14.116 0.940 9.480) 17.030 21.439 ( -19.161 -0.366 8.714) 21.053 ======================= Grid point 279 (122/343) ======================= q-point: ( 0.38 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( -8.431 6.295 -0.456) 10.532 3.045 ( -11.986 4.070 0.954) 12.694 3.120 ( -6.489 -4.001 2.245) 7.947 3.165 ( -6.110 -0.618 -0.088) 6.142 3.347 ( -4.184 3.438 -2.093) 5.806 3.377 ( -4.194 4.199 -0.662) 5.972 3.475 ( -1.042 -8.903 -0.167) 8.965 3.699 ( -4.616 1.395 1.868) 5.171 3.735 ( -4.738 -5.703 0.520) 7.433 5.764 ( 4.723 4.098 -0.736) 6.296 5.817 ( 7.923 -0.957 -0.408) 7.991 5.918 ( 0.164 -1.361 -2.824) 3.139 6.163 ( 9.761 -0.696 -7.134) 12.110 6.361 ( -4.764 -0.094 -0.750) 4.823 6.717 ( 9.711 0.413 -6.696) 11.803 6.730 ( 13.873 -1.472 -6.465) 15.376 7.093 ( -3.527 -1.938 2.247) 4.609 7.726 ( 2.125 1.065 -1.341) 2.729 8.732 ( -18.806 2.030 1.853) 19.006 9.558 ( -3.311 0.216 3.394) 4.747 9.689 ( -10.862 -0.333 7.581) 13.250 10.162 ( -10.209 0.229 6.533) 12.122 10.790 ( -7.424 3.290 10.485) 13.262 11.161 ( -21.107 2.446 5.699) 22.000 11.266 ( -10.019 -0.307 -6.775) 12.099 12.089 ( 1.088 3.590 1.874) 4.193 12.138 ( 2.576 -2.982 -1.115) 4.095 12.507 ( -10.686 8.352 -0.880) 13.591 12.850 ( 5.928 -5.379 4.182) 9.031 12.946 ( 12.145 -6.595 -0.581) 13.832 13.848 ( -1.116 0.566 -5.565) 5.704 13.861 ( 3.120 -1.021 -1.386) 3.564 15.444 ( -3.890 2.218 3.041) 5.413 15.828 ( -3.900 -1.431 2.254) 4.727 21.522 ( -12.207 0.505 5.571) 13.428 21.764 ( -14.233 -0.277 5.361) 15.211 ======================= Grid point 280 (123/343) ======================= q-point: ( 0.46 -0.38 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.072 ( -6.537 3.622 -0.000) 7.473 3.134 ( 5.509 2.924 -0.000) 6.237 3.227 ( -9.791 0.866 -0.000) 9.829 3.240 ( -7.437 -4.048 0.000) 8.467 3.408 ( -4.830 3.082 -0.000) 5.729 3.436 ( -4.177 -4.719 0.000) 6.302 3.501 ( -7.111 -0.288 0.000) 7.117 3.772 ( -3.355 0.965 -0.000) 3.491 3.803 ( -6.238 -2.326 0.000) 6.658 5.638 ( 14.938 -0.948 0.000) 14.968 5.724 ( 3.486 1.727 -0.000) 3.890 5.890 ( 2.974 9.431 -0.000) 9.888 5.980 ( 5.355 -10.744 0.000) 12.005 6.378 ( 15.881 0.462 -0.000) 15.888 6.435 ( 1.996 0.526 -0.000) 2.064 6.544 ( 13.298 -0.200 0.000) 13.300 7.190 ( -6.363 -1.026 0.000) 6.445 7.720 ( -1.047 0.564 -0.000) 1.189 8.993 ( -16.589 0.702 -0.000) 16.604 9.607 ( -1.249 -0.137 0.000) 1.257 9.870 ( -6.298 0.633 -0.000) 6.329 10.306 ( -4.658 -0.039 -0.000) 4.658 10.927 ( -1.844 1.198 -0.000) 2.199 11.324 ( -7.468 0.126 -0.000) 7.470 11.462 ( -14.545 0.862 -0.000) 14.570 11.923 ( 14.672 -0.808 0.000) 14.694 12.222 ( -6.428 0.256 -0.000) 6.433 12.650 ( 7.054 1.094 -0.000) 7.138 12.748 ( -3.237 12.492 -0.000) 12.904 12.884 ( -4.373 -15.666 0.000) 16.265 13.822 ( -0.842 2.993 -0.000) 3.109 13.841 ( -1.813 -2.184 0.000) 2.839 15.526 ( -3.802 0.599 -0.000) 3.848 15.880 ( -1.630 -0.375 0.000) 1.673 21.708 ( -9.404 0.164 -0.000) 9.406 21.959 ( -9.118 -0.117 -0.000) 9.119 ======================= Grid point 290 (124/343) ======================= q-point: ( 0.15 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.294 ( -16.956 -3.616 -7.846) 19.030 2.507 ( -9.284 2.559 -14.449) 17.364 2.665 ( -9.441 -1.160 -7.709) 12.243 2.827 ( -5.070 0.524 -3.934) 6.439 2.938 ( -6.099 -2.533 -5.445) 8.560 3.298 ( -4.872 3.953 0.509) 6.294 3.392 ( -3.847 0.679 -2.473) 4.624 3.588 ( 2.265 4.312 -2.821) 5.629 3.717 ( -1.284 -1.749 1.461) 2.615 5.597 ( -13.102 0.739 -5.363) 14.176 5.750 ( -7.915 1.929 -4.590) 9.351 5.877 ( -5.983 -1.351 -15.637) 16.797 6.218 ( 2.202 1.534 2.942) 3.982 6.437 ( 1.061 -6.361 -6.450) 9.121 6.874 ( -10.065 -6.456 -15.642) 19.689 7.281 ( -12.300 -1.376 -2.298) 12.588 7.455 ( 5.909 -2.890 -3.696) 7.545 7.843 ( -9.309 -1.002 -17.720) 20.042 8.286 ( -22.191 1.577 3.723) 22.557 8.500 ( 1.683 0.453 -11.416) 11.548 8.871 ( -10.715 2.015 -8.973) 14.121 9.152 ( -19.219 -2.007 0.200) 19.324 9.449 ( -17.494 5.591 11.024) 21.420 9.672 ( -17.509 -0.042 8.849) 19.618 10.594 ( -20.483 -0.298 -7.897) 21.955 11.242 ( -25.194 4.065 -7.478) 26.593 11.712 ( -19.495 9.199 -13.444) 25.404 12.656 ( 6.287 -3.568 8.237) 10.960 13.212 ( 7.368 4.147 5.745) 10.222 13.682 ( 5.029 -7.676 -3.658) 9.879 14.089 ( 3.023 5.826 -8.509) 10.746 14.402 ( 0.788 -8.328 -1.185) 8.449 14.946 ( -8.189 10.147 9.020) 15.855 15.449 ( -0.459 -9.429 10.199) 13.897 20.337 ( -28.347 0.822 -3.281) 28.548 20.494 ( -15.622 1.064 1.874) 15.769 ======================= Grid point 291 (125/343) ======================= q-point: ( 0.23 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.447 ( -17.484 0.562 -4.564) 18.079 2.506 ( -12.097 4.941 -8.163) 15.407 2.728 ( -11.170 -0.923 -3.040) 11.613 2.866 ( -8.576 -4.942 -2.850) 10.300 2.981 ( -8.630 0.522 -3.121) 9.191 3.372 ( -1.814 0.601 -0.394) 1.951 3.420 ( -5.602 1.533 0.717) 5.852 3.512 ( 5.288 4.952 -2.353) 7.617 3.771 ( -3.926 -5.400 0.827) 6.727 5.741 ( -9.182 2.379 -5.921) 11.181 5.780 ( -11.034 0.186 -6.537) 12.826 5.824 ( -9.303 -0.346 -3.854) 10.076 6.242 ( 2.417 0.764 4.544) 5.204 6.323 ( 1.147 -7.647 -3.048) 8.311 6.794 ( -9.889 -5.526 -12.511) 16.878 7.183 ( 8.392 1.711 -9.440) 12.746 7.374 ( 1.154 -5.736 -5.558) 8.070 7.831 ( -19.625 4.592 -10.099) 22.544 8.140 ( 11.676 2.679 -9.651) 15.384 8.914 ( -28.232 -0.784 10.902) 30.274 8.975 ( -18.663 0.547 -0.393) 18.675 9.411 ( -20.191 -2.796 -0.326) 20.386 9.925 ( -19.698 6.967 15.577) 26.062 10.055 ( -21.358 0.584 7.845) 22.761 10.764 ( -19.215 1.179 -7.819) 20.779 11.513 ( -20.482 3.207 -1.217) 20.768 11.837 ( -18.445 11.234 -11.462) 24.450 12.642 ( 8.053 -4.853 5.999) 11.153 13.165 ( 8.882 -0.072 2.730) 9.292 13.516 ( 8.900 -1.741 -3.496) 9.719 13.949 ( 2.964 6.386 -8.193) 10.802 14.301 ( 8.697 -14.159 1.602) 16.694 15.166 ( -3.987 11.780 5.396) 13.557 15.563 ( -6.129 -9.060 4.989) 12.022 20.750 ( -29.120 0.809 3.528) 29.344 20.791 ( -19.977 0.969 5.002) 20.617 ======================= Grid point 292 (126/343) ======================= q-point: ( 0.31 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( -13.200 8.524 -3.405) 16.078 2.663 ( -15.079 1.376 -0.565) 15.152 2.870 ( -12.219 -0.832 0.409) 12.254 2.946 ( -10.641 -7.806 -1.414) 13.273 3.073 ( -9.212 2.726 -2.194) 9.855 3.394 ( -2.795 -1.721 -0.137) 3.286 3.435 ( 3.793 5.888 -1.572) 7.178 3.534 ( -6.423 2.932 1.210) 7.164 3.782 ( -0.438 -10.326 0.615) 10.353 5.734 ( -4.891 0.185 -4.510) 6.655 5.828 ( -5.732 -0.433 -3.440) 6.699 5.963 ( -5.783 2.924 1.382) 6.625 6.244 ( 1.783 -1.792 0.024) 2.527 6.301 ( -2.979 -4.226 -0.193) 5.174 6.733 ( 0.825 0.465 -5.326) 5.410 7.021 ( -2.769 -1.416 -5.494) 6.314 7.177 ( 10.793 -5.015 -5.837) 13.256 7.899 ( 10.812 2.345 -4.107) 11.801 8.095 ( -25.961 4.795 -2.496) 26.518 9.222 ( -19.230 1.890 2.251) 19.453 9.388 ( -16.339 -4.803 6.427) 18.203 9.709 ( -22.863 0.096 2.773) 23.030 10.405 ( -18.031 7.846 12.382) 23.238 10.461 ( -24.915 1.639 4.769) 25.420 10.901 ( -16.484 1.026 -8.116) 18.402 11.765 ( -15.296 1.113 0.929) 15.364 11.991 ( -15.615 14.431 -6.538) 22.245 12.559 ( 9.711 -7.248 2.866) 12.452 13.064 ( 7.696 -5.353 1.253) 9.458 13.342 ( 12.353 2.910 -1.515) 12.782 13.847 ( 2.006 4.178 -4.580) 6.516 14.123 ( 11.628 -12.813 0.708) 17.318 15.300 ( -3.333 9.201 2.161) 10.022 15.679 ( -8.044 -6.528 1.871) 10.527 21.108 ( -17.795 1.306 4.449) 18.389 21.207 ( -27.265 -0.038 3.522) 27.492 ======================= Grid point 293 (127/343) ======================= q-point: ( 0.38 -0.31 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( -11.218 8.499 -0.000) 14.074 2.863 ( -13.534 2.704 -0.000) 13.801 3.036 ( -10.822 -2.840 0.000) 11.188 3.051 ( -10.214 -5.371 0.000) 11.540 3.196 ( -9.569 4.329 -0.000) 10.503 3.375 ( 3.988 5.879 -0.000) 7.104 3.458 ( -4.752 -4.047 0.000) 6.242 3.636 ( -5.758 2.174 -0.000) 6.155 3.741 ( 0.173 -11.006 0.000) 11.007 5.752 ( -1.633 0.232 -0.000) 1.649 5.863 ( -2.523 0.539 -0.000) 2.580 5.974 ( 6.774 0.839 -0.000) 6.826 6.209 ( 4.085 2.300 -0.000) 4.688 6.306 ( -2.184 -3.517 0.000) 4.140 6.692 ( -0.844 0.850 -0.000) 1.198 6.931 ( 16.295 -2.875 0.000) 16.547 7.056 ( -5.262 -3.167 0.000) 6.141 7.762 ( 6.300 1.746 -0.000) 6.537 8.441 ( -23.737 3.519 -0.000) 23.996 9.488 ( -12.784 2.866 -0.000) 13.102 9.573 ( -11.623 -4.961 0.000) 12.637 10.021 ( -17.139 0.718 -0.000) 17.154 10.739 ( -10.824 8.421 -0.000) 13.714 10.856 ( -26.956 2.146 -0.000) 27.042 11.039 ( -14.471 -1.127 0.000) 14.515 11.960 ( -12.457 0.049 -0.000) 12.457 12.171 ( -6.035 15.827 -0.000) 16.938 12.428 ( 5.071 -8.269 0.000) 9.700 12.965 ( 4.338 -9.610 0.000) 10.544 13.152 ( 15.794 2.555 -0.000) 15.999 13.805 ( 0.753 1.531 -0.000) 1.706 13.947 ( 8.727 -6.280 0.000) 10.751 15.392 ( -4.272 5.148 -0.000) 6.690 15.777 ( -6.808 -3.471 0.000) 7.642 21.370 ( -15.229 0.995 -0.000) 15.261 21.562 ( -20.964 -0.331 -0.000) 20.966 ======================= Grid point 303 (128/343) ======================= q-point: ( 0.15 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -22.511 -0.217 -11.319) 25.197 2.094 ( -15.345 6.327 -20.244) 26.178 2.464 ( -9.336 -7.980 -4.352) 13.030 2.662 ( -8.089 -7.338 -7.372) 13.177 2.826 ( -3.743 3.818 -3.273) 6.269 3.142 ( -20.711 10.860 -4.612) 23.836 3.214 ( -5.904 4.354 -0.381) 7.346 3.592 ( 4.453 -2.353 -1.680) 5.309 3.777 ( 5.570 -0.920 0.441) 5.663 5.330 ( -12.546 -1.475 -7.343) 14.612 5.532 ( -11.146 0.740 -9.318) 14.547 5.625 ( -3.968 1.259 -8.432) 9.404 6.144 ( -14.749 -4.385 -6.689) 16.778 6.312 ( -11.206 -4.837 -7.177) 14.159 6.621 ( 0.353 -6.467 -10.131) 12.024 7.042 ( -12.759 -1.788 -6.175) 14.287 7.496 ( -1.335 0.511 -5.840) 6.013 7.553 ( -6.721 -6.001 -3.353) 9.614 7.995 ( -26.896 -1.750 6.774) 27.791 8.427 ( 8.460 1.050 -8.695) 12.177 8.557 ( -10.783 0.738 -12.654) 16.641 8.812 ( -23.248 -4.885 -8.007) 25.069 9.274 ( -23.573 6.285 7.509) 25.526 9.592 ( -14.681 0.367 9.628) 17.560 10.206 ( -20.958 -1.003 -7.229) 22.193 10.709 ( -35.155 4.825 -8.009) 36.377 11.235 ( -21.061 3.879 -12.059) 24.577 12.850 ( 5.198 -4.077 6.813) 9.490 13.356 ( 6.172 3.349 3.793) 7.980 13.685 ( 2.737 -1.246 -4.856) 5.712 13.967 ( 2.823 10.803 -8.923) 14.293 14.413 ( -5.968 -5.667 3.139) 8.808 14.931 ( -9.575 4.338 9.818) 14.383 15.770 ( 17.519 -9.087 14.769) 24.650 19.818 ( -35.170 3.250 -7.648) 36.138 20.245 ( -21.190 -2.004 -2.049) 21.383 ======================= Grid point 304 (129/343) ======================= q-point: ( 0.23 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( -20.705 5.860 -5.820) 22.292 2.170 ( -20.446 3.441 -6.990) 21.880 2.544 ( -11.075 -2.832 -1.482) 11.527 2.692 ( -12.592 -11.205 -4.037) 17.332 2.872 ( -4.959 2.225 -0.557) 5.464 3.311 ( -6.226 4.784 0.099) 7.852 3.336 ( -7.559 1.759 -0.975) 7.822 3.519 ( 2.606 2.164 -1.687) 3.784 3.741 ( -1.450 -1.246 0.225) 1.925 5.485 ( -18.995 -0.437 -2.347) 19.145 5.547 ( -9.983 -2.361 -6.736) 12.273 5.649 ( -7.366 2.513 -2.782) 8.266 6.279 ( -12.027 -3.686 0.946) 12.615 6.312 ( -4.100 -8.795 -2.373) 9.990 6.496 ( -4.599 -5.959 -9.003) 11.735 7.138 ( -8.204 0.260 -5.112) 9.669 7.348 ( 4.707 3.618 -4.169) 7.254 7.521 ( -2.552 -3.930 -4.199) 6.292 8.184 ( 10.670 2.120 -4.465) 11.760 8.626 ( -30.421 -0.409 5.923) 30.995 8.671 ( -27.197 -0.532 2.591) 27.325 9.021 ( -27.223 -5.740 -9.292) 29.332 9.753 ( -25.053 8.740 8.019) 27.719 9.917 ( -15.921 0.819 6.742) 17.309 10.394 ( -19.963 -0.487 -5.934) 20.832 11.147 ( -31.473 7.813 0.335) 32.430 11.389 ( -20.525 3.826 -9.004) 22.738 12.828 ( 6.536 -5.322 3.876) 9.277 13.298 ( 7.490 0.029 0.623) 7.516 13.567 ( 6.569 3.825 -3.046) 8.189 13.872 ( 3.285 9.859 -4.359) 11.269 14.455 ( 0.895 -12.533 1.925) 12.711 15.145 ( -4.462 7.993 4.375) 10.146 15.673 ( 9.227 -9.218 4.953) 13.951 20.289 ( -38.500 2.587 -0.643) 38.592 20.549 ( -23.215 -0.643 1.508) 23.273 ======================= Grid point 305 (130/343) ======================= q-point: ( 0.31 -0.23 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.341 ( -16.830 9.981 -0.000) 19.568 2.419 ( -19.395 0.456 -0.000) 19.401 2.697 ( -12.805 1.042 -0.000) 12.847 2.802 ( -13.510 -12.992 0.000) 18.743 2.952 ( -6.293 1.946 -0.000) 6.587 3.359 ( -2.071 -1.629 0.000) 2.634 3.434 ( -6.446 4.077 -0.000) 7.627 3.473 ( 4.304 4.930 -0.000) 6.544 3.784 ( -4.069 -5.509 0.000) 6.848 5.615 ( -7.759 -0.721 0.000) 7.792 5.697 ( -10.347 1.299 -0.000) 10.428 5.785 ( -16.407 -0.184 -0.000) 16.409 6.279 ( -0.113 -7.721 0.000) 7.722 6.350 ( 4.904 -2.541 0.000) 5.523 6.573 ( -17.667 -3.263 0.000) 17.966 7.034 ( 10.821 3.970 -0.000) 11.526 7.281 ( 6.017 -6.909 0.000) 9.162 7.688 ( -25.458 4.941 -0.000) 25.933 8.011 ( 11.143 2.320 -0.000) 11.382 8.934 ( -22.961 1.144 -0.000) 22.990 9.214 ( -21.387 -6.904 0.000) 22.474 9.303 ( -35.702 0.658 -0.000) 35.708 10.157 ( -21.725 3.912 -0.000) 22.074 10.226 ( -19.709 8.305 -0.000) 21.387 10.598 ( -18.128 -0.940 0.000) 18.152 11.556 ( -17.990 0.733 -0.000) 18.005 11.609 ( -24.051 12.846 -0.000) 27.267 12.732 ( 8.491 -6.472 0.000) 10.676 13.189 ( 7.720 -3.239 0.000) 8.372 13.458 ( 9.523 6.499 -0.000) 11.529 13.830 ( 2.963 6.857 -0.000) 7.469 14.340 ( 9.515 -16.575 0.000) 19.112 15.244 ( -1.665 11.781 -0.000) 11.898 15.633 ( -3.639 -9.277 0.000) 9.965 20.801 ( -34.577 1.164 -0.000) 34.597 20.870 ( -21.440 0.734 -0.000) 21.452 ======================= Grid point 316 (131/343) ======================= q-point: ( 0.15 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -26.283 5.090 -9.838) 28.521 1.522 ( -22.901 9.040 -19.919) 31.669 2.328 ( -14.595 -13.501 -1.633) 19.949 2.483 ( -13.818 -9.880 -7.647) 18.629 2.548 ( -21.922 13.598 -4.455) 26.179 2.839 ( -2.437 9.639 -2.033) 10.148 3.118 ( -4.990 5.055 -0.430) 7.117 3.655 ( 3.546 -8.531 -0.706) 9.266 3.879 ( 9.167 1.882 0.417) 9.368 5.097 ( -8.441 -3.369 -6.295) 11.055 5.266 ( -9.650 -0.795 -6.761) 11.810 5.492 ( -4.156 2.860 -3.099) 5.921 5.775 ( -20.561 -6.366 -9.551) 23.548 5.982 ( -19.459 -0.139 -7.581) 20.884 6.590 ( -0.417 -8.319 -3.224) 8.932 6.824 ( -11.298 -4.563 -5.126) 13.219 7.300 ( -14.294 -6.058 -2.727) 15.762 7.416 ( -23.769 1.527 7.296) 24.910 7.886 ( -5.743 -2.345 6.914) 9.288 8.277 ( -8.141 -3.875 -10.796) 14.066 8.383 ( -16.369 -5.692 -11.202) 20.635 8.532 ( 14.875 0.338 -1.934) 15.004 8.970 ( -28.741 0.859 2.343) 28.849 9.493 ( -15.006 -1.104 4.637) 15.745 9.859 ( -19.952 -0.198 -3.380) 20.237 10.074 ( -40.151 -3.160 -7.371) 40.944 10.796 ( -22.327 1.059 -7.705) 23.643 13.012 ( 4.771 -5.431 4.661) 8.601 13.456 ( 5.300 3.938 1.389) 6.748 13.656 ( 2.031 2.331 -3.265) 4.496 13.869 ( 3.243 16.273 -4.349) 17.153 14.380 ( -6.325 -1.595 2.984) 7.173 14.917 ( -9.084 0.932 8.361) 12.381 16.329 ( 29.548 -8.259 13.073) 33.349 19.196 ( -36.398 6.355 -7.679) 37.739 19.887 ( -27.153 -8.038 -4.348) 28.649 ======================= Grid point 317 (132/343) ======================= q-point: ( 0.23 -0.15 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -23.976 9.246 -0.000) 25.697 1.772 ( -26.800 3.893 -0.000) 27.082 2.422 ( -9.092 -8.887 0.000) 12.713 2.532 ( -12.052 -13.105 0.000) 17.804 2.785 ( -6.319 5.317 -0.000) 8.258 3.074 ( -23.610 11.079 -0.000) 26.080 3.212 ( -6.351 5.242 -0.000) 8.235 3.564 ( 5.153 -3.254 0.000) 6.095 3.777 ( 5.803 -0.198 0.000) 5.806 5.220 ( -16.732 -3.213 0.000) 17.038 5.357 ( -11.792 -3.093 0.000) 12.191 5.542 ( -4.167 4.411 -0.000) 6.068 5.990 ( -23.842 -6.164 0.000) 24.626 6.172 ( -16.371 -5.892 0.000) 17.399 6.513 ( 3.690 -7.466 0.000) 8.328 6.922 ( -11.992 -2.058 0.000) 12.167 7.363 ( -0.764 -3.219 0.000) 3.308 7.572 ( 4.638 1.640 -0.000) 4.919 8.257 ( -32.553 -0.761 0.000) 32.562 8.309 ( 11.752 1.067 -0.000) 11.800 8.354 ( -15.911 0.205 -0.000) 15.913 8.580 ( -27.772 -10.477 0.000) 29.683 9.408 ( -29.063 6.215 -0.000) 29.720 9.744 ( -16.406 -0.335 0.000) 16.410 10.092 ( -19.140 -0.859 0.000) 19.159 10.613 ( -41.077 6.734 -0.000) 41.626 11.043 ( -21.192 0.501 -0.000) 21.198 12.956 ( 5.161 -6.175 0.000) 8.048 13.393 ( 6.528 1.822 -0.000) 6.777 13.601 ( 4.240 4.458 -0.000) 6.152 13.849 ( 3.727 13.935 -0.000) 14.425 14.466 ( -5.013 -5.634 0.000) 7.541 15.081 ( -7.109 2.015 -0.000) 7.389 15.993 ( 25.299 -8.694 0.000) 26.751 19.713 ( -41.611 5.055 -0.000) 41.917 20.219 ( -27.263 -4.403 0.000) 27.616 ======================= Grid point 329 (133/343) ======================= q-point: ( 0.15 -0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( -29.703 7.621 -0.000) 30.665 0.967 ( -26.482 14.210 -0.000) 30.054 1.770 ( -48.150 18.982 -0.000) 51.757 2.311 ( -5.459 -11.334 0.000) 12.580 2.410 ( -7.156 -10.463 0.000) 12.676 2.836 ( 6.591 7.703 -0.000) 10.138 3.037 ( -3.586 4.999 -0.000) 6.152 3.721 ( 0.610 -14.720 0.000) 14.733 4.018 ( 12.128 6.500 -0.000) 13.760 4.984 ( -2.542 -3.655 0.000) 4.452 5.134 ( -2.959 -0.014 -0.000) 2.959 5.395 ( -6.765 0.636 -0.000) 6.795 5.458 ( -17.427 -6.146 0.000) 18.479 5.697 ( -12.407 3.671 -0.000) 12.939 6.523 ( -11.812 -6.325 0.000) 13.399 6.580 ( -22.361 -3.441 0.000) 22.625 7.056 ( -20.329 -3.074 0.000) 20.560 7.230 ( -11.147 -3.436 0.000) 11.665 7.861 ( -22.186 -11.148 0.000) 24.829 8.013 ( -1.746 -6.793 0.000) 7.014 8.260 ( 1.773 -1.707 0.000) 2.461 8.594 ( -26.668 -4.996 0.000) 27.132 8.793 ( 20.970 -0.160 0.000) 20.970 9.296 ( -27.453 -18.941 0.000) 33.353 9.465 ( -33.086 -11.130 0.000) 34.908 9.633 ( -17.109 -2.366 0.000) 17.272 10.426 ( -23.270 0.432 -0.000) 23.274 13.144 ( 6.294 -6.722 0.000) 9.209 13.518 ( 6.627 8.920 -0.000) 11.112 13.648 ( 2.043 4.234 -0.000) 4.701 13.811 ( 2.490 20.739 -0.000) 20.888 14.335 ( -4.188 -0.074 0.000) 4.188 14.888 ( -5.642 -0.372 0.000) 5.654 16.889 ( 31.407 -7.901 0.000) 32.385 18.652 ( -29.320 8.572 -0.000) 30.548 19.492 ( -29.911 -14.632 0.000) 33.298 ======================= Grid point 342 (134/343) ======================= q-point: ( 0.15 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.435 ( -0.000 29.211 -0.000) 29.211 0.436 ( -0.000 29.293 -0.000) 29.293 0.852 ( -0.000 57.557 -0.000) 57.557 2.262 ( 0.000 -11.834 0.000) 11.834 2.275 ( 0.000 -12.111 0.000) 12.111 2.980 ( -0.000 4.899 -0.000) 4.899 2.987 ( -0.000 4.928 -0.000) 4.928 3.733 ( 0.000 -18.902 0.000) 18.902 4.330 ( -0.000 7.408 -0.000) 7.408 4.774 ( 0.000 -2.341 0.000) 2.341 5.032 ( 0.000 -2.221 0.000) 2.221 5.197 ( -0.000 0.594 -0.000) 0.594 5.293 ( -0.000 1.870 -0.000) 1.870 5.496 ( -0.000 0.886 -0.000) 0.886 5.918 ( -0.000 1.185 -0.000) 1.185 5.986 ( 0.000 -12.632 0.000) 12.632 6.308 ( -0.000 2.192 -0.000) 2.192 6.758 ( 0.000 -0.177 0.000) 0.177 7.319 ( -0.000 7.531 -0.000) 7.531 7.790 ( -0.000 3.382 -0.000) 3.382 8.083 ( -0.000 3.370 -0.000) 3.370 8.166 ( 0.000 -3.228 0.000) 3.228 8.424 ( 0.000 -2.712 0.000) 2.712 9.128 ( 0.000 -0.265 0.000) 0.265 9.329 ( 0.000 -0.248 0.000) 0.248 9.383 ( 0.000 -0.689 0.000) 0.689 9.963 ( -0.000 0.629 -0.000) 0.629 13.269 ( 0.000 -14.903 0.000) 14.903 13.664 ( -0.000 0.305 -0.000) 0.305 13.765 ( -0.000 16.677 -0.000) 16.677 14.065 ( 0.000 -0.159 0.000) 0.159 14.269 ( -0.000 0.083 -0.000) 0.083 14.810 ( 0.000 -0.316 0.000) 0.316 17.376 ( 0.000 -15.396 0.000) 15.396 18.062 ( -0.000 15.217 -0.000) 15.217 19.013 ( 0.000 -2.723 0.000) 2.723 ======================= Grid point 343 (135/343) ======================= q-point: ( 0.23 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.798 ( -16.167 14.210 22.990) 31.494 0.978 ( -16.953 15.772 30.765) 38.506 1.399 ( -30.974 34.497 15.158) 48.777 2.245 ( -1.340 -11.472 3.482) 12.063 2.322 ( -6.167 -12.585 6.817) 15.585 2.959 ( 5.747 5.562 1.099) 8.073 3.023 ( -1.793 4.820 0.891) 5.219 3.648 ( -1.337 -20.007 0.955) 20.074 4.199 ( 12.617 8.315 -2.650) 15.341 4.978 ( -15.407 -4.882 -4.919) 16.894 5.094 ( -1.217 -0.833 -1.688) 2.242 5.242 ( -9.840 -8.444 8.234) 15.360 5.384 ( -7.797 1.682 7.532) 10.971 5.638 ( -2.225 4.976 3.945) 6.729 6.108 ( -36.126 -4.059 -7.142) 37.048 6.306 ( -22.841 -1.544 17.228) 28.651 6.879 ( -10.103 -8.183 6.662) 14.609 6.989 ( -7.401 -14.041 6.777) 17.259 7.647 ( -5.853 -10.544 16.094) 20.111 8.012 ( -14.067 -1.061 3.239) 14.474 8.224 ( -9.814 -3.430 0.565) 10.412 8.412 ( -4.377 -6.951 14.504) 16.669 8.784 ( -34.801 -27.820 40.561) 60.252 8.970 ( 6.290 -0.377 -10.707) 12.423 9.281 ( 0.552 -0.286 -0.194) 0.652 9.487 ( -9.189 -0.999 5.518) 10.765 10.215 ( -17.473 0.549 11.939) 21.169 13.144 ( 4.030 -9.481 -5.866) 11.855 13.632 ( 5.917 4.535 -2.504) 7.864 13.713 ( 4.583 10.446 -2.628) 11.706 13.980 ( 6.701 15.086 3.230) 16.820 14.249 ( -3.456 -0.520 -5.824) 6.792 14.659 ( -10.431 8.638 -18.422) 22.865 17.055 ( 17.326 -9.974 -21.402) 29.286 18.471 ( -16.041 10.516 15.202) 24.475 19.189 ( -17.629 -14.414 16.264) 27.983 ======================= Grid point 344 (136/343) ======================= q-point: ( 0.31 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( -15.544 9.079 20.136) 27.009 1.674 ( -15.234 8.331 30.886) 35.432 2.100 ( -24.060 -0.412 12.893) 27.300 2.391 ( -13.402 5.052 10.393) 17.696 2.494 ( -7.157 -6.987 10.166) 14.262 2.937 ( 4.512 7.101 3.627) 9.162 3.090 ( -3.181 3.985 1.397) 5.287 3.633 ( -2.122 -14.846 1.838) 15.110 4.014 ( 11.599 4.074 -2.214) 12.491 5.139 ( -5.160 -2.183 8.405) 10.102 5.225 ( -13.464 0.875 5.557) 14.592 5.502 ( -9.815 -4.845 11.786) 16.085 5.663 ( -12.254 -0.848 10.562) 16.200 5.813 ( -18.994 0.153 3.566) 19.326 6.561 ( -18.797 -3.838 15.381) 24.589 6.756 ( -10.301 -4.858 11.145) 15.935 6.965 ( -12.511 -3.926 -2.880) 13.425 7.206 ( -11.505 -3.750 11.778) 16.886 7.809 ( -3.320 -6.176 4.270) 8.210 8.267 ( -13.348 -0.964 8.149) 15.668 8.391 ( -10.052 -2.075 5.643) 11.713 8.669 ( -2.590 -0.712 3.761) 4.622 8.712 ( -1.700 -0.308 3.952) 4.313 9.273 ( -5.777 -0.576 -3.415) 6.735 9.648 ( -25.173 -3.815 17.983) 31.171 9.782 ( -22.447 -7.106 16.143) 28.547 10.660 ( -20.070 1.259 14.488) 24.785 12.972 ( 4.020 -5.578 -7.091) 9.877 13.516 ( 6.314 6.682 -4.186) 10.102 13.712 ( 0.172 2.207 1.592) 2.726 14.029 ( 1.205 10.302 3.701) 11.013 14.232 ( -5.985 0.154 -5.016) 7.811 14.635 ( -10.880 6.125 -11.969) 17.296 16.371 ( 22.357 -8.832 -29.526) 38.074 18.995 ( -22.653 6.905 18.942) 30.326 19.661 ( -20.002 -9.334 17.084) 27.911 ======================= Grid point 345 (137/343) ======================= q-point: ( 0.38 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -15.153 0.831 17.035) 22.814 2.245 ( -10.854 3.472 22.402) 25.134 2.389 ( -9.810 -8.690 9.510) 16.192 2.667 ( -6.098 -8.732 11.127) 15.403 2.869 ( -8.432 12.315 8.925) 17.390 3.031 ( -10.227 11.695 7.034) 17.054 3.172 ( -4.072 3.114 1.388) 5.311 3.634 ( 0.097 -7.520 2.027) 7.789 3.861 ( 8.982 0.758 -1.321) 9.110 5.337 ( -5.918 -0.796 10.642) 12.203 5.507 ( -10.528 1.863 7.779) 13.222 5.756 ( -3.458 -0.222 16.012) 16.383 6.009 ( -18.351 -6.737 9.099) 21.563 6.187 ( -20.826 -1.115 6.812) 21.940 6.757 ( 2.742 -5.553 6.707) 9.130 6.979 ( -7.384 -2.041 6.819) 10.256 7.229 ( -22.515 2.134 3.348) 22.862 7.583 ( -12.758 -6.226 17.998) 22.923 7.837 ( -2.093 -5.573 2.449) 6.437 8.538 ( -12.367 0.998 3.367) 12.856 8.594 ( -8.252 -0.342 3.160) 8.843 8.708 ( -6.458 -0.160 12.427) 14.005 9.025 ( -10.987 3.045 10.663) 15.611 9.306 ( -8.946 -0.254 -5.547) 10.529 10.052 ( -17.449 -0.530 11.097) 20.686 10.448 ( -30.098 1.700 19.495) 35.900 11.150 ( -20.828 3.659 15.487) 26.212 12.796 ( 4.192 -3.948 -8.363) 10.154 13.387 ( 5.926 6.330 -6.328) 10.734 13.739 ( 0.041 -2.633 1.760) 3.168 14.106 ( -2.931 2.771 1.894) 4.456 14.296 ( -5.734 1.289 2.638) 6.442 14.662 ( -10.583 6.547 -8.843) 15.267 15.692 ( 15.198 -10.354 -25.138) 31.146 19.594 ( -24.113 2.740 18.023) 30.229 20.072 ( -14.922 -2.098 11.024) 18.671 ======================= Grid point 346 (138/343) ======================= q-point: ( 0.46 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( -12.312 -4.766 11.630) 17.594 2.565 ( -9.060 -3.223 10.634) 14.337 2.683 ( -8.034 1.220 13.112) 15.426 2.861 ( -3.599 -0.612 8.885) 9.606 2.976 ( 1.099 0.943 6.128) 6.297 3.252 ( -3.837 2.250 0.882) 4.534 3.363 ( -9.605 6.345 5.206) 12.634 3.647 ( -0.570 2.403 2.736) 3.686 3.733 ( 6.755 -1.206 -1.734) 7.078 5.565 ( -7.167 0.764 8.884) 11.440 5.716 ( -7.105 -1.437 6.356) 9.641 6.034 ( -3.465 0.591 15.490) 15.883 6.204 ( -2.048 -0.063 -0.367) 2.082 6.493 ( -9.309 -2.674 8.826) 13.103 6.887 ( -11.308 -5.018 8.373) 14.939 7.130 ( -8.351 -0.480 1.932) 8.585 7.480 ( -4.431 -4.060 4.444) 7.475 7.908 ( -11.908 0.619 12.233) 17.083 8.062 ( -14.418 -4.669 12.156) 19.428 8.693 ( -7.013 1.424 3.133) 7.812 8.771 ( -10.643 2.542 -0.925) 10.981 8.970 ( -8.684 -0.746 6.253) 10.727 9.286 ( -6.273 4.531 8.575) 11.551 9.399 ( -9.955 -1.337 2.097) 10.261 10.451 ( -17.922 -1.176 11.986) 21.593 11.065 ( -24.124 3.666 15.174) 28.734 11.666 ( -20.669 7.887 15.496) 27.009 12.599 ( 4.994 -3.171 -9.663) 11.330 13.231 ( 6.079 6.756 -8.018) 12.120 13.705 ( 2.027 -10.414 -2.541) 10.909 14.165 ( -2.313 0.091 0.695) 2.417 14.450 ( -4.620 0.527 7.522) 8.843 14.734 ( -9.240 10.155 -4.775) 14.536 15.262 ( 2.214 -11.097 -14.050) 18.041 20.118 ( -19.970 0.450 13.329) 24.014 20.346 ( -9.515 1.088 5.485) 11.037 ======================= Grid point 347 (139/343) ======================= q-point: ( 0.54 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.453 ( -9.199 -4.202 6.197) 11.861 2.821 ( -9.937 -1.313 8.360) 13.052 2.892 ( -0.758 2.107 5.638) 6.066 2.956 ( 0.230 0.159 6.704) 6.709 3.101 ( -5.071 -0.970 5.891) 7.833 3.311 ( -2.670 1.266 0.354) 2.976 3.427 ( 2.502 -0.878 0.232) 2.661 3.599 ( 6.450 -0.755 -2.834) 7.085 3.774 ( -3.888 5.980 3.867) 8.114 5.753 ( -5.385 1.406 4.964) 7.458 5.863 ( -4.808 -3.349 3.727) 6.944 6.128 ( 2.094 2.938 -2.390) 4.328 6.264 ( -1.490 -0.283 8.260) 8.398 6.683 ( -0.714 -2.305 12.037) 12.276 7.145 ( -9.135 1.078 4.422) 10.206 7.261 ( -10.311 -2.871 1.161) 10.766 7.536 ( 0.498 -4.913 4.606) 6.753 8.238 ( -12.017 3.702 7.888) 14.844 8.380 ( -10.324 -3.554 11.090) 15.563 8.818 ( -7.481 2.578 -3.119) 8.505 8.854 ( -6.779 0.674 -2.405) 7.224 9.078 ( -4.203 -0.029 -1.390) 4.427 9.485 ( -3.076 3.412 8.735) 9.869 9.574 ( -6.042 -2.230 6.083) 8.859 10.827 ( -14.658 -0.683 10.275) 17.913 11.539 ( -17.278 1.714 12.305) 21.281 12.148 ( -15.457 11.108 11.529) 22.254 12.383 ( 5.127 -3.133 -9.590) 11.317 13.064 ( 5.799 5.414 -7.393) 10.844 13.540 ( 4.319 -13.952 -6.814) 16.116 14.198 ( 0.957 1.012 2.710) 3.046 14.592 ( -4.401 0.070 3.743) 5.778 14.837 ( -6.297 9.134 -2.562) 11.386 15.161 ( -6.230 -8.980 -1.392) 11.018 20.474 ( -8.838 1.282 4.935) 10.203 20.507 ( -8.945 -0.176 4.705) 10.108 ======================= Grid point 348 (140/343) ======================= q-point: ( 0.62 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( -6.113 -1.434 2.160) 6.640 2.890 ( 3.029 0.752 -0.330) 3.138 3.015 ( -4.193 1.531 4.213) 6.138 3.073 ( -2.724 -2.887 4.973) 6.363 3.222 ( -5.686 0.991 1.788) 6.042 3.344 ( -0.970 0.626 0.366) 1.211 3.379 ( 1.905 -1.396 -1.231) 2.663 3.470 ( 5.904 0.173 -2.686) 6.488 3.845 ( 1.872 2.056 1.917) 3.377 5.826 ( -1.075 0.870 -0.672) 1.538 5.931 ( -3.223 -1.177 0.615) 3.486 6.111 ( 0.037 -0.063 -0.005) 0.073 6.345 ( 0.745 -0.101 3.326) 3.410 6.826 ( 1.008 -0.367 9.193) 9.255 7.212 ( -1.964 2.816 -3.494) 4.898 7.410 ( -4.576 -3.029 3.633) 6.581 7.581 ( -2.058 -1.672 2.788) 3.848 8.421 ( -3.883 1.522 1.247) 4.353 8.596 ( -5.002 -0.962 5.214) 7.289 8.809 ( -3.161 0.834 -6.479) 7.257 8.925 ( -3.303 0.062 -0.107) 3.306 9.091 ( -0.964 -0.072 -0.970) 1.370 9.590 ( 1.774 1.216 3.580) 4.176 9.692 ( -2.773 -1.109 3.224) 4.395 11.080 ( -6.507 -0.242 4.279) 7.792 11.890 ( -11.541 0.447 10.241) 15.436 12.137 ( 6.929 -0.917 -10.327) 12.470 12.435 ( -3.007 7.286 1.441) 8.013 12.922 ( 5.117 -1.794 -4.033) 6.757 13.424 ( -2.777 -4.138 1.608) 5.236 14.211 ( 3.205 0.245 2.604) 4.136 14.666 ( -2.828 0.134 -0.175) 2.837 14.870 ( -3.062 1.717 -4.918) 6.042 15.248 ( -3.525 -1.966 4.414) 5.981 20.538 ( -0.997 0.602 -0.228) 1.186 20.685 ( -4.612 -0.276 2.782) 5.393 ======================= Grid point 349 (141/343) ======================= q-point: (-0.31 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( -1.935 1.423 -1.370) 2.765 2.831 ( 1.922 -1.640 -2.876) 3.828 3.049 ( 1.624 2.708 -2.899) 4.286 3.088 ( 1.478 -2.092 -3.178) 4.082 3.250 ( 4.973 2.552 -3.625) 6.662 3.314 ( -1.061 -1.470 -2.108) 2.780 3.407 ( -4.208 0.237 2.105) 4.711 3.439 ( -2.889 -1.215 2.157) 3.804 3.790 ( 7.838 -0.588 -0.155) 7.862 5.836 ( -3.147 0.938 -1.929) 3.809 5.937 ( 1.098 -0.391 -2.152) 2.447 6.083 ( 2.330 -1.301 -1.338) 2.985 6.339 ( 2.719 -0.174 -0.721) 2.818 6.870 ( -0.775 1.369 -3.639) 3.964 7.188 ( 2.789 0.720 1.336) 3.175 7.425 ( 4.899 -1.269 0.376) 5.075 7.650 ( -4.658 1.495 -0.126) 4.893 8.392 ( 5.397 -0.000 -3.775) 6.586 8.606 ( -3.128 -0.396 -11.043) 11.485 8.778 ( 8.330 -0.521 6.469) 10.560 8.919 ( 1.714 -0.165 -2.385) 2.942 9.089 ( 1.245 -0.101 1.156) 1.702 9.554 ( 2.384 -0.587 -4.248) 4.907 9.713 ( 2.454 0.136 -0.678) 2.549 11.085 ( 4.975 0.023 -4.928) 7.003 11.865 ( 11.739 -0.657 -11.697) 16.584 12.107 ( -2.421 -1.423 3.167) 4.233 12.393 ( 3.282 2.858 -2.628) 5.084 12.836 ( 1.579 -3.815 2.503) 4.828 13.637 ( -10.325 5.014 11.958) 16.575 14.174 ( 5.124 -1.500 0.404) 5.354 14.664 ( -0.061 0.026 -3.002) 3.003 14.799 ( 2.477 -1.525 -6.180) 6.830 15.317 ( 1.737 1.226 3.808) 4.361 20.521 ( 2.094 -0.223 -1.016) 2.338 20.689 ( 4.360 -0.016 -2.462) 5.008 ======================= Grid point 350 (142/343) ======================= q-point: (-0.23 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.621 ( 2.996 3.393 -6.598) 8.002 2.749 ( 0.736 -2.878 -5.531) 6.278 2.920 ( 7.480 2.132 -7.135) 10.555 2.935 ( 5.185 -1.364 -9.823) 11.191 3.146 ( 3.535 0.675 -3.897) 5.305 3.271 ( 1.788 -0.502 -3.036) 3.559 3.453 ( 4.881 0.652 -2.419) 5.486 3.515 ( -5.362 -2.526 1.287) 6.065 3.691 ( 2.295 0.162 1.745) 2.887 5.806 ( 2.836 4.073 -6.975) 8.561 5.838 ( 3.683 -4.097 -6.456) 8.487 6.068 ( -2.111 -0.404 3.091) 3.764 6.244 ( 3.944 -0.346 -6.916) 7.969 6.771 ( 1.580 1.107 -10.011) 10.195 7.171 ( 6.065 0.771 3.497) 7.044 7.283 ( 11.473 -0.435 -4.247) 12.241 7.695 ( -3.462 2.049 -3.350) 5.235 8.196 ( 12.455 0.179 -5.850) 13.762 8.423 ( 2.239 -0.188 -16.037) 16.194 8.728 ( 12.560 -1.258 8.094) 14.995 8.819 ( 4.996 -0.419 -5.008) 7.086 9.080 ( 4.892 0.044 3.028) 5.754 9.410 ( 3.222 -0.714 -11.217) 11.692 9.604 ( 8.371 0.132 -4.255) 9.391 10.846 ( 13.197 0.175 -10.604) 16.930 11.477 ( 19.559 -0.782 -13.803) 23.952 11.918 ( 13.524 -1.669 -11.825) 18.042 12.485 ( -5.114 1.335 8.142) 9.706 12.926 ( -3.690 -1.552 8.410) 9.314 13.959 ( -7.890 8.936 9.521) 15.256 14.080 ( 4.512 -6.152 -1.111) 7.710 14.597 ( 2.788 0.442 -3.490) 4.489 14.637 ( 8.208 -2.222 -5.159) 9.946 15.335 ( 3.553 1.389 5.346) 6.567 20.453 ( 5.107 -0.103 -1.976) 5.477 20.497 ( 13.112 -0.220 -8.329) 15.536 ======================= Grid point 351 (143/343) ======================= q-point: (-0.15 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( 13.952 0.000 -16.243) 21.412 2.597 ( 6.050 0.000 -15.309) 16.461 2.735 ( 0.088 0.000 -8.438) 8.438 2.754 ( 5.403 0.000 -4.267) 6.884 3.028 ( 4.308 0.000 -6.300) 7.632 3.148 ( 15.382 0.000 -7.564) 17.141 3.218 ( 8.884 0.000 -3.787) 9.657 3.623 ( -8.262 -0.000 0.470) 8.276 3.760 ( -4.546 -0.000 2.155) 5.030 5.637 ( 4.800 0.000 -12.015) 12.939 5.638 ( 8.208 0.000 -6.740) 10.621 6.040 ( 4.364 0.000 -14.303) 14.954 6.178 ( -3.068 -0.000 3.695) 4.803 6.556 ( 13.239 0.000 -8.264) 15.607 7.021 ( 13.085 0.000 -7.129) 14.901 7.114 ( 5.595 0.000 -0.041) 5.595 7.589 ( 12.477 0.000 -7.731) 14.678 7.990 ( 3.745 0.000 -4.073) 5.533 8.120 ( 8.365 0.000 -18.009) 19.857 8.665 ( 9.964 0.000 5.513) 11.387 8.666 ( 6.029 0.000 -5.323) 8.043 8.999 ( 10.998 0.000 -1.476) 11.097 9.169 ( 5.194 0.000 -14.324) 15.236 9.414 ( 10.756 0.000 -1.778) 10.902 10.476 ( 17.709 0.000 -12.186) 21.497 10.970 ( 25.052 0.000 -15.219) 29.312 11.524 ( 17.236 0.000 -13.931) 22.162 12.677 ( -5.302 -0.000 8.826) 10.296 13.110 ( -5.105 -0.000 9.278) 10.589 13.933 ( 5.674 0.000 -4.639) 7.329 14.131 ( -4.271 -0.000 -5.065) 6.625 14.440 ( 11.582 0.000 -1.911) 11.738 14.554 ( 6.068 0.000 6.768) 9.090 15.451 ( -3.755 -0.000 14.125) 14.616 20.106 ( 20.779 0.000 -14.889) 25.562 20.324 ( 8.308 0.000 -3.983) 9.213 ======================= Grid point 356 (144/343) ======================= q-point: ( 0.23 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( -0.000 13.808 25.749) 29.217 1.155 ( -0.000 22.695 28.272) 36.254 1.548 ( -0.000 15.075 42.944) 45.513 2.358 ( 0.000 -11.816 7.331) 13.905 2.437 ( 0.000 -8.716 11.067) 14.087 2.992 ( -0.000 4.205 0.936) 4.308 3.027 ( -0.000 5.070 3.421) 6.116 3.734 ( 0.000 -19.207 1.052) 19.236 4.234 ( -0.000 10.151 -3.872) 10.865 4.648 ( 0.000 -2.871 0.873) 3.000 4.978 ( -0.000 2.445 -4.047) 4.728 5.343 ( 0.000 -6.049 7.835) 9.898 5.497 ( -0.000 -1.728 14.620) 14.722 5.683 ( -0.000 5.614 6.534) 8.615 6.084 ( -0.000 2.564 30.018) 30.128 6.507 ( -0.000 -2.075 28.626) 28.701 6.985 ( 0.000 -10.447 7.021) 12.588 7.112 ( 0.000 -2.014 9.408) 9.622 7.846 ( -0.000 3.046 4.815) 5.698 7.967 ( 0.000 -10.129 14.687) 17.841 8.153 ( 0.000 -2.455 0.930) 2.625 8.669 ( 0.000 -4.574 21.026) 21.517 8.751 ( 0.000 0.069 -20.719) 20.719 9.273 ( 0.000 -10.043 8.176) 12.950 9.384 ( 0.000 -20.866 29.690) 36.289 9.536 ( -0.000 -0.501 10.225) 10.237 10.316 ( -0.000 0.126 19.372) 19.372 13.096 ( 0.000 -6.119 -8.945) 10.837 13.592 ( -0.000 15.232 -7.247) 16.868 13.667 ( -0.000 0.254 0.855) 0.892 14.071 ( -0.000 1.707 -9.275) 9.430 14.099 ( -0.000 -0.109 2.863) 2.865 14.287 ( -0.000 20.433 -7.002) 21.600 16.783 ( 0.000 -7.181 -38.342) 39.008 18.619 ( -0.000 7.424 25.772) 26.820 19.443 ( 0.000 -12.797 26.284) 29.234 ======================= Grid point 357 (145/343) ======================= q-point: ( 0.31 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -14.687 6.760 23.577) 28.588 1.720 ( -19.563 16.602 22.930) 34.411 2.175 ( -6.867 7.493 33.164) 34.687 2.444 ( -1.902 -8.652 10.869) 14.022 2.616 ( -4.025 -7.335 13.138) 15.576 3.018 ( 2.123 5.315 3.501) 6.709 3.092 ( 0.546 4.113 4.290) 5.968 3.691 ( -0.920 -15.649 1.552) 15.753 4.118 ( 10.615 6.669 -2.777) 12.840 4.925 ( -25.612 -4.465 7.599) 27.086 5.150 ( -15.410 3.455 6.571) 17.105 5.501 ( -10.795 -2.606 8.273) 13.848 5.699 ( -3.001 -3.235 13.265) 13.980 5.847 ( 2.056 2.215 18.440) 18.686 6.564 ( -13.357 3.583 20.104) 24.401 6.885 ( -4.008 -5.370 16.597) 17.899 6.972 ( 0.580 -7.864 3.173) 8.500 7.291 ( -4.733 -0.712 13.699) 14.511 7.920 ( 2.567 -3.991 8.272) 9.537 8.190 ( -8.722 -4.087 8.140) 12.611 8.288 ( -10.723 -1.311 6.268) 12.490 8.525 ( -7.196 -0.109 -13.261) 15.088 8.956 ( 2.619 -1.794 24.113) 24.321 9.269 ( 3.054 -0.115 2.354) 3.857 9.725 ( -5.281 0.282 15.682) 16.550 9.861 ( -12.421 -4.493 27.695) 30.683 10.666 ( -11.258 0.508 18.779) 21.901 12.932 ( 2.793 -6.106 -8.649) 10.949 13.492 ( 5.243 9.271 -7.272) 12.897 13.712 ( -1.896 0.746 2.410) 3.156 13.977 ( -4.190 -2.189 -6.265) 7.849 14.157 ( -1.175 3.740 4.005) 5.604 14.350 ( -7.777 11.714 -3.976) 14.612 16.139 ( 9.138 -8.351 -39.355) 41.256 19.097 ( -9.291 4.429 30.102) 31.813 19.801 ( -6.085 -6.631 22.871) 24.578 ======================= Grid point 358 (146/343) ======================= q-point: ( 0.38 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( -10.544 0.994 20.068) 22.691 2.309 ( -17.412 5.742 17.374) 25.259 2.501 ( -1.397 -8.583 12.599) 15.309 2.762 ( -9.767 -0.993 14.873) 17.821 2.836 ( -6.082 8.184 14.813) 17.983 3.079 ( 2.355 6.667 6.428) 9.556 3.159 ( -0.849 1.987 3.820) 4.389 3.680 ( -1.074 -10.023 1.154) 10.146 3.969 ( 10.092 3.509 -1.215) 10.753 5.358 ( -15.288 -2.417 10.673) 18.801 5.459 ( -12.765 1.215 10.607) 16.641 5.828 ( -16.434 -0.308 9.382) 18.926 5.948 ( -12.412 -5.795 11.648) 17.981 6.123 ( -3.415 0.734 18.395) 18.724 6.774 ( -0.658 -0.256 -3.316) 3.391 7.024 ( -5.447 -4.728 7.591) 10.471 7.187 ( -9.224 2.074 15.158) 17.865 7.625 ( -15.091 -4.306 13.042) 20.406 7.917 ( 3.921 -8.711 3.937) 10.332 8.352 ( -11.287 1.895 -2.911) 11.810 8.500 ( -9.843 0.090 8.363) 12.917 8.701 ( -14.621 -2.252 7.918) 16.779 9.213 ( 3.597 3.710 19.372) 20.049 9.302 ( 2.213 -0.005 9.660) 9.910 10.064 ( -10.875 -0.523 17.898) 20.950 10.438 ( -16.513 5.237 26.436) 31.606 11.106 ( -16.281 2.498 17.435) 23.985 12.745 ( 3.721 -5.177 -9.446) 11.397 13.335 ( 5.649 7.365 -9.174) 13.051 13.748 ( -1.133 -3.938 -0.643) 4.148 14.010 ( -8.423 -2.622 -0.402) 8.831 14.255 ( -4.870 4.249 1.145) 6.564 14.478 ( -6.473 8.318 3.835) 11.216 15.504 ( 7.268 -10.132 -30.046) 32.530 19.659 ( -12.115 1.628 28.059) 30.607 20.138 ( -5.195 -1.219 17.070) 17.885 ======================= Grid point 359 (147/343) ======================= q-point: ( 0.46 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -7.827 -5.256 14.683) 17.449 2.604 ( -5.578 -6.857 8.857) 12.513 2.750 ( -7.971 3.257 12.687) 15.333 2.960 ( -2.281 -1.807 9.641) 10.071 3.090 ( 3.497 5.128 6.857) 9.249 3.231 ( -2.621 0.852 3.618) 4.548 3.269 ( -10.795 10.240 8.389) 17.081 3.670 ( 0.277 -3.058 0.356) 3.091 3.831 ( 9.638 1.129 -0.671) 9.727 5.603 ( -5.686 -0.534 8.850) 10.532 5.756 ( -6.967 -2.432 11.449) 13.621 6.123 ( -4.854 -0.381 6.619) 8.217 6.184 ( -6.985 -0.070 3.452) 7.791 6.401 ( -12.626 -0.607 6.328) 14.136 6.818 ( -10.569 -3.647 4.138) 11.921 7.172 ( -1.761 -0.100 10.404) 10.553 7.477 ( -9.684 -1.814 3.090) 10.326 7.906 ( -12.334 -3.951 4.930) 13.858 8.027 ( -10.108 -2.917 9.911) 14.454 8.477 ( -11.883 -0.017 -2.658) 12.177 8.724 ( -3.683 1.951 8.865) 9.796 8.951 ( -8.680 -1.247 5.394) 10.295 9.417 ( 1.427 4.506 15.823) 16.514 9.505 ( -0.947 -0.180 18.794) 18.819 10.474 ( -11.479 -1.143 19.583) 22.728 11.019 ( -16.733 5.974 21.819) 28.138 11.589 ( -18.354 6.323 16.433) 25.434 12.539 ( 4.259 -4.617 -10.214) 11.991 13.154 ( 5.019 7.196 -10.315) 13.542 13.683 ( -0.796 -11.255 -7.150) 13.357 14.119 ( -4.756 1.505 1.401) 5.182 14.357 ( -8.818 0.696 -0.461) 8.858 14.654 ( -3.353 9.031 4.733) 10.733 15.141 ( -2.006 -10.716 -9.508) 14.466 20.164 ( -10.088 -0.003 23.013) 25.127 20.387 ( -2.062 1.337 12.380) 12.622 ======================= Grid point 360 (148/343) ======================= q-point: ( 0.54 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( -4.000 -7.053 8.805) 11.970 2.790 ( -8.831 -3.203 6.118) 11.210 2.963 ( -1.123 2.651 7.382) 7.924 3.076 ( 2.718 2.219 7.306) 8.105 3.131 ( -0.280 -0.926 3.528) 3.659 3.305 ( -1.499 0.123 3.311) 3.637 3.457 ( -0.895 0.112 1.514) 1.762 3.664 ( 5.242 2.769 -1.356) 6.082 3.743 ( -0.576 4.965 2.556) 5.614 5.774 ( -4.369 -1.113 6.672) 8.053 5.919 ( 1.499 -4.537 5.829) 7.538 6.096 ( 0.143 3.026 -2.572) 3.974 6.340 ( -1.979 1.575 5.894) 6.414 6.599 ( -13.604 -1.481 -4.116) 14.290 7.074 ( -14.514 -3.225 5.871) 15.985 7.338 ( 3.422 2.292 13.802) 14.404 7.548 ( -5.421 -3.817 -2.963) 7.262 8.144 ( -16.902 -1.166 -1.196) 16.984 8.283 ( -12.765 -0.457 4.354) 13.495 8.593 ( -8.857 -1.199 -0.950) 8.989 8.858 ( 1.609 1.162 9.220) 9.431 9.094 ( -2.200 -0.411 6.361) 6.743 9.618 ( 0.938 4.387 11.702) 12.533 9.767 ( 2.947 -1.656 20.716) 20.990 10.866 ( -8.547 -1.025 17.489) 19.493 11.510 ( -14.480 3.098 16.893) 22.465 12.062 ( -15.235 9.886 12.430) 22.007 12.328 ( 3.927 -4.541 -9.302) 11.071 12.988 ( 3.006 6.583 -8.923) 11.489 13.503 ( 0.826 -14.011 -10.857) 17.744 14.177 ( -2.923 6.077 -1.942) 7.018 14.462 ( -8.599 -2.785 -2.278) 9.321 14.747 ( -4.734 2.395 0.719) 5.354 15.203 ( -4.024 -4.245 10.552) 12.065 20.527 ( -1.079 1.093 12.857) 12.948 20.558 ( -2.579 -0.009 14.156) 14.389 ======================= Grid point 361 (149/343) ======================= q-point: ( 0.62 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.599 ( -2.594 -4.396 4.510) 6.811 2.923 ( -1.762 -1.681 0.668) 2.525 3.015 ( 1.936 3.556 3.214) 5.169 3.126 ( 1.242 -2.013 2.630) 3.537 3.184 ( -2.854 0.219 1.641) 3.300 3.358 ( -0.162 -0.140 2.612) 2.620 3.410 ( 4.107 -2.567 -1.646) 5.115 3.551 ( 8.187 1.127 0.280) 8.269 3.847 ( -2.500 6.407 1.702) 7.085 5.839 ( 2.829 -2.099 -0.948) 3.648 5.908 ( -2.937 -1.619 1.582) 3.708 6.142 ( 1.114 0.778 4.478) 4.680 6.405 ( 1.583 1.103 2.909) 3.491 6.644 ( -10.565 0.890 -12.734) 16.570 7.279 ( -8.919 0.959 0.504) 8.985 7.454 ( 5.240 0.708 11.191) 12.377 7.549 ( -2.619 -2.451 -3.033) 4.698 8.279 ( -15.053 -1.627 -9.936) 18.109 8.454 ( -12.032 -1.515 -4.760) 13.028 8.685 ( -2.525 -0.743 3.793) 4.617 8.961 ( 2.932 -0.086 10.218) 10.631 9.195 ( 2.499 -0.096 9.116) 9.453 9.704 ( 6.722 2.310 6.446) 9.595 9.941 ( 10.193 -0.683 18.225) 20.893 11.131 ( -1.561 -0.898 10.435) 10.589 11.892 ( -10.985 0.902 12.996) 17.041 12.090 ( 5.221 -2.310 -9.241) 10.863 12.387 ( -4.503 6.427 2.820) 8.339 12.898 ( -0.094 1.259 -4.463) 4.638 13.369 ( -5.794 -5.030 -3.290) 8.348 14.195 ( -2.271 5.307 -4.038) 7.045 14.504 ( -8.997 -2.625 -7.371) 11.923 14.829 ( -1.632 -3.085 3.775) 5.141 15.382 ( 1.144 0.527 12.099) 12.164 20.615 ( 4.704 0.562 7.918) 9.227 20.775 ( 1.857 -0.209 12.502) 12.641 ======================= Grid point 362 (150/343) ======================= q-point: (-0.31 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( -0.164 -1.262 0.947) 1.587 2.864 ( 5.767 -1.312 -1.769) 6.174 2.999 ( 1.877 1.307 -5.468) 5.927 3.089 ( 3.937 0.271 -2.060) 4.452 3.237 ( 0.123 1.602 -1.165) 1.985 3.309 ( 2.117 -3.921 -1.241) 4.625 3.393 ( -1.369 -0.777 1.115) 1.929 3.489 ( 4.376 0.995 2.598) 5.185 3.872 ( 3.826 2.927 0.882) 4.897 5.800 ( -0.750 -1.710 -0.635) 1.972 5.932 ( 1.020 -0.829 -0.744) 1.511 6.140 ( 5.542 -0.799 2.144) 5.996 6.369 ( 4.927 1.010 -3.452) 6.100 6.590 ( -9.105 2.879 -13.516) 16.549 7.338 ( -2.930 4.395 -4.495) 6.936 7.492 ( 7.346 -2.179 6.373) 9.966 7.526 ( -3.468 -0.525 -5.045) 6.145 8.279 ( -8.640 -1.572 -12.943) 15.641 8.472 ( -7.847 -2.680 -10.297) 13.221 8.735 ( 4.817 -0.196 4.822) 6.818 9.031 ( 4.732 -0.934 7.100) 8.583 9.273 ( 6.120 0.246 11.140) 12.713 9.631 ( 13.227 -0.221 2.865) 13.536 9.971 ( 16.481 0.512 12.958) 20.972 11.151 ( 8.491 -0.748 0.026) 8.524 11.871 ( 8.804 -1.891 -8.424) 12.331 12.136 ( -2.110 -1.705 4.737) 5.458 12.385 ( 0.995 2.511 -1.408) 3.046 12.866 ( -2.118 -3.090 0.650) 3.803 13.566 ( -14.662 6.517 6.305) 17.239 14.159 ( -0.633 1.546 -6.013) 6.241 14.498 ( -8.349 -0.458 -9.307) 12.511 14.846 ( 4.622 -5.200 3.592) 7.830 15.483 ( 6.228 2.396 9.553) 11.653 20.632 ( 7.689 -0.378 6.963) 10.380 20.827 ( 10.438 0.036 7.328) 12.753 ======================= Grid point 363 (151/343) ======================= q-point: (-0.23 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.602 ( 5.440 2.063 -3.434) 6.756 2.732 ( 5.678 -2.338 -5.958) 8.556 2.837 ( 5.144 -0.075 -10.396) 11.599 2.961 ( 8.309 0.546 -4.082) 9.273 3.144 ( 5.055 1.781 -3.844) 6.596 3.284 ( 2.473 -2.281 -0.129) 3.367 3.433 ( -2.775 0.043 -0.865) 2.907 3.497 ( -1.147 -0.970 1.130) 1.879 3.801 ( 8.695 0.730 1.294) 8.821 5.785 ( 4.239 0.408 -1.426) 4.491 5.848 ( 5.089 -2.123 -4.368) 7.034 6.093 ( 1.794 -0.201 1.851) 2.585 6.186 ( 5.622 -0.016 -11.635) 12.923 6.570 ( -5.938 2.829 -7.041) 9.635 7.258 ( 3.979 4.327 -9.889) 11.504 7.425 ( 10.424 -1.178 3.721) 11.131 7.503 ( -7.023 -0.002 -8.750) 11.220 8.147 ( -1.561 0.332 -16.459) 16.536 8.389 ( 0.929 -2.556 -7.053) 7.559 8.664 ( 10.085 0.018 0.001) 10.085 8.999 ( 7.944 -1.608 1.188) 8.191 9.324 ( 10.153 1.624 10.961) 15.029 9.450 ( 16.635 -3.056 2.815) 17.146 9.855 ( 20.473 0.600 7.290) 21.741 10.934 ( 15.231 -0.352 -6.333) 16.499 11.580 ( 17.017 -1.551 -8.524) 19.095 11.960 ( 13.118 -3.405 -10.244) 16.989 12.516 ( -6.086 2.225 8.538) 10.718 12.968 ( -5.941 -2.122 6.280) 8.902 13.836 ( -11.760 8.799 -1.649) 14.779 14.064 ( 0.093 -4.298 -7.488) 8.635 14.519 ( -6.805 4.897 -1.547) 8.525 14.770 ( 9.077 -7.221 3.133) 12.015 15.510 ( 7.544 2.536 8.270) 11.478 20.590 ( 10.899 -0.429 5.464) 12.200 20.682 ( 19.974 -0.222 1.563) 20.036 ======================= Grid point 364 (152/343) ======================= q-point: (-0.15 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( 15.857 1.824 -10.330) 19.013 2.466 ( 9.521 -0.717 -18.273) 20.617 2.657 ( 3.519 -0.772 -5.199) 6.325 2.807 ( 7.931 -0.122 -1.765) 8.126 3.019 ( 6.313 1.844 -4.728) 8.100 3.215 ( 5.330 -1.724 -1.042) 5.698 3.359 ( 12.104 -0.809 -3.348) 12.585 3.535 ( -4.876 -0.504 -0.402) 4.918 3.743 ( 0.683 0.345 1.180) 1.406 5.624 ( 11.671 1.880 -5.304) 12.957 5.673 ( 8.163 -2.619 -5.616) 10.249 5.910 ( 6.911 0.599 -14.796) 16.341 6.186 ( -4.275 -0.571 5.068) 6.654 6.543 ( 1.177 1.551 -4.735) 5.120 6.995 ( 9.731 2.021 -15.122) 18.095 7.289 ( 14.445 -0.117 0.599) 14.458 7.490 ( -9.534 0.233 -10.022) 13.835 7.905 ( 1.484 1.880 -18.019) 18.178 8.237 ( 17.589 -1.267 3.755) 18.030 8.502 ( 3.658 0.171 -7.888) 8.697 8.828 ( 10.641 -0.856 -7.261) 12.911 9.231 ( 18.239 5.210 4.825) 19.572 9.288 ( 18.399 -6.732 5.963) 20.479 9.672 ( 17.864 0.009 7.319) 19.305 10.599 ( 18.786 0.064 -8.212) 20.502 11.162 ( 26.255 -1.306 -8.846) 27.736 11.591 ( 17.281 -1.361 -11.426) 20.762 12.721 ( -5.578 1.054 8.603) 10.307 13.146 ( -6.640 -1.003 7.211) 9.854 13.865 ( -3.323 8.599 -11.043) 14.386 13.928 ( -1.667 -8.366 -10.883) 13.828 14.598 ( 10.341 6.187 2.642) 12.337 14.739 ( -2.098 -6.138 11.084) 12.843 15.579 ( -0.801 1.645 10.432) 10.591 20.323 ( 29.498 -0.229 -4.514) 29.842 20.477 ( 14.406 -0.216 2.953) 14.707 ======================= Grid point 365 (153/343) ======================= q-point: (-0.08 0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.934 ( 25.105 0.000 -13.187) 28.357 2.003 ( 15.513 0.000 -23.725) 28.346 2.585 ( -1.021 0.000 -3.495) 3.641 2.675 ( 9.061 0.000 -1.499) 9.184 2.854 ( 7.855 0.000 -5.689) 9.699 2.983 ( 28.749 0.000 -4.525) 29.103 3.146 ( 6.326 0.000 -1.619) 6.529 3.617 ( -8.508 -0.000 -0.896) 8.555 3.789 ( -4.794 -0.000 -0.114) 4.795 5.376 ( 12.224 0.000 -6.566) 13.876 5.479 ( 9.735 0.000 -5.218) 11.045 5.628 ( 5.624 0.000 -12.198) 13.432 6.202 ( 10.181 0.000 -3.634) 10.810 6.355 ( 16.780 0.000 -7.002) 18.183 6.716 ( 0.374 0.000 -10.028) 10.035 7.075 ( 10.154 0.000 -5.167) 11.393 7.468 ( 0.337 0.000 -3.932) 3.947 7.664 ( 7.135 0.000 -10.046) 12.322 8.022 ( 23.071 0.000 8.135) 24.463 8.416 ( -7.955 -0.000 -7.744) 11.102 8.544 ( 9.045 0.000 -12.182) 15.173 8.939 ( 26.308 0.000 -5.294) 26.835 9.116 ( 17.034 0.000 8.205) 18.907 9.585 ( 14.159 0.000 9.574) 17.092 10.219 ( 21.016 0.000 -7.385) 22.275 10.639 ( 31.760 0.000 -8.721) 32.936 11.187 ( 19.966 0.000 -10.113) 22.381 12.905 ( -4.868 -0.000 7.742) 9.145 13.318 ( -5.520 -0.000 5.745) 7.968 13.757 ( -4.352 0.000 -15.911) 16.495 13.775 ( 2.504 0.000 -5.319) 5.879 14.482 ( 11.135 0.000 2.927) 11.513 14.876 ( 6.310 0.000 11.809) 13.389 15.883 ( -18.231 -0.000 14.689) 23.413 19.774 ( 36.609 0.000 -9.052) 37.711 20.274 ( 18.475 0.000 -0.189) 18.476 ======================= Grid point 366 (154/343) ======================= q-point: ( 0.00 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 24.297 0.000 -0.000) 24.297 1.739 ( 30.511 0.000 -0.000) 30.511 2.537 ( -0.574 -0.000 0.000) 0.574 2.666 ( 11.573 0.000 -0.000) 11.573 2.763 ( 9.723 0.000 -0.000) 9.723 2.916 ( 34.399 0.000 -0.000) 34.399 3.126 ( 6.309 0.000 -0.000) 6.309 3.598 ( -9.643 -0.000 0.000) 9.643 3.779 ( -5.034 -0.000 0.000) 5.034 5.290 ( 16.340 0.000 -0.000) 16.340 5.377 ( 12.529 0.000 -0.000) 12.529 5.478 ( 3.476 0.000 -0.000) 3.476 6.079 ( 21.840 0.000 -0.000) 21.840 6.228 ( 22.833 0.000 -0.000) 22.833 6.616 ( -4.923 -0.000 0.000) 4.923 6.963 ( 8.336 0.000 -0.000) 8.336 7.381 ( -11.534 -0.000 0.000) 11.534 7.572 ( 6.082 0.000 -0.000) 6.082 8.266 ( 32.938 0.000 -0.000) 32.938 8.296 ( -13.295 -0.000 0.000) 13.295 8.351 ( 13.666 0.000 -0.000) 13.666 8.794 ( 28.486 0.000 -0.000) 28.486 9.264 ( 19.413 0.000 -0.000) 19.413 9.743 ( 14.506 0.000 -0.000) 14.506 10.101 ( 19.509 0.000 -0.000) 19.509 10.519 ( 35.787 0.000 -0.000) 35.787 11.036 ( 21.241 0.000 -0.000) 21.241 13.047 ( -4.881 -0.000 0.000) 4.881 13.401 ( -5.458 -0.000 0.000) 5.458 13.482 ( -3.560 -0.000 0.000) 3.560 13.696 ( 1.179 0.000 -0.000) 1.179 14.529 ( 9.803 0.000 -0.000) 9.803 15.056 ( 3.635 0.000 -0.000) 3.635 16.105 ( -25.759 -0.000 0.000) 25.759 19.646 ( 43.706 0.000 -0.000) 43.706 20.280 ( 22.939 0.000 -0.000) 22.939 ======================= Grid point 370 (155/343) ======================= q-point: ( 0.31 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( -0.000 7.900 24.823) 26.050 1.891 ( -0.000 13.316 25.652) 28.902 2.544 ( -0.000 3.221 27.373) 27.562 2.643 ( 0.000 -11.781 12.656) 17.290 2.786 ( 0.000 -3.415 13.037) 13.477 3.067 ( -0.000 2.282 4.828) 5.340 3.157 ( -0.000 5.492 6.024) 8.151 3.749 ( 0.000 -13.303 -0.176) 13.304 4.123 ( -0.000 7.426 -3.845) 8.363 4.961 ( 0.000 -3.790 20.875) 21.217 5.145 ( -0.000 3.854 15.192) 15.673 5.528 ( -0.000 0.411 6.019) 6.033 5.937 ( 0.000 -7.556 17.943) 19.469 6.126 ( -0.000 3.129 19.705) 19.952 6.674 ( -0.000 2.344 9.184) 9.479 7.010 ( 0.000 -6.745 -2.018) 7.040 7.072 ( 0.000 -2.496 10.630) 10.919 7.435 ( -0.000 0.377 14.075) 14.080 8.009 ( -0.000 1.300 -3.165) 3.421 8.295 ( -0.000 0.177 -0.238) 0.297 8.345 ( -0.000 -0.610 12.917) 12.931 8.392 ( 0.000 -12.976 16.216) 20.769 9.300 ( -0.000 2.181 20.144) 20.261 9.363 ( -0.000 1.474 9.349) 9.465 9.884 ( -0.000 -0.039 15.014) 15.014 10.171 ( -0.000 6.344 29.902) 30.568 10.854 ( -0.000 -0.257 19.587) 19.588 12.852 ( 0.000 -6.520 -9.704) 11.691 13.378 ( -0.000 8.008 -9.997) 12.809 13.765 ( -0.000 0.130 7.571) 7.572 13.869 ( 0.000 -6.992 -5.502) 8.898 14.215 ( -0.000 13.411 -0.253) 13.414 14.251 ( -0.000 0.005 8.983) 8.983 15.684 ( 0.000 -7.350 -38.330) 39.028 19.477 ( -0.000 1.864 34.727) 34.777 20.088 ( -0.000 -2.479 21.119) 21.264 ======================= Grid point 371 (156/343) ======================= q-point: ( 0.38 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( -10.682 3.906 18.820) 21.990 2.323 ( -9.861 11.717 20.678) 25.732 2.726 ( 4.353 -11.063 12.057) 16.933 2.878 ( -4.489 -1.924 14.347) 15.156 2.972 ( -1.399 2.734 12.842) 13.204 3.155 ( -0.533 1.882 6.540) 6.827 3.244 ( 2.790 4.899 6.548) 8.641 3.710 ( -0.912 -10.567 -0.061) 10.606 4.050 ( 6.556 5.341 -2.151) 8.726 5.367 ( -12.934 -3.118 22.038) 25.742 5.473 ( -8.616 1.894 15.366) 17.718 5.689 ( -12.534 1.297 7.092) 14.460 6.131 ( 0.564 -6.533 14.236) 15.674 6.345 ( 2.151 1.191 12.802) 13.036 6.725 ( -0.113 2.094 -3.139) 3.775 7.006 ( -7.191 -7.285 0.580) 10.253 7.199 ( -7.787 -0.138 2.358) 8.138 7.688 ( -3.020 0.480 17.896) 18.155 7.888 ( -4.693 -0.696 -12.702) 13.559 8.398 ( 4.537 -4.557 17.793) 18.920 8.555 ( -5.145 -0.083 12.370) 13.398 8.666 ( -11.717 -7.907 12.558) 18.908 9.506 ( 2.391 1.535 16.741) 16.980 9.551 ( 7.076 8.348 19.261) 22.153 10.180 ( -9.829 0.130 18.424) 20.882 10.662 ( -4.928 8.923 31.046) 32.676 11.172 ( -8.578 0.537 18.229) 20.154 12.674 ( 2.196 -6.506 -10.418) 12.478 13.228 ( 3.262 7.338 -12.139) 14.555 13.744 ( 1.760 -8.740 -3.634) 9.628 13.963 ( -6.675 -1.563 9.181) 11.458 14.221 ( 1.936 8.889 0.334) 9.104 14.463 ( -6.728 3.433 10.022) 12.550 15.186 ( -0.142 -8.609 -27.360) 28.683 19.972 ( -3.635 0.468 32.613) 32.818 20.361 ( 0.086 0.139 19.095) 19.096 ======================= Grid point 372 (157/343) ======================= q-point: ( 0.46 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.381 ( -8.210 -1.864 13.914) 16.262 2.726 ( -4.206 -1.021 12.983) 13.685 2.794 ( -2.590 -0.718 10.215) 10.563 3.052 ( -2.076 -2.253 7.460) 8.065 3.181 ( -2.598 8.109 8.672) 12.153 3.267 ( -1.801 2.522 6.875) 7.541 3.296 ( 3.440 2.513 5.988) 7.349 3.686 ( -0.213 -6.678 -0.506) 6.700 3.944 ( 8.457 3.008 -0.526) 8.992 5.662 ( -3.729 -1.045 9.054) 9.848 5.835 ( -9.624 -1.475 16.991) 19.583 6.020 ( -17.242 0.593 4.791) 17.905 6.203 ( 3.999 -4.022 1.311) 5.821 6.404 ( 0.816 2.483 1.864) 3.210 6.781 ( -7.314 0.296 5.923) 9.416 7.142 ( -14.021 -5.693 0.244) 15.134 7.316 ( -12.073 -2.540 -5.551) 13.529 7.853 ( -12.340 0.510 -8.638) 15.071 7.961 ( 0.231 1.383 17.182) 17.239 8.580 ( 2.983 -6.410 19.075) 20.343 8.779 ( -6.374 0.261 8.209) 10.396 8.951 ( -8.301 -2.525 12.165) 14.942 9.680 ( 8.022 8.852 17.270) 20.999 9.812 ( 1.093 -0.272 24.732) 24.758 10.603 ( -11.922 0.892 20.179) 23.454 11.165 ( -6.583 7.171 26.356) 28.097 11.575 ( -14.060 3.941 16.910) 22.342 12.472 ( 3.154 -6.532 -10.269) 12.573 13.036 ( 3.809 7.346 -12.345) 14.862 13.607 ( 0.405 -13.212 -9.278) 16.149 14.088 ( 1.219 6.565 0.523) 6.698 14.321 ( -4.833 -1.632 8.457) 9.876 14.602 ( -2.422 4.027 -2.052) 5.127 15.038 ( -10.339 -6.439 2.114) 12.362 20.432 ( -2.981 -0.417 28.055) 28.216 20.591 ( 2.511 1.515 16.856) 17.109 ======================= Grid point 373 (158/343) ======================= q-point: ( 0.54 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( -2.958 -6.848 9.692) 12.230 2.812 ( -0.938 -5.307 6.424) 8.385 3.026 ( -3.507 3.361 7.793) 9.183 3.136 ( -0.638 -0.211 2.985) 3.060 3.259 ( 7.422 4.211 6.137) 10.511 3.354 ( -0.077 -0.587 5.133) 5.167 3.430 ( -6.047 5.404 3.387) 8.789 3.656 ( 0.486 0.438 -0.881) 1.097 3.836 ( 8.413 1.303 0.895) 8.560 5.810 ( -4.186 -2.255 6.131) 7.759 5.990 ( 3.978 -0.445 -8.382) 9.288 6.123 ( -0.966 -0.666 11.821) 11.879 6.283 ( -10.905 -1.221 -1.341) 11.054 6.457 ( -2.046 1.702 2.052) 3.360 6.985 ( -10.869 -0.166 2.528) 11.161 7.275 ( -11.960 -2.612 -6.473) 13.847 7.410 ( -15.617 -2.293 -5.120) 16.594 7.937 ( -18.438 -0.079 -11.668) 21.820 8.153 ( 5.861 1.221 16.172) 17.244 8.773 ( 2.903 -5.408 18.209) 19.215 8.949 ( -4.367 -0.460 6.562) 7.896 9.201 ( -2.175 0.684 14.596) 14.773 9.842 ( 7.228 6.537 17.131) 19.709 10.128 ( 2.682 -2.216 24.591) 24.836 11.013 ( -8.216 0.807 18.260) 20.040 11.593 ( -7.678 3.847 19.743) 21.529 12.007 ( -13.425 7.622 13.013) 20.190 12.275 ( 2.727 -6.283 -8.020) 10.547 12.865 ( 1.744 7.234 -10.052) 12.507 13.392 ( 0.230 -13.561 -13.077) 18.840 14.080 ( -0.162 8.246 -3.089) 8.807 14.376 ( -1.032 -4.425 -3.207) 5.562 14.725 ( -7.175 -0.650 9.077) 11.588 15.289 ( -8.531 -1.405 12.346) 15.072 20.751 ( 5.231 1.343 15.641) 16.548 20.804 ( 0.621 -0.435 22.623) 22.636 ======================= Grid point 374 (159/343) ======================= q-point: ( 0.62 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 1.447 -7.208 5.968) 9.469 2.898 ( -3.431 -2.928 1.875) 4.884 3.104 ( 4.044 3.491 2.401) 5.858 3.153 ( 1.218 1.166 0.369) 1.726 3.241 ( 5.151 -0.863 4.086) 6.631 3.403 ( 0.881 -0.903 2.467) 2.770 3.461 ( 3.456 -3.606 -0.048) 4.995 3.653 ( 5.182 5.477 0.696) 7.572 3.809 ( -1.345 6.005 2.400) 6.606 5.826 ( 1.342 -2.285 -6.795) 7.293 5.921 ( -2.650 -2.652 3.844) 5.369 6.259 ( 1.782 2.999 7.473) 8.247 6.325 ( -7.575 -0.042 -9.707) 12.313 6.490 ( 3.326 0.182 2.861) 4.391 7.091 ( -10.902 1.350 -8.894) 14.134 7.336 ( -9.481 -1.231 -4.093) 10.400 7.517 ( -13.445 0.349 -9.274) 16.337 8.013 ( -18.569 -1.725 -13.983) 23.309 8.244 ( 8.128 -2.203 11.521) 14.271 8.950 ( 4.544 -3.243 17.484) 18.354 9.076 ( -1.284 -1.091 6.662) 6.872 9.402 ( 3.850 1.598 15.858) 16.397 9.964 ( 10.594 2.722 15.155) 18.690 10.350 ( 9.476 -1.637 20.391) 22.545 11.283 ( -0.067 -0.239 11.300) 11.303 11.932 ( -7.498 2.087 11.623) 13.988 12.061 ( 3.065 -4.649 -4.293) 7.031 12.348 ( -4.699 5.390 3.956) 8.172 12.802 ( -3.395 3.687 -4.167) 6.518 13.230 ( -6.363 -5.365 -6.998) 10.874 14.071 ( -1.957 6.145 -4.626) 7.937 14.316 ( -3.893 -3.198 -7.894) 9.365 14.922 ( -2.010 -4.264 10.283) 11.312 15.528 ( -2.719 1.289 10.948) 11.354 20.856 ( 8.463 0.462 13.775) 16.173 21.045 ( 5.624 -0.136 18.387) 19.228 ======================= Grid point 375 (160/343) ======================= q-point: (-0.31 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.697 ( 2.426 -4.526 2.687) 5.796 2.883 ( 2.320 -2.282 -4.314) 5.404 3.023 ( 8.890 1.734 -1.344) 9.157 3.132 ( 4.591 2.212 0.111) 5.098 3.234 ( 0.584 -1.184 0.859) 1.575 3.342 ( 3.764 -3.515 -2.341) 5.657 3.429 ( 3.005 -2.023 2.463) 4.380 3.590 ( 6.836 2.528 1.318) 7.407 3.894 ( -0.715 6.921 2.050) 7.254 5.769 ( -3.179 -2.766 -1.950) 4.643 5.955 ( 1.340 -2.235 0.425) 2.640 6.235 ( -3.764 0.883 -14.238) 14.753 6.295 ( 7.554 2.708 4.864) 9.384 6.459 ( 3.718 1.496 0.637) 4.058 7.088 ( -10.453 2.203 -12.880) 16.734 7.373 ( -4.721 1.199 -6.019) 7.743 7.528 ( -8.798 0.657 -10.765) 13.918 8.049 ( -16.418 -2.552 -14.454) 22.022 8.225 ( 8.918 -5.414 4.348) 11.302 9.084 ( 10.173 -0.902 17.139) 19.951 9.143 ( 3.200 -1.401 5.409) 6.439 9.533 ( 7.728 1.520 14.360) 16.378 9.967 ( 17.021 -1.006 12.524) 21.157 10.399 ( 17.627 -0.456 14.460) 22.804 11.286 ( 9.672 -1.378 -0.067) 9.770 11.895 ( 5.711 -3.488 -3.952) 7.772 12.187 ( -0.916 -0.629 5.099) 5.218 12.367 ( -0.517 2.155 -0.163) 2.222 12.823 ( -5.585 -2.428 -0.268) 6.096 13.387 ( -15.393 7.365 2.121) 17.196 14.042 ( -1.956 1.866 -6.166) 6.732 14.262 ( -7.181 0.294 -8.836) 11.390 15.009 ( 4.101 -6.275 7.467) 10.581 15.660 ( 3.043 2.793 7.953) 8.961 20.899 ( 11.255 -0.499 12.207) 16.611 21.136 ( 12.985 0.155 13.339) 18.616 ======================= Grid point 376 (161/343) ======================= q-point: (-0.23 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 5.642 -1.359 -0.741) 5.850 2.709 ( 7.655 -1.670 -10.051) 12.744 2.868 ( 10.153 -0.667 -1.990) 10.368 3.034 ( 8.082 0.261 -1.699) 8.263 3.177 ( 6.754 3.393 -1.662) 7.739 3.318 ( -2.061 -3.770 0.494) 4.325 3.403 ( 1.931 -2.246 0.384) 2.987 3.527 ( 4.575 1.675 -0.289) 4.880 3.912 ( 5.006 3.814 1.727) 6.526 5.818 ( -3.072 -1.932 1.941) 4.116 5.869 ( 6.085 -1.994 -4.082) 7.594 6.061 ( 3.057 2.008 -12.227) 12.762 6.221 ( 9.795 -0.101 2.968) 10.236 6.448 ( -1.955 3.543 -1.812) 4.434 7.050 ( -8.584 2.626 -13.558) 16.260 7.298 ( 1.002 2.260 -9.405) 9.725 7.492 ( -5.055 0.711 -8.063) 9.543 8.044 ( 1.171 -2.972 -7.938) 8.557 8.075 ( -2.748 -4.458 -9.850) 11.156 9.092 ( 15.204 0.759 8.776) 17.571 9.122 ( 14.921 -1.486 9.889) 17.962 9.595 ( 9.541 2.463 10.372) 14.307 9.851 ( 20.796 -5.329 11.222) 24.224 10.268 ( 23.557 0.018 8.418) 25.016 11.060 ( 14.806 -1.421 -6.169) 16.103 11.715 ( 13.124 -2.546 -3.040) 13.710 12.017 ( 12.095 -4.207 -8.719) 15.492 12.533 ( -6.839 3.915 8.481) 11.577 12.949 ( -8.678 -2.592 4.497) 10.112 13.587 ( -11.067 6.998 -6.312) 14.536 13.957 ( -0.625 -3.042 -8.390) 8.946 14.350 ( -13.502 7.632 0.638) 15.523 14.976 ( 8.408 -8.243 4.696) 12.677 15.696 ( 6.359 3.245 5.922) 9.276 20.873 ( 14.256 -0.766 9.676) 17.246 21.043 ( 22.130 -0.055 7.758) 23.451 ======================= Grid point 377 (162/343) ======================= q-point: (-0.15 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.401 ( 13.135 -1.521 -13.229) 18.704 2.485 ( 14.097 0.565 -4.515) 14.813 2.700 ( 9.207 -1.314 -2.235) 9.565 2.907 ( 7.880 -0.215 -0.223) 7.886 3.065 ( 8.801 4.685 -1.643) 10.104 3.294 ( 4.850 -3.474 0.559) 5.992 3.393 ( -0.766 -1.160 -1.310) 1.910 3.482 ( -0.378 0.504 -1.953) 2.052 3.837 ( 9.204 0.972 1.006) 9.310 5.697 ( 7.229 -1.021 -5.579) 9.188 5.779 ( 12.587 -0.007 -0.016) 12.587 5.844 ( 8.064 0.859 -9.391) 12.408 6.220 ( -2.142 -0.720 6.511) 6.892 6.476 ( -2.934 3.897 -1.884) 5.230 6.911 ( 6.190 3.137 -13.746) 15.399 7.179 ( -7.709 0.780 -11.471) 13.843 7.448 ( 3.976 0.308 -2.714) 4.824 7.738 ( 11.128 -1.980 -12.250) 16.668 8.081 ( -12.120 -1.670 -9.100) 15.248 8.928 ( 17.555 0.217 -0.353) 17.560 8.973 ( 29.976 0.259 13.570) 32.906 9.522 ( 17.895 7.406 2.045) 19.475 9.698 ( 19.648 -11.305 9.956) 24.758 10.040 ( 21.512 -0.375 6.553) 22.491 10.740 ( 17.530 -0.560 -7.363) 19.022 11.425 ( 22.327 -2.607 -3.031) 22.682 11.689 ( 16.190 -2.130 -8.568) 18.441 12.747 ( -6.109 3.016 7.840) 10.387 13.128 ( -8.771 -1.897 4.847) 10.199 13.582 ( -7.147 2.599 -12.827) 14.912 13.835 ( 0.543 -3.145 -7.218) 7.892 14.635 ( -9.894 14.849 5.725) 18.740 14.883 ( 4.981 -13.580 4.244) 15.075 15.702 ( 4.041 2.882 5.339) 7.290 20.739 ( 31.317 -0.107 2.504) 31.417 20.766 ( 18.218 -0.770 5.834) 19.145 ======================= Grid point 378 (163/343) ======================= q-point: (-0.08 0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.004 ( 19.151 -1.254 -11.297) 22.270 2.155 ( 24.112 0.165 -4.961) 24.618 2.573 ( 4.840 0.199 -1.493) 5.069 2.802 ( 8.948 -0.057 0.674) 8.974 2.919 ( 10.666 2.953 -2.248) 11.293 3.204 ( 7.184 -2.318 -0.057) 7.549 3.297 ( 14.801 -0.710 -1.117) 14.861 3.500 ( -5.789 -0.135 -1.451) 5.969 3.750 ( 2.099 0.019 -0.236) 2.112 5.532 ( 13.728 3.445 -1.927) 14.284 5.557 ( 11.557 -3.170 -2.009) 12.152 5.603 ( 10.347 -0.045 -6.520) 12.230 6.323 ( 7.046 0.517 4.131) 8.184 6.458 ( 6.333 2.028 -1.885) 6.911 6.618 ( 5.558 2.177 -9.506) 11.225 7.174 ( 13.856 3.298 -5.806) 15.381 7.232 ( -10.641 -4.672 -6.770) 13.450 7.597 ( -3.187 1.250 -4.161) 5.388 8.146 ( -11.440 -0.603 -3.809) 12.073 8.631 ( 20.184 0.042 -3.888) 20.555 8.685 ( 37.426 0.274 11.267) 39.086 9.213 ( 26.306 6.983 -5.833) 27.835 9.493 ( 19.846 -8.397 6.445) 22.492 9.895 ( 14.789 -0.373 6.082) 15.995 10.401 ( 19.112 0.092 -5.207) 19.809 11.010 ( 31.522 -1.936 -2.567) 31.685 11.349 ( 19.011 -0.358 -5.358) 19.755 12.928 ( -5.396 1.707 5.891) 8.169 13.290 ( -7.545 -0.328 3.004) 8.127 13.504 ( -5.514 -0.865 -10.446) 11.844 13.739 ( 1.160 -1.683 -3.633) 4.169 14.661 ( 11.259 3.520 1.388) 11.878 14.999 ( -7.166 -2.769 5.788) 9.618 15.807 ( -9.784 1.771 5.024) 11.140 20.244 ( 40.514 -0.684 -1.387) 40.543 20.563 ( 20.558 0.246 2.321) 20.690 ======================= Grid point 384 (164/343) ======================= q-point: ( 0.38 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.177 ( -0.000 6.007 17.626) 18.621 2.505 ( -0.000 7.383 19.282) 20.647 2.983 ( 0.000 -11.460 11.737) 16.404 3.005 ( 0.000 -3.046 9.005) 9.507 3.098 ( -0.000 4.142 8.961) 9.871 3.248 ( -0.000 -0.513 7.650) 7.667 3.338 ( -0.000 5.904 7.047) 9.193 3.737 ( 0.000 -9.436 -0.377) 9.444 4.041 ( -0.000 5.687 -2.135) 6.075 5.609 ( -0.000 -0.345 21.757) 21.760 5.669 ( -0.000 0.016 21.301) 21.301 5.683 ( -0.000 0.016 5.204) 5.204 6.276 ( 0.000 -1.405 3.329) 3.613 6.481 ( 0.000 -1.642 2.862) 3.300 6.636 ( -0.000 3.144 -8.206) 8.788 7.010 ( 0.000 -6.679 6.942) 9.633 7.113 ( 0.000 -3.213 -4.996) 5.939 7.653 ( 0.000 0.865 -14.222) 14.248 7.980 ( -0.000 2.810 25.456) 25.611 8.652 ( -0.000 0.029 7.650) 7.650 8.755 ( -0.000 0.057 22.848) 22.848 8.800 ( 0.000 -14.954 14.091) 20.547 9.759 ( -0.000 6.639 18.135) 19.312 9.851 ( -0.000 9.844 23.434) 25.417 10.342 ( -0.000 0.364 18.441) 18.444 11.037 ( -0.000 6.545 31.701) 32.369 11.358 ( -0.000 -0.407 17.350) 17.355 12.569 ( 0.000 -6.892 -10.629) 12.668 13.042 ( -0.000 7.110 -14.174) 15.858 13.735 ( 0.000 -15.025 -6.864) 16.518 14.116 ( -0.000 0.037 18.174) 18.174 14.166 ( -0.000 13.426 -4.543) 14.174 14.601 ( -0.000 0.085 16.540) 16.541 14.877 ( 0.000 -6.389 -18.985) 20.032 20.394 ( -0.000 -0.281 31.969) 31.970 20.624 ( -0.000 1.017 19.126) 19.153 ======================= Grid point 385 (165/343) ======================= q-point: ( 0.46 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( -5.901 3.616 13.237) 14.938 2.802 ( -5.406 7.322 14.296) 16.948 3.012 ( 6.692 -9.166 8.528) 14.196 3.128 ( -1.491 -3.934 5.949) 7.286 3.231 ( -1.781 4.953 6.920) 8.694 3.344 ( -0.163 -0.703 6.438) 6.479 3.427 ( 3.805 5.021 6.606) 9.129 3.705 ( -0.208 -8.208 -0.153) 8.212 4.007 ( 4.082 4.143 -1.095) 5.918 5.742 ( -0.771 -0.951 5.766) 5.894 5.903 ( -7.701 -1.014 4.716) 9.087 5.974 ( -5.749 1.796 15.980) 17.077 6.241 ( 2.098 -2.956 -5.076) 6.237 6.417 ( 2.268 2.758 -1.218) 3.772 6.649 ( -11.357 3.697 -4.977) 12.939 7.054 ( -7.581 -6.019 -7.262) 12.101 7.131 ( -1.729 -7.764 7.055) 10.632 7.535 ( -9.327 0.794 -12.305) 15.461 8.320 ( 4.581 4.118 25.935) 26.656 8.775 ( -4.810 -0.746 6.155) 7.847 8.921 ( 2.446 -10.936 16.288) 19.771 9.102 ( -3.715 -0.212 21.080) 21.406 9.997 ( 6.947 12.518 18.700) 23.551 10.195 ( 2.814 1.470 27.638) 27.819 10.687 ( -11.376 2.319 18.276) 21.652 11.466 ( -0.452 4.904 26.604) 27.056 11.640 ( -8.054 1.608 16.263) 18.219 12.392 ( 1.275 -8.172 -9.730) 12.770 12.866 ( 1.521 8.225 -13.569) 15.939 13.531 ( 1.516 -15.613 -12.767) 20.225 14.100 ( 5.038 10.266 -2.604) 11.729 14.439 ( -4.706 -0.870 17.621) 18.259 14.579 ( 5.943 -2.450 -3.497) 7.318 14.975 ( -13.749 -1.660 12.544) 18.685 20.804 ( 0.088 -0.647 27.990) 27.998 20.869 ( 2.626 1.480 18.990) 19.228 ======================= Grid point 386 (166/343) ======================= q-point: ( 0.54 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.690 ( -4.713 -1.376 9.199) 10.427 2.980 ( 6.621 -7.342 6.358) 11.754 3.058 ( -4.063 3.817 7.697) 9.504 3.183 ( 0.638 -1.322 3.583) 3.872 3.370 ( -3.761 8.297 4.045) 9.967 3.415 ( 2.661 0.847 5.744) 6.387 3.455 ( 4.581 1.691 5.502) 7.357 3.670 ( 1.131 -5.260 -0.493) 5.402 3.939 ( 6.303 2.313 -0.016) 6.714 5.830 ( -3.634 -1.848 2.668) 4.872 5.884 ( 0.989 0.563 -9.954) 10.019 6.139 ( -5.332 -3.313 -3.141) 7.019 6.234 ( -3.159 2.488 3.904) 5.604 6.481 ( -4.346 2.862 4.118) 6.636 6.763 ( -12.062 1.369 -4.448) 12.929 7.051 ( -15.623 -3.736 -13.597) 21.046 7.163 ( -1.347 -4.039 -1.752) 4.604 7.576 ( -13.405 -2.194 -5.720) 14.739 8.555 ( 10.974 3.638 21.354) 24.283 8.949 ( -6.184 -1.603 9.221) 11.218 9.074 ( 1.237 -7.910 14.747) 16.780 9.429 ( -1.015 1.703 21.388) 21.480 10.184 ( 9.191 9.867 19.335) 23.573 10.519 ( 3.330 -3.038 25.821) 26.211 11.098 ( -11.537 3.825 15.859) 19.981 11.790 ( -1.543 1.242 18.055) 18.164 11.996 ( -9.888 5.029 12.233) 16.514 12.230 ( 0.782 -7.215 -5.367) 9.026 12.717 ( 0.711 8.446 -9.574) 12.787 13.267 ( 1.395 -13.269 -14.082) 19.399 14.043 ( 3.299 6.979 -2.180) 8.021 14.375 ( 6.243 -3.481 -4.910) 8.671 14.810 ( -6.588 -0.988 16.908) 18.173 15.327 ( -10.816 -0.182 13.448) 17.259 21.054 ( 5.921 1.120 17.576) 18.580 21.149 ( 2.239 -0.463 23.891) 24.000 ======================= Grid point 387 (167/343) ======================= q-point: ( 0.62 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( -0.107 -6.226 6.052) 8.684 2.943 ( 4.388 -4.521 2.983) 6.971 3.131 ( 1.056 0.036 0.525) 1.180 3.216 ( 2.656 1.496 3.615) 4.729 3.393 ( 8.367 1.464 3.332) 9.125 3.439 ( 1.485 0.514 0.491) 1.647 3.528 ( 0.308 0.476 4.799) 4.833 3.653 ( -0.485 5.622 0.850) 5.706 3.865 ( 5.782 1.848 1.062) 6.163 5.731 ( -0.608 -1.695 -8.396) 8.587 5.908 ( -5.222 -2.462 -0.375) 5.786 6.129 ( -3.597 -1.407 -5.990) 7.127 6.310 ( -2.524 5.257 -0.072) 5.832 6.563 ( -3.467 1.752 -2.999) 4.908 6.854 ( -4.232 -1.487 1.026) 4.601 7.074 ( -18.143 -0.645 -16.570) 24.579 7.137 ( -10.626 -0.655 -10.556) 14.993 7.679 ( -10.858 -2.928 -3.198) 11.692 8.620 ( 15.003 0.163 13.735) 20.341 9.159 ( -2.116 -1.893 12.979) 13.285 9.229 ( 0.714 -4.385 13.564) 14.273 9.699 ( 3.727 2.071 19.524) 19.984 10.329 ( 10.703 3.842 17.374) 20.765 10.753 ( 7.774 -3.169 20.617) 22.261 11.399 ( -3.270 2.242 9.194) 10.013 11.951 ( -1.535 -1.745 -0.878) 2.485 12.116 ( -1.321 -3.140 8.221) 8.899 12.330 ( -3.814 4.720 4.825) 7.753 12.686 ( -4.188 5.477 -2.195) 7.236 13.075 ( -3.662 -5.874 -7.593) 10.275 13.996 ( 1.387 4.306 -3.297) 5.598 14.215 ( 2.887 -2.540 -7.959) 8.839 15.070 ( -1.794 -3.002 13.372) 13.822 15.604 ( -5.725 1.224 10.218) 11.776 21.182 ( 9.005 0.363 15.777) 18.170 21.388 ( 5.995 -0.095 19.351) 20.258 ======================= Grid point 388 (168/343) ======================= q-point: (-0.31 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( 4.995 -7.333 3.538) 9.552 2.887 ( 4.333 -2.978 -2.373) 5.768 3.101 ( 3.649 0.238 -0.228) 3.664 3.200 ( 4.975 1.281 1.293) 5.297 3.311 ( 7.855 -1.012 1.515) 8.063 3.378 ( 4.814 0.162 -1.716) 5.113 3.538 ( 4.298 -3.410 3.779) 6.661 3.674 ( 5.141 5.709 0.253) 7.687 3.874 ( -1.537 7.323 2.219) 7.805 5.686 ( -5.392 -2.718 -2.854) 6.679 5.935 ( -4.564 -2.213 -4.730) 6.935 6.063 ( 1.280 -0.542 -5.104) 5.290 6.341 ( -1.428 5.961 -2.550) 6.639 6.520 ( 0.005 0.154 -6.114) 6.116 6.862 ( 1.826 -0.102 -1.721) 2.511 7.091 ( -17.533 1.400 -15.666) 23.553 7.182 ( -13.913 0.518 -9.183) 16.679 7.748 ( -8.231 -2.490 -4.285) 9.608 8.533 ( 17.211 -4.232 6.922) 19.027 9.307 ( 4.224 -1.676 11.230) 12.115 9.390 ( 2.145 -1.277 13.941) 14.163 9.857 ( 9.330 1.701 15.577) 18.237 10.372 ( 14.494 -2.054 13.339) 19.804 10.825 ( 15.473 -2.043 14.165) 21.077 11.398 ( 8.472 -1.036 -2.708) 8.954 11.937 ( 0.888 -3.979 0.536) 4.112 12.243 ( 1.160 2.249 2.461) 3.530 12.364 ( 0.006 0.889 2.278) 2.446 12.745 ( -6.963 -2.635 0.483) 7.461 13.184 ( -12.614 8.102 1.610) 15.078 13.948 ( -0.349 1.083 -4.425) 4.569 14.077 ( -2.106 0.012 -8.973) 9.217 15.191 ( 3.651 -4.889 8.564) 10.515 15.764 ( -0.287 2.453 6.469) 6.925 21.237 ( 11.794 -0.497 13.159) 17.678 21.499 ( 11.702 0.260 14.259) 18.448 ======================= Grid point 389 (169/343) ======================= q-point: (-0.23 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.723 ( 9.233 -3.057 -5.445) 11.146 2.746 ( 6.504 -5.144 0.586) 8.313 3.004 ( 10.271 -0.089 -0.197) 10.274 3.121 ( 6.928 -1.687 -1.080) 7.212 3.247 ( 5.518 3.883 0.934) 6.812 3.306 ( 1.927 -0.226 -0.549) 2.017 3.498 ( 5.626 -3.756 2.310) 7.149 3.592 ( 7.088 2.262 -1.129) 7.525 3.948 ( 0.140 7.353 1.582) 7.523 5.770 ( -7.568 -1.299 1.616) 7.847 5.874 ( 0.696 -2.271 -5.930) 6.388 5.970 ( 3.117 -0.432 -3.967) 5.064 6.319 ( 0.956 4.225 -3.792) 5.757 6.430 ( 2.346 0.621 -3.507) 4.265 6.789 ( -1.339 0.055 -7.432) 7.552 7.143 ( -12.157 3.857 -8.722) 15.451 7.219 ( -6.916 1.607 -7.425) 10.273 7.780 ( -8.474 -2.593 -5.507) 10.433 8.310 ( 20.850 -6.090 0.969) 21.743 9.326 ( 11.279 -1.420 7.474) 13.605 9.511 ( 7.613 1.971 12.549) 14.809 9.877 ( 13.793 1.453 9.498) 16.810 10.288 ( 17.632 -8.006 9.937) 21.765 10.701 ( 23.231 -1.246 7.681) 24.500 11.171 ( 13.281 -1.449 -6.315) 14.777 11.867 ( 9.289 -3.669 0.927) 10.030 12.082 ( 10.829 -3.645 -6.680) 13.236 12.528 ( -6.712 7.402 7.035) 12.220 12.889 ( -9.908 -4.394 4.283) 11.654 13.344 ( -8.187 7.016 -5.828) 12.256 13.864 ( 0.663 -2.321 -6.430) 6.869 14.130 ( -14.292 7.012 -0.525) 15.928 15.176 ( 7.864 -6.867 4.416) 11.336 15.816 ( 3.722 3.233 3.680) 6.152 21.209 ( 14.627 -0.918 9.324) 17.370 21.446 ( 19.422 0.187 8.664) 21.268 ======================= Grid point 390 (170/343) ======================= q-point: (-0.15 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( 14.098 -3.348 -5.452) 15.482 2.621 ( 10.565 -1.856 -0.914) 10.766 2.837 ( 12.334 -1.125 -0.530) 12.396 3.004 ( 6.946 -1.386 -0.505) 7.101 3.171 ( 10.188 8.245 0.650) 13.123 3.318 ( -3.265 -2.421 -0.212) 4.070 3.428 ( 5.568 -4.261 1.039) 7.088 3.485 ( 5.411 1.280 -1.991) 5.906 3.947 ( 5.526 4.065 0.735) 6.899 5.724 ( 6.003 -0.591 -3.721) 7.087 5.845 ( 5.770 0.832 -3.980) 7.059 5.910 ( 1.377 -1.384 2.837) 3.444 6.282 ( -0.706 1.068 1.372) 1.877 6.402 ( -1.681 3.654 -1.069) 4.162 6.715 ( -4.604 -0.809 -9.095) 10.226 7.092 ( 8.143 3.608 -4.057) 9.787 7.280 ( -13.155 3.031 -4.897) 14.361 7.836 ( -11.009 -2.353 -3.868) 11.904 7.956 ( 25.949 -5.657 -2.408) 26.667 9.187 ( 18.328 -0.998 2.482) 18.522 9.516 ( 18.449 4.926 11.878) 22.489 9.734 ( 18.214 3.424 -0.757) 18.548 10.121 ( 17.903 -14.307 6.748) 23.890 10.427 ( 25.260 -0.990 3.202) 25.481 10.886 ( 16.323 -0.245 -4.942) 17.056 11.686 ( 16.543 -4.270 0.302) 17.088 11.813 ( 14.703 -1.621 -5.013) 15.619 12.734 ( -6.765 7.288 5.227) 11.234 13.065 ( -9.823 -4.727 3.501) 11.450 13.336 ( -5.903 2.076 -8.663) 10.686 13.775 ( 0.596 -2.147 -3.866) 4.462 14.430 ( -19.299 12.053 2.620) 22.904 15.067 ( 9.097 -9.804 1.781) 13.493 15.802 ( 4.996 3.471 1.955) 6.389 21.083 ( 17.466 -0.712 4.569) 18.068 21.202 ( 28.400 -0.318 3.297) 28.593 ======================= Grid point 391 (171/343) ======================= q-point: (-0.08 0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 18.029 -2.794 0.000) 18.244 2.415 ( 18.045 0.060 0.000) 18.045 2.671 ( 10.313 -0.771 0.000) 10.342 2.910 ( 6.502 -0.679 0.000) 6.537 3.050 ( 12.159 6.997 -0.000) 14.029 3.303 ( 5.192 -4.199 0.000) 6.678 3.376 ( 0.605 -1.395 0.000) 1.521 3.440 ( -0.888 0.627 -0.000) 1.087 3.850 ( 9.995 0.914 -0.000) 10.037 5.608 ( 6.397 -0.574 0.000) 6.423 5.704 ( 10.355 0.824 -0.000) 10.388 5.789 ( 16.104 0.081 0.000) 16.105 6.387 ( -5.863 1.026 -0.000) 5.952 6.448 ( -2.579 4.294 -0.000) 5.009 6.638 ( 7.719 1.564 -0.000) 7.876 7.000 ( -4.396 0.358 -0.000) 4.410 7.391 ( 0.096 2.058 -0.000) 2.060 7.566 ( 18.066 -3.665 0.000) 18.434 7.960 ( -11.991 -1.434 0.000) 12.076 8.913 ( 22.594 -0.506 0.000) 22.599 9.289 ( 34.912 -0.323 0.000) 34.913 9.443 ( 20.298 11.687 -0.000) 23.423 9.857 ( 19.908 -15.570 0.000) 25.274 10.153 ( 17.885 -0.719 0.000) 17.899 10.615 ( 18.114 0.392 -0.000) 18.118 11.391 ( 24.568 -4.058 0.000) 24.901 11.558 ( 17.133 -0.050 0.000) 17.133 12.884 ( -5.942 5.060 -0.000) 7.805 13.202 ( -8.858 -2.606 0.000) 9.233 13.353 ( -6.314 -0.931 0.000) 6.382 13.732 ( 0.682 -2.013 0.000) 2.125 14.716 ( -6.439 17.031 -0.000) 18.207 14.952 ( -1.219 -15.209 0.000) 15.258 15.778 ( 1.494 3.024 -0.000) 3.373 20.775 ( 36.596 -0.724 0.000) 36.603 20.858 ( 19.749 -0.205 0.000) 19.750 ======================= Grid point 398 (172/343) ======================= q-point: ( 0.46 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.573 ( -0.000 4.884 11.881) 12.846 2.925 ( -0.000 4.352 11.738) 12.519 3.146 ( 0.000 -1.503 2.622) 3.022 3.261 ( 0.000 -10.717 8.708) 13.809 3.279 ( -0.000 3.817 4.559) 5.946 3.435 ( 0.000 -1.300 6.520) 6.649 3.523 ( -0.000 5.756 6.295) 8.530 3.732 ( 0.000 -7.908 -0.145) 7.909 4.001 ( -0.000 4.505 -1.071) 4.631 5.787 ( 0.000 -0.948 2.015) 2.227 5.880 ( 0.000 -0.853 -5.840) 5.902 6.076 ( -0.000 4.662 7.556) 8.878 6.146 ( 0.000 -4.174 -10.703) 11.489 6.365 ( -0.000 5.267 -6.493) 8.361 6.547 ( -0.000 0.299 5.015) 5.024 6.866 ( 0.000 -4.859 -13.581) 14.424 7.282 ( 0.000 1.380 -12.014) 12.093 7.342 ( 0.000 -7.852 12.954) 15.148 8.692 ( -0.000 4.069 25.596) 25.917 8.842 ( -0.000 -1.028 8.786) 8.846 9.170 ( 0.000 -10.032 12.910) 16.350 9.385 ( -0.000 1.121 23.035) 23.063 10.252 ( -0.000 14.493 18.688) 23.649 10.598 ( -0.000 0.935 28.679) 28.695 10.834 ( -0.000 0.402 16.914) 16.918 11.781 ( -0.000 -0.383 13.725) 13.730 11.796 ( -0.000 3.465 22.505) 22.770 12.313 ( 0.000 -9.640 -7.581) 12.264 12.668 ( -0.000 9.561 -11.474) 14.935 13.396 ( 0.000 -12.630 -16.057) 20.429 14.064 ( -0.000 7.434 -2.052) 7.712 14.568 ( 0.000 -3.352 -8.179) 8.839 14.688 ( -0.000 0.030 22.410) 22.410 15.100 ( -0.000 0.080 19.119) 19.119 21.132 ( -0.000 0.767 18.890) 18.905 21.182 ( -0.000 -0.216 25.163) 25.164 ======================= Grid point 399 (173/343) ======================= q-point: ( 0.54 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.755 ( -2.852 3.279 8.809) 9.822 3.078 ( -1.303 1.019 5.086) 5.348 3.163 ( 1.824 -0.240 4.399) 4.768 3.286 ( 4.172 -5.763 5.795) 9.176 3.366 ( -1.107 3.083 3.691) 4.935 3.511 ( 0.261 -1.587 5.436) 5.669 3.586 ( 4.730 4.463 4.940) 8.167 3.702 ( 0.698 -6.230 0.246) 6.274 3.984 ( 2.613 3.161 -0.765) 4.172 5.741 ( 0.868 1.869 -11.103) 11.293 5.815 ( -2.383 -0.950 -1.006) 2.755 5.992 ( -5.054 -5.449 -11.513) 13.704 6.187 ( -4.111 1.732 1.085) 4.591 6.349 ( -4.580 8.054 -4.804) 10.437 6.638 ( -8.562 -1.075 -2.486) 8.980 6.693 ( -7.308 -3.905 -16.013) 18.030 7.144 ( 4.015 0.258 -2.943) 4.985 7.505 ( -4.235 -6.179 8.159) 11.076 8.923 ( 7.066 1.533 14.430) 16.140 9.069 ( -3.655 0.344 19.491) 19.834 9.300 ( 1.234 -6.828 11.923) 13.795 9.702 ( -1.050 1.525 21.285) 21.366 10.505 ( 5.982 12.209 17.799) 22.398 10.925 ( 3.850 -3.239 24.050) 24.570 11.136 ( -9.901 3.096 14.538) 17.860 11.959 ( -0.099 -1.678 5.946) 6.179 12.015 ( -4.875 -0.255 5.057) 7.029 12.248 ( 0.041 -3.504 6.623) 7.493 12.592 ( 0.180 8.663 -3.838) 9.477 13.146 ( 1.139 -10.375 -12.359) 16.177 14.034 ( 2.441 4.270 -2.527) 5.529 14.395 ( 6.287 -2.302 -8.322) 10.681 15.003 ( -2.613 -0.266 19.592) 19.767 15.400 ( -6.543 0.120 15.778) 17.081 21.354 ( 3.530 0.789 16.928) 17.310 21.488 ( 1.624 -0.376 21.347) 21.412 ======================= Grid point 400 (174/343) ======================= q-point: ( 0.62 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.891 ( -1.586 -1.054 5.761) 6.068 3.066 ( 4.434 -4.114 0.499) 6.069 3.202 ( 4.338 -3.200 3.933) 6.673 3.294 ( 2.191 -0.846 3.697) 4.380 3.430 ( -0.191 5.266 1.414) 5.456 3.553 ( 5.143 1.833 3.041) 6.249 3.577 ( 2.378 3.347 3.034) 5.105 3.683 ( 2.044 -2.725 2.298) 4.109 3.937 ( 4.473 2.029 -0.162) 4.915 5.608 ( -1.506 -0.992 -8.051) 8.250 5.814 ( -3.719 -2.396 -4.485) 6.300 5.949 ( -10.734 -0.150 -9.856) 14.574 6.228 ( -1.405 2.550 -1.517) 3.283 6.383 ( -7.159 3.197 -5.976) 9.859 6.590 ( -13.867 -1.390 -16.524) 21.616 6.714 ( -15.043 -0.292 -11.606) 19.002 7.097 ( 6.947 0.077 6.661) 9.625 7.621 ( -3.320 -3.947 4.118) 6.600 8.964 ( 12.102 0.349 10.019) 15.715 9.368 ( -1.249 -1.383 19.005) 19.096 9.411 ( 1.076 -3.831 10.011) 10.773 9.977 ( 0.815 1.566 17.458) 17.547 10.662 ( 8.214 5.638 14.637) 17.706 11.129 ( 6.071 -4.532 17.879) 19.418 11.436 ( -6.131 3.850 8.404) 11.092 11.873 ( -2.234 -3.625 -8.148) 9.193 12.210 ( -4.675 -0.988 8.473) 9.727 12.358 ( -0.491 2.615 5.443) 6.059 12.616 ( -1.111 3.492 0.864) 3.764 13.001 ( 0.173 -3.605 -1.346) 3.852 13.968 ( 2.577 2.361 -3.759) 5.133 14.174 ( 6.513 -1.765 -9.747) 11.855 15.253 ( -0.235 -1.297 14.105) 14.166 15.665 ( -5.108 0.697 10.672) 11.853 21.497 ( 6.858 0.265 14.210) 15.781 21.706 ( 4.288 -0.069 16.552) 17.098 ======================= Grid point 401 (175/343) ======================= q-point: (-0.31 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.933 ( 2.833 -5.117 2.173) 6.240 2.976 ( 6.621 -5.407 0.553) 8.566 3.153 ( 4.493 -2.472 1.138) 5.253 3.279 ( 4.032 -2.400 0.950) 4.787 3.419 ( 4.627 4.366 -0.215) 6.365 3.466 ( 10.235 0.690 1.376) 10.350 3.641 ( 1.075 3.852 2.667) 4.807 3.687 ( 1.261 3.382 1.585) 3.942 3.888 ( 3.272 3.109 0.626) 4.556 5.579 ( -6.225 -3.643 -2.360) 7.589 5.795 ( -5.099 -2.022 -5.627) 7.859 5.972 ( -8.312 2.742 -7.826) 11.741 6.207 ( -0.991 0.894 -4.285) 4.488 6.392 ( -4.398 0.155 -5.070) 6.714 6.622 ( -18.770 2.413 -11.868) 22.339 6.738 ( -12.874 0.008 -12.423) 17.891 7.122 ( 5.690 1.068 8.513) 10.295 7.678 ( -2.056 -2.193 0.615) 3.068 8.865 ( 17.118 -2.696 5.497) 18.180 9.510 ( 1.835 -0.650 8.467) 8.688 9.589 ( 1.294 -2.883 14.037) 14.388 10.145 ( 5.254 1.203 12.115) 13.260 10.708 ( 10.419 -2.071 9.611) 14.325 11.197 ( 11.375 -3.601 11.235) 16.389 11.456 ( 6.872 0.224 -3.476) 7.704 11.915 ( -8.841 -1.064 1.386) 9.012 12.267 ( 3.637 3.263 -0.939) 4.975 12.445 ( 1.818 -2.499 6.017) 6.764 12.657 ( -7.854 -0.644 0.149) 7.882 13.087 ( -3.237 7.238 5.949) 9.913 13.892 ( 0.325 0.841 -4.593) 4.681 13.963 ( 3.633 -1.284 -9.169) 9.946 15.371 ( 3.853 -2.819 8.092) 9.395 15.825 ( -1.509 1.599 5.802) 6.205 21.551 ( 9.860 -0.394 10.380) 14.322 21.811 ( 8.354 0.290 11.188) 13.966 ======================= Grid point 402 (176/343) ======================= q-point: (-0.23 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.818 ( 9.353 -4.508 -1.707) 10.522 2.880 ( 7.301 -7.763 1.187) 10.723 3.105 ( 4.294 -0.763 0.243) 4.368 3.204 ( 5.296 -4.283 -0.429) 6.825 3.340 ( 8.869 1.379 0.684) 9.002 3.361 ( 7.110 6.656 0.074) 9.740 3.620 ( 5.677 -2.189 2.010) 6.407 3.661 ( 5.946 2.879 -0.903) 6.668 3.918 ( -1.852 8.233 0.875) 8.484 5.680 ( -9.744 -2.848 1.669) 10.288 5.788 ( -4.034 -2.140 -3.188) 5.569 5.964 ( -1.040 1.673 -4.057) 4.510 6.169 ( -4.312 -0.457 -5.778) 7.224 6.376 ( -1.100 1.089 -2.596) 3.023 6.718 ( -5.204 0.234 -6.381) 8.238 6.788 ( -18.078 3.655 -5.198) 19.162 7.160 ( 2.219 2.735 3.388) 4.887 7.686 ( -1.504 -1.779 -1.249) 2.644 8.639 ( 20.898 -5.348 1.672) 21.636 9.556 ( 6.608 0.277 5.284) 8.465 9.690 ( 3.317 -0.696 6.904) 7.692 10.162 ( 11.096 0.647 6.040) 12.650 10.630 ( 12.424 -9.338 5.128) 16.366 11.089 ( 19.016 -2.568 4.827) 19.787 11.270 ( 11.681 -0.009 -3.778) 12.277 11.991 ( 1.901 -4.424 2.095) 5.251 12.152 ( 8.407 -0.710 -3.756) 9.236 12.500 ( -2.143 7.932 3.672) 8.999 12.826 ( -11.631 -4.746 3.629) 13.076 13.188 ( -1.223 8.497 -1.571) 8.727 13.820 ( 1.855 -1.632 -3.995) 4.698 13.919 ( -10.232 3.757 -2.080) 11.096 15.354 ( 7.405 -4.700 3.141) 9.316 15.882 ( 1.829 2.534 2.220) 3.834 21.503 ( 12.772 -0.866 5.450) 13.913 21.773 ( 14.219 0.392 5.404) 15.216 ======================= Grid point 403 (177/343) ======================= q-point: (-0.15 0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 12.542 -4.371 0.000) 13.282 2.756 ( 8.267 -5.319 0.000) 9.831 3.002 ( 10.797 -0.663 0.000) 10.817 3.101 ( 6.863 -3.059 0.000) 7.514 3.272 ( 6.676 6.553 -0.000) 9.354 3.296 ( 2.286 1.556 -0.000) 2.766 3.540 ( 6.902 -2.514 0.000) 7.346 3.558 ( 7.350 -0.251 0.000) 7.354 3.970 ( 0.374 7.497 -0.000) 7.507 5.752 ( 0.932 0.329 -0.000) 0.988 5.849 ( -5.046 -0.363 0.000) 5.059 5.923 ( 0.430 -3.070 0.000) 3.100 6.198 ( -6.694 0.722 -0.000) 6.733 6.373 ( -0.403 2.095 -0.000) 2.134 6.675 ( 3.509 -0.445 0.000) 3.537 7.017 ( -17.653 3.732 -0.000) 18.043 7.153 ( 4.406 4.192 -0.000) 6.081 7.706 ( -5.378 -2.455 0.000) 5.912 8.316 ( 24.625 -6.169 0.000) 25.386 9.444 ( 14.680 -1.116 0.000) 14.722 9.695 ( 4.682 5.275 -0.000) 7.053 10.006 ( 18.060 0.086 0.000) 18.061 10.442 ( 14.524 -14.623 0.000) 20.610 10.805 ( 25.417 -1.756 0.000) 25.477 11.061 ( 14.740 0.656 -0.000) 14.755 11.898 ( 10.405 -6.214 0.000) 12.119 11.968 ( 13.035 -0.392 0.000) 13.041 12.638 ( -7.300 10.868 -0.000) 13.092 12.987 ( -10.521 -8.177 0.000) 13.325 13.198 ( -2.339 5.610 -0.000) 6.078 13.767 ( 1.187 -1.637 0.000) 2.022 14.141 ( -18.619 8.804 -0.000) 20.595 15.237 ( 9.262 -6.975 0.000) 11.595 15.865 ( 4.018 3.264 -0.000) 5.177 21.344 ( 15.518 -0.968 0.000) 15.548 21.569 ( 21.473 0.128 0.000) 21.474 ======================= Grid point 408 (178/343) ======================= q-point: ( 0.23 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.721 ( -0.316 -0.000 9.231) 9.236 2.842 ( -1.947 -0.000 6.629) 6.909 2.918 ( 7.029 0.000 8.091) 10.718 2.963 ( 6.765 0.000 5.733) 8.868 3.153 ( 1.902 0.000 2.551) 3.182 3.303 ( 1.066 -0.000 4.235) 4.367 3.377 ( 10.542 0.000 5.264) 11.783 3.612 ( -9.672 -0.000 0.147) 9.673 3.698 ( -4.982 -0.000 -1.778) 5.290 5.829 ( 5.669 0.000 6.700) 8.776 5.968 ( -1.055 -0.000 8.856) 8.919 6.064 ( -5.118 -0.000 -1.361) 5.295 6.267 ( 3.001 0.000 3.179) 4.372 6.630 ( 14.357 0.000 -5.614) 15.416 7.129 ( 14.459 0.000 2.322) 14.644 7.332 ( -6.540 -0.000 15.917) 17.208 7.626 ( 8.721 0.000 -7.803) 11.702 8.227 ( 18.466 0.000 -6.508) 19.579 8.236 ( 10.149 0.000 7.824) 12.815 8.640 ( 6.335 0.000 2.138) 6.686 8.816 ( -2.858 -0.000 14.554) 14.832 9.094 ( 1.418 -0.000 5.589) 5.766 9.517 ( 2.490 -0.000 10.382) 10.677 9.786 ( -3.592 -0.000 21.528) 21.825 10.888 ( 8.866 0.000 16.884) 19.070 11.434 ( 17.627 0.000 18.426) 25.499 11.903 ( 13.312 0.000 13.259) 18.788 12.448 ( -4.687 -0.000 -7.353) 8.719 12.836 ( -2.470 0.000 -10.476) 10.764 13.856 ( -3.203 0.000 -17.449) 17.741 13.971 ( 6.950 0.000 -0.836) 7.000 14.550 ( 4.389 0.000 -2.587) 5.094 14.647 ( 8.393 0.000 12.065) 14.697 15.296 ( 2.650 0.000 3.921) 4.733 20.508 ( -1.209 -0.000 9.765) 9.839 20.554 ( 5.087 -0.000 17.803) 18.515 ======================= Grid point 412 (179/343) ======================= q-point: ( 0.54 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.830 ( -0.000 4.210 7.207) 8.347 3.128 ( 0.000 -1.943 2.922) 3.509 3.214 ( -0.000 2.126 3.602) 4.182 3.374 ( 0.000 5.371 3.023) 6.163 3.453 ( -0.000 -9.708 5.452) 11.135 3.577 ( 0.000 -3.269 2.603) 4.179 3.667 ( 0.000 4.844 4.168) 6.390 3.739 ( 0.000 -4.652 1.493) 4.886 3.974 ( -0.000 3.523 -0.950) 3.649 5.562 ( 0.000 6.536 -12.354) 13.977 5.772 ( -0.000 -3.243 -4.025) 5.168 5.828 ( -0.000 -10.176 -9.844) 14.158 6.131 ( 0.000 -0.534 -5.972) 5.995 6.228 ( -0.000 14.311 -3.250) 14.676 6.440 ( 0.000 -5.384 -11.800) 12.971 6.492 ( 0.000 -0.718 -11.230) 11.253 7.189 ( -0.000 1.325 4.380) 4.576 7.619 ( -0.000 -5.204 7.316) 8.978 9.140 ( 0.000 -1.271 11.637) 11.706 9.331 ( -0.000 0.568 20.717) 20.724 9.471 ( -0.000 -2.596 9.488) 9.837 9.959 ( -0.000 1.423 18.204) 18.259 10.724 ( 0.000 10.746 14.713) 18.219 11.223 ( 0.000 0.227 11.414) 11.416 11.276 ( -0.000 -2.538 19.686) 19.849 11.891 ( -0.000 -3.400 -12.307) 12.768 12.090 ( -0.000 -0.280 8.858) 8.863 12.369 ( 0.000 -0.951 5.603) 5.683 12.592 ( 0.000 3.976 7.291) 8.305 13.057 ( -0.000 -4.176 -5.055) 6.557 14.000 ( 0.000 1.973 -3.450) 3.974 14.309 ( 0.000 -1.423 -11.370) 11.459 15.243 ( 0.000 0.060 17.193) 17.193 15.569 ( -0.000 0.033 14.445) 14.445 21.589 ( 0.000 0.439 14.352) 14.359 21.761 ( 0.000 -0.217 16.911) 16.912 ======================= Grid point 413 (180/343) ======================= q-point: ( 0.62 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.938 ( -1.415 3.007 4.677) 5.738 3.123 ( 1.987 -4.315 0.281) 4.758 3.279 ( -0.451 2.193 2.978) 3.726 3.410 ( 4.110 0.568 3.387) 5.356 3.456 ( 2.537 -2.429 2.672) 4.414 3.577 ( -0.141 -2.679 -0.397) 2.712 3.687 ( 5.664 3.864 2.556) 7.318 3.755 ( 1.038 -2.539 3.168) 4.191 3.963 ( 1.541 2.413 -0.666) 2.940 5.471 ( -3.178 5.981 -7.193) 9.879 5.659 ( -5.095 -8.684 -10.230) 14.353 5.755 ( -2.184 -2.441 -3.501) 4.794 6.074 ( -11.613 -0.518 -12.033) 16.731 6.224 ( 2.550 10.744 -2.227) 11.265 6.359 ( -6.144 -3.083 -5.232) 8.638 6.390 ( -6.660 -1.486 -9.356) 11.580 7.247 ( 2.383 2.108 5.508) 6.361 7.681 ( 0.266 -4.299 4.254) 6.054 9.226 ( 7.583 -0.751 8.604) 11.493 9.529 ( -0.629 -2.978 7.326) 7.933 9.633 ( 1.001 0.200 16.402) 16.434 10.181 ( -0.254 1.495 13.018) 13.106 10.890 ( 4.285 7.153 9.396) 12.563 11.374 ( -0.963 -1.685 8.385) 8.607 11.489 ( -1.621 -1.086 11.138) 11.307 11.720 ( -1.610 -1.986 -10.624) 10.928 12.232 ( -5.604 -0.021 6.145) 8.317 12.389 ( 0.663 0.542 -1.087) 1.384 12.677 ( 2.483 -2.733 5.936) 6.991 13.073 ( 1.887 3.069 8.625) 9.347 13.931 ( 1.661 0.425 -5.581) 5.839 14.115 ( 4.315 -1.103 -10.972) 11.841 15.438 ( 0.738 -0.211 11.608) 11.633 15.753 ( -2.161 0.175 9.440) 9.686 21.735 ( 3.490 0.162 10.397) 10.969 21.941 ( 2.059 -0.040 11.689) 11.869 ======================= Grid point 414 (181/343) ======================= q-point: (-0.31 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.003 ( 0.036 -1.182 2.462) 2.732 3.059 ( 4.338 -4.558 -0.569) 6.318 3.273 ( 5.893 -4.270 1.213) 7.378 3.359 ( 4.289 -6.001 1.158) 7.467 3.457 ( 3.822 7.460 0.600) 8.404 3.578 ( 0.796 2.808 -0.010) 2.918 3.634 ( 5.957 6.458 1.081) 8.852 3.760 ( 2.364 -2.751 2.068) 4.176 3.931 ( 3.343 1.901 -0.175) 3.850 5.492 ( -5.955 -3.481 -0.101) 6.898 5.618 ( -9.263 0.712 -7.751) 12.099 5.751 ( -5.543 -0.613 -3.648) 6.664 6.119 ( -12.798 0.201 -7.637) 14.905 6.215 ( -2.563 1.246 -0.610) 2.914 6.371 ( -6.724 -1.340 -3.547) 7.720 6.428 ( -10.743 3.123 -4.777) 12.165 7.280 ( 4.174 2.894 4.130) 6.546 7.695 ( 0.811 -3.149 1.237) 3.479 9.155 ( 14.542 -1.480 3.787) 15.100 9.596 ( -0.083 -0.275 3.564) 3.576 9.799 ( 1.677 -3.583 10.022) 10.774 10.313 ( 1.656 1.244 6.570) 6.889 10.918 ( 6.433 -0.072 3.934) 7.541 11.410 ( 4.759 -0.962 1.564) 5.101 11.534 ( 6.762 -2.180 1.967) 7.372 11.762 ( -13.365 1.388 0.372) 13.442 12.297 ( 3.465 1.024 -1.183) 3.802 12.454 ( -11.746 -1.030 2.333) 12.020 12.662 ( 6.733 -2.643 2.901) 7.793 13.190 ( 4.660 8.318 9.288) 13.311 13.810 ( 0.965 -1.781 -7.950) 8.204 13.936 ( 4.526 -0.772 -4.661) 6.543 15.522 ( 3.454 -1.121 5.240) 6.375 15.870 ( -1.287 0.708 4.017) 4.277 21.774 ( 6.739 -0.235 5.527) 8.719 22.016 ( 4.844 0.224 5.962) 7.685 ======================= Grid point 415 (182/343) ======================= q-point: (-0.23 0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.944 ( 7.556 -5.108 0.000) 9.121 2.998 ( 3.625 -6.284 0.000) 7.254 3.171 ( 5.857 -2.998 0.000) 6.580 3.286 ( 4.267 -6.333 0.000) 7.637 3.420 ( 6.255 9.066 -0.000) 11.014 3.485 ( 10.462 0.865 -0.000) 10.498 3.666 ( 0.241 10.424 -0.000) 10.427 3.721 ( 3.751 -3.805 0.000) 5.343 3.897 ( 2.060 3.912 -0.000) 4.421 5.580 ( -9.305 -7.801 0.000) 12.143 5.692 ( -7.129 1.747 -0.000) 7.340 5.821 ( -8.573 3.585 -0.000) 9.292 6.140 ( 1.054 -0.173 0.000) 1.068 6.307 ( -8.579 -4.531 0.000) 9.702 6.478 ( -13.510 5.259 -0.000) 14.498 6.562 ( -12.412 1.753 -0.000) 12.535 7.251 ( 6.185 3.146 -0.000) 6.939 7.682 ( 0.365 -2.163 0.000) 2.193 8.940 ( 18.769 -3.588 0.000) 19.109 9.624 ( 0.598 1.673 -0.000) 1.776 9.812 ( 4.083 -4.536 0.000) 6.103 10.314 ( 5.596 0.825 -0.000) 5.656 10.831 ( 8.480 -6.518 0.000) 10.695 11.318 ( 9.730 -0.097 0.000) 9.731 11.413 ( 11.458 -2.481 0.000) 11.724 11.950 ( -10.827 -0.039 -0.000) 10.827 12.222 ( 6.027 1.152 -0.000) 6.136 12.551 ( 6.230 -0.554 0.000) 6.254 12.676 ( -13.368 0.317 -0.000) 13.372 13.205 ( 6.288 9.152 -0.000) 11.104 13.764 ( -4.238 -0.847 0.000) 4.321 13.855 ( 2.679 -0.923 0.000) 2.833 15.483 ( 6.033 -2.654 0.000) 6.591 15.905 ( 0.308 1.565 -0.000) 1.595 21.698 ( 9.884 -0.620 0.000) 9.904 21.966 ( 8.927 0.412 -0.000) 8.937 ======================= Grid point 421 (183/343) ======================= q-point: ( 0.23 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( -4.580 2.238 3.314) 6.080 2.882 ( -2.932 -1.691 4.415) 5.563 3.060 ( 2.124 4.380 1.113) 4.994 3.090 ( 1.033 -3.599 0.809) 3.830 3.231 ( 5.802 1.265 4.325) 7.347 3.359 ( -0.526 -0.284 3.080) 3.137 3.453 ( -3.955 -1.050 -1.480) 4.352 3.500 ( -7.435 0.082 0.926) 7.493 3.683 ( 5.684 -1.374 -0.176) 5.850 5.913 ( -3.759 0.761 -1.361) 4.070 5.953 ( 2.169 0.746 3.352) 4.062 6.121 ( -2.224 -0.143 7.256) 7.591 6.319 ( 1.274 -1.565 0.167) 2.025 6.639 ( 8.391 0.153 -14.534) 16.783 7.273 ( 8.745 0.119 -4.586) 9.876 7.438 ( -8.493 -0.403 14.005) 16.384 7.598 ( 4.820 0.618 -8.245) 9.571 8.358 ( 15.209 1.304 -7.904) 17.190 8.458 ( 11.065 -0.537 1.275) 11.151 8.719 ( 1.219 0.531 2.429) 2.769 8.971 ( -3.266 0.198 13.675) 14.061 9.183 ( -1.912 -0.317 7.958) 8.190 9.630 ( -3.781 -0.869 7.202) 8.180 9.952 ( -11.793 0.039 17.853) 21.396 11.153 ( 1.400 0.185 10.480) 10.575 11.866 ( 12.978 -0.292 13.765) 18.921 12.108 ( -2.444 -0.349 -1.197) 2.744 12.390 ( 5.138 2.444 4.100) 7.013 12.735 ( 3.948 -3.300 -4.597) 6.900 13.559 ( -4.490 2.471 -15.812) 16.622 14.045 ( 6.874 -1.796 -2.943) 7.690 14.563 ( 7.115 0.556 -7.270) 10.187 14.888 ( 3.121 0.310 11.256) 11.685 15.375 ( -3.339 0.022 6.754) 7.535 20.602 ( -3.686 -0.109 9.087) 9.806 20.777 ( -2.196 0.001 12.151) 12.348 ======================= Grid point 422 (184/343) ======================= q-point: ( 0.31 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.888 ( -7.448 -0.000 4.279) 8.590 2.996 ( -2.204 -0.000 4.348) 4.875 3.056 ( 1.173 0.000 1.957) 2.282 3.080 ( -0.699 -0.000 0.889) 1.131 3.228 ( 4.329 0.000 5.351) 6.883 3.402 ( 1.219 0.000 0.929) 1.533 3.444 ( 1.382 0.000 2.981) 3.285 3.638 ( -9.331 -0.000 1.482) 9.448 3.665 ( -4.226 -0.000 -1.444) 4.466 5.885 ( 0.424 0.000 -5.027) 5.045 5.963 ( 2.982 0.000 2.726) 4.040 6.233 ( 5.992 0.000 -7.071) 9.269 6.328 ( -6.924 -0.000 10.458) 12.542 6.432 ( 0.238 0.000 -4.721) 4.727 7.056 ( 9.894 0.000 -9.377) 13.631 7.384 ( 8.632 0.000 -6.941) 11.076 7.500 ( 10.124 0.000 -9.076) 13.596 8.067 ( 19.858 0.000 -12.665) 23.553 8.282 ( -3.133 -0.000 13.247) 13.613 9.021 ( -8.837 -0.000 17.352) 19.473 9.107 ( 2.023 -0.000 7.260) 7.537 9.369 ( -3.599 -0.000 14.972) 15.398 9.879 ( -7.004 -0.000 17.648) 18.987 10.382 ( -11.200 -0.000 20.850) 23.668 11.286 ( 2.375 -0.000 11.031) 11.284 11.900 ( 8.812 0.000 13.723) 16.309 12.134 ( -1.602 -0.000 0.862) 1.819 12.385 ( 5.814 0.000 5.454) 7.972 12.595 ( 4.984 0.000 -5.416) 7.360 13.376 ( -1.604 0.000 -16.813) 16.889 13.941 ( 3.321 0.000 -1.175) 3.523 14.374 ( 3.077 0.000 -8.882) 9.400 14.998 ( 4.631 -0.000 12.647) 13.468 15.504 ( 0.859 -0.000 8.630) 8.672 20.847 ( -7.667 -0.000 14.711) 16.589 21.047 ( -5.970 -0.000 18.028) 18.991 ======================= Grid point 426 (185/343) ======================= q-point: ( 0.62 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.962 ( -0.000 3.899 2.490) 4.626 3.160 ( 0.000 -5.152 0.405) 5.168 3.294 ( -0.000 2.937 1.534) 3.313 3.448 ( 0.000 6.968 2.132) 7.287 3.554 ( -0.000 -8.869 1.912) 9.072 3.572 ( 0.000 -4.753 -1.435) 4.965 3.744 ( 0.000 3.718 1.451) 3.991 3.806 ( 0.000 -1.796 2.038) 2.717 3.953 ( -0.000 2.722 -0.492) 2.766 5.320 ( 0.000 9.052 -4.767) 10.230 5.577 ( -0.000 -15.072 -4.848) 15.832 5.720 ( -0.000 -1.889 -1.805) 2.613 5.833 ( 0.000 0.168 -8.704) 8.706 6.179 ( -0.000 18.043 -0.741) 18.058 6.182 ( -0.000 -0.405 -6.669) 6.681 6.354 ( 0.000 -9.579 -0.562) 9.596 7.305 ( -0.000 2.624 2.592) 3.689 7.745 ( -0.000 -3.303 2.199) 3.969 9.381 ( 0.000 -1.100 5.003) 5.123 9.603 ( -0.000 -1.651 3.012) 3.435 9.828 ( -0.000 -0.088 10.971) 10.972 10.311 ( -0.000 1.384 6.946) 7.083 10.978 ( -0.000 6.687 3.573) 7.582 11.435 ( 0.000 0.075 4.030) 4.031 11.572 ( -0.000 -2.086 -4.863) 5.292 11.642 ( 0.000 -2.672 4.450) 5.191 12.253 ( -0.000 -0.199 3.082) 3.089 12.361 ( 0.000 -0.735 -2.923) 3.014 12.803 ( 0.000 -6.354 5.727) 8.555 13.208 ( 0.000 10.384 10.267) 14.602 13.859 ( 0.000 -3.749 -6.932) 7.881 14.016 ( -0.000 0.493 -7.048) 7.065 15.569 ( 0.000 0.084 6.301) 6.302 15.842 ( -0.000 -0.006 5.258) 5.258 21.866 ( 0.000 0.052 5.469) 5.470 22.075 ( 0.000 0.012 5.978) 5.978 ======================= Grid point 427 (186/343) ======================= q-point: (-0.31 0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.003 ( -1.229 3.039 -0.000) 3.278 3.125 ( 2.639 -5.425 0.000) 6.033 3.317 ( -0.177 1.184 -0.000) 1.197 3.470 ( 4.268 0.634 -0.000) 4.314 3.486 ( 4.032 -1.020 0.000) 4.159 3.559 ( -0.654 -2.308 0.000) 2.399 3.722 ( 5.913 3.551 -0.000) 6.897 3.807 ( 1.084 -2.031 0.000) 2.302 3.953 ( 1.082 2.022 -0.000) 2.293 5.377 ( -7.342 10.451 -0.000) 12.772 5.503 ( -2.551 -14.387 0.000) 14.612 5.694 ( -0.654 -1.170 0.000) 1.341 5.874 ( -12.340 -0.484 0.000) 12.350 6.169 ( -3.269 3.606 -0.000) 4.867 6.245 ( -2.983 9.526 -0.000) 9.983 6.338 ( -3.283 -7.448 0.000) 8.139 7.327 ( 1.116 3.208 -0.000) 3.396 7.737 ( 1.458 -3.423 0.000) 3.720 9.350 ( 8.803 -1.032 0.000) 8.863 9.620 ( -0.073 -0.761 0.000) 0.765 9.898 ( 0.632 -2.271 0.000) 2.357 10.363 ( 0.138 1.442 -0.000) 1.449 10.999 ( 3.072 4.105 -0.000) 5.128 11.454 ( 1.894 0.839 -0.000) 2.071 11.588 ( -7.369 0.028 -0.000) 7.369 11.648 ( 1.423 -4.118 0.000) 4.356 12.314 ( -1.633 1.183 -0.000) 2.016 12.336 ( -4.170 -1.442 0.000) 4.412 12.791 ( 4.598 -5.541 0.000) 7.200 13.306 ( 4.754 12.611 -0.000) 13.477 13.766 ( 0.663 -6.300 0.000) 6.335 13.953 ( 2.740 0.542 -0.000) 2.793 15.599 ( 1.867 -0.173 0.000) 1.875 15.884 ( -0.791 0.149 -0.000) 0.805 21.881 ( 3.366 -0.071 0.000) 3.367 22.102 ( 2.107 0.106 -0.000) 2.110 ======================= Grid point 434 (187/343) ======================= q-point: ( 0.23 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( -7.683 0.626 0.314) 7.715 2.896 ( -1.829 0.026 1.792) 2.561 2.994 ( -3.500 1.311 -5.890) 6.976 3.044 ( -4.202 -1.742 -5.334) 7.010 3.288 ( -5.482 3.937 -1.511) 6.916 3.378 ( -0.457 -2.022 1.769) 2.725 3.394 ( -2.906 -0.820 2.513) 3.928 3.469 ( 0.755 1.246 3.536) 3.824 3.759 ( 5.564 -2.315 -2.783) 6.639 5.880 ( -1.495 1.883 1.484) 2.826 5.968 ( -2.790 0.934 0.030) 2.943 6.147 ( -3.936 -0.565 2.978) 4.968 6.306 ( -2.411 -1.870 -3.236) 4.448 6.516 ( 7.879 -0.615 -17.516) 19.216 7.256 ( 3.940 -0.872 -9.940) 10.728 7.471 ( -8.212 -1.249 6.929) 10.817 7.535 ( 0.805 -0.056 -6.868) 6.916 8.383 ( 5.530 2.634 -9.575) 11.367 8.543 ( 7.368 0.786 -7.068) 10.240 8.736 ( -5.146 -0.041 3.467) 6.205 9.078 ( -4.293 1.133 9.312) 10.316 9.256 ( -5.369 -0.564 9.549) 10.970 9.625 ( -9.463 -0.389 5.718) 11.063 9.950 ( -18.692 -0.430 12.779) 22.647 11.175 ( -9.462 0.358 0.889) 9.510 11.930 ( -10.961 0.844 -6.822) 12.938 12.165 ( 8.748 -0.542 9.701) 13.074 12.479 ( -0.909 7.601 -0.009) 7.655 12.856 ( 9.947 -4.828 3.392) 11.565 13.368 ( 1.688 -2.550 -5.765) 6.526 14.087 ( 5.778 -1.552 -4.202) 7.311 14.529 ( 6.760 0.701 -11.602) 13.446 15.025 ( -2.203 3.531 9.090) 9.998 15.375 ( -9.858 -2.675 6.104) 11.899 20.650 ( -6.560 0.453 8.077) 10.415 20.821 ( -10.658 -0.225 7.043) 12.777 ======================= Grid point 435 (188/343) ======================= q-point: ( 0.31 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( -8.696 1.243 1.957) 9.000 2.977 ( -5.724 0.183 1.079) 5.828 2.993 ( -5.651 1.262 -3.063) 6.551 3.040 ( -4.692 -1.488 -2.509) 5.525 3.346 ( 0.501 6.401 1.717) 6.647 3.396 ( -2.703 -5.878 0.246) 6.474 3.477 ( -1.831 -0.416 2.768) 3.345 3.548 ( -4.643 5.161 1.798) 7.171 3.637 ( 2.379 -6.384 -2.158) 7.146 5.873 ( 3.771 1.707 -0.623) 4.186 5.993 ( -0.686 -0.428 -0.690) 1.063 6.189 ( 5.599 -0.373 -12.997) 14.156 6.308 ( -7.764 4.117 1.987) 9.010 6.344 ( -7.636 -5.134 1.101) 9.267 7.022 ( 7.273 -0.712 -11.871) 13.940 7.376 ( 4.882 0.382 -8.580) 9.879 7.474 ( 6.898 -0.870 -11.356) 13.316 8.132 ( 17.151 0.907 -14.422) 22.427 8.361 ( -6.317 1.272 6.032) 8.826 9.102 ( -12.626 0.110 15.511) 20.001 9.192 ( -2.626 0.616 5.631) 6.243 9.492 ( -7.663 -0.426 13.975) 15.944 9.974 ( -13.799 -0.141 17.538) 22.316 10.411 ( -19.937 0.121 14.877) 24.876 11.323 ( -8.891 0.347 1.159) 8.973 12.006 ( -9.715 1.292 -3.398) 10.373 12.154 ( 9.373 -0.962 6.917) 11.689 12.518 ( 0.448 6.938 1.511) 7.114 12.730 ( 11.737 -6.072 3.881) 13.772 13.214 ( 5.815 -1.163 -7.933) 9.904 13.966 ( 4.161 -0.904 -2.522) 4.949 14.282 ( 4.424 0.361 -12.205) 12.987 15.172 ( -0.044 1.657 8.995) 9.147 15.571 ( -6.211 -1.105 6.543) 9.089 20.916 ( -10.214 0.200 13.043) 16.567 21.129 ( -13.214 -0.106 13.078) 18.591 ======================= Grid point 436 (189/343) ======================= q-point: ( 0.38 -0.46 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.970 ( -8.680 0.000 1.662) 8.838 3.052 ( -2.995 -0.000 0.889) 3.124 3.057 ( -8.482 0.000 -0.797) 8.519 3.126 ( -6.051 -0.000 2.706) 6.629 3.366 ( 3.218 -0.000 3.616) 4.840 3.389 ( 1.287 0.000 -0.652) 1.443 3.499 ( -4.278 -0.000 -1.983) 4.715 3.642 ( -4.446 -0.000 1.759) 4.782 3.678 ( -7.609 0.000 1.385) 7.734 5.789 ( 6.756 -0.000 -1.573) 6.937 5.969 ( 3.163 -0.000 -8.501) 9.071 5.976 ( 0.945 -0.000 -2.562) 2.731 6.380 ( -4.804 -0.000 -0.889) 4.886 6.417 ( 4.187 0.000 -6.810) 7.994 6.856 ( -3.716 -0.000 -1.632) 4.059 7.081 ( 17.647 0.000 -17.368) 24.760 7.148 ( 10.848 -0.000 -9.839) 14.645 7.810 ( 8.976 -0.000 -5.270) 10.409 8.617 ( -13.320 -0.000 8.143) 15.612 9.369 ( -4.401 0.000 12.943) 13.671 9.385 ( -4.683 -0.000 9.688) 10.761 9.833 ( -9.375 -0.000 16.641) 19.100 10.390 ( -10.217 -0.000 18.264) 20.927 10.873 ( -17.778 -0.000 14.984) 23.250 11.424 ( -5.781 -0.000 -1.443) 5.958 12.079 ( 10.065 0.000 1.587) 10.190 12.109 ( -8.503 -0.000 -0.360) 8.511 12.557 ( 1.420 -0.000 3.564) 3.836 12.646 ( 8.181 -0.000 7.401) 11.032 13.009 ( 6.368 -0.000 -8.757) 10.827 13.901 ( 1.156 -0.000 -1.761) 2.107 14.099 ( -0.421 -0.000 -10.838) 10.846 15.292 ( -0.104 -0.000 8.657) 8.658 15.707 ( -1.953 -0.000 6.082) 6.388 21.249 ( -10.995 -0.000 13.711) 17.575 21.492 ( -11.945 -0.000 14.019) 18.418 ======================= Grid point 448 (190/343) ======================= q-point: ( 0.23 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.532 ( -12.585 -1.436 -3.049) 13.028 2.808 ( -7.373 2.079 -10.046) 12.634 2.852 ( -4.829 -0.257 -5.472) 7.303 2.913 ( -2.962 -1.622 -2.628) 4.279 3.123 ( -9.499 0.956 -5.386) 10.962 3.371 ( -3.102 2.028 1.564) 4.023 3.400 ( -0.281 -1.685 0.328) 1.740 3.563 ( 5.172 1.999 2.569) 6.111 3.760 ( -0.134 -1.180 -3.481) 3.678 5.822 ( -9.056 2.993 -0.891) 9.579 5.894 ( -5.631 -1.022 -2.244) 6.147 6.125 ( -2.575 2.047 -5.854) 6.715 6.173 ( -0.551 -1.529 -4.489) 4.774 6.435 ( 6.613 -3.037 -10.473) 12.753 7.119 ( -3.420 -2.749 -12.799) 13.530 7.410 ( -6.954 -1.166 -0.906) 7.109 7.450 ( -1.003 -2.375 -4.836) 5.480 8.204 ( -6.226 2.725 -14.512) 16.025 8.483 ( -2.664 1.811 -5.310) 6.211 8.653 ( -7.680 -0.470 -2.846) 8.204 9.074 ( -6.601 1.792 0.542) 6.861 9.281 ( -10.198 -0.771 7.815) 12.871 9.556 ( -13.503 2.023 8.574) 16.123 9.819 ( -21.233 -1.133 8.742) 22.990 10.950 ( -17.343 0.360 -5.413) 18.172 11.646 ( -16.580 1.344 -7.115) 18.092 12.240 ( -13.608 11.290 -10.239) 20.432 12.415 ( 6.626 -2.711 8.224) 10.904 13.060 ( 9.771 2.022 5.452) 11.370 13.473 ( 8.306 -10.296 2.908) 13.544 14.113 ( 4.893 -0.868 -2.839) 5.723 14.431 ( 4.980 -0.158 -13.689) 14.568 15.057 ( -6.184 9.409 7.986) 13.804 15.325 ( -11.376 -8.338 6.771) 15.645 20.625 ( -11.119 1.562 5.429) 12.472 20.681 ( -19.011 -0.640 2.251) 19.155 ======================= Grid point 449 (191/343) ======================= q-point: ( 0.31 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.683 ( -12.813 0.333 -0.490) 12.826 2.806 ( -8.239 4.651 -6.680) 11.582 2.883 ( -9.310 -3.562 -3.739) 10.646 2.945 ( -5.563 -1.087 0.007) 5.668 3.203 ( -10.626 2.627 -4.620) 11.882 3.395 ( -2.088 -1.756 -0.373) 2.753 3.477 ( -3.943 0.674 2.791) 4.877 3.539 ( 3.463 8.404 0.265) 9.094 3.689 ( 2.346 -9.928 -0.745) 10.228 5.914 ( -0.573 2.656 -2.157) 3.469 5.936 ( -3.844 0.791 0.270) 3.934 6.013 ( -3.274 -0.235 -13.261) 13.662 6.223 ( -6.626 0.934 2.058) 7.001 6.289 ( -1.350 -4.716 -2.014) 5.302 6.947 ( 3.020 -1.942 -10.912) 11.488 7.277 ( 1.625 0.554 -11.058) 11.191 7.403 ( 3.793 -2.559 -10.211) 11.189 8.148 ( 13.905 1.676 -13.238) 19.272 8.225 ( -14.583 2.669 -4.220) 15.414 9.077 ( -20.588 -0.209 13.482) 24.610 9.166 ( -9.403 0.811 2.124) 9.674 9.531 ( -11.284 -0.982 9.439) 14.744 9.995 ( -17.675 1.999 17.962) 25.279 10.264 ( -24.894 -0.167 9.706) 26.720 11.113 ( -15.945 0.944 -5.323) 16.837 11.795 ( -14.349 1.225 -2.817) 14.674 12.314 ( -7.315 10.858 -6.477) 14.607 12.403 ( 4.836 -3.450 3.622) 6.958 12.969 ( 11.932 -2.590 3.847) 12.801 13.333 ( 12.156 -4.741 1.259) 13.108 14.005 ( 5.520 -0.466 -1.798) 5.824 14.172 ( 5.219 -1.488 -12.369) 13.507 15.240 ( -2.611 5.587 6.339) 8.844 15.539 ( -10.629 -4.437 5.200) 12.638 20.909 ( -13.763 0.877 9.842) 16.943 21.038 ( -21.650 -0.313 8.058) 23.104 ======================= Grid point 450 (192/343) ======================= q-point: ( 0.38 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.852 ( -10.710 1.727 0.390) 10.855 2.892 ( -10.992 4.319 -2.182) 12.010 2.967 ( -9.802 -5.192 -0.583) 11.107 3.052 ( -8.503 0.280 1.076) 8.576 3.294 ( -9.941 2.601 -4.003) 11.027 3.410 ( -0.598 -0.124 -0.034) 0.612 3.469 ( 4.085 1.654 -1.940) 4.816 3.608 ( -4.720 2.518 2.660) 5.974 3.650 ( -1.630 -7.676 1.741) 8.038 5.858 ( 0.219 2.443 -6.613) 7.053 5.907 ( 6.017 0.090 0.635) 6.051 5.940 ( -0.998 -2.046 -3.211) 3.936 6.288 ( -4.790 1.803 -1.064) 5.227 6.353 ( -3.212 -2.414 -4.401) 5.959 6.779 ( 0.580 -0.168 -5.157) 5.192 7.095 ( 13.632 0.349 -12.153) 18.266 7.127 ( 2.750 -1.682 -7.967) 8.594 7.851 ( 9.483 0.706 -6.174) 11.338 8.456 ( -19.253 1.297 0.774) 19.313 9.394 ( -12.060 2.537 7.993) 14.689 9.424 ( -9.243 -2.739 7.966) 12.505 9.861 ( -14.926 -0.007 11.338) 18.744 10.460 ( -13.855 1.318 16.880) 21.878 10.736 ( -25.426 0.329 8.960) 26.961 11.225 ( -12.544 0.671 -7.429) 14.594 11.960 ( -12.177 0.809 -0.298) 12.208 12.275 ( 11.932 1.391 2.470) 12.264 12.429 ( -10.894 3.248 -5.578) 12.663 12.857 ( 9.203 -4.142 3.935) 10.832 13.146 ( 15.704 -1.400 0.833) 15.788 13.918 ( 4.129 0.458 -1.419) 4.390 13.966 ( 2.346 -1.410 -9.367) 9.758 15.357 ( -2.405 1.922 4.572) 5.511 15.709 ( -7.181 -1.370 3.569) 8.135 21.239 ( -13.993 0.356 9.512) 16.924 21.437 ( -19.154 -0.150 8.717) 21.045 ======================= Grid point 451 (193/343) ======================= q-point: ( 0.46 -0.38 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.981 ( -8.084 0.000 -0.206) 8.086 3.061 ( -12.956 -0.000 0.474) 12.965 3.095 ( -8.204 0.000 2.155) 8.482 3.169 ( -5.141 -0.000 0.176) 5.144 3.360 ( -2.884 -0.000 -1.831) 3.416 3.413 ( -4.855 -0.000 -1.725) 5.152 3.420 ( 0.644 0.000 0.717) 0.964 3.708 ( -5.815 -0.000 0.675) 5.854 3.709 ( -4.486 0.000 1.689) 4.793 5.785 ( 1.263 -0.000 -3.581) 3.797 5.808 ( 11.906 -0.000 2.328) 12.132 5.913 ( -1.214 -0.000 -2.115) 2.438 6.160 ( 11.371 -0.000 -7.910) 13.851 6.361 ( -5.646 -0.000 -0.418) 5.661 6.722 ( 4.014 0.000 -5.959) 7.185 6.722 ( 19.508 -0.000 -7.325) 20.838 7.086 ( -3.599 -0.000 2.176) 4.206 7.730 ( 2.157 -0.000 -1.360) 2.550 8.739 ( -18.649 -0.000 1.857) 18.741 9.559 ( -3.007 -0.000 3.205) 4.394 9.688 ( -11.497 -0.000 7.670) 13.821 10.163 ( -10.135 -0.000 6.569) 12.078 10.802 ( -7.050 -0.000 11.010) 13.073 11.170 ( -21.802 -0.000 6.242) 22.678 11.265 ( -9.394 -0.000 -7.551) 12.052 12.113 ( -9.871 0.000 0.039) 9.871 12.116 ( 14.573 -0.000 1.063) 14.611 12.546 ( -12.685 -0.000 -1.705) 12.799 12.818 ( 2.898 -0.000 3.702) 4.701 12.927 ( 16.806 -0.000 0.283) 16.808 13.850 ( -0.915 -0.000 -5.903) 5.973 13.858 ( 2.361 -0.000 -1.081) 2.597 15.453 ( -3.554 -0.000 3.032) 4.672 15.823 ( -4.144 -0.000 2.258) 4.719 21.523 ( -12.145 -0.000 5.583) 13.367 21.763 ( -14.244 -0.000 5.356) 15.218 ======================= Grid point 462 (194/343) ======================= q-point: ( 0.23 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.272 ( -17.089 -2.399 -6.748) 18.528 2.525 ( -10.025 2.438 -12.661) 16.332 2.655 ( -9.668 -1.530 -8.442) 12.926 2.823 ( -6.775 -1.442 -7.230) 10.012 2.929 ( -4.657 0.116 -3.758) 5.985 3.323 ( -4.981 3.019 0.921) 5.897 3.394 ( -1.162 -0.154 -2.079) 2.386 3.621 ( 1.936 4.381 -3.093) 5.702 3.704 ( -1.300 -1.849 0.845) 2.413 5.607 ( -13.615 2.116 -5.464) 14.822 5.755 ( -8.333 -0.668 -3.847) 9.202 5.871 ( -5.612 -0.329 -16.140) 17.091 6.227 ( 1.302 0.960 2.247) 2.769 6.395 ( 1.784 -4.982 -7.487) 9.168 6.832 ( -10.101 -4.968 -16.050) 19.604 7.269 ( -12.140 -1.698 -2.240) 12.462 7.435 ( 5.757 -2.427 -2.530) 6.740 7.841 ( -11.308 0.158 -18.232) 21.454 8.295 ( -24.705 0.726 4.709) 25.160 8.504 ( 3.758 0.676 -12.567) 13.134 8.884 ( -10.916 1.447 -9.370) 14.459 9.140 ( -19.182 -1.283 -0.620) 19.235 9.482 ( -17.749 3.490 11.493) 21.431 9.671 ( -17.332 -0.084 9.485) 19.758 10.592 ( -21.125 -0.260 -7.785) 22.515 11.267 ( -24.750 2.832 -7.020) 25.882 11.780 ( -21.267 8.867 -14.361) 27.150 12.632 ( 6.513 -2.798 8.047) 10.724 13.242 ( 8.238 3.882 4.689) 10.242 13.631 ( 6.016 -6.390 -0.210) 8.779 14.126 ( 3.366 4.202 -5.311) 7.562 14.348 ( 2.460 -6.272 -5.202) 8.512 15.019 ( -9.913 10.087 8.501) 16.501 15.376 ( -0.585 -10.364 10.345) 14.655 20.343 ( -28.025 0.656 -2.889) 28.181 20.501 ( -15.950 0.921 1.558) 16.053 ======================= Grid point 463 (195/343) ======================= q-point: ( 0.31 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( -18.057 0.048 -2.738) 18.263 2.550 ( -11.975 6.771 -7.814) 15.821 2.707 ( -11.621 -4.907 -3.407) 13.067 2.837 ( -8.950 -2.591 -4.951) 10.551 2.989 ( -8.950 1.297 -2.645) 9.423 3.367 ( -0.757 -1.214 -1.217) 1.879 3.434 ( -6.044 1.918 1.619) 6.544 3.555 ( 4.479 6.723 -2.295) 8.398 3.727 ( -1.428 -6.759 0.665) 6.940 5.755 ( -7.957 1.155 -8.379) 11.613 5.785 ( -11.105 1.434 -5.702) 12.566 5.822 ( -11.384 -0.437 -2.774) 11.726 6.246 ( 2.519 0.354 3.913) 4.667 6.274 ( 0.903 -5.582 -3.248) 6.521 6.759 ( -10.654 -3.783 -12.238) 16.661 7.198 ( 9.000 2.521 -8.443) 12.596 7.333 ( 0.941 -5.396 -6.223) 8.290 7.859 ( -20.971 3.078 -9.944) 23.412 8.157 ( 11.575 1.795 -9.803) 15.274 8.909 ( -29.447 -0.532 12.044) 31.819 8.979 ( -17.260 0.487 -2.251) 17.413 9.395 ( -20.495 -1.631 -0.379) 20.563 9.965 ( -20.274 4.162 16.311) 26.351 10.057 ( -21.251 0.120 8.202) 22.779 10.771 ( -19.829 0.799 -7.882) 21.353 11.531 ( -19.956 1.762 -1.118) 20.065 11.917 ( -20.350 9.909 -11.902) 25.573 12.611 ( 8.813 -3.491 5.531) 10.974 13.160 ( 10.092 -1.079 1.434) 10.250 13.508 ( 9.551 -0.575 -0.082) 9.569 13.998 ( 4.390 7.107 -7.405) 11.163 14.205 ( 8.302 -12.344 -0.226) 14.878 15.249 ( -3.469 10.916 5.470) 12.693 15.494 ( -7.575 -9.721 4.860) 13.248 20.756 ( -29.605 0.698 3.454) 29.814 20.796 ( -19.340 0.566 5.140) 20.020 ======================= Grid point 464 (196/343) ======================= q-point: ( 0.38 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( -15.066 3.118 -1.204) 15.433 2.682 ( -13.182 6.910 -1.754) 14.986 2.833 ( -12.822 -8.661 0.312) 15.476 2.917 ( -11.049 -0.739 -2.421) 11.335 3.092 ( -9.990 2.051 -2.180) 10.429 3.376 ( -3.298 -2.291 -0.651) 4.068 3.489 ( 4.593 7.583 -0.967) 8.918 3.552 ( -6.064 2.217 1.051) 6.541 3.707 ( 0.931 -9.786 0.780) 9.861 5.735 ( -4.917 0.052 -4.684) 6.791 5.826 ( -5.749 -0.172 -3.545) 6.757 5.982 ( -5.942 1.945 1.173) 6.361 6.234 ( -0.584 -1.001 -0.377) 1.219 6.276 ( -1.917 -2.614 0.180) 3.246 6.735 ( -0.710 0.164 -4.242) 4.304 7.015 ( -0.460 -0.137 -6.022) 6.041 7.146 ( 9.930 -3.277 -5.993) 12.052 7.912 ( 10.756 1.264 -4.173) 11.606 8.121 ( -26.031 2.506 -2.570) 26.278 9.235 ( -19.876 1.368 2.152) 20.039 9.360 ( -15.601 -2.831 5.743) 16.864 9.710 ( -23.284 0.138 3.324) 23.521 10.447 ( -20.769 3.960 10.565) 23.636 10.470 ( -22.762 0.618 7.904) 24.104 10.908 ( -16.652 0.685 -8.885) 18.887 11.770 ( -15.194 0.411 0.385) 15.205 12.088 ( -17.537 11.080 -6.195) 21.649 12.513 ( 11.264 -5.217 2.435) 12.650 13.026 ( 9.245 -4.345 0.578) 10.232 13.361 ( 13.348 2.032 0.454) 13.509 13.878 ( 3.552 4.251 -4.899) 7.395 14.042 ( 9.284 -9.051 0.313) 12.970 15.357 ( -1.679 5.945 2.184) 6.553 15.637 ( -9.756 -4.734 1.857) 11.001 21.117 ( -17.773 0.836 4.410) 18.331 21.206 ( -27.088 -0.121 3.587) 27.325 ======================= Grid point 465 (197/343) ======================= q-point: ( 0.46 -0.31 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.842 ( -10.732 5.468 -0.000) 12.045 2.878 ( -13.754 1.567 -0.000) 13.842 2.977 ( -11.929 -6.808 0.000) 13.735 3.055 ( -10.493 0.842 -0.000) 10.527 3.220 ( -10.353 1.968 -0.000) 10.539 3.406 ( -0.790 1.542 -0.000) 1.733 3.443 ( 3.064 0.298 -0.000) 3.078 3.648 ( -5.603 1.055 -0.000) 5.701 3.676 ( -1.076 -5.823 0.000) 5.921 5.753 ( -2.037 0.112 -0.000) 2.040 5.865 ( -3.397 0.204 -0.000) 3.403 5.977 ( 7.988 0.170 -0.000) 7.990 6.226 ( 5.383 1.872 -0.000) 5.699 6.284 ( -4.380 -2.207 0.000) 4.905 6.696 ( -0.260 0.363 -0.000) 0.446 6.917 ( 15.815 -1.066 0.000) 15.851 7.040 ( -5.206 -1.135 0.000) 5.328 7.771 ( 6.373 0.616 -0.000) 6.403 8.458 ( -23.633 1.205 -0.000) 23.664 9.510 ( -10.935 3.332 -0.000) 11.431 9.540 ( -13.931 -4.044 0.000) 14.506 10.024 ( -17.077 0.270 -0.000) 17.079 10.780 ( -10.643 2.855 -0.000) 11.019 10.868 ( -27.576 0.866 -0.000) 27.590 11.032 ( -14.167 -0.490 0.000) 14.175 11.960 ( -12.543 0.004 -0.000) 12.543 12.280 ( -1.577 13.601 -0.000) 13.692 12.365 ( 0.155 -9.648 0.000) 9.649 12.909 ( 6.118 -4.578 0.000) 7.641 13.165 ( 16.782 0.957 -0.000) 16.809 13.814 ( 1.676 0.729 -0.000) 1.828 13.914 ( 6.363 -2.382 0.000) 6.794 15.419 ( -3.351 1.917 -0.000) 3.860 15.758 ( -7.579 -1.366 0.000) 7.701 21.375 ( -15.149 0.377 -0.000) 15.154 21.561 ( -20.908 -0.138 -0.000) 20.909 ======================= Grid point 476 (198/343) ======================= q-point: ( 0.23 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -21.005 1.576 -9.352) 23.046 2.141 ( -14.768 6.448 -18.541) 24.565 2.410 ( -12.226 -6.543 -5.738) 15.007 2.598 ( -9.739 -9.778 -9.427) 16.714 2.859 ( -1.252 4.510 -2.675) 5.391 3.220 ( -16.429 10.346 -4.341) 19.894 3.244 ( -5.767 3.790 0.042) 6.902 3.573 ( 1.037 -2.881 -2.395) 3.887 3.770 ( 6.110 -0.992 0.703) 6.230 5.324 ( -12.969 -0.115 -7.881) 15.176 5.529 ( -10.880 -1.554 -11.501) 15.908 5.639 ( -3.732 2.435 -6.216) 7.649 6.110 ( -16.810 -4.789 -7.832) 19.153 6.273 ( -9.169 -5.705 -8.021) 13.452 6.579 ( 0.279 -5.023 -10.097) 11.281 7.030 ( -13.734 -1.317 -6.258) 15.150 7.484 ( -7.879 -3.571 -12.211) 14.964 7.528 ( -0.511 -0.877 4.273) 4.392 7.983 ( -28.335 -1.403 6.581) 29.123 8.435 ( 8.560 1.157 -9.126) 12.566 8.562 ( -11.544 0.514 -12.808) 17.250 8.783 ( -22.804 -3.158 -9.131) 24.767 9.310 ( -25.282 3.831 7.538) 26.659 9.594 ( -14.869 0.163 9.475) 17.632 10.199 ( -21.037 -0.975 -7.181) 22.251 10.742 ( -36.765 4.029 -7.619) 37.762 11.264 ( -22.310 3.922 -13.278) 26.257 12.821 ( 5.089 -3.772 6.314) 8.944 13.381 ( 6.967 3.447 2.801) 8.262 13.680 ( 3.207 -0.325 -2.656) 4.177 14.046 ( 3.591 10.772 -6.777) 13.224 14.368 ( -3.224 -6.693 2.674) 7.896 14.964 ( -11.066 4.631 8.665) 14.799 15.701 ( 17.375 -9.368 15.053) 24.825 19.841 ( -34.316 2.983 -6.831) 35.117 20.231 ( -22.636 -1.705 -3.051) 22.904 ======================= Grid point 477 (199/343) ======================= q-point: ( 0.31 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( -21.803 3.447 -2.343) 22.198 2.211 ( -17.999 7.886 -8.497) 21.409 2.518 ( -13.484 -4.679 -1.175) 14.321 2.612 ( -13.200 -10.161 -6.210) 17.778 2.889 ( -4.109 2.276 -0.380) 4.712 3.337 ( -3.569 1.743 -0.872) 4.066 3.350 ( -6.521 2.557 0.141) 7.006 3.539 ( 0.206 2.995 -1.889) 3.547 3.729 ( -0.271 -1.907 0.378) 1.963 5.486 ( -19.806 0.657 -2.763) 20.009 5.530 ( -11.102 -2.123 -7.013) 13.302 5.663 ( -5.903 1.552 -2.729) 6.686 6.240 ( -5.357 -6.889 -2.893) 9.194 6.264 ( -13.044 -4.088 -0.258) 13.672 6.459 ( -3.666 -4.149 -8.364) 10.030 7.141 ( -9.754 0.658 -4.567) 10.790 7.367 ( 9.717 1.801 -2.746) 10.257 7.497 ( -7.678 -2.617 -5.072) 9.567 8.198 ( 10.410 1.657 -4.699) 11.541 8.623 ( -34.287 -0.390 9.977) 35.711 8.669 ( -23.168 -0.225 -1.416) 23.213 8.988 ( -27.931 -3.452 -9.975) 29.858 9.806 ( -25.984 5.932 8.627) 28.014 9.919 ( -16.751 -0.227 6.725) 18.052 10.390 ( -20.373 -0.450 -6.237) 21.311 11.195 ( -30.696 5.295 1.943) 31.210 11.421 ( -23.032 4.770 -10.898) 25.923 12.794 ( 6.835 -4.119 3.383) 8.668 13.298 ( 8.742 0.000 0.113) 8.743 13.592 ( 5.864 3.075 -1.507) 6.791 13.950 ( 5.480 11.419 -3.707) 13.198 14.362 ( 3.716 -13.036 1.705) 13.662 15.202 ( -7.859 7.487 3.906) 11.536 15.605 ( 9.872 -9.173 5.083) 14.402 20.306 ( -37.625 2.045 -0.322) 37.682 20.545 ( -24.295 -0.393 1.170) 24.327 ======================= Grid point 478 (200/343) ======================= q-point: ( 0.38 -0.23 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( -17.081 6.801 -0.000) 18.385 2.425 ( -18.515 5.266 -0.000) 19.249 2.696 ( -13.518 -6.431 0.000) 14.970 2.712 ( -14.532 -6.403 0.000) 15.880 2.966 ( -6.472 1.621 -0.000) 6.672 3.346 ( -1.274 -1.811 0.000) 2.214 3.459 ( -7.002 2.661 -0.000) 7.490 3.515 ( 3.681 6.308 -0.000) 7.304 3.740 ( -1.445 -6.432 0.000) 6.592 5.609 ( -8.686 -0.825 0.000) 8.725 5.708 ( -8.149 1.601 -0.000) 8.304 5.784 ( -18.370 -0.080 -0.000) 18.370 6.230 ( -1.395 -5.552 0.000) 5.724 6.334 ( 4.728 -1.917 0.000) 5.101 6.552 ( -19.256 -2.232 0.000) 19.385 7.067 ( 12.677 5.029 -0.000) 13.638 7.231 ( 5.865 -6.858 0.000) 9.024 7.718 ( -26.475 3.111 -0.000) 26.657 8.025 ( 10.936 1.557 -0.000) 11.047 8.941 ( -23.119 0.870 -0.000) 23.135 9.174 ( -21.327 -4.134 0.000) 21.724 9.307 ( -35.947 0.467 -0.000) 35.950 10.175 ( -20.079 1.612 -0.000) 20.143 10.278 ( -22.940 5.453 -0.000) 23.579 10.592 ( -18.113 -0.705 0.000) 18.127 11.559 ( -17.235 0.126 -0.000) 17.236 11.699 ( -26.217 10.882 -0.000) 28.386 12.691 ( 9.389 -4.543 0.000) 10.430 13.167 ( 9.401 -2.649 0.000) 9.767 13.499 ( 8.988 4.562 -0.000) 10.080 13.885 ( 5.306 8.129 -0.000) 9.707 14.226 ( 9.522 -14.532 0.000) 17.374 15.326 ( -1.616 10.958 -0.000) 11.077 15.563 ( -4.938 -9.951 0.000) 11.109 20.808 ( -34.074 0.778 -0.000) 34.083 20.875 ( -21.818 0.574 -0.000) 21.826 ======================= Grid point 490 (201/343) ======================= q-point: ( 0.23 -0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( -23.811 8.636 -8.205) 26.624 1.594 ( -21.484 10.698 -18.860) 30.523 2.225 ( -13.975 -14.242 -1.996) 20.053 2.390 ( -10.314 -14.006 -8.160) 19.213 2.670 ( -21.342 17.620 -4.501) 28.039 2.908 ( -5.234 9.655 -2.186) 11.198 3.153 ( -5.069 4.637 -0.178) 6.873 3.584 ( -0.402 -10.841 -1.152) 10.910 3.891 ( 10.744 1.384 0.683) 10.854 5.076 ( -8.439 -2.523 -6.952) 11.221 5.256 ( -8.986 -1.809 -7.638) 11.931 5.515 ( -5.603 3.288 -2.447) 6.942 5.730 ( -19.642 -5.915 -9.344) 22.541 5.973 ( -17.753 -2.389 -7.580) 19.451 6.525 ( -1.441 -9.288 -4.027) 10.225 6.791 ( -11.898 -4.334 -5.375) 13.756 7.255 ( -13.334 -6.051 -3.798) 15.127 7.427 ( -26.569 1.380 9.143) 28.132 7.867 ( -6.564 -2.665 7.455) 10.284 8.254 ( -11.463 -2.258 -12.466) 17.085 8.349 ( -12.285 -3.828 -11.991) 17.589 8.535 ( 14.810 0.406 -2.039) 14.955 8.973 ( -31.648 0.020 1.765) 31.697 9.485 ( -15.953 -1.083 3.870) 16.452 9.857 ( -19.365 -0.415 -3.519) 19.686 10.055 ( -46.513 -2.130 -7.347) 47.138 10.804 ( -22.557 1.007 -8.258) 24.042 12.970 ( 4.311 -5.799 3.854) 8.190 13.486 ( 6.522 4.041 1.338) 7.788 13.674 ( 2.294 2.597 -2.163) 4.085 13.989 ( 4.512 16.338 -2.650) 17.155 14.365 ( -4.982 -2.462 3.029) 6.329 14.925 ( -9.167 1.172 7.305) 11.780 16.266 ( 29.697 -8.837 13.246) 33.696 19.246 ( -34.990 7.084 -6.868) 36.354 19.827 ( -29.972 -8.188 -5.630) 31.576 ======================= Grid point 491 (202/343) ======================= q-point: ( 0.31 -0.15 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( -24.408 9.157 -0.000) 26.069 1.810 ( -23.475 7.515 -0.000) 24.648 2.356 ( -13.325 -9.202 0.000) 16.194 2.432 ( -12.292 -14.184 0.000) 18.769 2.823 ( -3.818 4.878 -0.000) 6.194 3.156 ( -19.025 11.217 -0.000) 22.086 3.247 ( -6.306 4.318 -0.000) 7.643 3.537 ( 1.566 -4.283 0.000) 4.560 3.775 ( 6.326 -0.343 0.000) 6.335 5.201 ( -17.424 -2.056 0.000) 17.545 5.333 ( -11.580 -3.191 0.000) 12.011 5.571 ( -3.860 3.709 -0.000) 5.353 5.946 ( -24.139 -5.715 0.000) 24.806 6.125 ( -13.833 -6.898 0.000) 15.457 6.462 ( 2.186 -6.484 0.000) 6.842 6.910 ( -13.980 -1.280 0.000) 14.039 7.337 ( -5.115 -3.627 0.000) 6.271 7.586 ( 8.653 2.155 -0.000) 8.918 8.251 ( -32.640 -0.815 0.000) 32.650 8.317 ( 11.132 0.957 -0.000) 11.173 8.356 ( -17.435 0.508 -0.000) 17.442 8.515 ( -27.500 -7.325 0.000) 28.459 9.445 ( -32.076 4.043 -0.000) 32.329 9.740 ( -16.814 -0.697 0.000) 16.828 10.086 ( -19.079 -0.940 0.000) 19.102 10.660 ( -44.340 5.923 -0.000) 44.734 11.046 ( -21.223 0.489 -0.000) 21.228 12.914 ( 5.007 -5.256 0.000) 7.259 13.407 ( 7.754 1.970 -0.000) 8.000 13.629 ( 3.496 3.202 -0.000) 4.741 13.957 ( 5.942 15.491 -0.000) 16.591 14.419 ( -2.224 -7.340 0.000) 7.669 15.097 ( -8.993 2.120 -0.000) 9.240 15.929 ( 25.335 -8.558 0.000) 26.742 19.750 ( -40.298 4.857 -0.000) 40.589 20.188 ( -29.533 -4.030 0.000) 29.807 ======================= Grid point 503 (203/343) ======================= q-point: ( 0.23 -0.08 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( -27.693 11.631 -0.000) 30.037 1.089 ( -21.631 18.963 -0.000) 28.767 1.899 ( -37.234 13.229 -0.000) 39.514 2.225 ( -6.977 -12.245 0.000) 14.094 2.350 ( -10.467 -3.247 0.000) 10.959 2.888 ( 5.229 6.579 -0.000) 8.404 3.074 ( -3.637 5.097 -0.000) 6.262 3.605 ( -2.703 -17.345 0.000) 17.554 4.060 ( 13.894 5.004 -0.000) 14.767 4.957 ( -2.371 -3.544 0.000) 4.264 5.131 ( -2.201 -0.749 0.000) 2.325 5.374 ( -14.834 -5.760 0.000) 15.913 5.445 ( -10.987 1.990 -0.000) 11.165 5.717 ( -11.063 1.823 -0.000) 11.212 6.460 ( -10.964 -11.159 0.000) 15.644 6.550 ( -21.521 -4.371 0.000) 21.961 7.030 ( -17.727 -3.744 0.000) 18.118 7.191 ( -20.233 -7.222 0.000) 21.483 7.749 ( -29.187 -15.698 0.000) 33.141 8.005 ( 1.989 2.557 -0.000) 3.240 8.244 ( 1.238 -2.792 0.000) 3.054 8.558 ( -28.766 -4.425 0.000) 29.104 8.792 ( 20.478 -0.211 0.000) 20.479 9.153 ( -47.820 -16.538 0.000) 50.599 9.435 ( -23.472 -0.630 0.000) 23.480 9.620 ( -15.793 -1.513 0.000) 15.865 10.429 ( -23.244 0.513 -0.000) 23.250 13.086 ( 4.777 -8.557 0.000) 9.800 13.572 ( 7.480 5.375 -0.000) 9.211 13.682 ( 3.562 5.492 -0.000) 6.546 13.964 ( 4.017 20.204 -0.000) 20.600 14.333 ( -3.850 -0.334 0.000) 3.865 14.885 ( -5.676 -0.450 0.000) 5.694 16.827 ( 30.499 -9.018 0.000) 31.805 18.724 ( -27.934 10.886 -0.000) 29.980 19.384 ( -31.987 -14.684 0.000) 35.196 ======================= Grid point 516 (204/343) ======================= q-point: ( 0.23 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( -0.000 27.520 -0.000) 27.520 0.643 ( -0.000 27.627 -0.000) 27.627 1.262 ( -0.000 55.157 -0.000) 55.157 2.164 ( 0.000 -14.846 0.000) 14.846 2.175 ( 0.000 -15.103 0.000) 15.103 3.016 ( -0.000 4.996 -0.000) 4.996 3.024 ( -0.000 4.963 -0.000) 4.963 3.577 ( 0.000 -23.962 0.000) 23.962 4.382 ( -0.000 6.484 -0.000) 6.484 4.755 ( 0.000 -2.615 0.000) 2.615 5.015 ( 0.000 -2.396 0.000) 2.396 5.201 ( -0.000 0.439 -0.000) 0.439 5.308 ( -0.000 1.978 -0.000) 1.978 5.503 ( -0.000 1.128 -0.000) 1.128 5.890 ( 0.000 -13.495 0.000) 13.495 5.928 ( -0.000 1.455 -0.000) 1.455 6.323 ( -0.000 1.854 -0.000) 1.854 6.757 ( 0.000 -0.107 0.000) 0.107 7.377 ( -0.000 8.070 -0.000) 8.070 7.820 ( -0.000 4.754 -0.000) 4.754 8.113 ( -0.000 4.662 -0.000) 4.662 8.138 ( 0.000 -4.579 0.000) 4.579 8.400 ( 0.000 -3.877 0.000) 3.877 9.126 ( 0.000 -0.322 0.000) 0.322 9.327 ( 0.000 -0.301 0.000) 0.301 9.378 ( 0.000 -0.819 0.000) 0.819 9.968 ( -0.000 0.746 -0.000) 0.746 13.169 ( 0.000 -12.532 0.000) 12.532 13.666 ( -0.000 0.370 -0.000) 0.370 13.880 ( -0.000 14.935 -0.000) 14.935 14.064 ( 0.000 -0.194 0.000) 0.194 14.270 ( 0.000 -0.062 0.000) 0.062 14.807 ( 0.000 -0.380 0.000) 0.380 17.266 ( 0.000 -14.706 0.000) 14.706 18.173 ( -0.000 14.846 -0.000) 14.846 18.990 ( 0.000 -3.743 0.000) 3.743 ======================= Grid point 517 (205/343) ======================= q-point: ( 0.31 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( -13.022 17.668 20.774) 30.221 1.104 ( -16.635 18.438 24.933) 35.191 1.643 ( -17.579 29.823 9.921) 36.012 2.168 ( -3.303 -8.981 6.046) 11.319 2.231 ( -8.631 -10.894 6.692) 15.426 2.996 ( 5.302 4.195 1.215) 6.870 3.057 ( -1.816 4.285 0.577) 4.689 3.493 ( -3.112 -22.637 1.574) 22.904 4.253 ( 13.923 6.439 -2.935) 15.619 4.940 ( -18.571 -5.276 -5.404) 20.048 5.084 ( -1.460 -1.738 1.888) 2.953 5.196 ( -7.528 -4.447 5.890) 10.542 5.396 ( -8.112 1.649 7.535) 11.194 5.666 ( -1.531 2.848 3.834) 5.015 6.066 ( -33.431 -7.196 -0.417) 34.199 6.294 ( -21.304 -1.661 16.374) 26.921 6.772 ( -15.477 -17.829 8.311) 25.030 6.927 ( -7.719 -3.803 12.472) 15.153 7.597 ( -3.843 -3.252 16.303) 17.063 8.015 ( -14.117 1.500 3.009) 14.512 8.198 ( -9.781 -3.613 1.044) 10.479 8.370 ( -6.015 -4.448 15.141) 16.888 8.660 ( -28.246 -9.737 32.959) 44.485 8.971 ( 7.231 0.248 -11.557) 13.635 9.280 ( 0.510 -0.198 -0.367) 0.659 9.480 ( -8.928 -0.976 5.468) 10.515 10.219 ( -17.534 0.563 11.899) 21.198 13.074 ( 2.793 -9.090 -4.372) 10.467 13.647 ( 3.192 0.946 -0.743) 3.411 13.792 ( 8.757 10.072 -3.586) 13.820 14.069 ( 0.892 9.935 0.185) 9.977 14.245 ( -3.806 -0.760 -6.155) 7.277 14.715 ( -5.710 6.546 -13.147) 15.758 16.982 ( 16.123 -9.901 -19.843) 27.418 18.554 ( -16.068 12.180 15.048) 25.159 19.092 ( -15.439 -12.433 14.223) 24.397 ======================= Grid point 518 (206/343) ======================= q-point: ( 0.38 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -12.639 12.291 17.961) 25.167 1.739 ( -13.893 9.285 28.727) 33.234 2.048 ( -15.077 -11.263 10.538) 21.569 2.368 ( -7.888 -11.056 12.358) 18.363 2.555 ( -19.404 21.038 11.021) 30.669 2.981 ( 3.411 5.011 3.877) 7.195 3.116 ( -3.356 3.210 0.905) 4.731 3.517 ( -5.117 -16.844 3.083) 17.871 4.039 ( 12.937 2.890 -2.430) 13.477 5.125 ( -6.228 -1.751 8.317) 10.537 5.235 ( -13.390 2.109 6.276) 14.937 5.462 ( -14.043 -6.026 11.848) 19.336 5.658 ( -7.160 -0.767 9.784) 12.148 5.808 ( -18.574 -1.237 3.527) 18.946 6.529 ( -14.174 -4.723 17.833) 23.265 6.725 ( -11.442 -3.509 11.306) 16.464 6.936 ( -17.922 -3.773 -1.768) 18.400 7.180 ( -9.805 -3.365 11.985) 15.846 7.771 ( -3.537 -4.026 3.676) 6.499 8.267 ( -12.688 0.727 7.898) 14.963 8.374 ( -10.256 -2.379 6.313) 12.276 8.664 ( -7.757 -0.649 8.847) 11.784 8.710 ( 1.941 -0.367 0.294) 1.997 9.269 ( -6.093 -0.578 -2.745) 6.708 9.621 ( -33.420 -3.355 24.870) 41.793 9.743 ( -17.924 -3.852 12.303) 22.079 10.668 ( -20.513 1.036 14.786) 25.307 12.931 ( 3.296 -5.357 -6.459) 9.015 13.558 ( 6.379 4.587 -3.267) 8.509 13.733 ( 1.900 3.388 0.286) 3.895 14.090 ( -1.158 6.347 -1.516) 6.627 14.236 ( -5.123 1.024 -3.342) 6.202 14.681 ( -8.421 6.397 -10.134) 14.647 16.308 ( 22.730 -8.437 -29.979) 38.556 19.047 ( -21.416 7.059 17.061) 28.276 19.595 ( -22.037 -8.608 19.557) 30.695 ======================= Grid point 519 (207/343) ======================= q-point: ( 0.46 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.844 ( -12.405 2.494 14.850) 19.509 2.249 ( -10.484 -3.469 16.850) 20.146 2.357 ( -11.680 1.377 15.034) 19.088 2.600 ( -7.363 -9.723 12.841) 17.710 2.942 ( -0.354 7.642 6.908) 10.308 3.124 ( -13.975 13.294 7.210) 20.592 3.194 ( -4.459 2.918 1.123) 5.446 3.575 ( -3.584 -8.621 3.390) 9.933 3.866 ( 10.138 0.395 -1.320) 10.232 5.336 ( -6.354 0.349 10.904) 12.625 5.517 ( -9.697 0.743 7.340) 12.185 5.757 ( -3.809 0.795 15.628) 16.105 5.954 ( -20.223 -8.078 9.708) 23.843 6.179 ( -19.636 -0.950 7.551) 21.059 6.722 ( 2.510 -3.925 7.727) 9.023 6.966 ( -7.295 -1.441 6.939) 10.171 7.245 ( -21.693 2.145 3.575) 22.090 7.542 ( -12.720 -4.777 18.167) 22.686 7.801 ( -3.223 -4.107 1.687) 5.487 8.547 ( -12.796 1.397 4.226) 13.548 8.589 ( -9.560 -0.975 3.344) 10.174 8.709 ( -4.740 0.252 12.509) 13.379 9.041 ( -12.231 1.593 11.512) 16.872 9.304 ( -9.110 -0.217 -5.916) 10.865 10.048 ( -16.947 -0.621 10.901) 20.160 10.460 ( -31.789 1.361 21.020) 38.134 11.174 ( -21.970 3.002 16.281) 27.509 12.770 ( 3.797 -3.234 -8.190) 9.589 13.432 ( 6.251 5.848 -5.509) 10.180 13.722 ( 1.416 -2.179 -0.449) 2.637 14.119 ( -4.672 0.896 -1.860) 5.107 14.308 ( -3.848 1.613 4.225) 5.938 14.711 ( -9.969 6.626 -7.166) 13.951 15.619 ( 15.326 -9.555 -25.701) 31.412 19.613 ( -23.523 2.219 16.974) 29.093 20.058 ( -16.091 -1.600 12.407) 20.382 ======================= Grid point 520 (208/343) ======================= q-point: ( 0.54 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -11.695 -2.877 10.605) 16.047 2.544 ( -10.768 -2.485 10.490) 15.237 2.695 ( -6.640 1.813 12.618) 14.373 2.848 ( -6.937 -2.377 11.406) 13.560 2.988 ( 3.691 1.785 4.914) 6.400 3.265 ( -4.067 1.490 0.395) 4.350 3.398 ( -4.950 3.339 3.615) 6.980 3.667 ( -4.378 2.887 4.399) 6.845 3.725 ( 7.266 -1.011 -1.498) 7.488 5.576 ( -7.364 2.345 9.025) 11.882 5.698 ( -7.116 -3.293 5.142) 9.377 6.039 ( -3.316 0.711 16.220) 16.571 6.201 ( -4.087 -0.748 0.332) 4.168 6.477 ( -8.428 -1.612 9.055) 12.475 6.858 ( -11.389 -2.907 8.673) 14.607 7.125 ( -7.840 -0.771 2.800) 8.361 7.457 ( -2.873 -2.446 3.356) 5.049 7.920 ( -13.453 2.441 13.950) 19.533 8.027 ( -15.439 -4.873 11.029) 19.589 8.702 ( -7.232 0.992 2.988) 7.887 8.785 ( -11.347 1.332 -0.886) 11.460 8.966 ( -8.127 -0.389 7.035) 10.756 9.316 ( -6.480 3.529 8.740) 11.439 9.388 ( -9.823 -1.737 1.448) 10.080 10.443 ( -18.028 -0.831 11.936) 21.638 11.087 ( -23.771 2.295 15.169) 28.292 11.718 ( -22.226 6.137 16.364) 28.275 12.579 ( 4.862 -2.135 -9.770) 11.120 13.279 ( 6.499 6.434 -7.550) 11.859 13.634 ( 3.516 -8.843 -5.093) 10.794 14.164 ( -2.583 -0.164 0.764) 2.699 14.453 ( -4.295 0.372 7.322) 8.497 14.808 ( -9.571 9.880 -2.918) 14.062 15.181 ( 2.205 -10.713 -14.915) 18.496 20.120 ( -19.808 0.295 12.965) 23.675 20.353 ( -9.780 0.804 5.816) 11.407 ======================= Grid point 521 (209/343) ======================= q-point: ( 0.62 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.430 ( -9.964 -2.210 6.073) 11.876 2.813 ( -10.490 -0.850 7.870) 13.142 2.904 ( -2.477 1.262 8.092) 8.556 2.956 ( 3.089 -0.026 4.315) 5.307 3.096 ( -5.839 -0.377 6.285) 8.587 3.318 ( -2.783 0.716 -0.058) 2.874 3.422 ( 2.721 -0.571 0.139) 2.784 3.594 ( 6.286 -0.638 -2.738) 6.886 3.809 ( -2.568 3.551 4.225) 6.088 5.770 ( -5.301 2.933 4.522) 7.560 5.835 ( -5.728 -4.220 3.390) 7.881 6.146 ( 2.469 1.990 -2.958) 4.337 6.260 ( -1.378 -0.669 9.028) 9.157 6.671 ( -0.920 -1.054 12.214) 12.294 7.157 ( -11.533 1.822 7.003) 13.615 7.240 ( -7.551 -2.683 0.265) 8.018 7.507 ( -0.067 -2.781 4.358) 5.171 8.266 ( -12.166 3.712 6.784) 14.416 8.353 ( -11.213 -3.571 11.826) 16.683 8.834 ( -7.020 1.741 -0.794) 7.276 8.856 ( -7.411 -0.117 -5.390) 9.165 9.078 ( -4.048 -0.006 -1.151) 4.208 9.509 ( -2.960 3.294 8.361) 9.462 9.556 ( -5.699 -2.735 6.425) 9.013 10.823 ( -14.928 -0.390 10.191) 18.079 11.549 ( -16.910 0.862 12.106) 20.815 12.217 ( -16.580 7.348 11.984) 21.737 12.364 ( 5.339 -1.904 -10.031) 11.522 13.099 ( 7.268 3.930 -7.986) 11.490 13.454 ( 3.833 -9.130 -6.465) 11.825 14.203 ( 1.499 0.371 3.508) 3.833 14.593 ( -4.690 0.050 3.494) 5.849 14.901 ( -5.364 8.026 -6.219) 11.483 15.098 ( -7.504 -8.061 1.856) 11.168 20.483 ( -10.790 1.133 6.320) 12.556 20.504 ( -6.899 -0.510 3.180) 7.614 ======================= Grid point 522 (210/343) ======================= q-point: ( 0.69 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.597 ( -6.943 -0.509 2.176) 7.293 2.893 ( 3.250 0.167 -0.665) 3.321 3.030 ( -4.442 2.404 4.433) 6.720 3.052 ( -2.639 -2.819 4.995) 6.313 3.228 ( -6.350 0.474 1.806) 6.619 3.348 ( -1.277 0.334 0.376) 1.373 3.371 ( 2.625 -0.701 -1.673) 3.190 3.470 ( 5.676 0.025 -2.459) 6.186 3.856 ( 3.249 0.788 2.072) 3.934 5.832 ( -1.237 0.523 -1.360) 1.912 5.923 ( -4.153 -0.648 0.933) 4.306 6.110 ( 0.761 -0.065 -0.368) 0.848 6.344 ( 1.004 -0.087 3.675) 3.811 6.825 ( 0.856 -0.048 9.726) 9.764 7.229 ( -1.508 1.544 -4.200) 4.722 7.391 ( -4.272 -1.664 4.923) 6.727 7.572 ( -3.256 -0.576 2.965) 4.441 8.429 ( -3.600 0.642 0.614) 3.708 8.591 ( -6.016 -0.424 4.949) 7.801 8.813 ( -2.671 0.296 -6.664) 7.186 8.925 ( -3.597 0.012 -0.402) 3.619 9.090 ( -0.912 -0.037 -0.974) 1.335 9.596 ( 2.696 0.505 3.383) 4.355 9.686 ( -3.183 -0.493 3.679) 4.890 11.078 ( -6.701 -0.096 4.181) 7.899 11.892 ( -11.456 0.144 10.057) 15.244 12.132 ( 6.846 -0.426 -10.515) 12.555 12.478 ( -2.681 3.476 0.514) 4.420 12.908 ( 7.158 -1.491 -5.057) 8.890 13.405 ( -5.187 -1.242 4.112) 6.734 14.212 ( 4.167 0.032 3.108) 5.199 14.667 ( -3.157 0.054 -0.513) 3.199 14.879 ( -3.206 0.599 -7.047) 7.765 15.238 ( -3.766 -0.720 6.089) 7.196 20.541 ( -0.817 0.236 -0.442) 0.959 20.683 ( -4.676 -0.119 2.870) 5.488 ======================= Grid point 523 (211/343) ======================= q-point: (-0.23 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( -2.833 -0.000 -1.211) 3.081 2.825 ( 2.564 0.000 -3.146) 4.058 3.065 ( 0.838 0.000 -3.980) 4.067 3.074 ( 2.002 0.000 -1.870) 2.739 3.261 ( 5.920 0.000 -4.318) 7.328 3.307 ( -2.265 -0.000 -1.849) 2.924 3.408 ( -5.490 -0.000 2.938) 6.227 3.434 ( -1.354 -0.000 1.433) 1.971 3.788 ( 8.407 0.000 -0.002) 8.407 5.839 ( -3.694 -0.000 -2.036) 4.218 5.935 ( 1.229 0.000 -2.471) 2.760 6.078 ( 2.434 0.000 -1.282) 2.750 6.339 ( 2.992 0.000 -0.523) 3.038 6.875 ( -0.686 0.000 -3.170) 3.243 7.191 ( 2.843 0.000 1.105) 3.050 7.420 ( 4.758 0.000 0.595) 4.795 7.655 ( -5.122 -0.000 0.105) 5.123 8.393 ( 5.614 0.000 -3.715) 6.731 8.605 ( -3.843 0.000 -11.828) 12.436 8.776 ( 8.811 0.000 6.596) 11.006 8.919 ( 1.630 0.000 -2.578) 3.050 9.089 ( 1.254 0.000 1.182) 1.723 9.552 ( 2.620 0.000 -4.284) 5.022 9.714 ( 2.487 0.000 -0.513) 2.539 11.085 ( 4.865 0.000 -4.969) 6.954 11.862 ( 11.716 0.000 -11.796) 16.626 12.102 ( -1.957 -0.000 2.641) 3.287 12.404 ( 3.289 0.000 -2.937) 4.409 12.821 ( 1.639 0.000 2.945) 3.370 13.656 ( -11.178 -0.000 12.783) 16.981 14.168 ( 5.950 0.000 0.450) 5.967 14.664 ( -0.319 0.000 -3.286) 3.301 14.793 ( 2.491 0.000 -6.727) 7.174 15.321 ( 1.614 -0.000 4.203) 4.502 20.520 ( 2.164 0.000 -1.090) 2.423 20.689 ( 4.350 0.000 -2.452) 4.993 ======================= Grid point 530 (212/343) ======================= q-point: ( 0.31 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.001 ( -0.000 17.147 22.719) 28.463 1.309 ( -0.000 19.039 30.060) 35.582 1.699 ( -0.000 25.781 32.047) 41.130 2.261 ( 0.000 -14.620 7.383) 16.379 2.370 ( 0.000 -9.206 12.847) 15.805 3.022 ( -0.000 3.742 0.547) 3.782 3.064 ( -0.000 5.077 3.482) 6.156 3.585 ( 0.000 -21.884 2.326) 22.007 4.302 ( -0.000 8.425 -4.437) 9.522 4.626 ( 0.000 -3.050 0.640) 3.117 4.997 ( -0.000 2.514 -3.524) 4.329 5.299 ( 0.000 -5.740 10.096) 11.614 5.492 ( -0.000 -0.063 13.497) 13.497 5.714 ( -0.000 2.683 5.101) 5.763 6.106 ( -0.000 3.418 30.886) 31.074 6.489 ( -0.000 -2.788 27.232) 27.375 6.890 ( 0.000 -15.329 6.452) 16.631 7.096 ( 0.000 -2.363 13.502) 13.707 7.873 ( -0.000 4.212 4.737) 6.339 7.897 ( 0.000 -8.335 15.554) 17.647 8.131 ( 0.000 -3.507 1.317) 3.746 8.633 ( 0.000 -5.114 22.145) 22.728 8.752 ( 0.000 0.077 -20.665) 20.665 9.147 ( 0.000 -17.175 40.266) 43.776 9.329 ( 0.000 -1.211 7.536) 7.632 9.532 ( -0.000 -0.608 10.332) 10.350 10.317 ( -0.000 0.153 19.215) 19.216 13.041 ( 0.000 -8.129 -7.906) 11.340 13.669 ( -0.000 0.307 0.825) 0.880 13.703 ( -0.000 14.767 -9.426) 17.519 14.075 ( 0.000 -0.342 -10.843) 10.849 14.098 ( -0.000 -0.133 2.891) 2.894 14.436 ( -0.000 19.468 -9.278) 21.566 16.725 ( 0.000 -8.513 -37.691) 38.641 18.681 ( -0.000 9.596 23.626) 25.500 19.347 ( 0.000 -13.457 28.808) 31.796 ======================= Grid point 531 (213/343) ======================= q-point: ( 0.38 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -12.488 10.932 21.903) 27.481 1.834 ( -14.367 14.414 22.622) 30.429 2.203 ( -2.170 -2.104 25.732) 25.908 2.404 ( -9.419 -2.105 13.220) 16.368 2.579 ( -3.958 -0.544 15.858) 16.354 3.052 ( 0.336 3.648 2.995) 4.732 3.122 ( 1.669 3.954 4.438) 6.174 3.569 ( -2.787 -17.684 3.188) 18.184 4.162 ( 11.762 5.331 -3.132) 13.289 4.894 ( -25.414 -3.868 7.856) 26.880 5.174 ( -14.914 3.337 6.723) 16.696 5.482 ( -9.564 -2.737 11.316) 15.067 5.677 ( -4.176 -2.935 9.678) 10.942 5.858 ( 2.381 0.779 18.502) 18.671 6.595 ( -12.764 4.859 20.417) 24.564 6.838 ( -1.747 -7.333 14.348) 16.208 6.912 ( -4.018 -8.357 7.329) 11.819 7.284 ( -3.783 -1.058 13.585) 14.141 7.888 ( 6.196 -4.408 7.736) 10.847 8.172 ( -11.040 -0.878 8.658) 14.058 8.276 ( -11.703 -1.915 6.335) 13.444 8.526 ( -7.342 0.149 -14.253) 16.033 8.942 ( 1.721 -1.919 25.795) 25.923 9.268 ( 3.051 -0.168 2.868) 4.190 9.727 ( -5.749 0.301 15.923) 16.932 9.832 ( -12.318 -3.284 34.402) 36.688 10.669 ( -11.850 0.464 18.794) 22.223 12.887 ( 2.181 -6.095 -8.519) 10.700 13.558 ( 6.549 8.502 -7.265) 12.960 13.721 ( -1.686 1.918 0.826) 2.684 13.960 ( -4.971 -2.561 -8.205) 9.929 14.176 ( -2.995 1.841 4.076) 5.382 14.443 ( -4.895 13.193 -4.965) 14.922 16.074 ( 9.404 -9.250 -39.843) 41.969 19.132 ( -8.881 4.990 28.300) 30.078 19.751 ( -7.027 -6.880 25.746) 27.560 ======================= Grid point 532 (214/343) ======================= q-point: ( 0.46 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -7.355 4.142 18.463) 20.301 2.321 ( -11.219 -3.674 15.150) 19.206 2.464 ( -5.497 -0.330 15.537) 16.484 2.722 ( -6.473 -7.411 13.911) 17.039 2.934 ( -10.895 15.661 14.537) 23.985 3.124 ( 0.863 5.804 6.069) 8.442 3.173 ( -0.134 1.814 3.609) 4.041 3.603 ( -3.555 -11.260 2.544) 12.079 3.991 ( 11.116 2.509 -1.307) 11.470 5.342 ( -17.065 -1.839 11.087) 20.434 5.469 ( -11.154 1.655 9.410) 14.687 5.822 ( -13.468 -1.517 12.235) 18.258 5.906 ( -15.373 -5.491 9.908) 19.096 6.125 ( -3.086 0.057 18.179) 18.439 6.771 ( 0.965 -0.603 -2.475) 2.724 6.994 ( -7.238 -3.324 7.490) 10.933 7.201 ( -10.417 1.783 15.505) 18.764 7.593 ( -13.354 -4.213 13.234) 19.267 7.861 ( 3.799 -6.587 4.706) 8.943 8.365 ( -11.129 1.763 -3.589) 11.826 8.500 ( -10.346 -0.036 9.418) 13.991 8.687 ( -15.833 -1.511 6.533) 17.194 9.234 ( 2.827 2.338 20.866) 21.186 9.302 ( 2.700 -0.182 9.970) 10.330 10.060 ( -10.747 -0.677 17.492) 20.540 10.475 ( -16.030 4.655 29.163) 33.602 11.124 ( -17.487 2.510 17.878) 25.134 12.710 ( 3.169 -4.489 -9.583) 11.047 13.390 ( 5.976 7.563 -9.225) 13.342 13.718 ( 0.081 -4.275 -3.199) 5.340 13.994 ( -8.897 -1.785 -0.083) 9.074 14.279 ( -4.484 2.561 1.522) 5.383 14.543 ( -6.451 9.397 3.061) 11.802 15.427 ( 7.556 -10.772 -30.336) 33.066 19.671 ( -11.803 1.493 27.100) 29.597 20.130 ( -5.930 -1.056 18.484) 19.441 ======================= Grid point 533 (215/343) ======================= q-point: ( 0.54 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -5.451 -3.136 13.751) 15.121 2.559 ( -7.540 -5.427 9.393) 13.211 2.772 ( -6.584 2.713 12.464) 14.355 2.942 ( -4.219 -2.858 11.108) 12.221 3.124 ( 5.815 3.908 6.181) 9.343 3.236 ( -2.539 0.563 2.938) 3.924 3.341 ( -9.223 9.055 6.735) 14.575 3.651 ( -3.664 -2.039 1.847) 4.582 3.837 ( 10.464 0.478 -0.645) 10.495 5.605 ( -5.555 1.248 8.346) 10.103 5.731 ( -6.792 -4.236 10.862) 13.493 6.121 ( -5.934 -0.097 5.983) 8.427 6.183 ( -8.421 -0.356 5.871) 10.272 6.395 ( -11.819 -0.792 6.439) 13.483 6.793 ( -8.909 -3.168 3.814) 10.196 7.176 ( -3.196 1.025 10.905) 11.410 7.463 ( -7.811 -1.959 1.981) 8.293 7.885 ( -13.793 -2.021 6.266) 15.284 8.006 ( -9.797 -2.698 11.505) 15.350 8.478 ( -12.317 0.158 -3.870) 12.911 8.735 ( -4.105 1.207 8.755) 9.745 8.943 ( -9.452 -0.891 5.042) 10.750 9.444 ( 1.576 2.997 17.143) 17.474 9.503 ( -0.570 -0.379 17.814) 17.827 10.466 ( -11.296 -0.938 19.737) 22.761 11.057 ( -15.712 4.496 22.027) 27.428 11.636 ( -19.836 6.195 17.225) 26.992 12.509 ( 3.927 -3.558 -10.607) 11.857 13.207 ( 5.036 7.246 -10.458) 13.683 13.603 ( 0.749 -10.532 -8.783) 13.734 14.128 ( -5.533 0.894 3.527) 6.622 14.363 ( -7.838 0.852 -1.725) 8.071 14.723 ( -3.664 9.992 3.057) 11.073 15.058 ( -2.386 -11.930 -8.147) 14.642 20.164 ( -9.997 -0.012 22.693) 24.797 20.396 ( -2.279 1.122 12.693) 12.945 ======================= Grid point 534 (216/343) ======================= q-point: ( 0.62 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -4.233 -4.463 8.636) 10.603 2.771 ( -9.238 -1.997 6.178) 11.291 2.979 ( -2.241 1.531 8.130) 8.571 3.088 ( 3.313 1.212 6.687) 7.560 3.125 ( 0.776 -0.555 3.672) 3.794 3.306 ( -1.604 0.164 2.967) 3.377 3.454 ( 0.800 -0.708 0.423) 1.149 3.678 ( 8.574 1.146 -0.849) 8.692 3.781 ( -5.020 5.004 3.017) 7.704 5.771 ( -4.670 0.299 5.801) 7.453 5.885 ( 1.404 -4.432 5.968) 7.565 6.116 ( 0.006 2.398 -2.395) 3.390 6.346 ( -1.942 0.442 5.977) 6.300 6.590 ( -13.545 -1.042 -3.607) 14.056 7.053 ( -15.192 -2.312 6.726) 16.775 7.358 ( 3.647 3.119 13.917) 14.721 7.521 ( -5.036 -3.701 -2.299) 6.659 8.139 ( -17.488 -0.370 -2.154) 17.624 8.278 ( -12.270 -0.750 5.499) 13.466 8.586 ( -9.620 -0.637 -2.119) 9.872 8.864 ( 1.680 0.717 8.816) 9.003 9.090 ( -2.420 -0.428 6.349) 6.808 9.646 ( 1.270 3.434 11.427) 11.999 9.753 ( 2.867 -1.880 20.955) 21.233 10.859 ( -8.420 -0.723 17.638) 19.558 11.529 ( -13.642 1.988 16.660) 21.625 12.131 ( -15.966 8.761 12.520) 22.100 12.299 ( 3.643 -3.412 -9.636) 10.852 13.032 ( 3.579 5.379 -9.598) 11.570 13.410 ( 0.826 -11.178 -10.013) 15.029 14.215 ( -2.394 4.325 -0.076) 4.944 14.445 ( -9.144 -2.045 -3.782) 10.105 14.760 ( -4.521 1.095 -2.616) 5.336 15.176 ( -4.409 -2.912 13.421) 14.423 20.535 ( -2.642 0.986 14.683) 14.951 20.558 ( -0.950 -0.219 12.166) 12.205 ======================= Grid point 535 (217/343) ======================= q-point: ( 0.69 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.574 ( -3.507 -2.398 4.477) 6.173 2.913 ( -2.755 -0.974 0.599) 2.983 3.041 ( 3.476 3.289 2.925) 5.609 3.108 ( 0.900 -2.527 3.534) 4.437 3.186 ( -2.894 0.366 1.237) 3.168 3.358 ( -0.313 0.012 2.482) 2.502 3.394 ( 4.065 -1.572 -2.279) 4.918 3.557 ( 8.315 0.496 0.753) 8.363 3.884 ( -1.476 3.651 1.705) 4.292 5.828 ( 2.630 -0.965 -1.862) 3.364 5.898 ( -3.355 -1.089 2.340) 4.233 6.146 ( 1.851 0.467 4.229) 4.640 6.409 ( 1.319 0.195 2.821) 3.120 6.650 ( -11.129 0.671 -11.984) 16.368 7.285 ( -10.706 0.773 0.826) 10.765 7.462 ( 8.293 1.336 12.234) 14.840 7.530 ( -3.748 -2.524 -3.183) 5.527 8.271 ( -15.354 -0.613 -10.657) 18.700 8.444 ( -11.708 -1.137 -5.309) 12.906 8.681 ( -3.122 -0.347 3.516) 4.715 8.961 ( 3.097 0.017 9.973) 10.443 9.194 ( 2.539 -0.149 9.310) 9.651 9.717 ( 7.182 1.243 5.985) 9.431 9.937 ( 9.806 -0.465 18.511) 20.953 11.126 ( -1.570 -0.527 10.406) 10.537 11.898 ( -10.472 0.510 12.944) 16.657 12.075 ( 5.046 -1.431 -9.790) 11.106 12.432 ( -3.822 5.113 1.748) 6.619 12.897 ( 1.875 -0.931 -6.014) 6.368 13.343 ( -8.798 -2.177 0.180) 9.065 14.227 ( -1.059 3.296 -3.711) 5.075 14.487 ( -9.721 -1.817 -7.610) 12.479 14.810 ( -1.558 -1.969 2.402) 3.475 15.385 ( 0.804 0.349 13.012) 13.041 20.618 ( 4.912 0.344 7.634) 9.084 20.773 ( 1.790 -0.147 12.617) 12.744 ======================= Grid point 536 (218/343) ======================= q-point: (-0.23 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( -1.255 -0.479 0.968) 1.656 2.857 ( 6.078 -0.473 -2.111) 6.452 3.006 ( 2.055 0.566 -5.738) 6.121 3.090 ( 3.877 -0.038 -1.319) 4.096 3.253 ( -1.774 2.435 -0.168) 3.017 3.282 ( 3.311 -3.172 -2.722) 5.332 3.389 ( -1.267 -0.267 1.052) 1.669 3.494 ( 4.685 0.326 2.701) 5.418 3.887 ( 4.882 1.049 1.076) 5.108 5.792 ( -1.183 -0.583 -0.940) 1.619 5.928 ( 1.009 -0.301 -0.858) 1.358 6.136 ( 5.995 -0.321 2.273) 6.420 6.374 ( 4.749 0.314 -3.437) 5.871 6.605 ( -9.224 1.102 -13.157) 16.106 7.366 ( -5.192 2.586 -5.623) 8.078 7.474 ( 11.282 -2.014 9.625) 14.966 7.524 ( -5.367 -0.085 -6.398) 8.352 8.273 ( -9.420 -0.367 -13.604) 16.551 8.458 ( -7.453 -1.077 -10.215) 12.691 8.734 ( 4.654 -0.100 4.681) 6.602 9.027 ( 4.943 -0.309 6.856) 8.458 9.274 ( 6.136 0.073 11.409) 12.954 9.630 ( 13.668 -0.115 2.394) 13.877 9.974 ( 16.214 0.179 13.015) 20.792 11.147 ( 8.352 -0.279 -0.086) 8.358 11.862 ( 8.556 -0.693 -8.580) 12.137 12.128 ( -0.934 -0.586 3.896) 4.049 12.399 ( 0.972 1.212 -1.615) 2.241 12.849 ( -1.998 -1.352 1.035) 2.625 13.600 ( -16.033 2.449 7.438) 17.843 14.167 ( 0.478 0.487 -6.661) 6.696 14.497 ( -8.772 -0.077 -8.376) 12.129 14.819 ( 4.801 -1.980 2.695) 5.851 15.495 ( 5.951 0.832 9.844) 11.533 20.630 ( 7.808 -0.126 6.828) 10.374 20.827 ( 10.442 0.001 7.350) 12.770 ======================= Grid point 537 (219/343) ======================= q-point: (-0.15 0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.611 ( 4.429 0.000 -3.497) 5.643 2.723 ( 6.073 0.000 -5.552) 8.229 2.837 ( 5.392 0.000 -10.955) 12.210 2.963 ( 8.279 0.000 -4.146) 9.259 3.151 ( 5.016 0.000 -3.575) 6.159 3.275 ( 2.285 0.000 -0.327) 2.308 3.433 ( -3.527 -0.000 -1.196) 3.724 3.493 ( -0.014 -0.000 1.495) 1.495 3.803 ( 9.010 0.000 1.408) 9.119 5.787 ( 3.185 0.000 -1.338) 3.455 5.840 ( 5.946 0.000 -4.593) 7.513 6.093 ( 1.607 0.000 2.514) 2.984 6.186 ( 6.037 0.000 -12.171) 13.586 6.580 ( -5.976 -0.000 -6.909) 9.135 7.276 ( 3.729 0.000 -10.563) 11.202 7.419 ( 12.002 0.000 6.030) 13.431 7.503 ( -8.724 -0.000 -10.197) 13.420 8.149 ( -2.610 0.000 -16.879) 17.080 8.380 ( 1.441 0.000 -6.695) 6.849 8.664 ( 10.084 0.000 0.124) 10.085 8.993 ( 8.188 0.000 1.198) 8.275 9.331 ( 9.683 0.000 11.890) 15.334 9.438 ( 17.261 0.000 1.617) 17.336 9.857 ( 20.449 0.000 7.211) 21.684 10.933 ( 15.075 0.000 -6.396) 16.376 11.574 ( 17.085 0.000 -8.650) 19.150 11.948 ( 13.205 0.000 -10.225) 16.701 12.525 ( -6.048 -0.000 8.526) 10.453 12.960 ( -5.876 -0.000 6.374) 8.670 13.871 ( -13.521 -0.000 -1.622) 13.618 14.045 ( 1.984 0.000 -8.317) 8.550 14.540 ( -7.908 -0.000 0.380) 7.917 14.741 ( 10.156 0.000 1.945) 10.341 15.519 ( 7.404 0.000 8.336) 11.149 20.588 ( 10.821 0.000 5.494) 12.136 20.681 ( 20.103 0.000 1.488) 20.158 ======================= Grid point 544 (220/343) ======================= q-point: ( 0.38 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -0.000 10.902 24.009) 26.368 1.999 ( -0.000 15.908 23.265) 28.184 2.547 ( 0.000 -14.186 12.773) 19.089 2.566 ( -0.000 1.924 24.649) 24.724 2.770 ( -0.000 -0.048 15.439) 15.439 3.084 ( -0.000 2.198 4.184) 4.727 3.197 ( -0.000 5.177 6.088) 7.992 3.645 ( 0.000 -15.247 1.482) 15.319 4.174 ( -0.000 6.369 -4.417) 7.751 4.934 ( 0.000 -3.499 20.892) 21.183 5.172 ( -0.000 3.572 15.199) 15.613 5.534 ( -0.000 1.254 6.452) 6.573 5.881 ( 0.000 -7.973 17.303) 19.052 6.144 ( -0.000 1.719 19.390) 19.466 6.694 ( -0.000 3.160 8.113) 8.707 6.953 ( 0.000 -8.574 -0.688) 8.601 7.050 ( 0.000 -3.320 12.011) 12.461 7.438 ( -0.000 0.306 14.375) 14.378 8.020 ( -0.000 1.584 -4.478) 4.749 8.296 ( -0.000 0.251 0.076) 0.262 8.298 ( 0.000 -12.094 14.872) 19.168 8.340 ( -0.000 -0.806 13.513) 13.537 9.314 ( -0.000 1.568 22.066) 22.122 9.372 ( -0.000 1.010 11.424) 11.468 9.883 ( -0.000 -0.047 15.167) 15.167 10.221 ( -0.000 7.144 33.106) 33.868 10.852 ( -0.000 -0.310 19.509) 19.511 12.803 ( 0.000 -6.739 -9.679) 11.793 13.441 ( -0.000 9.139 -10.995) 14.297 13.766 ( -0.000 0.157 7.531) 7.533 13.822 ( 0.000 -6.077 -7.393) 9.570 14.251 ( -0.000 0.006 9.018) 9.018 14.314 ( -0.000 13.627 -1.500) 13.709 15.622 ( 0.000 -9.492 -38.426) 39.581 19.492 ( -0.000 2.309 33.639) 33.719 20.068 ( -0.000 -2.954 23.059) 23.247 ======================= Grid point 545 (221/343) ======================= q-point: ( 0.46 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -7.006 7.149 18.438) 20.980 2.405 ( -8.606 9.966 19.380) 23.430 2.643 ( 2.667 -11.279 12.102) 16.757 2.853 ( -4.584 -4.522 13.158) 14.649 3.009 ( -2.719 7.059 14.038) 15.946 3.168 ( -1.336 2.040 5.706) 6.205 3.278 ( 3.377 4.386 6.630) 8.636 3.630 ( -2.107 -11.604 1.124) 11.847 4.085 ( 7.192 4.141 -2.491) 8.665 5.346 ( -13.118 -2.610 22.893) 26.514 5.485 ( -7.395 1.522 13.963) 15.874 5.699 ( -12.918 1.613 7.049) 14.804 6.083 ( 0.402 -6.823 15.869) 17.278 6.350 ( 1.972 0.245 12.090) 12.252 6.742 ( 0.196 2.595 -2.729) 3.771 6.953 ( -7.442 -7.166 0.413) 10.340 7.195 ( -8.875 -1.070 1.531) 9.069 7.692 ( -1.957 0.610 19.112) 19.222 7.882 ( -3.370 -0.858 -11.249) 11.774 8.362 ( 3.836 -5.099 15.701) 16.948 8.555 ( -5.622 0.109 12.880) 14.054 8.621 ( -12.969 -4.784 12.652) 18.739 9.513 ( 1.818 0.751 16.897) 17.011 9.605 ( 8.339 6.223 21.576) 23.954 10.180 ( -9.563 0.082 19.005) 21.276 10.731 ( -4.298 9.750 31.271) 33.037 11.178 ( -9.662 0.879 18.363) 20.769 12.628 ( 1.889 -6.096 -10.599) 12.372 13.283 ( 3.463 7.597 -12.372) 14.925 13.680 ( 1.251 -8.551 -6.712) 10.942 13.955 ( -6.244 -0.824 10.258) 12.037 14.277 ( 3.863 6.584 1.506) 7.780 14.495 ( -8.435 5.436 8.541) 13.177 15.116 ( 0.084 -10.374 -27.176) 29.089 19.975 ( -3.538 0.478 31.985) 32.183 20.362 ( -0.160 0.176 20.037) 20.038 ======================= Grid point 546 (222/343) ======================= q-point: ( 0.54 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -4.512 0.983 13.722) 14.478 2.677 ( 1.202 -9.015 11.093) 14.344 2.823 ( -7.710 5.356 11.911) 15.166 3.033 ( -3.084 -2.823 8.074) 9.092 3.230 ( -2.370 4.197 7.494) 8.910 3.295 ( -3.306 6.183 6.543) 9.591 3.318 ( 3.942 3.287 6.037) 7.924 3.638 ( -2.384 -6.408 0.245) 6.841 3.962 ( 9.090 1.810 -0.770) 9.300 5.656 ( -3.314 -0.602 8.399) 9.049 5.821 ( -9.709 -2.309 18.322) 20.864 6.026 ( -17.020 0.999 4.023) 17.518 6.177 ( 3.486 -3.222 1.586) 5.005 6.418 ( 0.709 1.452 2.984) 3.394 6.779 ( -5.298 -0.913 6.379) 8.342 7.111 ( -16.290 -2.692 0.011) 16.511 7.293 ( -12.367 -3.580 -7.136) 14.720 7.858 ( -12.467 0.628 -8.368) 15.028 7.971 ( 1.501 1.228 19.033) 19.132 8.536 ( 1.759 -5.298 17.752) 18.609 8.781 ( -6.716 0.179 7.600) 10.144 8.937 ( -8.748 -1.272 13.444) 16.090 9.733 ( 7.282 5.671 18.871) 21.007 9.810 ( 3.227 -0.141 23.449) 23.670 10.609 ( -11.241 0.744 21.147) 23.960 11.216 ( -5.790 6.601 25.206) 26.692 11.609 ( -15.581 5.373 17.694) 24.181 12.428 ( 2.840 -5.648 -10.789) 12.505 13.088 ( 3.863 6.920 -12.313) 14.643 13.514 ( 0.585 -12.132 -10.866) 16.297 14.128 ( -0.116 4.383 3.916) 5.878 14.314 ( -1.888 -0.304 5.222) 5.561 14.628 ( -3.244 3.000 -5.222) 6.841 14.990 ( -10.967 -6.279 5.904) 13.949 20.429 ( -2.958 -0.350 27.882) 28.040 20.602 ( 2.410 1.383 16.991) 17.217 ======================= Grid point 547 (223/343) ======================= q-point: ( 0.62 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( -0.484 -4.531 9.666) 10.686 2.778 ( -2.855 -3.995 6.709) 8.314 3.047 ( -2.910 2.391 7.850) 8.707 3.133 ( -1.459 -0.708 3.005) 3.414 3.282 ( 8.416 2.319 5.531) 10.335 3.350 ( 0.034 -0.307 5.021) 5.031 3.457 ( -2.547 1.937 2.041) 3.796 3.676 ( -4.096 4.777 0.584) 6.320 3.839 ( 8.432 -0.236 0.816) 8.475 5.795 ( -4.106 -1.908 5.812) 7.367 5.982 ( 6.004 -1.538 -7.308) 9.582 6.127 ( -2.581 1.627 12.201) 12.576 6.271 ( -12.202 -1.955 -2.080) 12.532 6.466 ( -1.123 0.838 1.900) 2.361 6.981 ( -10.221 -0.939 4.468) 11.195 7.263 ( -12.421 -0.579 -7.903) 14.734 7.393 ( -17.476 -2.300 -4.653) 18.230 7.937 ( -18.447 0.180 -12.469) 22.267 8.161 ( 7.541 0.919 16.934) 18.560 8.738 ( 1.867 -4.169 17.752) 18.331 8.946 ( -4.758 -0.363 5.769) 7.487 9.206 ( -1.985 0.738 15.564) 15.707 9.882 ( 8.321 4.479 16.907) 19.369 10.112 ( 2.426 -2.120 24.358) 24.570 11.018 ( -7.295 0.603 18.890) 20.259 11.619 ( -7.319 3.129 18.948) 20.552 12.067 ( -13.201 8.594 11.982) 19.791 12.234 ( 1.622 -4.995 -7.283) 8.979 12.912 ( 1.941 5.562 -10.316) 11.880 13.299 ( -0.290 -11.822 -12.410) 17.142 14.137 ( -0.148 7.367 -3.316) 8.080 14.344 ( -1.220 -4.464 -2.962) 5.495 14.717 ( -6.545 -1.423 7.652) 10.169 15.280 ( -8.819 -0.863 13.610) 16.240 20.761 ( 5.238 1.311 15.570) 16.480 20.801 ( 0.652 -0.562 22.527) 22.544 ======================= Grid point 548 (224/343) ======================= q-point: ( 0.69 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 1.100 -4.690 5.950) 7.656 2.881 ( -3.447 -1.744 1.968) 4.335 3.127 ( 2.913 2.840 1.323) 4.278 3.159 ( 0.873 0.517 1.376) 1.709 3.234 ( 6.732 -1.124 3.879) 7.851 3.399 ( 1.141 -0.168 2.161) 2.450 3.436 ( 3.845 -3.033 -0.243) 4.904 3.684 ( 7.874 3.029 1.090) 8.506 3.850 ( -4.159 4.923 2.509) 6.916 5.811 ( 1.988 -1.586 -6.707) 7.173 5.904 ( -2.952 -1.908 3.639) 5.060 6.281 ( 1.587 3.054 7.170) 7.953 6.324 ( -6.926 -0.426 -7.722) 10.382 6.487 ( 1.985 -0.811 1.773) 2.783 7.099 ( -11.208 0.807 -8.582) 14.140 7.331 ( -9.802 -0.368 -3.508) 10.417 7.518 ( -14.188 -0.019 -9.456) 17.050 8.004 ( -18.633 -0.819 -14.873) 23.855 8.229 ( 10.201 -1.761 11.547) 15.508 8.930 ( 3.779 -2.274 17.627) 18.171 9.069 ( -1.580 -0.720 6.151) 6.391 9.413 ( 4.213 1.173 16.356) 16.931 9.979 ( 11.223 1.483 14.392) 18.310 10.339 ( 8.953 -1.194 20.364) 22.277 11.281 ( 0.623 -0.211 11.388) 11.407 11.948 ( -6.720 2.297 11.240) 13.295 12.030 ( 2.465 -3.909 -4.545) 6.481 12.391 ( -3.618 5.932 2.931) 7.541 12.814 ( -1.726 -0.127 -5.971) 6.217 13.200 ( -9.823 -2.705 -3.180) 10.673 14.112 ( -1.634 4.988 -5.755) 7.789 14.293 ( -4.309 -2.934 -7.255) 8.934 14.893 ( -1.242 -3.357 9.859) 10.489 15.537 ( -3.148 0.965 11.464) 11.928 20.859 ( 8.683 0.341 13.485) 16.042 21.044 ( 5.535 -0.113 18.508) 19.319 ======================= Grid point 549 (225/343) ======================= q-point: (-0.23 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 1.474 -2.592 2.606) 3.960 2.871 ( 2.338 -1.095 -4.286) 5.003 3.034 ( 9.253 1.199 -1.919) 9.526 3.142 ( 4.783 0.471 -0.145) 4.809 3.230 ( -1.098 0.174 1.495) 1.863 3.322 ( 5.538 -1.973 -1.837) 6.159 3.417 ( 2.509 -1.234 1.837) 3.346 3.604 ( 7.146 1.224 1.483) 7.400 3.934 ( -0.070 3.767 2.148) 4.337 5.754 ( -2.934 -1.459 -1.890) 3.782 5.942 ( 1.062 -1.300 0.125) 1.684 6.240 ( -4.317 0.556 -13.994) 14.655 6.312 ( 9.843 1.684 5.915) 11.606 6.466 ( 1.528 0.533 -0.109) 1.623 7.100 ( -11.250 1.171 -13.190) 17.376 7.383 ( -4.718 1.223 -5.107) 7.059 7.529 ( -8.839 -0.223 -10.819) 13.973 8.035 ( -16.594 -1.150 -15.020) 22.411 8.193 ( 9.850 -3.297 4.276) 11.233 9.079 ( 9.745 -0.580 17.681) 20.197 9.136 ( 3.176 -0.716 5.018) 5.981 9.542 ( 7.910 0.887 14.631) 16.656 9.960 ( 17.545 -0.748 11.428) 20.952 10.396 ( 17.157 -0.252 14.392) 22.396 11.278 ( 9.867 -0.780 -0.255) 9.901 11.876 ( 5.583 -1.824 -3.994) 7.103 12.183 ( 0.865 -0.491 3.863) 3.989 12.384 ( -0.781 2.110 0.402) 2.285 12.806 ( -5.634 -2.024 -0.311) 5.994 13.431 ( -16.686 4.297 3.264) 17.537 14.051 ( -1.035 0.653 -7.737) 7.834 14.266 ( -8.388 0.650 -7.278) 11.124 14.972 ( 4.988 -3.771 7.209) 9.543 15.676 ( 2.641 1.514 8.151) 8.701 20.896 ( 11.425 -0.263 12.049) 16.607 21.137 ( 12.983 0.067 13.378) 18.642 ======================= Grid point 550 (226/343) ======================= q-point: (-0.15 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 4.439 -0.545 -0.820) 4.547 2.701 ( 7.577 -0.575 -10.184) 12.706 2.865 ( 10.836 -0.177 -2.312) 11.082 3.034 ( 7.843 -0.131 -2.112) 8.123 3.199 ( 7.263 2.158 -0.776) 7.616 3.296 ( -2.250 -1.970 0.885) 3.119 3.392 ( 1.584 -0.843 -0.148) 1.801 3.535 ( 4.714 0.580 -0.221) 4.754 3.930 ( 5.863 1.294 1.802) 6.268 5.809 ( -3.080 -0.653 2.368) 3.940 5.859 ( 5.778 -0.729 -4.475) 7.344 6.071 ( 2.665 0.800 -12.366) 12.676 6.220 ( 10.908 -0.082 3.302) 11.397 6.466 ( -2.714 1.267 -1.718) 3.453 7.063 ( -9.613 0.900 -14.194) 17.167 7.312 ( 1.595 1.180 -8.955) 9.172 7.493 ( -4.943 -0.135 -7.434) 8.929 8.030 ( 9.661 -0.734 -5.762) 11.273 8.051 ( -11.794 -1.957 -12.428) 17.245 9.097 ( 10.862 0.560 3.974) 11.580 9.113 ( 19.268 -0.817 15.167) 24.535 9.609 ( 8.728 1.109 11.079) 14.148 9.823 ( 21.891 -2.211 9.593) 24.003 10.268 ( 23.403 0.001 8.203) 24.799 11.053 ( 14.700 -0.504 -6.220) 15.969 11.702 ( 13.126 -0.929 -3.171) 13.535 11.997 ( 12.502 -1.298 -8.591) 15.224 12.554 ( -6.594 1.518 8.913) 11.191 12.935 ( -8.764 -1.089 4.315) 9.829 13.623 ( -11.335 2.668 -7.278) 13.732 13.940 ( 0.219 -1.347 -8.543) 8.651 14.391 ( -15.363 3.233 2.117) 15.841 14.932 ( 9.896 -3.379 4.222) 11.277 15.712 ( 6.076 1.123 5.996) 8.610 20.870 ( 14.261 -0.261 9.662) 17.227 21.043 ( 22.256 -0.036 7.710) 23.553 ======================= Grid point 551 (227/343) ======================= q-point: (-0.08 0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( 13.032 0.000 -13.526) 18.783 2.487 ( 13.837 0.000 -4.661) 14.601 2.695 ( 9.176 0.000 -2.064) 9.405 2.906 ( 7.794 0.000 -0.323) 7.801 3.084 ( 8.899 0.000 -1.150) 8.973 3.280 ( 4.939 0.000 0.385) 4.954 3.388 ( -1.196 -0.000 -1.374) 1.822 3.485 ( 0.102 0.000 -1.883) 1.886 3.841 ( 9.613 0.000 0.991) 9.664 5.693 ( 6.961 0.000 -5.606) 8.938 5.779 ( 12.655 0.000 0.497) 12.665 5.847 ( 8.171 0.000 -9.806) 12.764 6.217 ( -2.129 -0.000 6.721) 7.050 6.490 ( -3.106 -0.000 -1.732) 3.556 6.923 ( 5.595 0.000 -13.941) 15.022 7.182 ( -7.600 -0.000 -11.634) 13.896 7.448 ( 5.183 0.000 -2.260) 5.654 7.731 ( 9.710 0.000 -12.618) 15.921 8.075 ( -12.176 -0.000 -9.039) 15.165 8.928 ( 16.123 0.000 -1.911) 16.236 8.974 ( 31.473 0.000 15.423) 35.049 9.562 ( 15.827 0.000 2.458) 16.016 9.642 ( 21.565 0.000 9.105) 23.409 10.039 ( 21.513 0.000 6.459) 22.462 10.738 ( 17.403 0.000 -7.297) 18.871 11.416 ( 22.477 0.000 -3.223) 22.707 11.682 ( 16.151 0.000 -8.255) 18.138 12.758 ( -5.876 -0.000 8.090) 9.999 13.120 ( -8.958 -0.000 4.801) 10.163 13.592 ( -7.180 -0.000 -13.784) 15.542 13.823 ( 0.994 0.000 -6.750) 6.822 14.711 ( -17.332 -0.000 7.877) 19.038 14.811 ( 12.410 0.000 2.272) 12.617 15.713 ( 3.895 0.000 5.375) 6.638 20.739 ( 32.222 0.000 2.161) 32.294 20.763 ( 17.350 0.000 6.161) 18.412 ======================= Grid point 552 (228/343) ======================= q-point: ( 0.00 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.187 ( 18.111 0.000 -0.000) 18.111 2.415 ( 17.810 0.000 -0.000) 17.810 2.668 ( 10.165 0.000 -0.000) 10.165 2.908 ( 6.428 0.000 -0.000) 6.428 3.077 ( 12.392 0.000 -0.000) 12.392 3.286 ( 5.356 0.000 -0.000) 5.356 3.371 ( -0.173 -0.000 0.000) 0.173 3.443 ( -0.374 -0.000 0.000) 0.374 3.854 ( 10.482 0.000 -0.000) 10.482 5.606 ( 6.323 0.000 -0.000) 6.323 5.707 ( 10.123 0.000 -0.000) 10.123 5.789 ( 16.281 0.000 -0.000) 16.281 6.390 ( -5.717 -0.000 0.000) 5.717 6.464 ( -2.968 -0.000 0.000) 2.968 6.644 ( 6.337 0.000 -0.000) 6.337 7.002 ( -3.637 -0.000 0.000) 3.637 7.398 ( 2.106 0.000 -0.000) 2.106 7.553 ( 16.083 0.000 -0.000) 16.083 7.954 ( -12.092 -0.000 0.000) 12.092 8.911 ( 22.563 0.000 -0.000) 22.563 9.288 ( 34.840 0.000 -0.000) 34.840 9.495 ( 19.853 0.000 -0.000) 19.853 9.790 ( 19.896 0.000 -0.000) 19.896 10.150 ( 17.983 0.000 -0.000) 17.983 10.616 ( 18.110 0.000 -0.000) 18.110 11.377 ( 24.651 0.000 -0.000) 24.651 11.558 ( 17.164 0.000 -0.000) 17.164 12.903 ( -5.465 -0.000 0.000) 5.465 13.191 ( -9.848 -0.000 0.000) 9.848 13.350 ( -5.460 -0.000 0.000) 5.460 13.725 ( 0.889 0.000 -0.000) 0.889 14.830 ( -20.289 -0.000 0.000) 20.289 14.843 ( 12.661 0.000 -0.000) 12.661 15.789 ( 1.332 0.000 -0.000) 1.332 20.772 ( 36.790 0.000 -0.000) 36.790 20.857 ( 19.580 0.000 -0.000) 19.580 ======================= Grid point 558 (229/343) ======================= q-point: ( 0.46 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( -0.000 8.592 17.185) 19.213 2.566 ( -0.000 9.115 18.113) 20.277 2.893 ( 0.000 -13.118 12.010) 17.786 2.981 ( 0.000 -3.521 9.072) 9.731 3.131 ( -0.000 4.989 9.155) 10.426 3.245 ( -0.000 0.077 7.223) 7.224 3.379 ( -0.000 5.064 7.024) 8.659 3.665 ( 0.000 -10.262 0.331) 10.267 4.079 ( -0.000 4.620 -2.530) 5.267 5.606 ( -0.000 -0.388 23.788) 23.791 5.669 ( -0.000 -0.003 19.106) 19.106 5.683 ( -0.000 0.097 4.852) 4.853 6.263 ( 0.000 -2.319 5.269) 5.757 6.470 ( 0.000 -1.166 2.823) 3.054 6.663 ( -0.000 4.220 -6.973) 8.150 6.955 ( 0.000 -8.248 5.702) 10.028 7.086 ( 0.000 -4.265 -6.481) 7.759 7.660 ( 0.000 0.999 -13.908) 13.944 8.002 ( -0.000 3.208 26.313) 26.507 8.653 ( -0.000 0.035 7.439) 7.439 8.694 ( 0.000 -13.623 14.615) 19.980 8.756 ( -0.000 0.070 23.134) 23.135 9.783 ( -0.000 1.546 21.494) 21.550 9.941 ( -0.000 12.886 21.809) 25.331 10.345 ( -0.000 0.441 18.510) 18.515 11.096 ( -0.000 9.547 30.790) 32.236 11.354 ( -0.000 -0.493 17.334) 17.341 12.517 ( 0.000 -7.200 -11.035) 13.176 13.096 ( -0.000 7.643 -13.956) 15.911 13.629 ( 0.000 -14.101 -8.671) 16.554 14.117 ( -0.000 0.044 18.160) 18.161 14.259 ( -0.000 12.404 -4.443) 13.175 14.601 ( -0.000 0.103 16.551) 16.551 14.822 ( 0.000 -8.642 -18.315) 20.252 20.391 ( -0.000 -0.311 31.663) 31.665 20.632 ( -0.000 1.197 19.496) 19.533 ======================= Grid point 559 (230/343) ======================= q-point: ( 0.54 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( -2.972 5.775 13.069) 14.594 2.855 ( -5.220 6.841 13.391) 15.917 2.939 ( 6.146 -10.432 9.471) 15.372 3.101 ( -2.586 -3.570 5.865) 7.337 3.271 ( -2.630 5.902 6.859) 9.424 3.340 ( -0.382 0.055 5.941) 5.954 3.460 ( 4.162 4.116 6.502) 8.749 3.645 ( -1.019 -8.173 0.341) 8.243 4.032 ( 4.461 2.745 -1.441) 5.432 5.734 ( -0.423 -1.169 5.462) 5.601 5.898 ( -8.614 -0.447 4.065) 9.535 5.986 ( -5.304 1.317 18.445) 19.237 6.219 ( 3.666 -3.090 -5.959) 7.648 6.439 ( 1.499 3.254 -0.429) 3.609 6.680 ( -11.024 5.024 -5.147) 13.163 7.003 ( -6.882 -7.901 -4.813) 11.530 7.073 ( -3.874 -7.898 4.599) 9.927 7.542 ( -8.895 0.870 -12.737) 15.559 8.351 ( 4.871 4.268 26.455) 27.236 8.769 ( -4.383 -0.904 6.145) 7.602 8.844 ( 0.853 -9.832 15.861) 18.680 9.104 ( -3.495 0.589 22.257) 22.538 10.071 ( 5.113 7.423 21.189) 23.026 10.212 ( 7.192 3.413 24.976) 26.214 10.706 ( -12.231 2.805 18.756) 22.567 11.504 ( 0.587 5.242 24.288) 24.855 11.659 ( -9.712 3.971 17.661) 20.543 12.334 ( 1.121 -7.657 -10.321) 12.900 12.925 ( 1.601 7.644 -13.214) 15.349 13.419 ( 1.143 -15.157 -12.812) 19.879 14.169 ( 5.604 8.696 -2.884) 10.740 14.433 ( -2.018 -0.871 15.198) 15.356 14.557 ( 2.525 -3.463 -2.579) 5.002 14.964 ( -13.229 -1.397 14.132) 19.408 20.799 ( 0.048 -0.517 28.057) 28.062 20.880 ( 2.643 1.398 18.832) 19.068 ======================= Grid point 560 (231/343) ======================= q-point: ( 0.62 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( -1.369 0.611 9.272) 9.392 2.924 ( 6.032 -7.874 7.068) 12.180 3.084 ( -3.516 3.137 6.024) 7.648 3.173 ( -0.402 -1.521 4.080) 4.373 3.409 ( 0.238 0.940 3.589) 3.718 3.432 ( -3.705 5.355 5.644) 8.617 3.473 ( 7.026 3.051 5.436) 9.392 3.640 ( -1.232 -2.684 0.348) 2.974 3.950 ( 6.584 0.673 -0.217) 6.622 5.815 ( -3.519 -2.092 2.892) 5.012 5.891 ( 2.051 1.451 -10.853) 11.140 6.103 ( -6.413 -5.620 -3.635) 9.269 6.268 ( -2.724 5.764 7.212) 9.625 6.495 ( -3.160 1.022 4.335) 5.461 6.774 ( -11.890 1.608 -6.991) 13.887 7.023 ( -16.930 -3.927 -12.637) 21.488 7.132 ( -2.161 -4.100 0.203) 4.639 7.563 ( -13.565 -1.452 -7.292) 15.469 8.582 ( 11.813 3.609 21.128) 24.474 8.938 ( -5.818 -1.340 9.333) 11.079 9.019 ( 0.039 -7.038 15.021) 16.588 9.442 ( -1.220 1.773 21.606) 21.713 10.249 ( 11.056 7.740 18.865) 23.196 10.496 ( 3.347 -3.285 25.315) 25.746 11.126 ( -10.927 3.719 16.336) 20.002 11.800 ( -2.135 1.517 16.965) 17.166 12.034 ( -7.864 4.942 7.613) 12.009 12.190 ( -1.578 -3.569 -0.688) 3.963 12.772 ( 0.882 6.534 -9.633) 11.674 13.170 ( 0.529 -13.186 -13.084) 18.584 14.091 ( 3.196 5.998 -3.576) 7.680 14.349 ( 6.260 -3.480 -4.204) 8.305 14.802 ( -5.968 -1.282 16.586) 17.674 15.326 ( -10.951 0.008 13.966) 17.748 21.063 ( 6.001 1.130 17.357) 18.400 21.146 ( 2.178 -0.514 23.963) 24.067 ======================= Grid point 561 (232/343) ======================= q-point: ( 0.69 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.777 ( 2.653 -4.308 6.223) 8.021 2.914 ( 2.742 -3.365 3.083) 5.324 3.132 ( 0.591 0.084 -0.303) 0.669 3.222 ( 1.754 0.189 3.309) 3.750 3.401 ( 8.845 0.797 3.168) 9.429 3.442 ( 3.161 0.817 0.834) 3.369 3.518 ( 2.431 -2.595 4.018) 5.366 3.712 ( -2.953 9.391 1.841) 10.015 3.871 ( 4.457 -0.305 1.311) 4.656 5.722 ( 0.147 -0.906 -8.785) 8.833 5.890 ( -5.168 -2.378 -0.268) 5.695 6.111 ( -4.872 -3.031 -5.627) 8.036 6.364 ( -1.571 8.870 0.224) 9.011 6.564 ( -2.551 -1.575 -2.035) 3.623 6.843 ( -5.288 -1.426 -0.009) 5.477 7.070 ( -19.095 -0.582 -16.272) 25.095 7.132 ( -10.831 -0.608 -9.935) 14.710 7.660 ( -10.999 -2.039 -3.358) 11.679 8.622 ( 16.561 0.187 12.884) 20.983 9.148 ( -2.060 -1.234 12.905) 13.127 9.198 ( -0.154 -3.926 14.359) 14.887 9.714 ( 3.648 1.921 19.381) 19.814 10.351 ( 12.179 2.194 16.257) 20.431 10.732 ( 7.260 -2.478 20.514) 21.902 11.414 ( -1.800 1.810 9.056) 9.409 11.939 ( -0.914 -1.438 -3.743) 4.113 12.098 ( -3.049 -1.899 11.345) 11.900 12.373 ( -2.166 6.724 3.643) 7.948 12.711 ( -2.490 1.236 -4.188) 5.026 13.037 ( -7.720 -4.216 -3.745) 9.561 14.024 ( 1.274 3.374 -4.560) 5.814 14.198 ( 2.920 -2.100 -7.337) 8.171 15.049 ( -0.875 -2.685 13.359) 13.654 15.613 ( -6.143 1.072 10.456) 12.174 21.184 ( 9.206 0.302 15.520) 18.047 21.387 ( 5.889 -0.084 19.475) 20.346 ======================= Grid point 562 (233/343) ======================= q-point: (-0.23 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( 4.794 -4.901 3.448) 7.674 2.870 ( 4.397 -1.760 -2.604) 5.405 3.103 ( 3.041 0.353 -0.598) 3.119 3.201 ( 4.113 -0.836 -0.153) 4.200 3.306 ( 8.595 -0.443 1.861) 8.805 3.390 ( 5.925 2.702 0.233) 6.516 3.511 ( 4.159 -3.717 3.424) 6.545 3.706 ( 7.030 3.336 0.091) 7.782 3.921 ( -3.343 5.294 2.454) 6.725 5.670 ( -5.163 -1.554 -2.911) 6.128 5.920 ( -4.386 -1.815 -4.386) 6.463 6.056 ( 0.353 -1.123 -5.300) 5.429 6.391 ( -0.841 7.319 -3.224) 8.042 6.512 ( 0.149 -2.399 -5.584) 6.080 6.860 ( 1.153 -0.212 -1.753) 2.109 7.103 ( -18.326 1.829 -15.399) 24.007 7.182 ( -14.332 -0.599 -8.933) 16.899 7.733 ( -7.819 -1.520 -3.985) 8.907 8.505 ( 18.521 -3.173 6.431) 19.861 9.298 ( 4.194 -0.962 11.192) 11.991 9.380 ( 1.417 -1.240 14.602) 14.723 9.869 ( 9.320 1.470 15.369) 18.034 10.356 ( 15.516 -2.001 11.809) 19.601 10.812 ( 14.993 -1.312 14.055) 20.592 11.392 ( 9.198 -0.642 -2.891) 9.663 11.914 ( 1.401 -2.421 0.656) 2.873 12.251 ( 3.487 0.197 1.090) 3.659 12.383 ( -1.594 3.541 3.880) 5.490 12.723 ( -6.667 -3.162 -0.121) 7.380 13.235 ( -14.270 5.608 2.775) 15.582 13.951 ( 0.415 -0.086 -5.883) 5.898 14.081 ( -3.488 0.823 -7.672) 8.468 15.160 ( 4.734 -3.614 8.600) 10.461 15.779 ( -0.778 1.696 6.549) 6.810 21.234 ( 11.993 -0.336 13.011) 17.699 21.500 ( 11.666 0.165 14.316) 18.468 ======================= Grid point 563 (234/343) ======================= q-point: (-0.15 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.706 ( 9.226 -1.530 -5.842) 11.027 2.716 ( 5.591 -3.006 0.478) 6.366 3.004 ( 10.651 0.138 -0.426) 10.660 3.108 ( 6.384 -1.489 -1.622) 6.753 3.265 ( 0.794 1.014 1.087) 1.685 3.317 ( 7.352 2.947 1.094) 7.996 3.469 ( 5.253 -3.567 1.899) 6.627 3.605 ( 7.447 1.310 -1.338) 7.678 3.989 ( 0.669 3.908 1.633) 4.288 5.764 ( -8.319 -0.451 2.597) 8.726 5.859 ( 1.674 -1.641 -5.980) 6.423 5.968 ( 2.252 -0.186 -4.774) 5.281 6.347 ( 2.065 3.131 -4.791) 6.085 6.431 ( 1.007 -0.302 -2.805) 2.995 6.789 ( -1.413 -0.062 -7.785) 7.912 7.171 ( -14.018 3.587 -9.095) 17.091 7.223 ( -5.938 -0.400 -6.216) 8.606 7.765 ( -8.014 -1.421 -5.401) 9.768 8.273 ( 21.313 -3.708 0.889) 21.651 9.318 ( 11.369 -0.730 7.513) 13.646 9.522 ( 6.732 1.007 13.542) 15.156 9.887 ( 13.349 1.267 9.323) 16.331 10.239 ( 18.930 -5.136 7.913) 21.150 10.694 ( 22.957 -0.676 7.456) 24.147 11.164 ( 13.501 -0.705 -5.947) 14.770 11.846 ( 9.342 -2.009 0.689) 9.580 12.064 ( 11.509 -1.533 -6.319) 13.218 12.575 ( -6.162 5.183 8.402) 11.638 12.858 ( -10.431 -3.670 3.232) 11.521 13.384 ( -7.452 3.842 -6.704) 10.735 13.850 ( 0.940 -1.460 -6.304) 6.539 14.173 ( -16.455 4.319 0.296) 17.015 15.135 ( 9.268 -4.141 4.355) 11.046 15.834 ( 3.278 1.750 3.706) 5.248 21.204 ( 14.711 -0.492 9.291) 17.406 21.447 ( 19.524 0.078 8.647) 21.353 ======================= Grid point 564 (235/343) ======================= q-point: (-0.08 0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 14.209 -1.132 -5.704) 15.353 2.611 ( 9.525 -0.729 -0.969) 9.602 2.832 ( 12.661 -0.362 -0.531) 12.677 2.997 ( 6.677 -0.496 -0.576) 6.721 3.218 ( 10.443 4.095 1.358) 11.299 3.304 ( -2.740 -1.251 -0.083) 3.013 3.401 ( 5.119 -2.371 0.531) 5.666 3.493 ( 5.282 0.578 -1.993) 5.675 3.967 ( 6.391 1.363 0.755) 6.578 5.721 ( 6.371 -0.245 -3.606) 7.325 5.850 ( 5.900 0.348 -4.244) 7.276 5.903 ( 0.152 -0.478 3.221) 3.260 6.287 ( -0.093 0.366 1.605) 1.649 6.421 ( -2.863 1.386 -1.178) 3.393 6.711 ( -4.916 -0.328 -9.573) 10.767 7.111 ( 8.667 1.497 -4.048) 9.682 7.295 ( -13.573 1.025 -4.549) 14.351 7.824 ( -11.099 -0.874 -3.878) 11.789 7.926 ( 26.106 -2.218 -2.434) 26.312 9.182 ( 18.270 -0.348 2.518) 18.446 9.541 ( 19.312 1.793 13.208) 23.465 9.761 ( 15.214 2.787 -1.169) 15.511 10.039 ( 19.873 -6.867 5.014) 21.616 10.422 ( 25.160 -0.340 3.163) 25.361 10.885 ( 16.332 -0.063 -4.502) 16.942 11.664 ( 16.791 -1.509 -0.243) 16.861 11.807 ( 14.730 -0.386 -4.278) 15.344 12.775 ( -5.764 3.268 6.230) 9.095 13.035 ( -10.970 -2.565 2.426) 11.524 13.348 ( -5.051 0.923 -8.969) 10.335 13.764 ( 0.881 -0.790 -3.703) 3.888 14.495 ( -22.179 5.079 3.022) 22.953 15.013 ( 11.758 -4.286 1.559) 12.612 15.819 ( 4.664 1.206 1.974) 5.206 21.079 ( 17.378 -0.243 4.584) 17.974 21.201 ( 28.622 -0.129 3.265) 28.808 ======================= Grid point 572 (236/343) ======================= q-point: ( 0.54 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( -0.000 7.029 11.593) 13.558 2.960 ( 0.000 5.006 10.654) 11.771 3.134 ( -0.000 -1.600 3.188) 3.567 3.179 ( -0.000 -11.667 9.028) 14.752 3.311 ( 0.000 5.051 4.736) 6.924 3.425 ( 0.000 -1.349 6.242) 6.386 3.560 ( 0.000 4.548 6.112) 7.618 3.674 ( 0.000 -7.910 0.398) 7.920 4.029 ( -0.000 3.154 -1.390) 3.446 5.779 ( -0.000 -1.218 1.687) 2.081 5.875 ( 0.000 -0.586 -3.004) 3.061 6.113 ( -0.000 5.351 6.473) 8.399 6.116 ( -0.000 -4.031 -12.620) 13.248 6.405 ( -0.000 5.763 -3.879) 6.947 6.551 ( 0.000 0.907 3.079) 3.209 6.825 ( 0.000 -6.401 -13.160) 14.634 7.277 ( -0.000 -9.531 13.523) 16.544 7.293 ( -0.000 1.483 -12.089) 12.179 8.725 ( -0.000 4.900 25.363) 25.832 8.834 ( 0.000 -1.204 8.536) 8.620 9.096 ( -0.000 -10.118 14.555) 17.726 9.394 ( -0.000 1.316 23.251) 23.288 10.356 ( -0.000 13.268 19.350) 23.461 10.610 ( -0.000 2.479 26.715) 26.830 10.837 ( 0.000 0.486 16.879) 16.886 11.778 ( -0.000 -0.465 13.750) 13.757 11.830 ( 0.000 6.012 21.359) 22.189 12.245 ( -0.000 -8.760 -7.588) 11.590 12.735 ( 0.000 8.671 -11.126) 14.106 13.295 ( -0.000 -14.695 -14.519) 20.657 14.118 ( 0.000 7.040 -4.156) 8.175 14.541 ( 0.000 -3.921 -7.208) 8.205 14.689 ( 0.000 0.036 22.416) 22.416 15.101 ( -0.000 0.097 19.108) 19.108 21.138 ( 0.000 1.003 19.282) 19.308 21.180 ( 0.000 -0.340 24.659) 24.662 ======================= Grid point 573 (237/343) ======================= q-point: ( 0.62 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( -0.551 4.931 8.667) 9.986 3.077 ( 0.711 -1.191 2.578) 2.928 3.158 ( 2.620 -1.799 6.885) 7.583 3.241 ( 0.655 -5.416 5.466) 7.722 3.403 ( -1.806 6.339 3.487) 7.457 3.500 ( -0.368 -1.275 5.215) 5.381 3.614 ( 4.856 2.964 4.552) 7.286 3.661 ( 0.202 -4.740 1.427) 4.954 4.000 ( 2.785 1.473 -1.022) 3.312 5.754 ( 1.776 1.435 -9.388) 9.661 5.809 ( -1.296 -0.724 -2.253) 2.698 5.955 ( -6.547 -4.565 -10.883) 13.496 6.203 ( -5.436 2.626 -1.474) 6.215 6.406 ( -2.571 7.474 -3.385) 8.598 6.629 ( -8.740 -1.547 -4.332) 9.876 6.664 ( -7.930 -4.062 -13.574) 16.237 7.144 ( 4.904 -0.353 -2.251) 5.407 7.459 ( -5.567 -6.176 8.157) 11.648 8.933 ( 5.526 1.138 12.587) 13.793 9.074 ( -1.905 1.161 20.353) 20.475 9.250 ( 1.128 -6.794 13.548) 15.197 9.714 ( -1.095 1.651 21.325) 21.416 10.593 ( 7.959 11.639 16.939) 22.039 10.899 ( 4.588 -3.800 23.251) 24.002 11.160 ( -11.296 3.507 14.411) 18.644 11.948 ( 0.365 -1.509 2.876) 3.268 12.006 ( -4.732 -2.230 3.489) 6.288 12.246 ( -0.972 2.795 11.541) 11.914 12.649 ( 0.199 6.931 -4.968) 8.530 13.062 ( 0.686 -12.537 -10.523) 16.382 14.064 ( 2.287 3.573 -3.853) 5.730 14.378 ( 6.366 -2.018 -7.701) 10.193 15.000 ( -2.235 -0.336 19.592) 19.722 15.401 ( -6.639 0.170 15.846) 17.182 21.360 ( 3.583 0.871 16.720) 17.122 21.485 ( 1.580 -0.435 21.442) 21.504 ======================= Grid point 574 (238/343) ======================= q-point: ( 0.69 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.889 ( 1.284 0.511 5.715) 5.880 3.036 ( 5.380 -4.269 1.029) 6.944 3.174 ( 3.746 -3.870 2.889) 6.112 3.283 ( 0.828 -2.212 2.576) 3.495 3.468 ( 1.629 4.981 1.830) 5.551 3.559 ( 4.375 0.792 2.612) 5.156 3.607 ( 1.996 2.538 4.582) 5.605 3.676 ( -0.194 2.206 2.281) 3.180 3.944 ( 4.266 -0.095 -0.252) 4.274 5.599 ( -0.511 -1.219 -8.797) 8.896 5.795 ( -3.743 -2.618 -4.414) 6.352 5.955 ( -10.593 1.556 -7.799) 13.246 6.236 ( -4.349 -0.295 -4.446) 6.226 6.412 ( -4.337 4.448 -6.077) 8.691 6.583 ( -14.771 -0.278 -15.228) 21.217 6.710 ( -15.007 -0.783 -11.182) 18.731 7.095 ( 7.355 -0.656 7.408) 10.459 7.594 ( -4.201 -3.400 4.376) 6.954 8.967 ( 12.465 0.392 9.191) 15.492 9.358 ( -0.863 -1.346 18.305) 18.375 9.384 ( 1.000 -3.498 11.562) 12.121 9.989 ( 0.813 1.611 17.331) 17.425 10.698 ( 10.408 3.906 13.071) 17.159 11.100 ( 5.933 -3.483 17.982) 19.253 11.463 ( -5.634 3.446 7.700) 10.145 11.848 ( -2.781 -3.229 -7.363) 8.507 12.202 ( -5.059 -1.231 9.698) 11.008 12.390 ( 0.658 5.981 3.620) 7.022 12.637 ( -0.653 2.253 -1.786) 2.948 12.969 ( -2.574 -5.236 2.854) 6.495 13.984 ( 2.423 1.716 -4.544) 5.428 14.163 ( 6.745 -1.159 -9.482) 11.694 15.243 ( 0.481 -1.301 14.163) 14.231 15.670 ( -5.458 0.705 10.715) 12.045 21.499 ( 7.008 0.247 14.011) 15.667 21.705 ( 4.189 -0.066 16.662) 17.181 ======================= Grid point 575 (239/343) ======================= q-point: (-0.23 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.901 ( 4.694 -3.538 2.624) 6.437 2.941 ( 7.177 -4.113 -0.151) 8.274 3.138 ( 2.972 -1.690 0.835) 3.519 3.255 ( 3.268 -3.772 -0.370) 5.005 3.457 ( 6.163 5.011 1.510) 8.085 3.473 ( 9.631 1.831 1.389) 9.901 3.631 ( 3.722 -3.845 3.615) 6.458 3.744 ( 0.546 8.859 0.202) 8.878 3.904 ( 0.399 1.315 1.061) 1.736 5.555 ( -6.379 -2.774 -3.134) 7.629 5.780 ( -4.975 -1.881 -5.238) 7.465 5.994 ( -6.358 3.076 -5.866) 9.182 6.204 ( -3.700 -1.533 -6.944) 8.017 6.397 ( -4.700 0.958 -6.214) 7.850 6.643 ( -17.851 3.484 -10.103) 20.805 6.737 ( -13.060 -0.422 -12.298) 17.944 7.126 ( 5.633 0.029 9.434) 10.988 7.665 ( -2.409 -1.499 0.734) 2.931 8.846 ( 18.362 -2.402 5.000) 19.182 9.508 ( 1.742 0.128 9.645) 9.801 9.567 ( 0.703 -3.199 13.253) 13.652 10.154 ( 5.323 1.254 11.928) 13.122 10.690 ( 12.152 -2.668 7.965) 14.773 11.176 ( 11.331 -2.168 11.405) 16.222 11.457 ( 7.433 0.061 -3.750) 8.326 11.907 ( -7.583 -1.059 1.973) 7.907 12.288 ( 3.896 2.303 -1.879) 4.900 12.439 ( -0.118 0.728 6.563) 6.605 12.652 ( -5.604 -0.813 0.536) 5.687 13.128 ( -6.213 4.188 6.848) 10.150 13.895 ( 0.988 0.075 -4.992) 5.089 13.958 ( 2.774 -0.253 -9.116) 9.532 15.352 ( 4.806 -2.414 8.171) 9.782 15.836 ( -1.993 1.330 5.801) 6.277 21.548 ( 10.051 -0.316 10.263) 14.369 21.812 ( 8.278 0.227 11.249) 13.968 ======================= Grid point 576 (240/343) ======================= q-point: (-0.15 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( 9.518 -2.764 -1.976) 10.106 2.832 ( 7.243 -5.305 1.077) 9.042 3.102 ( 3.960 -0.276 0.143) 3.973 3.176 ( 4.843 -3.237 -0.806) 5.881 3.342 ( 9.155 0.016 0.697) 9.182 3.419 ( 7.361 7.972 1.107) 10.907 3.589 ( 5.389 -5.274 1.974) 7.795 3.685 ( 7.685 2.934 -1.192) 8.312 3.970 ( -3.052 5.679 0.965) 6.518 5.663 ( -11.214 -1.758 1.609) 11.465 5.774 ( -3.604 -1.551 -3.357) 5.164 5.973 ( 1.709 0.917 -2.822) 3.424 6.165 ( -6.526 -0.491 -7.440) 9.908 6.383 ( -1.840 0.777 -2.740) 3.391 6.719 ( -4.461 0.187 -6.237) 7.671 6.814 ( -18.315 3.126 -4.827) 19.197 7.176 ( 1.565 1.472 3.993) 4.534 7.676 ( -1.173 -1.040 -1.279) 2.024 8.604 ( 21.761 -4.164 1.547) 22.210 9.559 ( 8.113 0.481 5.952) 10.074 9.684 ( 0.247 -0.971 6.644) 6.719 10.168 ( 11.225 0.919 5.883) 12.707 10.569 ( 14.459 -7.128 3.704) 16.541 11.074 ( 19.027 -1.505 4.902) 19.706 11.270 ( 11.644 -0.037 -3.459) 12.147 11.964 ( 2.975 -2.854 1.686) 4.454 12.148 ( 9.600 -0.422 -3.280) 10.154 12.563 ( -4.216 9.064 4.625) 11.015 12.786 ( -10.005 -6.154 3.163) 12.165 13.237 ( -1.441 5.044 -2.164) 5.674 13.809 ( 2.041 -1.296 -3.566) 4.308 13.944 ( -12.471 3.045 -2.019) 12.995 15.324 ( 8.603 -3.449 3.176) 9.798 15.897 ( 1.308 1.749 2.212) 3.109 21.498 ( 12.919 -0.587 5.416) 14.020 21.776 ( 14.248 0.247 5.413) 15.243 ======================= Grid point 577 (241/343) ======================= q-point: (-0.08 0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 12.733 -2.238 0.000) 12.928 2.724 ( 7.247 -3.118 0.000) 7.890 2.999 ( 11.123 -0.179 0.000) 11.124 3.084 ( 6.267 -1.636 0.000) 6.477 3.279 ( 0.528 -0.502 0.000) 0.729 3.345 ( 8.990 7.498 -0.000) 11.706 3.503 ( 6.141 -5.554 0.000) 8.280 3.569 ( 8.252 1.403 -0.000) 8.370 4.012 ( 0.897 3.975 -0.000) 4.075 5.755 ( 1.404 0.306 -0.000) 1.437 5.848 ( -9.111 -0.041 -0.000) 9.111 5.904 ( 3.411 -2.066 0.000) 3.988 6.203 ( -7.333 0.543 -0.000) 7.353 6.384 ( -0.850 1.125 -0.000) 1.410 6.673 ( 4.013 -0.204 0.000) 4.018 7.039 ( -17.666 2.218 -0.000) 17.804 7.178 ( 3.772 2.417 -0.000) 4.480 7.692 ( -4.920 -1.410 0.000) 5.118 8.279 ( 24.958 -3.834 0.000) 25.251 9.438 ( 15.021 -0.549 0.000) 15.031 9.727 ( 1.911 3.288 -0.000) 3.803 10.010 ( 18.358 0.705 -0.000) 18.372 10.352 ( 16.855 -9.385 0.000) 19.292 10.795 ( 25.240 -0.924 0.000) 25.257 11.065 ( 14.674 0.323 -0.000) 14.678 11.864 ( 11.036 -3.042 0.000) 11.448 11.967 ( 12.944 -0.055 0.000) 12.944 12.714 ( -6.508 9.592 -0.000) 11.592 12.925 ( -10.808 -8.325 0.000) 13.642 13.230 ( -1.677 3.045 -0.000) 3.476 13.757 ( 1.424 -0.984 0.000) 1.731 14.194 ( -20.999 5.288 -0.000) 21.655 15.195 ( 10.869 -4.230 0.000) 11.663 15.884 ( 3.546 1.772 -0.000) 3.964 21.339 ( 15.556 -0.520 0.000) 15.564 21.569 ( 21.627 0.043 0.000) 21.627 ======================= Grid point 586 (242/343) ======================= q-point: ( 0.62 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.868 ( -0.000 6.052 7.049) 9.290 3.111 ( 0.000 -2.506 1.324) 2.834 3.234 ( -0.000 2.627 4.245) 4.992 3.379 ( -0.000 -10.463 5.716) 11.922 3.415 ( 0.000 5.992 3.368) 6.874 3.554 ( 0.000 -2.582 2.086) 3.320 3.698 ( 0.000 3.649 3.872) 5.321 3.707 ( 0.000 -4.133 2.751) 4.964 3.995 ( -0.000 1.982 -1.212) 2.323 5.619 ( 0.000 9.024 -11.068) 14.281 5.728 ( -0.000 -8.258 -10.690) 13.508 5.781 ( -0.000 -3.455 -4.678) 5.816 6.124 ( 0.000 -1.601 -5.721) 5.941 6.328 ( -0.000 13.061 -1.629) 13.162 6.395 ( 0.000 -6.749 -13.374) 14.981 6.487 ( -0.000 -0.720 -11.325) 11.348 7.199 ( -0.000 1.494 4.706) 4.937 7.576 ( -0.000 -6.489 8.096) 10.376 9.130 ( 0.000 -1.495 11.682) 11.777 9.334 ( -0.000 0.017 18.116) 18.116 9.454 ( -0.000 -2.119 12.552) 12.730 9.970 ( -0.000 1.678 18.210) 18.287 10.810 ( -0.000 12.677 13.344) 18.406 11.225 ( 0.000 0.275 11.355) 11.358 11.254 ( -0.000 -3.698 18.862) 19.221 11.863 ( -0.000 -4.118 -11.596) 12.305 12.087 ( -0.000 -0.339 8.891) 8.897 12.374 ( 0.000 2.661 6.589) 7.106 12.619 ( 0.000 3.572 3.430) 4.952 13.016 ( -0.000 -7.175 -1.324) 7.296 14.015 ( 0.000 1.948 -4.343) 4.760 14.299 ( 0.000 -1.231 -11.056) 11.124 15.243 ( 0.000 0.073 17.203) 17.203 15.569 ( -0.000 0.039 14.430) 14.430 21.593 ( 0.000 0.539 14.186) 14.196 21.759 ( 0.000 -0.273 17.001) 17.004 ======================= Grid point 587 (243/343) ======================= q-point: ( 0.69 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.965 ( 0.624 4.375 4.625) 6.396 3.094 ( 1.986 -3.451 -0.194) 3.986 3.283 ( 1.218 -1.249 2.454) 3.011 3.367 ( 4.487 -8.348 3.358) 10.055 3.487 ( 0.055 7.131 2.753) 7.644 3.570 ( -1.288 0.894 0.404) 1.619 3.710 ( 4.965 2.151 2.688) 6.042 3.738 ( 1.307 -1.833 3.211) 3.922 3.974 ( 1.485 0.483 -0.865) 1.785 5.495 ( 0.546 -1.134 -7.092) 7.203 5.627 ( -8.459 1.889 -10.588) 13.683 5.743 ( -2.306 -0.950 -3.149) 4.017 6.068 ( -10.953 -1.306 -11.271) 15.770 6.240 ( -0.065 -6.209 -5.122) 8.050 6.363 ( -4.311 2.814 -6.942) 8.642 6.401 ( -6.474 5.856 -5.790) 10.476 7.262 ( 2.572 1.895 6.070) 6.860 7.647 ( -0.246 -4.731 4.704) 6.677 9.221 ( 7.191 -0.787 8.435) 11.112 9.508 ( -0.960 -2.783 8.192) 8.705 9.633 ( 2.255 -0.074 15.650) 15.812 10.193 ( -0.172 1.582 12.987) 13.084 10.940 ( 6.565 6.264 7.820) 11.979 11.363 ( 1.164 -1.337 9.846) 10.005 11.481 ( -5.117 -0.932 9.307) 10.661 11.705 ( -1.547 -2.054 -9.463) 9.806 12.231 ( -5.773 -0.254 6.350) 8.585 12.400 ( 0.863 2.614 -2.144) 3.489 12.665 ( 2.559 -0.503 4.340) 5.063 13.080 ( 0.877 -1.233 11.928) 12.024 13.937 ( 1.630 1.053 -6.309) 6.600 14.107 ( 4.490 -1.004 -10.894) 11.826 15.436 ( 1.081 -0.245 11.629) 11.682 15.754 ( -2.353 0.203 9.429) 9.720 21.736 ( 3.568 0.170 10.267) 10.871 21.941 ( 1.999 -0.043 11.768) 11.937 ======================= Grid point 588 (244/343) ======================= q-point: (-0.23 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.997 ( 3.392 -0.767 2.199) 4.114 3.032 ( 4.135 -2.652 -0.489) 4.937 3.236 ( 6.373 -5.317 1.186) 8.384 3.312 ( 3.152 -6.379 0.268) 7.120 3.514 ( 3.937 7.962 1.237) 8.968 3.598 ( 3.886 2.409 0.564) 4.607 3.688 ( 0.877 7.968 1.222) 8.109 3.739 ( 2.461 -2.802 1.748) 4.119 3.937 ( 2.631 -0.486 -0.201) 2.683 5.449 ( -5.813 -6.918 -2.304) 9.326 5.645 ( -6.760 4.700 -4.850) 9.556 5.760 ( -7.345 3.674 -4.243) 9.243 6.116 ( -13.991 -0.995 -7.706) 16.003 6.182 ( -2.431 -8.792 -1.282) 9.212 6.378 ( -10.694 1.848 -5.752) 12.283 6.465 ( -6.322 6.762 -2.079) 9.488 7.299 ( 4.284 2.183 4.651) 6.689 7.673 ( 0.185 -2.952 1.274) 3.221 9.144 ( 15.231 -1.477 3.548) 15.709 9.595 ( -0.823 0.023 4.182) 4.262 9.772 ( 2.469 -3.732 9.383) 10.396 10.322 ( 1.814 1.238 6.518) 6.879 10.913 ( 8.748 -1.364 2.940) 9.329 11.407 ( 5.742 0.184 3.590) 6.774 11.518 ( 6.143 -2.058 0.025) 6.479 11.770 ( -13.779 0.877 0.804) 13.830 12.307 ( 3.346 1.745 -1.441) 4.039 12.446 ( -10.440 -1.010 2.594) 10.805 12.658 ( 5.449 1.219 2.690) 6.198 13.229 ( 2.888 2.488 10.775) 11.429 13.807 ( 1.307 1.080 -9.015) 9.173 13.927 ( 4.451 -1.865 -4.516) 6.609 15.514 ( 4.111 -1.103 5.270) 6.774 15.875 ( -1.660 0.696 4.004) 4.390 21.772 ( 6.888 -0.218 5.463) 8.795 22.018 ( 4.753 0.205 6.002) 7.658 ======================= Grid point 589 (245/343) ======================= q-point: (-0.15 0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.912 ( 7.816 -3.549 0.000) 8.584 2.958 ( 6.372 -4.798 0.000) 7.977 3.153 ( 4.091 -2.037 0.000) 4.570 3.244 ( 3.808 -5.086 0.000) 6.354 3.483 ( 7.050 6.935 -0.000) 9.889 3.493 ( 9.666 2.442 -0.000) 9.970 3.689 ( 4.195 -4.870 0.000) 6.428 3.735 ( 2.341 8.316 -0.000) 8.639 3.920 ( -1.190 2.458 -0.000) 2.731 5.530 ( -10.787 -5.680 0.000) 12.191 5.698 ( -4.632 0.028 -0.000) 4.632 5.861 ( -8.565 7.272 -0.000) 11.236 6.117 ( 0.748 -5.865 0.000) 5.912 6.281 ( -11.073 -2.516 0.000) 11.355 6.512 ( -13.372 3.776 -0.000) 13.895 6.580 ( -10.957 3.186 -0.000) 11.411 7.271 ( 6.082 2.079 -0.000) 6.428 7.668 ( -0.025 -1.601 0.000) 1.601 8.915 ( 19.873 -3.255 0.000) 20.138 9.639 ( 0.080 2.552 -0.000) 2.553 9.777 ( 3.576 -5.185 0.000) 6.298 10.320 ( 5.768 0.918 -0.000) 5.840 10.786 ( 10.893 -5.713 0.000) 12.300 11.319 ( 11.157 0.123 0.000) 11.158 11.397 ( 10.069 -1.851 0.000) 10.237 11.946 ( -8.804 -0.744 0.000) 8.836 12.232 ( 6.328 1.348 -0.000) 6.469 12.558 ( 0.890 2.233 -0.000) 2.404 12.679 ( -9.094 0.346 -0.000) 9.101 13.253 ( 5.123 4.197 -0.000) 6.623 13.766 ( -4.862 1.411 -0.000) 5.063 13.845 ( 2.150 -1.810 0.000) 2.810 15.465 ( 6.972 -2.263 0.000) 7.330 15.916 ( -0.181 1.298 -0.000) 1.311 21.693 ( 10.059 -0.496 0.000) 10.071 21.969 ( 8.873 0.320 -0.000) 8.879 ======================= Grid point 600 (246/343) ======================= q-point: ( 0.69 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.997 ( -0.000 5.604 2.441) 6.112 3.124 ( 0.000 -4.736 0.125) 4.738 3.310 ( -0.000 0.969 1.289) 1.613 3.486 ( -0.000 -9.785 2.029) 9.993 3.496 ( 0.000 5.776 2.493) 6.291 3.552 ( 0.000 0.336 -1.314) 1.356 3.767 ( 0.000 2.763 1.267) 3.039 3.791 ( 0.000 -2.300 2.210) 3.189 3.968 ( -0.000 1.105 -0.635) 1.275 5.399 ( 0.000 12.598 -4.335) 13.323 5.470 ( -0.000 -13.860 -5.530) 14.923 5.710 ( -0.000 -1.160 -1.555) 1.940 5.835 ( 0.000 0.174 -8.694) 8.696 6.177 ( -0.000 -1.422 -6.164) 6.325 6.274 ( 0.000 -12.086 -1.621) 12.194 6.305 ( -0.000 16.530 -0.311) 16.533 7.326 ( -0.000 2.887 2.836) 4.047 7.717 ( -0.000 -4.269 2.500) 4.947 9.372 ( 0.000 -1.296 5.036) 5.200 9.590 ( -0.000 -1.765 3.666) 4.069 9.827 ( -0.000 -0.333 10.092) 10.098 10.322 ( -0.000 1.639 6.935) 7.126 11.030 ( -0.000 7.149 2.726) 7.651 11.436 ( 0.000 0.090 4.003) 4.004 11.553 ( -0.000 -2.829 -1.049) 3.017 11.623 ( 0.000 -2.420 1.082) 2.651 12.251 ( -0.000 -0.241 3.096) 3.105 12.360 ( 0.000 0.569 -3.077) 3.129 12.768 ( 0.000 -3.270 5.080) 6.042 13.266 ( 0.000 5.103 13.110) 14.068 13.839 ( 0.000 -1.336 -9.312) 9.407 14.016 ( -0.000 -0.600 -6.410) 6.438 15.569 ( 0.000 0.102 6.306) 6.306 15.842 ( -0.000 -0.008 5.251) 5.251 21.867 ( 0.000 0.062 5.408) 5.408 22.075 ( 0.000 0.014 6.017) 6.017 ======================= Grid point 601 (247/343) ======================= q-point: (-0.23 0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.031 ( 0.571 4.465 -0.000) 4.501 3.089 ( 2.705 -4.530 0.000) 5.276 3.311 ( 1.201 -2.681 0.000) 2.938 3.413 ( 5.805 -9.076 0.000) 10.774 3.538 ( 2.201 8.144 -0.000) 8.436 3.563 ( -3.070 3.205 -0.000) 4.438 3.745 ( 5.309 2.921 -0.000) 6.060 3.790 ( 1.268 -2.683 0.000) 2.967 3.961 ( 0.906 -0.016 0.000) 0.906 5.403 ( -3.211 -12.001 0.000) 12.423 5.466 ( -6.428 12.995 -0.000) 14.498 5.688 ( -0.595 -0.501 0.000) 0.778 5.870 ( -11.980 -0.524 0.000) 11.991 6.171 ( -4.840 -3.269 0.000) 5.840 6.231 ( -3.150 -9.221 0.000) 9.744 6.374 ( -1.898 13.053 -0.000) 13.190 7.351 ( 1.019 3.066 -0.000) 3.231 7.710 ( 1.232 -3.911 0.000) 4.100 9.342 ( 8.779 -1.099 0.000) 8.848 9.615 ( -0.486 -0.668 0.000) 0.826 9.880 ( 1.693 -2.557 0.000) 3.067 10.374 ( 0.252 1.505 -0.000) 1.526 11.024 ( 5.337 2.735 -0.000) 5.997 11.464 ( 1.642 1.915 -0.000) 2.523 11.587 ( -5.359 -0.330 0.000) 5.369 11.618 ( -1.616 -3.885 0.000) 4.208 12.326 ( -7.304 0.627 -0.000) 7.331 12.328 ( 1.408 0.624 -0.000) 1.540 12.763 ( 4.499 -2.080 0.000) 4.957 13.373 ( 4.063 4.960 -0.000) 6.412 13.735 ( 0.707 -1.255 0.000) 1.440 13.951 ( 2.788 -1.255 0.000) 3.057 15.598 ( 2.183 -0.200 0.000) 2.193 15.885 ( -0.981 0.172 -0.000) 0.996 21.880 ( 3.446 -0.076 0.000) 3.447 22.103 ( 2.047 0.111 -0.000) 2.050 ======================= Grid point 608 (248/343) ======================= q-point: ( 0.31 -0.46 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.688 ( -8.222 -0.000 0.242) 8.225 2.896 ( -1.434 -0.000 1.982) 2.446 3.000 ( -3.670 -0.000 -6.013) 7.045 3.036 ( -4.381 -0.000 -5.334) 6.902 3.307 ( -8.373 0.000 -2.331) 8.692 3.364 ( 2.466 -0.000 2.466) 3.488 3.393 ( -2.819 0.000 2.780) 3.959 3.475 ( 0.297 -0.000 3.977) 3.988 3.750 ( 6.450 -0.000 -3.334) 7.261 5.887 ( -1.489 -0.000 1.634) 2.211 5.971 ( -3.159 -0.000 0.062) 3.160 6.144 ( -4.060 -0.000 3.217) 5.180 6.299 ( -1.823 -0.000 -3.364) 3.826 6.514 ( 7.752 -0.000 -17.786) 19.402 7.253 ( 4.294 -0.000 -10.585) 11.423 7.466 ( -8.912 -0.000 7.634) 11.735 7.535 ( 0.917 -0.000 -7.403) 7.460 8.393 ( 5.453 -0.000 -9.525) 10.976 8.546 ( 7.111 -0.000 -6.474) 9.616 8.736 ( -5.056 -0.000 3.134) 5.949 9.082 ( -4.374 -0.000 9.513) 10.471 9.253 ( -5.246 -0.000 9.450) 10.808 9.624 ( -9.165 -0.000 5.874) 10.886 9.949 ( -18.859 -0.000 12.783) 22.783 11.176 ( -9.524 -0.000 0.951) 9.571 11.933 ( -11.079 -0.000 -6.684) 12.939 12.163 ( 8.770 -0.000 9.669) 13.054 12.511 ( -1.068 -0.000 0.567) 1.210 12.835 ( 11.389 -0.000 3.751) 11.991 13.359 ( 0.509 -0.000 -6.889) 6.907 14.082 ( 6.041 -0.000 -4.140) 7.324 14.532 ( 6.696 -0.000 -11.629) 13.419 15.038 ( -1.776 -0.000 9.620) 9.783 15.364 ( -10.374 -0.000 5.646) 11.811 20.652 ( -6.456 -0.000 8.169) 10.412 20.820 ( -10.698 -0.000 7.009) 12.790 ======================= Grid point 622 (249/343) ======================= q-point: ( 0.31 -0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.525 ( -13.220 -0.497 -3.004) 13.566 2.822 ( -8.476 1.634 -8.988) 12.462 2.845 ( -5.352 -1.199 -7.700) 9.453 2.905 ( -1.055 -0.420 -1.319) 1.741 3.128 ( -10.370 0.486 -5.381) 11.693 3.382 ( -2.828 1.076 1.662) 3.453 3.390 ( -0.133 -1.056 0.319) 1.111 3.573 ( 3.906 0.742 3.863) 5.543 3.754 ( 2.148 -0.438 -4.984) 5.445 5.842 ( -8.855 2.120 -0.626) 9.126 5.884 ( -7.095 -1.445 -2.077) 7.533 6.140 ( -3.224 1.801 -9.591) 10.277 6.160 ( 0.889 -1.655 -0.488) 1.941 6.421 ( 7.001 -0.987 -11.293) 13.323 7.105 ( -3.185 -0.953 -13.566) 13.967 7.404 ( -9.263 -0.478 1.328) 9.370 7.438 ( 0.610 -0.874 -6.816) 6.898 8.219 ( -6.754 1.046 -14.608) 16.128 8.492 ( -3.870 0.589 -4.278) 5.799 8.651 ( -6.779 -0.168 -3.587) 7.672 9.083 ( -6.673 0.636 0.454) 6.718 9.277 ( -9.953 -0.271 7.607) 12.530 9.566 ( -13.178 0.675 8.944) 15.941 9.813 ( -21.427 -0.425 8.990) 23.240 10.952 ( -17.605 0.122 -5.291) 18.384 11.652 ( -16.578 0.450 -6.986) 17.996 12.302 ( -15.190 4.962 -10.792) 19.283 12.400 ( 7.460 -1.338 8.547) 11.423 13.070 ( 11.643 0.667 5.514) 12.900 13.419 ( 7.633 -4.001 3.579) 9.332 14.108 ( 5.202 -0.417 -2.766) 5.906 14.431 ( 4.918 0.050 -14.334) 15.155 15.114 ( -3.804 5.321 9.006) 11.131 15.272 ( -14.074 -5.015 5.837) 16.041 20.634 ( -10.532 0.747 5.671) 11.985 20.677 ( -19.495 -0.415 2.099) 19.612 ======================= Grid point 623 (250/343) ======================= q-point: ( 0.38 -0.38 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( -13.193 -0.000 -0.500) 13.203 2.832 ( -7.614 -0.000 -5.461) 9.370 2.859 ( -9.918 -0.000 -5.162) 11.181 2.942 ( -5.553 -0.000 0.280) 5.560 3.213 ( -11.313 -0.000 -4.750) 12.270 3.387 ( -1.612 -0.000 -0.375) 1.655 3.480 ( -3.991 -0.000 3.016) 5.002 3.591 ( 1.775 -0.000 3.792) 4.187 3.631 ( 4.712 0.000 -4.419) 6.460 5.925 ( -4.243 -0.000 -4.082) 5.888 5.938 ( 0.049 -0.000 2.177) 2.178 6.013 ( -3.233 -0.000 -13.342) 13.729 6.229 ( -8.668 -0.000 2.555) 9.037 6.269 ( 0.357 -0.000 -2.525) 2.550 6.940 ( 2.734 -0.000 -10.805) 11.145 7.280 ( 1.760 -0.000 -11.074) 11.212 7.394 ( 3.605 -0.000 -10.312) 10.924 8.154 ( 14.100 -0.000 -13.378) 19.437 8.235 ( -14.888 -0.000 -4.147) 15.455 9.076 ( -20.714 -0.000 13.562) 24.759 9.169 ( -9.254 -0.000 1.841) 9.435 9.528 ( -11.356 -0.000 9.478) 14.792 10.002 ( -17.536 -0.000 18.301) 25.346 10.263 ( -25.010 -0.000 9.758) 26.846 11.116 ( -16.041 -0.000 -5.245) 16.876 11.800 ( -14.479 -0.000 -2.851) 14.757 12.371 ( -13.447 -0.000 -9.253) 16.323 12.375 ( 10.446 0.000 6.106) 12.099 12.957 ( 13.105 -0.000 3.777) 13.638 13.315 ( 12.134 -0.000 1.971) 12.293 14.003 ( 5.848 -0.000 -1.208) 5.972 14.167 ( 4.724 -0.000 -13.313) 14.127 15.262 ( -1.752 -0.000 6.476) 6.709 15.522 ( -11.528 -0.000 5.081) 12.598 20.913 ( -13.670 -0.000 9.863) 16.857 21.036 ( -21.675 -0.000 8.070) 23.128 ======================= Grid point 636 (251/343) ======================= q-point: ( 0.31 -0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( -17.080 -1.155 -5.936) 18.119 2.541 ( -11.489 1.641 -10.955) 15.959 2.645 ( -8.125 -1.150 -9.302) 12.404 2.811 ( -9.029 -1.453 -9.578) 13.243 2.934 ( -3.436 0.763 -2.655) 4.409 3.340 ( -5.136 1.655 1.189) 5.526 3.392 ( 0.405 -0.334 -1.893) 1.964 3.650 ( 2.067 3.469 -1.856) 4.445 3.690 ( -1.229 -1.931 -0.944) 2.476 5.625 ( -14.126 2.348 -5.671) 15.402 5.744 ( -8.580 -1.916 -3.496) 9.461 5.870 ( -5.416 0.133 -16.071) 16.960 6.232 ( 0.549 0.399 1.775) 1.900 6.367 ( 2.327 -2.590 -8.367) 9.063 6.804 ( -9.990 -2.690 -16.373) 19.368 7.258 ( -12.273 -1.166 -1.859) 12.467 7.421 ( 6.021 -1.312 -2.112) 6.514 7.843 ( -12.569 0.359 -18.622) 22.470 8.298 ( -26.353 0.223 5.473) 26.916 8.509 ( 5.030 0.487 -13.248) 14.179 8.892 ( -11.095 0.760 -9.586) 14.682 9.133 ( -19.108 -0.645 -1.130) 19.152 9.500 ( -18.007 1.623 11.681) 21.525 9.671 ( -17.190 -0.081 9.909) 19.842 10.590 ( -21.559 -0.153 -7.712) 22.898 11.282 ( -24.448 1.402 -6.757) 25.403 11.833 ( -22.899 5.481 -15.068) 27.954 12.617 ( 6.667 -1.531 7.896) 10.447 13.266 ( 9.175 2.570 3.478) 10.143 13.592 ( 6.704 -3.907 2.892) 8.281 14.149 ( 3.581 2.224 -1.242) 4.395 14.313 ( 3.480 -3.409 -9.898) 11.031 15.090 ( -12.305 8.903 7.577) 16.973 15.303 ( 0.668 -9.307 10.999) 14.424 20.346 ( -27.853 0.364 -2.651) 27.981 20.506 ( -16.121 0.532 1.379) 16.189 ======================= Grid point 637 (252/343) ======================= q-point: ( 0.38 -0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( -18.164 0.002 -2.148) 18.290 2.601 ( -12.646 7.095 -6.263) 15.796 2.662 ( -10.906 -6.830 -4.861) 13.756 2.827 ( -9.549 -0.534 -5.660) 11.114 2.996 ( -9.226 0.592 -2.515) 9.581 3.360 ( -0.284 -0.634 -1.407) 1.569 3.444 ( -5.933 0.741 1.840) 6.256 3.605 ( 2.652 6.400 -2.847) 7.490 3.677 ( 1.164 -6.372 1.160) 6.580 5.759 ( -7.068 0.155 -10.372) 12.553 5.798 ( -8.798 1.641 -4.730) 10.123 5.816 ( -15.284 -0.878 -2.064) 15.448 6.245 ( 1.217 -1.588 -2.531) 3.226 6.248 ( 2.305 -0.398 2.726) 3.592 6.740 ( -11.064 -1.340 -12.080) 16.436 7.216 ( 10.500 1.758 -7.547) 13.050 7.301 ( -0.433 -2.792 -6.874) 7.432 7.874 ( -21.610 1.073 -9.915) 23.801 8.166 ( 11.524 0.628 -9.884) 15.195 8.906 ( -29.880 -0.185 12.419) 32.358 8.982 ( -16.720 0.192 -3.010) 16.990 9.388 ( -20.648 -0.540 -0.348) 20.658 9.985 ( -20.637 1.447 16.824) 26.665 10.057 ( -21.164 -0.085 8.180) 22.690 10.775 ( -20.181 0.278 -7.908) 21.677 11.539 ( -19.706 0.552 -1.146) 19.747 11.970 ( -21.924 4.008 -12.115) 25.368 12.593 ( 9.416 -1.308 5.271) 10.870 13.153 ( 11.193 -0.624 0.734) 11.234 13.506 ( 9.863 -0.074 1.913) 10.047 14.053 ( 5.782 8.069 -6.699) 11.975 14.123 ( 7.447 -9.937 -1.527) 12.511 15.321 ( -0.465 8.233 5.720) 10.035 15.427 ( -11.098 -7.917 4.566) 14.377 20.759 ( -30.119 0.281 3.345) 30.306 20.799 ( -18.738 0.175 5.287) 19.470 ======================= Grid point 638 (253/343) ======================= q-point: ( 0.46 -0.31 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( -16.018 -0.000 -0.519) 16.027 2.732 ( -10.790 -0.000 -1.796) 10.939 2.780 ( -14.319 -0.000 -0.557) 14.330 2.916 ( -11.303 -0.000 -2.195) 11.514 3.100 ( -10.381 -0.000 -2.223) 10.617 3.367 ( -3.020 -0.000 -0.685) 3.097 3.522 ( 2.912 -0.000 -0.362) 2.934 3.565 ( -4.399 -0.000 0.003) 4.399 3.661 ( 1.469 -0.000 1.305) 1.965 5.735 ( -4.949 -0.000 -4.740) 6.853 5.825 ( -5.761 -0.000 -3.612) 6.800 5.989 ( -5.837 -0.000 1.116) 5.943 6.230 ( -2.497 -0.000 -0.595) 2.567 6.266 ( -0.600 -0.000 0.396) 0.719 6.735 ( -1.330 -0.000 -3.847) 4.071 7.016 ( 0.546 -0.000 -6.210) 6.234 7.133 ( 9.518 -0.000 -6.054) 11.281 7.917 ( 10.735 -0.000 -4.196) 11.526 8.130 ( -26.059 -0.000 -2.599) 26.188 9.240 ( -20.267 -0.000 2.092) 20.374 9.349 ( -15.178 -0.000 5.551) 16.161 9.711 ( -23.418 -0.000 3.505) 23.679 10.463 ( -26.209 -0.000 4.436) 26.581 10.470 ( -17.543 0.000 14.463) 22.736 10.910 ( -16.732 -0.000 -9.143) 19.067 11.772 ( -15.169 -0.000 0.213) 15.170 12.133 ( -19.167 -0.000 -6.154) 20.131 12.492 ( 12.552 -0.000 2.310) 12.763 13.009 ( 10.097 -0.000 0.467) 10.108 13.369 ( 13.678 -0.000 1.099) 13.722 13.898 ( 4.658 -0.000 -5.424) 7.150 14.004 ( 7.871 -0.000 0.560) 7.891 15.380 ( -0.674 -0.000 2.192) 2.293 15.618 ( -10.806 -0.000 1.849) 10.963 21.120 ( -17.743 -0.000 4.394) 18.279 21.206 ( -27.046 -0.000 3.612) 27.286 ======================= Grid point 650 (254/343) ======================= q-point: ( 0.31 -0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( -19.197 2.320 -7.376) 20.696 2.182 ( -14.953 4.352 -15.978) 22.312 2.377 ( -13.303 -2.030 -8.154) 15.735 2.526 ( -11.569 -9.931 -10.977) 18.787 2.887 ( 0.084 3.148 -2.498) 4.020 3.267 ( -6.018 2.610 0.260) 6.565 3.288 ( -10.887 7.860 -3.635) 13.911 3.552 ( -3.458 -2.703 -3.380) 5.540 3.763 ( 6.644 -0.850 0.898) 6.758 5.327 ( -13.475 0.781 -8.424) 15.911 5.514 ( -10.399 -2.094 -12.216) 16.179 5.656 ( -3.403 2.058 -5.252) 6.588 6.077 ( -18.854 -4.218 -8.606) 21.150 6.235 ( -7.755 -4.189 -8.966) 12.573 6.549 ( 0.219 -2.993 -10.164) 10.598 7.023 ( -14.304 -0.821 -6.099) 15.571 7.459 ( -10.643 -2.887 -12.782) 16.882 7.527 ( 1.968 0.104 5.467) 5.812 7.975 ( -29.324 -0.863 6.576) 30.065 8.443 ( 8.654 0.908 -9.450) 12.846 8.565 ( -12.177 0.273 -12.904) 17.744 8.766 ( -22.459 -1.753 -9.833) 24.580 9.331 ( -26.504 1.951 7.609) 27.643 9.595 ( -14.921 0.008 9.274) 17.568 10.193 ( -21.141 -0.705 -7.156) 22.330 10.766 ( -37.896 2.556 -7.304) 38.678 11.289 ( -23.696 2.909 -14.355) 27.857 12.797 ( 4.944 -2.625 5.937) 8.160 13.404 ( 7.637 2.550 1.818) 8.254 13.679 ( 3.530 0.115 -0.938) 3.655 14.122 ( 3.640 10.173 -4.089) 11.553 14.316 ( -0.538 -7.536 1.547) 7.711 14.995 ( -12.388 3.852 7.506) 14.987 15.639 ( 17.530 -7.349 15.532) 24.547 19.860 ( -33.557 2.066 -6.113) 34.172 20.221 ( -23.839 -1.101 -3.894) 24.180 ======================= Grid point 651 (255/343) ======================= q-point: ( 0.38 -0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -21.189 1.584 -1.493) 21.300 2.277 ( -17.803 9.613 -7.059) 21.429 2.469 ( -13.629 -8.577 -2.642) 16.319 2.558 ( -14.908 -4.394 -6.844) 16.982 2.903 ( -3.621 1.364 -0.353) 3.885 3.342 ( -0.958 0.180 -1.210) 1.554 3.368 ( -6.679 1.831 0.584) 6.950 3.560 ( -2.079 2.517 -2.089) 3.876 3.715 ( 1.354 -1.756 0.513) 2.276 5.493 ( -20.031 1.232 -3.410) 20.356 5.516 ( -12.363 -1.670 -6.806) 14.211 5.671 ( -4.837 0.631 -2.742) 5.596 6.197 ( -3.587 -4.299 -3.621) 6.668 6.241 ( -16.454 -2.155 -0.816) 16.614 6.437 ( -3.062 -2.057 -7.795) 8.624 7.146 ( -11.274 0.501 -4.185) 12.036 7.375 ( 15.690 0.472 -1.360) 15.756 7.483 ( -13.131 -1.093 -6.132) 14.533 8.207 ( 10.232 0.899 -4.856) 11.361 8.620 ( -36.405 -0.227 12.350) 38.443 8.668 ( -20.889 -0.050 -3.846) 21.240 8.970 ( -28.413 -1.612 -10.266) 30.254 9.841 ( -26.988 3.576 9.458) 28.820 9.914 ( -16.824 -1.000 6.223) 17.966 10.388 ( -20.670 -0.273 -6.453) 21.655 11.223 ( -29.565 2.384 2.770) 29.790 11.452 ( -25.809 3.411 -11.948) 28.644 12.770 ( 7.055 -2.238 3.094) 8.022 13.298 ( 9.796 0.018 -0.130) 9.797 13.610 ( 5.268 1.696 -0.779) 5.589 14.034 ( 7.207 11.320 -2.945) 13.739 14.269 ( 5.390 -12.045 1.439) 13.274 15.250 ( -11.437 5.400 3.392) 13.095 15.546 ( 11.742 -6.560 5.382) 14.487 20.318 ( -36.987 1.112 -0.089) 37.004 20.544 ( -25.059 -0.163 0.930) 25.077 ======================= Grid point 652 (256/343) ======================= q-point: ( 0.46 -0.23 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -19.221 0.194 -0.000) 19.222 2.510 ( -15.588 12.773 -0.000) 20.153 2.605 ( -14.720 -13.373 0.000) 19.888 2.708 ( -14.705 0.189 -0.000) 14.706 2.974 ( -6.622 0.628 -0.000) 6.652 3.336 ( -0.779 -0.740 0.000) 1.074 3.472 ( -6.928 0.871 -0.000) 6.983 3.556 ( 1.995 4.033 -0.000) 4.500 3.698 ( 0.961 -4.016 0.000) 4.129 5.604 ( -9.192 -0.331 0.000) 9.198 5.717 ( -5.914 0.694 -0.000) 5.955 5.784 ( -20.565 -0.003 -0.000) 20.565 6.202 ( -1.963 -2.040 0.000) 2.831 6.324 ( 4.431 -0.727 0.000) 4.490 6.541 ( -19.878 -0.784 0.000) 19.893 7.102 ( 15.722 3.839 -0.000) 16.184 7.187 ( 3.581 -4.457 0.000) 5.717 7.733 ( -26.969 1.054 -0.000) 26.990 8.033 ( 10.828 0.546 -0.000) 10.842 8.946 ( -23.227 0.331 -0.000) 23.229 9.154 ( -21.237 -1.382 0.000) 21.282 9.309 ( -36.086 0.169 -0.000) 36.087 10.183 ( -19.570 0.535 -0.000) 19.577 10.304 ( -24.338 1.743 -0.000) 24.400 10.588 ( -18.098 -0.262 -0.000) 18.100 11.559 ( -17.106 0.034 -0.000) 17.106 11.756 ( -27.671 4.246 -0.000) 27.995 12.668 ( 10.088 -1.674 0.000) 10.226 13.153 ( 10.589 -1.017 0.000) 10.638 13.522 ( 8.514 1.621 -0.000) 8.667 13.940 ( 7.622 5.643 -0.000) 9.483 14.140 ( 8.687 -7.882 0.000) 11.730 15.402 ( 1.025 9.244 -0.000) 9.301 15.492 ( -8.251 -9.000 0.000) 12.210 20.812 ( -33.847 0.273 -0.000) 33.848 20.877 ( -21.971 0.216 -0.000) 21.972 ======================= Grid point 664 (257/343) ======================= q-point: ( 0.31 -0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( -20.896 11.158 -6.635) 24.600 1.672 ( -19.979 9.968 -17.208) 28.189 2.127 ( -15.577 -12.096 -3.092) 19.962 2.286 ( -10.687 -14.606 -9.039) 20.230 2.787 ( -11.382 13.467 -3.612) 17.999 2.985 ( -11.420 12.057 -2.610) 16.811 3.183 ( -5.161 3.467 -0.002) 6.217 3.499 ( -4.573 -12.723 -1.693) 13.626 3.899 ( 11.853 0.795 0.892) 11.913 5.061 ( -8.582 -1.489 -7.646) 11.590 5.242 ( -8.216 -1.882 -8.233) 11.783 5.540 ( -7.361 3.600 -2.360) 8.527 5.688 ( -17.987 -5.671 -8.366) 20.632 5.950 ( -16.267 -3.387 -7.659) 18.296 6.463 ( -3.054 -7.475 -5.183) 9.595 6.763 ( -12.727 -3.297 -5.665) 14.316 7.216 ( -12.582 -4.499 -4.035) 13.958 7.436 ( -29.072 0.868 10.080) 30.782 7.850 ( -7.414 -2.005 6.990) 10.385 8.246 ( -11.534 0.184 -12.672) 17.136 8.324 ( -10.747 -3.176 -12.698) 16.936 8.538 ( 14.650 0.357 -2.174) 14.815 8.971 ( -33.659 -0.412 1.424) 33.691 9.478 ( -16.766 -0.836 3.228) 17.094 9.853 ( -18.626 -0.524 -3.627) 18.983 10.043 ( -50.923 -1.056 -7.100) 51.426 10.811 ( -22.782 0.776 -8.714) 24.404 12.932 ( 3.821 -4.592 3.333) 6.841 13.511 ( 6.858 2.718 1.021) 7.448 13.693 ( 2.925 2.472 -1.507) 4.115 14.101 ( 4.358 14.200 -0.845) 14.878 14.343 ( -3.238 -3.685 2.918) 5.708 14.933 ( -9.293 1.162 6.174) 11.217 16.206 ( 30.032 -7.431 13.535) 33.770 19.295 ( -33.355 6.361 -5.948) 34.473 19.771 ( -32.581 -6.824 -6.844) 33.985 ======================= Grid point 665 (258/343) ======================= q-point: ( 0.38 -0.15 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( -21.920 5.210 -0.000) 22.531 1.887 ( -23.185 11.777 -0.000) 26.005 2.289 ( -16.020 -9.307 0.000) 18.527 2.334 ( -13.150 -11.620 0.000) 17.549 2.853 ( -2.261 3.251 -0.000) 3.960 3.232 ( -13.493 9.419 -0.000) 16.455 3.274 ( -6.288 2.849 -0.000) 6.904 3.504 ( -3.132 -4.583 0.000) 5.551 3.772 ( 6.833 -0.408 0.000) 6.845 5.190 ( -18.121 -0.989 0.000) 18.148 5.313 ( -11.501 -2.337 0.000) 11.736 5.594 ( -3.251 2.489 -0.000) 4.095 5.909 ( -24.332 -4.239 0.000) 24.699 6.078 ( -12.211 -5.473 0.000) 13.382 6.422 ( 0.782 -4.255 0.000) 4.327 6.903 ( -15.503 -0.633 0.000) 15.516 7.313 ( -7.539 -2.621 0.000) 7.982 7.601 ( 10.991 1.629 -0.000) 11.111 8.246 ( -32.944 -0.638 0.000) 32.950 8.322 ( 9.851 0.510 -0.000) 9.864 8.361 ( -17.800 0.916 -0.000) 17.823 8.473 ( -27.001 -4.453 0.000) 27.366 9.467 ( -34.334 2.261 -0.000) 34.409 9.735 ( -16.743 -0.693 0.000) 16.758 10.079 ( -19.062 -0.725 0.000) 19.075 10.696 ( -47.063 3.942 -0.000) 47.228 11.049 ( -21.292 0.358 -0.000) 21.295 12.882 ( 4.865 -3.464 0.000) 5.972 13.420 ( 8.506 1.372 -0.000) 8.616 13.648 ( 3.171 2.063 -0.000) 3.783 14.069 ( 6.935 14.773 -0.000) 16.320 14.360 ( 0.451 -8.928 0.000) 8.940 15.111 ( -10.657 1.699 -0.000) 10.792 15.874 ( 25.588 -6.360 0.000) 26.366 19.781 ( -39.038 3.546 -0.000) 39.199 20.163 ( -31.476 -2.842 0.000) 31.604 ======================= Grid point 678 (259/343) ======================= q-point: ( 0.31 -0.08 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.085 ( -25.002 14.217 -0.000) 28.761 1.236 ( -17.313 21.339 -0.000) 27.478 1.921 ( -20.770 -6.941 0.000) 21.899 2.129 ( -7.751 -14.240 0.000) 16.213 2.406 ( -20.511 18.696 -0.000) 27.753 2.928 ( 3.903 4.218 -0.000) 5.747 3.108 ( -3.698 4.186 -0.000) 5.585 3.471 ( -6.022 -19.533 0.000) 20.440 4.090 ( 15.272 3.491 -0.000) 15.666 4.934 ( -2.366 -2.789 0.000) 3.657 5.125 ( -1.215 -0.832 0.000) 1.473 5.333 ( -17.779 -5.177 0.000) 18.518 5.466 ( -9.461 3.105 -0.000) 9.957 5.724 ( -9.314 0.043 -0.000) 9.314 6.366 ( -12.449 -14.075 0.000) 18.790 6.519 ( -20.682 -4.042 0.000) 21.073 7.004 ( -15.601 -3.322 0.000) 15.951 7.135 ( -31.473 -7.549 0.000) 32.366 7.664 ( -25.565 -7.344 0.000) 26.599 8.033 ( 1.221 4.912 -0.000) 5.062 8.220 ( 0.747 -3.785 0.000) 3.858 8.531 ( -29.821 -3.098 0.000) 29.981 8.790 ( 20.013 -0.210 0.000) 20.015 9.064 ( -50.810 -8.588 0.000) 51.531 9.437 ( -21.557 0.668 -0.000) 21.567 9.610 ( -15.362 -1.260 0.000) 15.413 10.433 ( -23.214 0.477 -0.000) 23.219 13.027 ( 3.686 -7.230 0.000) 8.116 13.597 ( 5.897 2.065 -0.000) 6.248 13.725 ( 5.896 5.676 -0.000) 8.184 14.095 ( 3.077 15.780 -0.000) 16.077 14.329 ( -3.367 -0.919 0.000) 3.490 14.882 ( -5.724 -0.424 0.000) 5.740 16.763 ( 29.778 -8.125 0.000) 30.866 18.807 ( -26.267 11.826 -0.000) 28.806 19.282 ( -32.908 -13.260 0.000) 35.479 ======================= Grid point 692 (260/343) ======================= q-point: ( 0.31 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( -0.000 24.433 -0.000) 24.433 0.834 ( -0.000 24.566 -0.000) 24.566 1.648 ( -0.000 51.055 -0.000) 51.055 2.052 ( 0.000 -15.745 0.000) 15.745 2.061 ( 0.000 -15.903 0.000) 15.903 3.050 ( -0.000 4.091 -0.000) 4.091 3.057 ( -0.000 3.964 -0.000) 3.964 3.388 ( 0.000 -27.788 0.000) 27.788 4.423 ( -0.000 4.787 -0.000) 4.787 4.737 ( 0.000 -2.291 0.000) 2.291 4.999 ( 0.000 -2.052 0.000) 2.052 5.203 ( -0.000 0.193 -0.000) 0.193 5.321 ( -0.000 1.659 -0.000) 1.659 5.511 ( -0.000 1.103 -0.000) 1.103 5.797 ( 0.000 -11.631 0.000) 11.631 5.938 ( -0.000 1.397 -0.000) 1.397 6.335 ( -0.000 1.418 -0.000) 1.418 6.757 ( 0.000 -0.028 0.000) 0.028 7.432 ( -0.000 6.845 -0.000) 6.845 7.858 ( -0.000 5.780 -0.000) 5.780 8.101 ( 0.000 -5.626 0.000) 5.626 8.150 ( -0.000 5.551 -0.000) 5.551 8.368 ( 0.000 -4.820 0.000) 4.820 9.123 ( 0.000 -0.307 0.000) 0.307 9.325 ( 0.000 -0.286 0.000) 0.286 9.372 ( 0.000 -0.761 0.000) 0.761 9.974 ( -0.000 0.691 -0.000) 0.691 13.088 ( 0.000 -9.483 0.000) 9.483 13.669 ( -0.000 0.351 -0.000) 0.351 13.979 ( -0.000 12.162 -0.000) 12.162 14.062 ( 0.000 -0.186 0.000) 0.186 14.268 ( 0.000 -0.367 0.000) 0.367 14.804 ( 0.000 -0.357 0.000) 0.357 17.168 ( 0.000 -11.956 0.000) 11.956 18.273 ( -0.000 12.630 -0.000) 12.630 18.960 ( 0.000 -4.181 0.000) 4.181 ======================= Grid point 693 (261/343) ======================= q-point: ( 0.38 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.048 ( -10.258 18.278 18.465) 27.933 1.239 ( -17.121 18.021 20.493) 32.216 1.774 ( 0.032 3.972 3.809) 5.503 2.093 ( -3.342 -12.750 9.499) 16.247 2.242 ( -18.852 17.568 7.455) 26.826 3.014 ( 5.058 0.060 1.124) 5.181 3.084 ( -1.846 2.893 0.293) 3.444 3.326 ( -4.963 -22.571 2.516) 23.247 4.292 ( 14.905 4.386 -3.034) 15.830 4.905 ( -20.778 -4.216 -5.222) 21.835 5.071 ( -2.386 -1.733 5.554) 6.288 5.174 ( -4.490 -1.879 2.356) 5.408 5.407 ( -8.471 1.241 7.531) 11.403 5.680 ( -0.861 0.864 2.496) 2.778 6.010 ( -30.208 -7.600 8.408) 32.264 6.283 ( -19.859 -1.407 15.535) 25.253 6.663 ( -18.507 -11.320 9.200) 23.564 6.911 ( -6.839 -1.401 11.729) 13.650 7.590 ( -1.757 0.638 14.171) 14.294 8.030 ( -13.622 2.540 2.407) 14.064 8.173 ( -10.133 -3.370 1.306) 10.758 8.347 ( -5.197 -2.191 13.513) 14.643 8.614 ( -24.912 -4.036 29.172) 38.574 8.973 ( 7.191 0.259 -11.418) 13.497 9.279 ( 0.376 -0.142 -0.471) 0.619 9.473 ( -8.744 -0.792 5.467) 10.343 10.223 ( -17.583 0.459 11.856) 21.211 13.016 ( 2.109 -6.718 -3.632) 7.923 13.652 ( 2.616 0.415 -0.411) 2.681 13.853 ( 10.157 6.638 -2.814) 12.456 14.129 ( -3.145 7.033 -2.077) 7.979 14.238 ( -4.091 -1.275 -6.320) 7.636 14.753 ( -3.582 4.111 -8.713) 10.279 16.916 ( 15.223 -7.837 -18.756) 25.396 18.645 ( -16.442 12.556 15.370) 25.772 19.006 ( -13.069 -11.383 11.632) 20.873 ======================= Grid point 694 (262/343) ======================= q-point: ( 0.46 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -9.598 14.533 15.701) 23.449 1.792 ( -11.065 2.996 25.150) 27.640 1.969 ( -16.104 -7.885 12.654) 21.946 2.280 ( -6.715 -11.941 13.276) 19.077 2.727 ( -18.611 24.513 10.049) 32.376 3.007 ( 1.030 1.658 4.436) 4.846 3.134 ( -3.643 1.599 0.557) 4.018 3.393 ( -7.502 -16.804 4.281) 18.894 4.056 ( 13.927 1.723 -2.551) 14.263 5.114 ( -7.481 -1.113 8.107) 11.087 5.257 ( -12.089 3.877 7.623) 14.808 5.416 ( -17.688 -6.749 11.070) 21.931 5.651 ( -3.032 -1.275 8.448) 9.066 5.799 ( -18.620 -1.052 4.466) 19.177 6.498 ( -11.055 -3.569 19.417) 22.627 6.706 ( -12.303 -1.962 12.696) 17.788 6.912 ( -22.007 -2.597 -1.673) 22.223 7.159 ( -8.648 -2.202 12.181) 15.100 7.750 ( -3.239 -1.898 2.957) 4.779 8.275 ( -12.565 1.409 7.245) 14.573 8.357 ( -10.147 -2.162 7.074) 12.557 8.660 ( -12.000 -0.495 13.047) 17.733 8.707 ( 5.179 -0.270 -2.875) 5.929 9.265 ( -6.414 -0.422 -2.131) 6.772 9.601 ( -38.320 -1.953 28.730) 47.933 9.722 ( -14.689 -1.944 9.621) 17.667 10.675 ( -20.836 0.684 15.000) 25.683 12.898 ( 2.777 -3.702 -5.983) 7.564 13.582 ( 5.638 2.264 -2.123) 6.436 13.757 ( 3.688 3.096 -0.712) 4.868 14.121 ( -3.642 2.628 -6.124) 7.595 14.246 ( -4.257 1.470 -1.457) 4.733 14.723 ( -6.616 4.893 -8.268) 11.665 16.254 ( 23.160 -6.098 -30.557) 38.824 19.094 ( -20.027 5.610 15.071) 25.684 19.540 ( -23.880 -6.354 21.766) 32.930 ======================= Grid point 695 (263/343) ======================= q-point: ( 0.54 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.863 ( -9.727 2.425 12.836) 16.287 2.212 ( -12.659 -4.898 14.396) 19.786 2.395 ( -10.986 7.601 17.398) 21.935 2.528 ( -8.376 -9.887 14.488) 19.438 2.982 ( 3.026 3.411 5.883) 7.443 3.196 ( -7.046 3.635 1.692) 8.106 3.231 ( -10.634 9.283 5.562) 15.172 3.512 ( -7.663 -8.020 5.060) 12.192 3.867 ( 10.877 0.137 -1.315) 10.957 5.340 ( -6.946 0.681 11.251) 13.240 5.519 ( -7.985 0.065 6.828) 10.507 5.767 ( -3.176 1.814 15.188) 15.622 5.898 ( -23.297 -6.711 10.292) 26.339 6.174 ( -18.666 -0.404 8.198) 20.391 6.701 ( 2.114 -1.876 8.405) 8.868 6.958 ( -6.968 -0.774 6.866) 9.813 7.259 ( -21.443 1.509 3.867) 21.841 7.515 ( -12.804 -2.726 18.481) 22.648 7.779 ( -3.708 -2.168 1.025) 4.416 8.558 ( -12.851 1.493 5.000) 13.870 8.581 ( -10.592 -1.312 3.130) 11.122 8.711 ( -3.639 0.270 12.507) 13.028 9.049 ( -12.965 0.613 12.130) 17.765 9.303 ( -9.223 -0.123 -6.188) 11.107 10.044 ( -16.669 -0.409 10.788) 19.860 10.467 ( -32.812 0.743 21.984) 39.503 11.191 ( -22.851 1.679 16.920) 28.483 12.751 ( 3.527 -1.804 -8.035) 8.959 13.467 ( 6.226 3.645 -4.417) 8.459 13.709 ( 2.525 -1.376 -2.557) 3.848 14.122 ( -5.687 0.068 -3.749) 6.812 14.318 ( -2.886 1.039 4.670) 5.587 14.753 ( -9.566 4.410 -5.665) 11.960 15.561 ( 15.601 -5.967 -26.418) 31.255 19.625 ( -23.067 1.231 16.198) 28.213 20.049 ( -16.933 -0.848 13.386) 21.602 ======================= Grid point 696 (264/343) ======================= q-point: ( 0.62 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( -11.301 -0.951 10.019) 15.133 2.531 ( -11.690 -0.912 10.613) 15.816 2.705 ( -5.415 0.920 11.728) 12.950 2.834 ( -8.768 -1.228 13.003) 15.731 2.998 ( 4.565 0.752 4.450) 6.419 3.273 ( -4.197 0.530 0.144) 4.232 3.413 ( -2.341 0.937 2.643) 3.652 3.684 ( -6.884 1.523 5.619) 9.016 3.718 ( 7.958 -0.606 -1.578) 8.135 5.594 ( -7.512 1.940 9.877) 12.560 5.674 ( -7.076 -2.387 3.699) 8.333 6.043 ( -3.094 0.308 16.699) 16.986 6.196 ( -5.525 -0.429 0.697) 5.585 6.469 ( -7.980 -0.499 9.161) 12.160 6.844 ( -11.372 -0.900 8.785) 14.398 7.120 ( -7.427 -0.367 3.427) 8.188 7.445 ( -2.086 -0.803 2.628) 3.450 7.939 ( -13.934 2.408 16.794) 21.954 7.996 ( -16.251 -3.218 8.528) 18.633 8.707 ( -7.376 0.355 2.897) 7.933 8.791 ( -11.761 0.402 -0.956) 11.807 8.965 ( -7.796 -0.115 7.454) 10.787 9.336 ( -6.215 1.840 10.680) 12.493 9.376 ( -10.137 -1.281 -0.676) 10.240 10.439 ( -18.094 -0.299 11.911) 21.664 11.098 ( -23.567 0.769 15.163) 28.034 11.750 ( -23.224 2.320 16.958) 28.850 12.569 ( 4.779 -0.751 -9.814) 10.942 13.317 ( 6.740 3.135 -6.953) 10.178 13.585 ( 4.395 -3.977 -6.946) 9.131 14.163 ( -2.618 -0.095 0.942) 2.784 14.455 ( -4.224 0.133 7.099) 8.261 14.867 ( -10.667 5.277 -0.357) 11.906 15.117 ( 3.148 -5.609 -16.962) 18.141 20.122 ( -19.732 0.102 12.776) 23.507 20.357 ( -9.913 0.296 5.981) 11.581 ======================= Grid point 697 (265/343) ======================= q-point: ( 0.69 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -10.220 -0.000 6.024) 11.863 2.810 ( -10.611 -0.000 7.734) 13.130 2.909 ( -3.524 -0.000 9.256) 9.905 2.956 ( 4.471 0.000 3.145) 5.466 3.095 ( -6.141 -0.000 6.413) 8.879 3.321 ( -2.821 -0.000 -0.200) 2.828 3.419 ( 2.779 0.000 0.107) 2.781 3.591 ( 6.262 0.000 -2.675) 6.809 3.822 ( -2.100 -0.000 4.326) 4.808 5.788 ( -4.213 -0.000 4.673) 6.292 5.811 ( -7.121 -0.000 2.975) 7.718 6.154 ( 2.667 0.000 -3.365) 4.294 6.257 ( -1.405 -0.000 9.497) 9.600 6.667 ( -1.032 -0.000 12.243) 12.287 7.165 ( -13.707 -0.000 8.833) 16.307 7.228 ( -5.136 -0.000 -0.860) 5.207 7.497 ( -0.326 -0.000 4.185) 4.198 8.283 ( -12.204 -0.000 5.065) 13.213 8.337 ( -11.525 -0.000 13.427) 17.694 8.841 ( -6.569 -0.000 2.090) 6.894 8.854 ( -7.958 -0.000 -8.517) 11.656 9.078 ( -3.991 -0.000 -1.072) 4.132 9.529 ( -0.198 -0.000 9.590) 9.592 9.538 ( -8.300 -0.000 5.194) 9.791 10.822 ( -15.023 -0.000 10.161) 18.136 11.552 ( -16.787 -0.000 12.042) 20.660 12.246 ( -17.377 -0.000 12.535) 21.426 12.357 ( 5.710 0.000 -10.515) 11.966 13.114 ( 8.149 0.000 -8.425) 11.721 13.418 ( 3.407 0.000 -6.181) 7.058 14.204 ( 1.701 0.000 3.793) 4.157 14.593 ( -4.796 -0.000 3.401) 5.880 14.937 ( -4.205 0.000 -10.344) 11.166 15.061 ( -8.791 -0.000 5.840) 10.554 20.488 ( -13.055 -0.000 7.961) 15.291 20.502 ( -4.601 -0.000 1.488) 4.836 ======================= Grid point 707 (266/343) ======================= q-point: ( 0.38 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( -0.000 17.732 20.132) 26.827 1.434 ( -0.000 15.822 32.259) 35.930 1.890 ( -0.000 23.442 19.593) 30.552 2.150 ( 0.000 -15.374 7.501) 17.106 2.322 ( -0.000 -1.344 16.322) 16.377 3.042 ( -0.000 1.218 0.112) 1.224 3.098 ( -0.000 4.105 3.497) 5.392 3.420 ( 0.000 -22.975 3.765) 23.282 4.355 ( -0.000 6.257 -4.683) 7.815 4.605 ( 0.000 -2.576 0.481) 2.620 5.013 ( -0.000 2.049 -3.050) 3.674 5.263 ( 0.000 -3.994 11.710) 12.373 5.493 ( -0.000 0.216 12.403) 12.405 5.723 ( -0.000 0.060 4.586) 4.586 6.132 ( -0.000 3.668 32.138) 32.347 6.467 ( -0.000 -3.035 25.419) 25.600 6.775 ( 0.000 -15.379 8.541) 17.592 7.080 ( -0.000 -1.805 14.919) 15.028 7.852 ( 0.000 -4.087 14.958) 15.506 7.906 ( -0.000 5.022 4.602) 6.811 8.102 ( 0.000 -4.364 1.776) 4.712 8.599 ( 0.000 -4.049 22.950) 23.305 8.752 ( 0.000 0.067 -20.608) 20.608 9.054 ( 0.000 -8.998 44.973) 45.864 9.327 ( -0.000 0.182 4.850) 4.854 9.527 ( -0.000 -0.575 10.445) 10.461 10.318 ( -0.000 0.145 19.050) 19.050 12.985 ( 0.000 -7.133 -6.905) 9.927 13.672 ( -0.000 0.291 0.793) 0.844 13.802 ( -0.000 12.189 -10.154) 15.864 14.068 ( 0.000 -1.395 -11.689) 11.772 14.097 ( -0.000 -0.127 2.922) 2.925 14.559 ( -0.000 14.230 -9.004) 16.839 16.664 ( 0.000 -7.938 -37.227) 38.064 18.755 ( -0.000 10.535 21.008) 23.502 19.252 ( 0.000 -12.539 30.547) 33.020 ======================= Grid point 708 (267/343) ======================= q-point: ( 0.46 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( -11.091 13.449 20.445) 26.868 1.923 ( -8.507 9.368 21.036) 24.548 2.153 ( 0.164 -8.871 21.776) 23.515 2.376 ( -11.064 -7.118 13.856) 19.107 2.641 ( -7.707 16.986 17.709) 25.720 3.068 ( -1.256 0.432 2.977) 3.260 3.148 ( 2.385 3.008 4.570) 5.968 3.438 ( -4.345 -18.105 4.821) 19.233 4.195 ( 12.692 3.747 -3.404) 13.664 4.870 ( -25.270 -2.783 8.074) 26.675 5.198 ( -15.321 3.150 6.733) 17.029 5.462 ( -6.878 -2.588 14.284) 16.064 5.656 ( -5.449 -2.753 6.190) 8.694 5.860 ( 2.393 -0.033 18.801) 18.953 6.634 ( -12.087 5.791 21.154) 25.043 6.784 ( -0.581 -7.230 11.744) 13.803 6.854 ( -7.456 -7.695 11.304) 15.575 7.277 ( -3.196 -0.995 13.718) 14.120 7.861 ( 8.255 -3.037 6.754) 11.090 8.173 ( -11.626 1.029 9.301) 14.924 8.262 ( -12.699 -2.118 6.170) 14.276 8.527 ( -7.595 0.249 -14.903) 16.728 8.929 ( 1.114 -1.608 27.096) 27.166 9.266 ( 3.038 -0.167 3.337) 4.516 9.729 ( -6.090 0.177 15.043) 16.230 9.814 ( -11.932 -1.859 39.907) 41.694 10.672 ( -12.357 0.351 18.824) 22.520 12.847 ( 1.749 -4.755 -8.218) 9.654 13.609 ( 6.976 5.349 -5.239) 10.234 13.742 ( -0.691 3.673 -2.275) 4.375 13.940 ( -5.722 -2.975 -9.255) 11.280 14.186 ( -4.220 0.984 3.801) 5.764 14.532 ( -3.268 10.939 -5.365) 12.614 16.010 ( 9.728 -8.074 -40.582) 42.506 19.167 ( -8.387 4.472 26.337) 27.999 19.704 ( -7.945 -5.743 28.426) 30.069 ======================= Grid point 709 (268/343) ======================= q-point: ( 0.54 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( -3.370 5.982 16.943) 18.281 2.269 ( -8.977 -8.885 13.914) 18.792 2.490 ( -7.986 5.969 16.868) 19.594 2.665 ( -6.628 -8.119 15.484) 18.698 3.041 ( -8.635 12.610 10.751) 18.686 3.166 ( -2.119 6.377 6.851) 9.596 3.185 ( 0.015 1.626 3.769) 4.105 3.518 ( -6.152 -11.790 4.166) 13.936 4.005 ( 11.880 1.501 -1.397) 12.055 5.331 ( -18.711 -1.133 11.546) 22.015 5.483 ( -9.226 2.059 7.576) 12.114 5.802 ( -11.098 -3.945 16.384) 20.178 5.876 ( -17.555 -2.523 7.786) 19.369 6.125 ( -3.194 -0.064 17.628) 17.915 6.766 ( 1.881 -0.805 -1.496) 2.535 6.977 ( -8.283 -1.544 7.292) 11.143 7.213 ( -11.932 1.278 15.710) 19.769 7.566 ( -11.723 -3.119 13.252) 17.966 7.823 ( 3.555 -3.919 5.286) 7.479 8.377 ( -10.909 1.243 -4.397) 11.827 8.499 ( -10.545 -0.104 10.647) 14.985 8.679 ( -16.723 -0.834 5.418) 17.598 9.247 ( 2.236 1.275 22.097) 22.246 9.300 ( 3.092 -0.289 9.925) 10.400 10.055 ( -10.625 -0.557 17.288) 20.300 10.504 ( -15.642 3.109 31.206) 35.045 11.141 ( -18.550 1.870 18.449) 26.229 12.682 ( 2.783 -3.010 -9.632) 10.468 13.441 ( 6.000 6.323 -9.010) 12.537 13.688 ( 1.232 -3.930 -5.668) 7.007 13.984 ( -9.231 -1.071 0.349) 9.299 14.293 ( -4.356 1.372 1.882) 4.940 14.608 ( -6.555 7.849 2.709) 10.579 15.354 ( 8.028 -8.796 -30.989) 33.199 19.680 ( -11.515 1.034 26.286) 28.716 20.124 ( -6.559 -0.695 19.641) 20.719 ======================= Grid point 710 (269/343) ======================= q-point: ( 0.62 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -3.475 -1.373 13.064) 13.588 2.528 ( -9.252 -3.028 9.887) 13.875 2.789 ( -5.437 1.786 11.787) 13.102 2.923 ( -5.422 -2.109 12.401) 13.697 3.146 ( 6.662 2.014 5.820) 9.072 3.240 ( -2.692 0.322 2.599) 3.755 3.393 ( -5.796 5.097 4.668) 9.020 3.641 ( -8.107 -0.820 3.835) 9.005 3.838 ( 11.074 0.060 -0.755) 11.100 5.621 ( -5.505 2.977 7.287) 9.606 5.697 ( -6.551 -4.923 11.080) 13.781 6.121 ( -7.198 0.107 5.201) 8.881 6.179 ( -8.733 -0.467 8.350) 12.092 6.391 ( -11.544 -0.443 6.314) 13.165 6.774 ( -7.869 -1.779 3.317) 8.722 7.184 ( -4.044 1.007 11.699) 12.419 7.450 ( -6.590 -1.327 0.895) 6.781 7.876 ( -15.267 -0.665 6.869) 16.754 7.990 ( -9.131 -1.680 12.685) 15.720 8.479 ( -12.561 0.127 -4.563) 13.365 8.741 ( -4.207 0.564 8.830) 9.797 8.938 ( -9.941 -0.460 4.724) 11.016 9.461 ( 1.174 1.594 18.571) 18.676 9.499 ( 0.027 -0.439 16.561) 16.566 10.461 ( -11.171 -0.526 19.860) 22.793 11.082 ( -15.005 2.333 22.151) 26.856 11.674 ( -20.983 3.901 18.070) 27.965 12.489 ( 3.710 -1.936 -10.888) 11.664 13.255 ( 4.862 5.610 -10.710) 13.032 13.536 ( 2.042 -7.475 -9.871) 12.549 14.133 ( -6.087 0.415 4.646) 7.669 14.368 ( -7.112 0.562 -2.154) 7.452 14.799 ( -3.934 10.883 1.358) 11.652 14.970 ( -2.580 -12.159 -6.865) 14.200 20.164 ( -9.946 -0.010 22.491) 24.592 20.403 ( -2.419 0.639 12.885) 13.126 ======================= Grid point 711 (270/343) ======================= q-point: ( 0.69 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -4.300 -1.525 8.533) 9.676 2.761 ( -9.480 -0.679 6.227) 11.363 2.986 ( -2.831 0.501 8.584) 9.053 3.094 ( 2.889 0.339 6.386) 7.018 3.123 ( 1.994 -0.139 3.652) 4.163 3.307 ( -1.656 0.079 2.782) 3.239 3.449 ( 1.373 -0.366 -0.090) 1.423 3.683 ( 9.920 0.310 -0.498) 9.938 3.808 ( -6.562 1.998 3.105) 7.529 5.776 ( -5.344 0.648 4.787) 7.203 5.859 ( 1.800 -2.172 6.679) 7.250 6.128 ( -0.020 0.921 -2.329) 2.504 6.348 ( -1.881 0.010 5.942) 6.232 6.585 ( -13.544 -0.364 -3.303) 13.946 7.041 ( -15.659 -0.824 7.139) 17.230 7.378 ( 4.260 1.772 14.921) 15.618 7.499 ( -5.228 -1.899 -2.832) 6.242 8.137 ( -17.882 -0.040 -2.808) 18.102 8.274 ( -11.916 -0.356 6.190) 13.433 8.583 ( -10.046 -0.195 -2.760) 10.420 8.868 ( 1.775 0.246 8.714) 8.896 9.088 ( -2.541 -0.182 6.307) 6.802 9.665 ( 1.261 1.507 10.553) 10.734 9.742 ( 2.940 -1.020 21.781) 22.002 10.855 ( -8.344 -0.260 17.717) 19.585 11.538 ( -13.204 0.674 16.564) 21.194 12.180 ( -17.049 3.940 13.584) 22.152 12.280 ( 4.051 -1.658 -10.678) 11.541 13.062 ( 4.241 2.404 -10.598) 11.666 13.350 ( 0.615 -4.666 -9.111) 10.254 14.237 ( -1.971 1.637 1.403) 2.922 14.434 ( -9.509 -0.809 -5.029) 10.787 14.764 ( -4.475 0.267 -4.739) 6.524 15.162 ( -4.613 -1.019 15.269) 15.983 20.540 ( -4.711 0.482 17.073) 17.717 20.556 ( 1.156 -0.206 9.683) 9.754 ======================= Grid point 712 (271/343) ======================= q-point: ( 0.77 0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( -3.814 -0.000 4.457) 5.866 2.910 ( -2.986 -0.000 0.591) 3.044 3.056 ( 4.656 0.000 2.499) 5.284 3.096 ( 0.017 -0.000 4.108) 4.108 3.188 ( -2.931 -0.000 1.173) 3.157 3.358 ( -0.428 -0.000 2.500) 2.536 3.388 ( 4.125 0.000 -2.566) 4.858 3.559 ( 8.356 0.000 0.908) 8.405 3.898 ( -1.102 -0.000 1.697) 2.023 5.824 ( 2.598 0.000 -2.304) 3.472 5.894 ( -3.553 -0.000 2.748) 4.492 6.148 ( 2.163 0.000 4.138) 4.669 6.409 ( 1.161 -0.000 2.758) 2.992 6.652 ( -11.331 -0.000 -11.684) 16.276 7.288 ( -11.574 -0.000 0.896) 11.608 7.468 ( 11.450 0.000 14.016) 18.098 7.519 ( -5.954 -0.000 -4.633) 7.544 8.269 ( -15.496 -0.000 -10.921) 18.958 8.439 ( -11.549 -0.000 -5.462) 12.775 8.680 ( -3.356 -0.000 3.374) 4.758 8.961 ( 3.168 -0.000 9.908) 10.402 9.193 ( 2.552 -0.000 9.382) 9.723 9.722 ( 7.340 0.000 5.783) 9.345 9.935 ( 9.661 0.000 18.642) 20.997 11.124 ( -1.570 -0.000 10.394) 10.512 11.899 ( -10.285 -0.000 12.949) 16.536 12.070 ( 4.972 0.000 -9.955) 11.127 12.452 ( -3.581 -0.000 1.302) 3.811 12.892 ( 2.648 0.000 -6.638) 7.147 13.335 ( -9.930 -0.000 1.495) 10.042 14.239 ( -0.498 0.000 -3.528) 3.563 14.480 ( -10.093 -0.000 -7.744) 12.722 14.803 ( -1.553 -0.000 1.913) 2.464 15.387 ( 0.691 -0.000 13.324) 13.341 20.620 ( 4.987 0.000 7.526) 9.028 20.773 ( 1.765 -0.000 12.664) 12.787 ======================= Grid point 722 (272/343) ======================= q-point: ( 0.46 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.758 ( -0.000 12.763 23.224) 26.500 2.114 ( -0.000 15.444 21.034) 26.095 2.440 ( 0.000 -15.061 12.941) 19.857 2.561 ( 0.000 -3.598 21.481) 21.780 2.799 ( -0.000 8.401 17.371) 19.296 3.098 ( -0.000 1.438 4.050) 4.298 3.231 ( -0.000 4.032 6.065) 7.283 3.530 ( 0.000 -16.355 3.353) 16.695 4.215 ( -0.000 4.818 -4.916) 6.883 4.911 ( 0.000 -2.735 21.010) 21.187 5.196 ( -0.000 2.800 15.111) 15.368 5.548 ( -0.000 2.730 6.697) 7.232 5.822 ( 0.000 -8.357 16.624) 18.606 6.152 ( -0.000 0.696 19.351) 19.364 6.718 ( -0.000 3.463 6.560) 7.418 6.890 ( 0.000 -8.380 0.763) 8.415 7.025 ( 0.000 -3.593 13.874) 14.332 7.440 ( -0.000 0.181 14.871) 14.873 8.031 ( -0.000 1.513 -5.981) 6.169 8.222 ( 0.000 -8.812 13.685) 16.277 8.298 ( -0.000 0.303 0.398) 0.500 8.334 ( -0.000 -0.863 14.279) 14.306 9.324 ( -0.000 1.180 24.237) 24.266 9.377 ( -0.000 0.198 12.202) 12.203 9.883 ( -0.000 -0.045 15.331) 15.331 10.271 ( -0.000 6.264 36.631) 37.163 10.850 ( -0.000 -0.292 19.425) 19.427 12.757 ( 0.000 -5.638 -9.627) 11.156 13.508 ( -0.000 9.019 -12.072) 15.069 13.767 ( -0.000 0.148 7.490) 7.491 13.780 ( 0.000 -5.545 -8.984) 10.557 14.251 ( -0.000 0.006 9.055) 9.055 14.409 ( -0.000 12.202 -2.648) 12.486 15.550 ( 0.000 -9.803 -38.729) 39.950 19.509 ( -0.000 2.247 32.397) 32.475 20.047 ( -0.000 -2.766 25.110) 25.262 ======================= Grid point 723 (273/343) ======================= q-point: ( 0.54 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( -4.021 9.882 17.794) 20.747 2.447 ( -2.050 -0.809 17.887) 18.022 2.582 ( -3.737 -3.119 12.726) 13.625 2.816 ( -4.434 -5.378 13.747) 15.413 3.066 ( -3.997 7.943 12.068) 14.990 3.188 ( -1.972 3.921 6.100) 7.515 3.306 ( 3.554 3.135 6.605) 8.129 3.543 ( -3.293 -12.272 2.562) 12.962 4.110 ( 7.707 2.770 -2.826) 8.663 5.329 ( -13.218 -1.871 23.533) 27.056 5.495 ( -6.496 1.269 12.717) 14.336 5.711 ( -12.995 1.606 6.738) 14.726 6.035 ( 0.033 -6.178 17.469) 18.529 6.350 ( 2.242 -0.163 11.777) 11.990 6.761 ( 0.998 2.390 -2.361) 3.505 6.905 ( -8.855 -5.644 0.462) 10.510 7.185 ( -9.419 -1.397 0.689) 9.547 7.696 ( -1.082 0.576 20.223) 20.260 7.876 ( -2.108 -0.791 -9.749) 10.005 8.328 ( 2.065 -3.937 13.449) 14.165 8.557 ( -6.318 0.391 13.168) 14.611 8.594 ( -12.657 -2.717 13.054) 18.385 9.518 ( 1.939 0.600 16.723) 16.846 9.640 ( 8.689 3.453 23.487) 25.280 10.181 ( -9.304 0.032 19.506) 21.611 10.797 ( -3.397 8.019 31.904) 33.071 11.185 ( -10.944 1.104 18.733) 21.724 12.588 ( 1.643 -4.645 -10.801) 11.872 13.336 ( 3.574 6.899 -12.740) 14.922 13.622 ( 1.076 -7.414 -9.046) 11.745 13.950 ( -5.858 -0.483 10.729) 12.234 14.316 ( 4.665 3.948 3.328) 6.958 14.540 ( -9.483 6.752 6.788) 13.476 15.039 ( 0.510 -10.321 -27.397) 29.281 19.978 ( -3.438 0.382 31.398) 31.588 20.363 ( -0.401 0.167 20.905) 20.909 ======================= Grid point 724 (274/343) ======================= q-point: ( 0.62 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -0.524 2.926 13.366) 13.692 2.613 ( -0.771 -8.184 11.231) 13.917 2.857 ( -6.490 3.911 11.734) 13.968 3.013 ( -3.913 -2.549 8.716) 9.888 3.245 ( -2.100 0.876 6.175) 6.581 3.332 ( 6.261 2.460 6.316) 9.227 3.359 ( -5.367 8.143 5.751) 11.322 3.593 ( -5.365 -5.771 1.522) 8.025 3.971 ( 9.627 0.824 -1.073) 9.722 5.654 ( -3.026 -0.012 7.304) 7.906 5.803 ( -9.379 -2.395 19.661) 21.915 6.034 ( -17.138 0.986 3.761) 17.574 6.157 ( 2.965 -2.173 1.768) 4.079 6.426 ( 0.767 0.756 4.189) 4.326 6.769 ( -3.631 -1.474 6.288) 7.409 7.102 ( -18.455 -0.150 0.242) 18.458 7.267 ( -12.337 -3.306 -8.485) 15.334 7.862 ( -12.830 0.510 -8.500) 15.399 7.978 ( 2.716 0.838 20.777) 20.971 8.505 ( 0.749 -3.388 16.604) 16.963 8.782 ( -7.037 0.106 7.072) 9.977 8.931 ( -8.798 -0.540 14.469) 16.943 9.763 ( 4.420 2.747 21.142) 21.773 9.810 ( 6.959 0.072 21.359) 22.464 10.613 ( -10.710 0.464 21.917) 24.398 11.256 ( -5.070 4.299 24.272) 25.166 11.649 ( -16.864 5.155 18.872) 25.828 12.392 ( 2.598 -3.913 -11.297) 12.234 13.134 ( 3.804 5.664 -12.572) 14.304 13.434 ( 0.957 -9.462 -12.064) 15.362 14.151 ( -1.745 2.198 7.140) 7.672 14.316 ( 0.791 0.717 2.223) 2.466 14.645 ( -3.522 1.618 -9.444) 10.209 14.950 ( -11.679 -4.543 10.403) 16.287 20.427 ( -2.949 -0.228 27.773) 27.930 20.610 ( 2.337 0.959 17.067) 17.253 ======================= Grid point 725 (275/343) ======================= q-point: ( 0.69 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( 1.335 -2.231 9.610) 9.955 2.755 ( -4.306 -2.159 6.906) 8.419 3.061 ( -2.485 1.364 8.100) 8.582 3.127 ( -2.095 -0.643 2.934) 3.662 3.294 ( 8.690 1.031 5.071) 10.114 3.349 ( 0.226 -0.046 5.007) 5.012 3.462 ( 0.016 -0.040 0.754) 0.755 3.715 ( -7.713 5.083 2.151) 9.485 3.833 ( 9.117 -1.349 0.433) 9.226 5.784 ( -4.124 -1.074 5.412) 6.888 5.971 ( 6.990 -1.251 -5.516) 8.992 6.141 ( -3.035 1.903 12.224) 12.738 6.257 ( -13.071 -1.754 -3.014) 13.528 6.470 ( -0.564 0.285 1.577) 1.699 6.974 ( -10.032 -0.823 5.872) 11.653 7.264 ( -12.204 0.386 -9.390) 15.403 7.378 ( -19.141 -1.562 -3.933) 19.604 7.939 ( -18.623 0.200 -13.073) 22.754 8.166 ( 8.893 0.493 17.587) 19.714 8.714 ( 1.204 -2.269 17.406) 17.595 8.944 ( -5.064 -0.197 5.189) 7.253 9.211 ( -1.768 0.467 16.254) 16.356 9.906 ( 8.994 2.244 16.653) 19.059 10.099 ( 2.169 -1.330 24.301) 24.434 11.021 ( -6.671 0.308 19.316) 20.438 11.637 ( -7.107 1.704 18.552) 19.940 12.125 ( -12.031 7.191 10.216) 17.345 12.202 ( -0.178 -4.019 -5.508) 6.820 12.945 ( 2.323 3.177 -11.170) 11.843 13.227 ( -0.752 -7.322 -11.679) 13.805 14.184 ( -0.260 5.459 -3.455) 6.466 14.313 ( -1.255 -3.838 -2.932) 4.991 14.707 ( -6.126 -1.158 6.898) 9.297 15.276 ( -9.011 -0.366 14.438) 17.024 20.769 ( 5.463 0.956 15.141) 16.125 20.797 ( 0.455 -0.534 22.838) 22.849 ======================= Grid point 726 (276/343) ======================= q-point: ( 0.77 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( 1.008 -1.623 5.922) 6.223 2.872 ( -3.511 -0.582 2.023) 4.094 3.143 ( 1.637 1.543 -0.466) 2.298 3.160 ( 0.910 -0.260 3.118) 3.259 3.227 ( 7.900 -0.558 3.745) 8.761 3.400 ( 1.161 0.522 2.821) 3.095 3.418 ( 4.084 -1.645 -1.058) 4.528 3.698 ( 9.197 0.927 1.292) 9.334 3.876 ( -5.351 1.896 2.493) 6.201 5.803 ( 2.348 -0.569 -6.572) 7.002 5.895 ( -3.173 -0.691 3.448) 4.736 6.302 ( 0.449 2.519 4.957) 5.579 6.317 ( -4.994 -1.457 -3.827) 6.458 6.482 ( 0.695 -0.493 0.440) 0.959 7.103 ( -11.380 0.255 -8.368) 14.128 7.330 ( -10.003 -0.012 -3.212) 10.506 7.518 ( -14.536 -0.078 -9.609) 17.425 8.000 ( -18.868 -0.199 -15.519) 24.431 8.220 ( 11.583 -0.683 11.713) 16.487 8.918 ( 3.396 -0.817 17.719) 18.060 9.066 ( -1.793 -0.252 5.834) 6.109 9.419 ( 4.447 0.432 16.664) 17.253 9.986 ( 11.511 0.446 13.939) 18.083 10.333 ( 8.663 -0.433 20.378) 22.147 11.280 ( 1.005 -0.085 11.437) 11.482 11.964 ( -6.904 1.614 13.260) 15.037 12.007 ( 2.765 -2.147 -6.815) 7.661 12.425 ( -2.873 2.721 2.268) 4.561 12.808 ( -0.790 -0.852 -7.191) 7.284 13.189 ( -11.900 -0.669 -0.865) 11.951 14.139 ( -1.298 2.129 -6.734) 7.181 14.277 ( -4.738 -1.386 -6.551) 8.202 14.876 ( -0.793 -1.284 9.668) 9.785 15.542 ( -3.370 0.357 11.729) 12.209 20.861 ( 8.806 0.126 13.316) 15.965 21.043 ( 5.487 -0.044 18.582) 19.375 ======================= Grid point 727 (277/343) ======================= q-point: (-0.15 0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.661 ( 1.161 0.000 2.566) 2.816 2.867 ( 2.353 0.000 -4.275) 4.880 3.038 ( 9.423 0.000 -2.130) 9.660 3.143 ( 4.806 0.000 -0.351) 4.819 3.232 ( -2.131 -0.000 1.870) 2.835 3.315 ( 6.624 0.000 -1.605) 6.816 3.413 ( 2.284 0.000 1.551) 2.761 3.608 ( 7.238 0.000 1.545) 7.401 3.947 ( 0.182 -0.000 2.168) 2.176 5.748 ( -2.842 -0.000 -1.857) 3.395 5.937 ( 0.949 0.000 0.000) 0.949 6.242 ( -4.613 0.000 -14.010) 14.750 6.318 ( 10.945 0.000 6.511) 12.735 6.468 ( 0.540 0.000 -0.473) 0.718 7.104 ( -11.547 -0.000 -13.313) 17.623 7.388 ( -4.737 -0.000 -4.687) 6.664 7.528 ( -8.789 -0.000 -10.905) 14.005 8.031 ( -16.807 -0.000 -15.361) 22.769 8.181 ( 10.326 0.000 4.355) 11.207 9.077 ( 9.607 0.000 17.886) 20.303 9.133 ( 3.148 0.000 4.861) 5.792 9.545 ( 7.986 0.000 14.746) 16.770 9.958 ( 17.722 0.000 11.023) 20.870 10.395 ( 16.991 0.000 14.369) 22.252 11.276 ( 9.940 0.000 -0.316) 9.945 11.869 ( 5.567 0.000 -4.008) 6.860 12.181 ( 1.413 -0.000 3.460) 3.738 12.393 ( -0.770 -0.000 0.544) 0.942 12.798 ( -5.738 -0.000 -0.258) 5.744 13.447 ( -17.132 -0.000 3.633) 17.513 14.053 ( -0.662 0.000 -8.385) 8.411 14.269 ( -8.889 -0.000 -6.639) 11.094 14.957 ( 5.344 0.000 7.113) 8.897 15.682 ( 2.507 -0.000 8.219) 8.593 20.895 ( 11.484 0.000 11.993) 16.605 21.137 ( 12.985 0.000 13.391) 18.653 ======================= Grid point 736 (278/343) ======================= q-point: ( 0.54 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -0.000 10.720 16.659) 19.810 2.633 ( -0.000 9.073 16.853) 19.140 2.794 ( -0.000 -13.978 12.435) 18.709 2.954 ( 0.000 -3.979 9.347) 10.159 3.167 ( 0.000 4.614 8.980) 10.096 3.253 ( -0.000 2.401 6.787) 7.199 3.411 ( 0.000 3.758 6.926) 7.880 3.589 ( 0.000 -10.637 1.301) 10.716 4.108 ( 0.000 3.189 -2.963) 4.353 5.604 ( -0.000 -0.341 25.805) 25.807 5.669 ( 0.000 -0.022 16.917) 16.917 5.685 ( -0.000 0.243 4.339) 4.346 6.243 ( -0.000 -3.083 7.400) 8.016 6.466 ( -0.000 0.070 3.018) 3.019 6.696 ( -0.000 4.631 -5.252) 7.002 6.895 ( -0.000 -8.128 4.368) 9.227 7.053 ( 0.000 -4.641 -8.430) 9.623 7.667 ( -0.000 0.902 -13.618) 13.648 8.024 ( -0.000 2.877 27.176) 27.328 8.607 ( -0.000 -10.286 14.923) 18.125 8.653 ( 0.000 0.033 7.211) 7.211 8.756 ( -0.000 0.067 23.443) 23.443 9.791 ( -0.000 0.679 22.114) 22.124 10.023 ( -0.000 9.364 23.088) 24.915 10.348 ( -0.000 0.417 18.584) 18.588 11.171 ( 0.000 10.717 30.218) 32.062 11.351 ( 0.000 -0.466 17.317) 17.324 12.467 ( 0.000 -6.246 -11.442) 13.036 13.150 ( 0.000 7.082 -13.907) 15.607 13.533 ( -0.000 -12.286 -10.525) 16.178 14.117 ( 0.000 0.041 18.146) 18.146 14.346 ( 0.000 11.424 -4.587) 12.310 14.602 ( -0.000 0.097 16.563) 16.563 14.754 ( 0.000 -9.949 -17.576) 20.196 20.389 ( 0.000 -0.269 31.376) 31.377 20.641 ( 0.000 1.102 19.850) 19.880 ======================= Grid point 737 (279/343) ======================= q-point: ( 0.62 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( -0.214 7.801 12.710) 14.914 2.849 ( 5.421 -10.551 11.352) 16.419 2.912 ( -5.049 5.293 11.316) 13.474 3.075 ( -3.115 -3.551 6.026) 7.656 3.306 ( -2.425 2.632 7.415) 8.234 3.354 ( -1.417 4.747 4.818) 6.910 3.485 ( 4.225 2.826 6.371) 8.150 3.587 ( -2.019 -7.899 1.142) 8.232 4.047 ( 4.808 1.425 -1.832) 5.339 5.726 ( -0.047 -1.068 5.096) 5.207 5.896 ( -9.382 -0.048 3.759) 10.107 5.993 ( -5.084 0.815 20.486) 21.123 6.198 ( 4.814 -2.666 -6.667) 8.645 6.463 ( 1.252 3.228 0.423) 3.488 6.721 ( -10.132 6.093 -5.235) 12.930 6.942 ( -6.610 -8.689 -2.482) 11.196 7.020 ( -6.063 -6.572 1.888) 9.139 7.547 ( -8.563 0.721 -12.985) 15.571 8.380 ( 5.130 3.568 27.059) 27.772 8.759 ( -2.255 -2.329 9.242) 9.794 8.785 ( -1.998 -5.623 12.424) 13.783 9.109 ( -3.520 0.661 22.870) 23.149 10.106 ( 2.247 2.730 24.211) 24.468 10.240 ( 12.108 3.885 22.009) 25.418 10.726 ( -12.860 2.489 19.364) 23.379 11.536 ( 1.125 3.234 21.362) 21.635 11.699 ( -10.832 6.794 20.098) 23.820 12.283 ( 0.972 -6.333 -10.898) 12.642 12.976 ( 1.734 6.314 -13.156) 14.695 13.316 ( 0.883 -12.928 -13.325) 18.587 14.225 ( 5.889 6.568 -2.541) 9.180 14.427 ( 1.364 -0.504 11.228) 11.321 14.530 ( -1.374 -3.888 -0.094) 4.125 14.955 ( -12.767 -0.877 15.381) 20.008 20.796 ( 0.000 -0.349 28.177) 28.179 20.889 ( 2.668 1.078 18.627) 18.848 ======================= Grid point 738 (280/343) ======================= q-point: ( 0.69 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.698 ( 2.024 2.158 9.212) 9.676 2.869 ( 4.200 -6.800 7.596) 11.026 3.104 ( -2.752 2.521 4.379) 5.754 3.161 ( -1.206 -1.883 4.849) 5.339 3.411 ( 0.646 0.013 5.076) 5.117 3.464 ( -0.352 3.111 3.366) 4.597 3.492 ( 5.715 1.568 4.736) 7.586 3.634 ( -5.462 1.042 2.250) 5.998 3.950 ( 7.018 -0.458 -0.541) 7.054 5.801 ( -3.331 -1.696 2.965) 4.771 5.904 ( 3.606 1.937 -11.731) 12.425 6.064 ( -7.714 -4.740 -3.579) 9.736 6.309 ( -3.208 5.130 11.099) 12.641 6.496 ( -1.348 -0.366 3.099) 3.399 6.785 ( -11.398 1.438 -9.199) 14.717 6.997 ( -18.406 -3.190 -11.622) 22.001 7.106 ( -3.193 -2.989 1.526) 4.632 7.555 ( -13.582 -0.730 -8.400) 15.987 8.605 ( 12.605 2.783 21.036) 24.681 8.930 ( -5.470 -0.626 9.591) 11.059 8.974 ( -0.961 -5.191 14.876) 15.785 9.453 ( -1.435 1.308 21.760) 21.846 10.295 ( 12.788 4.953 18.475) 23.009 10.473 ( 2.952 -2.755 25.105) 25.428 11.150 ( -10.318 2.610 16.782) 19.872 11.811 ( -2.857 1.285 16.516) 16.810 12.059 ( -2.581 1.389 -3.327) 4.434 12.184 ( -6.988 1.868 10.299) 12.585 12.811 ( 1.364 4.011 -10.111) 10.962 13.083 ( -0.384 -10.319 -12.562) 16.261 14.128 ( 2.772 4.171 -4.958) 7.047 14.326 ( 6.506 -2.701 -3.294) 7.776 14.793 ( -5.384 -1.111 16.476) 17.369 15.326 ( -11.082 0.105 14.337) 18.121 21.070 ( 6.115 0.869 17.094) 18.175 21.142 ( 2.080 -0.434 24.104) 24.198 ======================= Grid point 739 (281/343) ======================= q-point: ( 0.77 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.753 ( 4.624 -2.183 6.302) 8.116 2.895 ( 1.454 -1.814 3.149) 3.915 3.133 ( 0.313 0.194 -0.797) 0.878 3.221 ( 1.105 -0.468 2.723) 2.976 3.405 ( 9.491 0.337 3.185) 10.017 3.453 ( 3.516 2.210 1.645) 4.467 3.496 ( 3.030 -3.221 3.551) 5.672 3.777 ( -2.582 8.243 2.077) 8.884 3.859 ( 2.890 -2.847 1.476) 4.317 5.717 ( 0.705 -0.342 -9.035) 9.068 5.875 ( -5.100 -1.479 -0.144) 5.312 6.092 ( -5.668 -1.936 -5.552) 8.167 6.430 ( -1.023 9.148 0.407) 9.214 6.540 ( -1.637 -5.000 -0.734) 5.312 6.835 ( -6.190 -0.814 -1.054) 6.331 7.066 ( -20.263 -0.336 -16.346) 26.036 7.129 ( -10.633 -0.394 -9.389) 14.190 7.649 ( -11.077 -0.985 -3.472) 11.650 8.623 ( 17.738 0.133 12.251) 21.557 9.142 ( -2.240 -0.316 12.584) 12.786 9.174 ( -0.545 -2.589 15.147) 15.376 9.725 ( 3.562 1.154 19.305) 19.665 10.362 ( 13.127 0.835 15.453) 20.293 10.718 ( 6.933 -1.303 20.541) 21.718 11.424 ( -0.762 0.978 8.964) 9.049 11.931 ( -0.406 -0.755 -5.622) 5.687 12.088 ( -4.281 -0.848 13.355) 14.050 12.420 ( -0.632 5.585 2.732) 6.249 12.707 ( -1.008 -1.623 -5.713) 6.024 13.016 ( -11.295 -1.773 -0.867) 11.466 14.043 ( 1.062 1.795 -5.723) 6.092 14.186 ( 3.037 -1.146 -6.594) 7.350 15.033 ( -0.193 -1.595 13.395) 13.491 15.619 ( -6.425 0.625 10.603) 12.413 21.186 ( 9.347 0.171 15.335) 17.960 21.387 ( 5.815 -0.049 19.565) 20.411 ======================= Grid point 740 (282/343) ======================= q-point: (-0.15 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.745 ( 4.824 -1.715 3.390) 6.140 2.861 ( 4.356 -0.587 -2.736) 5.177 3.105 ( 2.635 0.201 -0.810) 2.764 3.194 ( 3.838 -0.644 -0.964) 4.010 3.304 ( 8.812 -0.087 2.086) 9.056 3.410 ( 6.914 2.055 1.671) 7.404 3.488 ( 3.639 -2.215 2.853) 5.127 3.722 ( 7.939 1.077 0.060) 8.012 3.948 ( -4.130 1.934 2.526) 5.214 5.663 ( -5.033 -0.498 -2.928) 5.844 5.911 ( -4.229 -0.708 -4.168) 5.980 6.050 ( -0.342 -0.477 -5.473) 5.505 6.443 ( -0.335 6.602 -4.313) 7.893 6.485 ( 0.207 -4.773 -4.488) 6.555 6.859 ( 0.765 -0.103 -1.783) 1.943 7.115 ( -19.314 1.049 -15.502) 24.788 7.176 ( -14.118 -0.643 -8.581) 16.534 7.726 ( -7.558 -0.484 -3.806) 8.476 8.489 ( 19.304 -1.183 6.120) 20.285 9.293 ( 4.217 -0.298 11.150) 11.925 9.373 ( 0.979 -0.516 14.968) 15.009 9.877 ( 9.295 0.588 15.293) 17.906 10.345 ( 16.055 -0.836 10.923) 19.436 10.806 ( 14.774 -0.442 14.019) 20.371 11.388 ( 9.585 -0.213 -2.963) 10.034 11.902 ( 1.661 -0.802 0.700) 1.973 12.251 ( 4.476 -0.083 0.378) 4.493 12.405 ( -2.068 1.819 4.847) 5.575 12.705 ( -6.638 -1.484 -0.423) 6.815 13.263 ( -15.175 2.010 3.247) 15.648 13.949 ( 0.861 -0.221 -6.745) 6.803 14.086 ( -4.309 0.473 -6.896) 8.145 15.141 ( 5.383 -1.339 8.632) 10.261 15.787 ( -1.034 0.604 6.591) 6.698 21.233 ( 12.100 -0.118 12.930) 17.709 21.501 ( 11.651 0.056 14.346) 18.482 ======================= Grid point 741 (283/343) ======================= q-point: (-0.08 0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 9.417 0.000 -6.319) 11.341 2.704 ( 5.106 0.000 0.772) 5.164 3.005 ( 10.806 0.000 -0.513) 10.818 3.102 ( 6.151 0.000 -1.699) 6.381 3.268 ( -0.390 -0.000 0.749) 0.844 3.332 ( 9.009 0.000 2.218) 9.278 3.454 ( 4.894 0.000 1.457) 5.106 3.610 ( 7.544 0.000 -1.369) 7.668 4.003 ( 0.880 0.000 1.648) 1.868 5.763 ( -8.677 -0.000 3.031) 9.191 5.853 ( 2.139 0.000 -6.088) 6.453 5.967 ( 1.872 0.000 -5.064) 5.399 6.359 ( 2.869 0.000 -5.435) 6.146 6.429 ( 0.136 0.000 -2.260) 2.264 6.789 ( -1.427 0.000 -7.899) 8.027 7.188 ( -16.977 -0.000 -10.330) 19.873 7.219 ( -3.340 -0.000 -4.673) 5.744 7.760 ( -7.816 -0.000 -5.369) 9.483 8.260 ( 21.498 0.000 0.846) 21.514 9.315 ( 11.407 0.000 7.529) 13.668 9.525 ( 6.378 0.000 13.913) 15.305 9.892 ( 13.104 0.000 9.335) 16.089 10.219 ( 19.520 0.000 7.088) 20.767 10.691 ( 22.871 0.000 7.381) 24.033 11.161 ( 13.580 0.000 -5.811) 14.771 11.838 ( 9.394 0.000 0.596) 9.412 12.059 ( 11.685 0.000 -6.173) 13.215 12.595 ( -5.790 -0.000 9.152) 10.830 12.844 ( -10.748 -0.000 2.576) 11.052 13.398 ( -7.234 -0.000 -7.027) 10.085 13.845 ( 1.036 0.000 -6.225) 6.311 14.189 ( -17.303 -0.000 0.579) 17.313 15.120 ( 9.852 0.000 4.329) 10.761 15.840 ( 3.129 0.000 3.715) 4.857 21.202 ( 14.738 0.000 9.279) 17.416 21.447 ( 19.563 0.000 8.641) 21.387 ======================= Grid point 742 (284/343) ======================= q-point: ( 0.00 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.604 ( 12.798 0.000 -0.000) 12.798 2.713 ( 6.915 0.000 -0.000) 6.915 2.999 ( 11.253 0.000 -0.000) 11.253 3.078 ( 6.035 0.000 -0.000) 6.035 3.277 ( 0.553 0.000 -0.000) 0.553 3.379 ( 9.536 0.000 -0.000) 9.536 3.477 ( 5.690 0.000 -0.000) 5.690 3.574 ( 8.343 0.000 -0.000) 8.343 4.027 ( 1.103 0.000 -0.000) 1.103 5.756 ( 1.691 0.000 -0.000) 1.691 5.848 ( -11.521 -0.000 0.000) 11.521 5.896 ( 5.284 0.000 -0.000) 5.284 6.205 ( -7.549 -0.000 0.000) 7.549 6.388 ( -1.019 -0.000 0.000) 1.019 6.672 ( 4.185 0.000 -0.000) 4.185 7.047 ( -17.639 -0.000 0.000) 17.639 7.187 ( 3.475 0.000 -0.000) 3.475 7.687 ( -4.714 -0.000 0.000) 4.714 8.264 ( 25.097 0.000 -0.000) 25.097 9.436 ( 15.145 0.000 -0.000) 15.145 9.739 ( 0.684 0.000 -0.000) 0.684 10.013 ( 18.358 0.000 -0.000) 18.358 10.316 ( 18.056 0.000 -0.000) 18.056 10.792 ( 25.184 0.000 -0.000) 25.184 11.066 ( 14.646 0.000 -0.000) 14.646 11.853 ( 11.228 0.000 -0.000) 11.228 11.967 ( 12.918 0.000 -0.000) 12.918 12.757 ( -5.343 -0.000 0.000) 5.343 12.887 ( -11.719 -0.000 0.000) 11.719 13.241 ( -1.535 -0.000 0.000) 1.535 13.753 ( 1.503 0.000 -0.000) 1.503 14.214 ( -21.931 -0.000 0.000) 21.931 15.179 ( 11.546 0.000 -0.000) 11.546 15.890 ( 3.386 0.000 -0.000) 3.386 21.337 ( 15.567 0.000 -0.000) 15.567 21.569 ( 21.685 0.000 -0.000) 21.685 ======================= Grid point 750 (285/343) ======================= q-point: ( 0.62 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( -0.000 8.839 11.205) 14.272 2.996 ( 0.000 4.686 9.044) 10.186 3.093 ( -0.000 -12.171 9.444) 15.405 3.122 ( -0.000 -1.948 4.199) 4.629 3.351 ( 0.000 5.849 4.945) 7.659 3.417 ( 0.000 -0.598 5.831) 5.862 3.589 ( 0.000 3.250 5.927) 6.759 3.619 ( 0.000 -7.435 1.158) 7.525 4.047 ( -0.000 1.641 -1.766) 2.411 5.770 ( -0.000 -1.192 1.393) 1.833 5.872 ( 0.000 -0.274 -0.801) 0.846 6.089 ( -0.000 -3.324 -13.974) 14.364 6.151 ( -0.000 4.936 6.635) 8.269 6.446 ( -0.000 5.482 -1.893) 5.800 6.561 ( 0.000 1.993 0.199) 2.003 6.775 ( 0.000 -7.206 -12.411) 14.351 7.208 ( -0.000 -9.225 14.147) 16.889 7.303 ( -0.000 1.256 -12.152) 12.217 8.761 ( -0.000 4.930 25.245) 25.722 8.825 ( 0.000 -1.101 8.277) 8.350 9.027 ( -0.000 -8.638 15.694) 17.914 9.403 ( -0.000 1.207 23.472) 23.503 10.434 ( -0.000 7.979 22.277) 23.663 10.636 ( -0.000 4.624 23.066) 23.525 10.840 ( 0.000 0.460 16.842) 16.848 11.775 ( -0.000 -0.440 13.776) 13.783 11.883 ( 0.000 8.540 19.700) 21.471 12.186 ( 0.000 -7.504 -6.655) 10.030 12.792 ( 0.000 7.159 -11.186) 13.281 13.188 ( -0.000 -14.573 -13.746) 20.033 14.163 ( 0.000 5.279 -6.025) 8.010 14.514 ( 0.000 -3.468 -5.899) 6.843 14.689 ( 0.000 0.034 22.423) 22.423 15.102 ( -0.000 0.091 19.096) 19.096 21.146 ( 0.000 1.104 19.861) 19.892 21.177 ( 0.000 -0.482 23.963) 23.967 ======================= Grid point 751 (286/343) ======================= q-point: ( 0.69 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.827 ( 1.719 6.406 8.420) 10.719 3.058 ( 4.201 -4.335 3.078) 6.776 3.135 ( 0.963 -3.474 5.975) 6.978 3.215 ( -1.880 -2.122 4.993) 5.742 3.451 ( -1.670 6.617 3.527) 7.682 3.495 ( -1.187 -0.020 5.451) 5.579 3.613 ( 1.788 -3.643 2.533) 4.783 3.649 ( 2.170 1.607 4.265) 5.048 4.006 ( 3.033 0.049 -1.351) 3.320 5.761 ( 0.974 0.703 -6.994) 7.097 5.804 ( 1.221 -0.579 -5.792) 5.948 5.928 ( -6.841 -2.859 -7.623) 10.634 6.223 ( -7.406 2.637 -5.439) 9.560 6.455 ( -0.877 6.035 -1.874) 6.380 6.615 ( -9.538 -2.319 -9.782) 13.858 6.638 ( -7.783 -2.757 -7.255) 10.992 7.139 ( 5.878 -1.004 -1.212) 6.085 7.419 ( -7.037 -4.677 7.708) 11.437 8.939 ( 3.673 0.580 11.194) 11.796 9.086 ( 0.101 2.081 20.713) 20.818 9.203 ( 1.144 -5.952 14.958) 16.140 9.725 ( -1.191 1.372 21.358) 21.435 10.669 ( 10.138 9.230 16.349) 21.337 10.871 ( 4.879 -3.996 22.851) 23.705 11.184 ( -12.591 3.103 14.053) 19.122 11.938 ( 0.590 -1.187 -2.143) 2.520 11.987 ( -4.198 -2.489 5.768) 7.555 12.283 ( -2.102 6.975 14.893) 16.579 12.692 ( 0.361 4.936 -5.987) 7.767 12.969 ( 0.140 -12.819 -9.505) 15.959 14.085 ( 2.050 2.161 -4.949) 5.776 14.367 ( 6.511 -1.204 -7.007) 9.640 14.998 ( -1.835 -0.320 19.613) 19.701 15.402 ( -6.761 0.172 15.897) 17.275 21.366 ( 3.646 0.755 16.495) 16.910 21.482 ( 1.525 -0.395 21.560) 21.618 ======================= Grid point 752 (287/343) ======================= q-point: ( 0.77 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.898 ( 4.036 1.917 5.616) 7.176 3.004 ( 5.856 -4.360 1.912) 7.547 3.151 ( 2.143 -2.396 1.717) 3.645 3.264 ( 0.486 -2.554 1.471) 2.987 3.503 ( 2.613 4.713 2.835) 6.089 3.565 ( 5.097 0.641 2.902) 5.900 3.603 ( 2.978 -2.463 4.218) 5.720 3.715 ( -4.285 6.789 2.892) 8.533 3.937 ( 4.434 -1.828 -0.515) 4.823 5.591 ( -0.298 -0.977 -9.854) 9.906 5.778 ( -3.766 -2.009 -4.187) 5.979 5.969 ( -8.366 1.953 -4.116) 9.526 6.228 ( -8.357 -1.363 -9.697) 12.874 6.441 ( -2.930 3.262 -6.579) 7.906 6.586 ( -14.616 1.130 -12.639) 19.355 6.702 ( -14.827 -1.179 -10.691) 18.317 7.089 ( 7.754 -1.004 7.958) 11.156 7.574 ( -5.001 -2.176 4.522) 7.085 8.970 ( 12.767 0.327 8.458) 15.318 9.349 ( -1.021 -1.121 16.439) 16.509 9.362 ( 1.494 -2.299 14.095) 14.359 10.000 ( 0.743 1.206 17.219) 17.277 10.718 ( 12.178 1.850 11.700) 16.989 11.080 ( 5.854 -1.943 18.398) 19.404 11.485 ( -5.174 2.372 6.955) 8.987 11.828 ( -3.293 -2.139 -6.756) 7.815 12.194 ( -5.347 -0.847 10.402) 11.727 12.438 ( 2.025 6.819 1.350) 7.241 12.648 ( 0.392 0.730 -2.677) 2.802 12.929 ( -6.006 -5.256 5.990) 9.979 13.993 ( 2.307 0.783 -5.059) 5.616 14.158 ( 6.948 -0.396 -9.231) 11.561 15.235 ( 1.097 -0.968 14.228) 14.303 15.674 ( -5.750 0.526 10.740) 12.194 21.500 ( 7.133 0.174 13.844) 15.575 21.705 ( 4.106 -0.048 16.755) 17.251 ======================= Grid point 753 (288/343) ======================= q-point: (-0.15 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.882 ( 6.747 -1.761 3.064) 7.617 2.918 ( 6.651 -2.285 -0.777) 7.075 3.129 ( 2.061 -0.734 0.649) 2.282 3.231 ( 2.884 -2.471 -0.901) 3.903 3.471 ( 10.542 0.488 1.686) 10.687 3.508 ( 5.583 6.051 2.306) 8.550 3.598 ( 3.998 -4.908 3.294) 7.136 3.799 ( 4.012 5.910 -0.410) 7.155 3.908 ( -3.816 -0.233 1.698) 4.183 5.540 ( -6.698 -1.484 -3.763) 7.824 5.769 ( -4.880 -1.131 -4.960) 7.049 6.014 ( -2.847 2.228 -2.697) 4.510 6.190 ( -8.184 -1.785 -10.892) 13.741 6.404 ( -4.695 0.662 -6.953) 8.416 6.669 ( -16.649 3.115 -8.432) 18.921 6.732 ( -13.412 -0.848 -12.397) 18.284 7.124 ( 5.692 -0.425 10.186) 11.676 7.657 ( -2.688 -0.684 0.800) 2.887 8.832 ( 19.317 -1.432 4.608) 19.911 9.512 ( 1.847 1.126 10.884) 11.097 9.545 ( 0.164 -2.909 12.267) 12.609 10.162 ( 5.283 0.813 11.795) 12.950 10.673 ( 13.289 -1.862 6.884) 15.082 11.165 ( 11.466 -0.927 11.610) 16.344 11.457 ( 7.704 0.002 -3.989) 8.676 11.900 ( -6.778 -0.634 2.225) 7.162 12.299 ( 4.746 0.917 -2.315) 5.359 12.450 ( -2.843 1.736 6.812) 7.583 12.646 ( -2.931 -0.748 1.078) 3.212 13.150 ( -8.712 1.788 7.066) 11.359 13.894 ( 2.032 -0.338 -5.061) 5.464 13.959 ( 1.693 0.310 -9.152) 9.313 15.338 ( 5.499 -1.395 8.234) 9.999 15.843 ( -2.320 0.752 5.799) 6.291 21.546 ( 10.181 -0.175 10.184) 14.401 21.814 ( 8.231 0.123 11.289) 13.972 ======================= Grid point 754 (289/343) ======================= q-point: (-0.08 0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.778 ( 9.655 -0.905 -2.158) 9.934 2.805 ( 7.251 -1.907 1.050) 7.571 3.101 ( 3.725 -0.011 0.104) 3.727 3.159 ( 4.605 -1.215 -0.881) 4.844 3.342 ( 9.408 -0.001 0.695) 9.433 3.470 ( 7.675 5.424 1.851) 9.579 3.550 ( 5.064 -4.512 1.482) 6.943 3.700 ( 8.374 1.008 -1.184) 8.517 3.998 ( -3.582 2.028 1.001) 4.236 5.654 ( -12.073 -0.591 1.522) 12.182 5.766 ( -3.362 -0.566 -3.400) 4.815 5.978 ( 3.761 0.279 -1.832) 4.193 6.163 ( -8.452 -0.196 -8.720) 12.146 6.387 ( -2.157 0.271 -2.790) 3.537 6.720 ( -4.107 0.070 -6.152) 7.398 6.831 ( -18.308 1.261 -4.659) 18.933 7.182 ( 1.144 0.403 4.422) 4.586 7.671 ( -0.959 -0.312 -1.309) 1.652 8.582 ( 22.307 -1.588 1.458) 22.411 9.562 ( 9.298 0.257 6.396) 11.288 9.678 ( -1.849 -0.477 6.427) 6.705 10.174 ( 11.165 0.462 5.819) 12.599 10.532 ( 15.773 -2.690 2.952) 16.270 11.067 ( 19.089 -0.490 4.930) 19.721 11.269 ( 11.588 -0.017 -3.328) 12.056 11.950 ( 3.492 -0.967 1.498) 3.921 12.146 ( 10.012 -0.130 -3.008) 10.455 12.622 ( -5.397 5.840 6.032) 9.981 12.743 ( -8.662 -4.717 1.990) 10.062 13.262 ( -1.732 1.668 -2.557) 3.510 13.803 ( 2.158 -0.499 -3.317) 3.988 13.960 ( -13.739 1.175 -1.947) 13.926 15.306 ( 9.323 -1.273 3.197) 9.938 15.906 ( 1.033 0.622 2.208) 2.516 21.495 ( 12.996 -0.207 5.398) 14.074 21.777 ( 14.270 0.083 5.417) 15.264 ======================= Grid point 764 (290/343) ======================= q-point: ( 0.69 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.917 ( -0.000 7.557 6.832) 10.187 3.095 ( 0.000 -1.935 0.380) 1.972 3.246 ( -0.000 0.604 3.845) 3.892 3.302 ( -0.000 -10.786 5.980) 12.333 3.460 ( 0.000 6.514 3.485) 7.388 3.543 ( 0.000 -0.280 2.609) 2.624 3.678 ( 0.000 -3.929 3.629) 5.348 3.720 ( 0.000 2.540 3.635) 4.434 4.003 ( -0.000 0.308 -1.521) 1.551 5.670 ( -0.000 -7.030 -13.733) 15.428 5.691 ( 0.000 10.575 -9.228) 14.035 5.762 ( -0.000 -2.128 -2.821) 3.534 6.105 ( 0.000 -3.737 -5.738) 6.848 6.347 ( 0.000 -6.162 -15.441) 16.625 6.415 ( -0.000 10.785 -0.328) 10.790 6.482 ( -0.000 -0.659 -11.208) 11.228 7.210 ( -0.000 1.319 5.024) 5.194 7.528 ( -0.000 -6.415 8.886) 10.960 9.119 ( 0.000 -1.373 11.727) 11.807 9.331 ( -0.000 -0.745 15.214) 15.232 9.442 ( -0.000 -0.977 15.764) 15.794 9.982 ( -0.000 1.544 18.220) 18.285 10.902 ( -0.000 12.106 11.934) 16.999 11.223 ( -0.000 -4.586 18.125) 18.696 11.227 ( 0.000 0.259 11.292) 11.295 11.834 ( -0.000 -3.652 -10.710) 11.316 12.085 ( -0.000 -0.321 8.925) 8.931 12.408 ( 0.000 6.591 6.390) 9.180 12.643 ( 0.000 2.931 0.728) 3.020 12.953 ( -0.000 -10.090 2.089) 10.304 14.027 ( 0.000 1.303 -4.942) 5.111 14.292 ( 0.000 -0.580 -10.760) 10.776 15.244 ( 0.000 0.068 17.213) 17.213 15.569 ( -0.000 0.037 14.413) 14.414 21.597 ( 0.000 0.518 14.000) 14.010 21.757 ( 0.000 -0.270 17.107) 17.109 ======================= Grid point 765 (291/343) ======================= q-point: ( 0.77 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( 2.757 5.233 4.409) 7.377 3.074 ( 1.974 -2.094 -0.393) 2.904 3.262 ( 3.587 -4.550 2.509) 6.313 3.309 ( 1.942 -7.104 2.372) 7.737 3.542 ( -0.250 7.523 2.949) 8.084 3.586 ( -2.120 3.174 1.610) 4.142 3.705 ( 2.163 -2.984 3.698) 5.221 3.741 ( 3.144 2.212 2.231) 4.445 3.971 ( 1.608 -1.238 -1.144) 2.330 5.465 ( -0.327 -5.274 -9.448) 10.825 5.670 ( -4.353 6.834 -6.876) 10.627 5.747 ( -4.966 3.262 -3.928) 7.122 6.050 ( -9.500 -4.271 -8.826) 13.652 6.179 ( -3.724 -8.541 -9.467) 13.283 6.371 ( -7.295 0.212 -11.176) 13.348 6.463 ( -1.572 8.952 -0.399) 9.097 7.274 ( 2.924 1.252 6.620) 7.344 7.615 ( -0.894 -4.053 5.065) 6.548 9.215 ( 6.826 -0.645 8.278) 10.749 9.490 ( -1.087 -2.112 8.825) 9.140 9.632 ( 3.267 -0.203 15.060) 15.412 10.204 ( -0.124 1.305 12.950) 13.016 10.977 ( 8.998 3.766 6.112) 11.511 11.357 ( 2.506 -0.238 11.568) 11.838 11.475 ( -8.030 -0.697 7.606) 11.083 11.691 ( -1.451 -1.647 -8.470) 8.750 12.229 ( -5.731 -0.350 6.516) 8.685 12.425 ( 1.081 3.862 -3.727) 5.475 12.669 ( 2.451 1.502 3.787) 4.755 13.057 ( -0.222 -4.723 14.252) 15.016 13.946 ( 1.644 1.331 -5.984) 6.347 14.101 ( 4.667 -0.710 -11.336) 12.279 15.435 ( 1.422 -0.219 11.652) 11.740 15.755 ( -2.547 0.182 9.417) 9.757 21.737 ( 3.643 0.140 10.144) 10.779 21.941 ( 1.942 -0.037 11.844) 12.002 ======================= Grid point 766 (292/343) ======================= q-point: (-0.15 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.989 ( 5.322 -1.147 0.712) 5.491 3.022 ( 5.414 -0.205 0.929) 5.497 3.201 ( 5.400 -4.097 1.185) 6.881 3.271 ( 2.366 -4.839 -0.199) 5.390 3.570 ( 3.836 7.357 1.648) 8.459 3.612 ( 5.963 1.463 0.760) 6.187 3.702 ( 2.730 -3.915 2.417) 5.350 3.761 ( -2.351 8.401 0.497) 8.738 3.924 ( 2.178 -3.030 -0.294) 3.743 5.405 ( -6.710 -4.953 -3.617) 9.091 5.667 ( -3.028 1.395 -2.690) 4.284 5.810 ( -8.894 9.938 -4.824) 14.182 6.089 ( -5.866 -9.715 -2.659) 11.656 6.123 ( -12.689 -3.342 -7.276) 15.004 6.388 ( -12.843 0.871 -6.854) 14.584 6.515 ( -3.127 6.285 -0.421) 7.033 7.311 ( 4.488 1.143 5.152) 6.927 7.654 ( -0.472 -2.034 1.244) 2.430 9.134 ( 15.866 -1.103 3.333) 16.250 9.597 ( -1.692 0.280 4.791) 5.088 9.747 ( 3.439 -2.956 8.736) 9.843 10.330 ( 1.884 0.911 6.464) 6.794 10.901 ( 10.390 -1.650 2.296) 10.768 11.411 ( 6.817 0.888 5.161) 8.597 11.505 ( 5.505 -1.642 -1.531) 5.945 11.775 ( -13.899 0.410 1.049) 13.945 12.320 ( 3.057 1.582 -1.468) 3.742 12.440 ( -9.001 -0.627 2.591) 9.388 12.674 ( 4.285 2.793 2.662) 5.766 13.231 ( 0.856 -1.298 11.185) 11.293 13.825 ( 2.185 3.451 -8.773) 9.678 13.909 ( 4.160 -2.932 -4.782) 6.984 15.507 ( 4.668 -0.809 5.297) 7.107 15.879 ( -1.968 0.509 3.993) 4.481 21.771 ( 7.009 -0.153 5.411) 8.856 22.019 ( 4.682 0.141 6.033) 7.638 ======================= Grid point 767 (293/343) ======================= q-point: (-0.08 0.38 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( 7.977 -1.790 0.000) 8.175 2.930 ( 8.156 -2.650 0.000) 8.576 3.142 ( 3.014 -0.856 0.000) 3.133 3.215 ( 3.368 -2.931 0.000) 4.465 3.494 ( 10.996 0.400 -0.000) 11.003 3.546 ( 5.662 7.878 -0.000) 9.702 3.649 ( 4.473 -5.936 0.000) 7.432 3.784 ( 5.442 4.753 -0.000) 7.225 3.933 ( -4.877 1.035 -0.000) 4.986 5.499 ( -11.705 -2.955 0.000) 12.072 5.696 ( -3.713 -0.391 0.000) 3.734 5.922 ( -6.924 9.210 -0.000) 11.522 6.061 ( -1.051 -8.887 0.000) 8.949 6.269 ( -12.278 -0.961 0.000) 12.316 6.530 ( -13.721 1.360 -0.000) 13.788 6.604 ( -9.374 2.893 -0.000) 9.810 7.281 ( 6.013 0.898 -0.000) 6.079 7.659 ( -0.356 -0.782 0.000) 0.859 8.895 ( 20.747 -1.962 0.000) 20.840 9.660 ( -1.012 3.207 -0.000) 3.363 9.739 ( 4.009 -4.793 0.000) 6.249 10.326 ( 5.772 0.619 -0.000) 5.805 10.752 ( 12.520 -3.314 0.000) 12.952 11.320 ( 12.472 0.172 0.000) 12.473 11.387 ( 8.878 -1.009 0.000) 8.935 11.941 ( -7.508 -0.588 0.000) 7.531 12.240 ( 6.821 0.790 -0.000) 6.866 12.576 ( -5.212 2.205 -0.000) 5.659 12.681 ( -3.542 0.214 -0.000) 3.549 13.271 ( 3.433 1.081 -0.000) 3.600 13.782 ( -4.564 2.749 -0.000) 5.327 13.829 ( 1.523 -2.469 0.000) 2.901 15.452 ( 7.653 -1.304 0.000) 7.764 15.923 ( -0.512 0.733 -0.000) 0.894 21.691 ( 10.176 -0.273 0.000) 10.179 21.970 ( 8.842 0.173 -0.000) 8.843 ======================= Grid point 778 (294/343) ======================= q-point: ( 0.77 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.043 ( -0.000 6.974 2.377) 7.368 3.093 ( 0.000 -3.648 -0.137) 3.651 3.304 ( -0.000 -2.461 0.767) 2.577 3.413 ( -0.000 -10.135 2.115) 10.353 3.532 ( 0.000 4.964 1.499) 5.186 3.579 ( 0.000 5.972 0.544) 5.997 3.773 ( 0.000 -2.937 2.304) 3.733 3.784 ( 0.000 1.906 1.135) 2.219 3.969 ( 0.000 -0.773 -0.810) 1.119 5.380 ( -0.000 -10.806 -6.124) 12.420 5.501 ( 0.000 15.194 -3.793) 15.660 5.703 ( -0.000 -0.975 -1.377) 1.687 5.836 ( 0.000 0.054 -8.599) 8.599 6.140 ( 0.000 -11.156 -2.910) 11.529 6.203 ( 0.000 -4.645 -5.615) 7.287 6.415 ( -0.000 13.473 0.082) 13.473 7.346 ( -0.000 2.496 3.062) 3.950 7.685 ( -0.000 -4.372 2.816) 5.201 9.363 ( 0.000 -1.193 5.069) 5.207 9.578 ( -0.000 -1.478 4.267) 4.515 9.823 ( -0.000 -0.510 9.233) 9.247 10.334 ( -0.000 1.516 6.925) 7.088 11.076 ( -0.000 5.333 1.610) 5.571 11.436 ( 0.000 0.085 3.975) 3.976 11.535 ( -0.000 -1.987 2.532) 3.218 11.608 ( -0.000 -1.909 -1.751) 2.591 12.250 ( -0.000 -0.228 3.110) 3.118 12.370 ( 0.000 2.104 -3.254) 3.875 12.755 ( 0.000 -0.582 4.591) 4.628 13.278 ( 0.000 -1.409 14.731) 14.798 13.844 ( 0.000 2.591 -9.877) 10.211 14.007 ( -0.000 -1.906 -6.511) 6.784 15.570 ( 0.000 0.096 6.310) 6.311 15.842 ( -0.000 -0.007 5.244) 5.244 21.867 ( 0.000 0.057 5.343) 5.343 22.076 ( 0.000 0.012 6.059) 6.059 ======================= Grid point 779 (295/343) ======================= q-point: (-0.15 0.46 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.059 ( 2.903 -2.167 0.000) 3.623 3.069 ( 2.224 4.572 -0.000) 5.084 3.285 ( 2.082 -4.030 0.000) 4.536 3.347 ( 5.093 -8.955 0.000) 10.301 3.593 ( -0.619 6.580 -0.000) 6.609 3.600 ( -1.407 6.701 -0.000) 6.847 3.762 ( 3.279 -0.187 0.000) 3.284 3.771 ( 2.378 -0.629 0.000) 2.459 3.953 ( 0.933 -2.001 0.000) 2.208 5.326 ( -3.850 -8.854 0.000) 9.655 5.567 ( -4.447 14.100 -0.000) 14.784 5.688 ( -1.362 0.941 -0.000) 1.655 5.866 ( -11.636 -0.444 0.000) 11.645 6.098 ( -2.734 -14.773 0.000) 15.024 6.198 ( -7.328 -1.100 0.000) 7.410 6.464 ( -0.457 10.937 -0.000) 10.946 7.370 ( 0.988 2.294 -0.000) 2.497 7.682 ( 0.942 -3.494 0.000) 3.619 9.334 ( 8.785 -0.915 0.000) 8.833 9.611 ( -0.903 -0.431 0.000) 1.000 9.862 ( 2.727 -2.264 0.000) 3.544 10.385 ( 0.350 1.227 -0.000) 1.276 11.037 ( 7.343 0.881 -0.000) 7.395 11.481 ( 1.382 2.835 -0.000) 3.154 11.578 ( 2.237 -2.469 0.000) 3.331 11.599 ( -9.931 -1.189 0.000) 10.002 12.321 ( -5.516 -0.638 0.000) 5.553 12.346 ( -0.325 2.864 -0.000) 2.882 12.758 ( 4.070 0.384 -0.000) 4.088 13.377 ( 2.767 -3.042 0.000) 4.112 13.751 ( 1.593 5.136 -0.000) 5.378 13.935 ( 2.708 -3.018 0.000) 4.055 15.596 ( 2.496 -0.179 0.000) 2.502 15.886 ( -1.171 0.154 -0.000) 1.181 21.880 ( 3.520 -0.063 0.000) 3.521 22.104 ( 1.992 0.091 -0.000) 1.994 ======================= Grid point 814 (296/343) ======================= q-point: ( 0.38 -0.31 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -17.057 -0.000 -5.635) 17.963 2.547 ( -12.468 -0.000 -10.149) 16.077 2.640 ( -6.917 0.000 -9.780) 11.979 2.806 ( -9.990 -0.000 -10.331) 14.371 2.937 ( -3.066 -0.000 -2.378) 3.880 3.347 ( -5.216 -0.000 1.287) 5.373 3.390 ( 0.924 -0.000 -1.849) 2.067 3.667 ( 3.726 0.000 2.436) 4.452 3.679 ( -2.734 -0.000 -5.421) 6.071 5.635 ( -14.479 -0.000 -5.862) 15.621 5.735 ( -8.509 -0.000 -3.315) 9.132 5.871 ( -5.372 -0.000 -15.954) 16.834 6.234 ( 0.244 -0.000 1.604) 1.623 6.357 ( 2.541 -0.000 -8.717) 9.080 6.794 ( -9.917 -0.000 -16.497) 19.248 7.254 ( -12.363 -0.000 -1.660) 12.474 7.416 ( 6.176 -0.000 -2.029) 6.501 7.844 ( -13.000 -0.000 -18.769) 22.832 8.298 ( -26.906 -0.000 5.753) 27.515 8.511 ( 5.441 -0.000 -13.465) 14.523 8.895 ( -11.167 -0.000 -9.653) 14.761 9.131 ( -19.073 -0.000 -1.303) 19.118 9.506 ( -18.112 -0.000 11.732) 21.580 9.670 ( -17.135 -0.000 10.053) 19.866 10.590 ( -21.712 -0.000 -7.687) 23.032 11.287 ( -24.343 -0.000 -6.674) 25.242 11.854 ( -23.573 -0.000 -15.340) 28.125 12.611 ( 6.723 -0.000 7.838) 10.326 13.276 ( 9.609 -0.000 2.855) 10.024 13.577 ( 6.930 -0.000 4.248) 8.128 14.157 ( 3.649 -0.000 0.976) 3.777 14.300 ( 3.827 -0.000 -12.356) 12.935 15.130 ( -15.741 -0.000 6.319) 16.962 15.261 ( 3.717 -0.000 12.157) 12.713 20.348 ( -27.803 -0.000 -2.574) 27.921 20.508 ( -16.170 -0.000 1.323) 16.224 ======================= Grid point 828 (297/343) ======================= q-point: ( 0.38 -0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -17.766 1.160 -5.989) 18.784 2.200 ( -16.406 0.914 -13.363) 21.179 2.384 ( -10.670 3.080 -10.625) 15.370 2.461 ( -14.736 -6.940 -12.126) 20.306 2.903 ( 0.651 1.108 -2.440) 2.758 3.280 ( -5.886 0.925 0.448) 5.975 3.329 ( -6.357 3.100 -2.922) 7.652 3.537 ( -7.682 -1.231 -4.331) 8.904 3.759 ( 7.008 -0.354 1.002) 7.088 5.333 ( -13.890 0.524 -8.809) 16.457 5.502 ( -10.071 -0.992 -12.272) 15.907 5.667 ( -2.941 0.786 -4.890) 5.760 6.054 ( -20.282 -1.759 -9.010) 22.263 6.215 ( -7.044 -1.449 -9.569) 11.970 6.535 ( 0.222 -0.987 -10.268) 10.318 7.019 ( -14.535 -0.283 -5.922) 15.697 7.445 ( -11.445 -0.965 -13.028) 17.368 7.527 ( 2.589 0.028 5.935) 6.475 7.971 ( -29.812 -0.285 6.617) 30.539 8.448 ( 8.731 0.345 -9.621) 12.997 8.566 ( -12.556 0.080 -12.950) 18.038 8.757 ( -22.262 -0.561 -10.163) 24.479 9.340 ( -27.152 0.586 7.674) 28.221 9.595 ( -14.899 -0.018 9.136) 17.478 10.189 ( -21.212 -0.257 -7.146) 22.384 10.778 ( -38.445 0.863 -7.131) 39.111 11.304 ( -24.608 1.071 -14.983) 28.830 12.784 ( 4.853 -0.936 5.740) 7.575 13.417 ( 7.982 0.932 1.168) 8.121 13.680 ( 3.699 0.106 0.024) 3.701 14.192 ( 2.509 9.025 -0.732) 9.396 14.259 ( 2.085 -8.112 -0.862) 8.420 15.016 ( -13.276 1.567 6.689) 14.949 15.601 ( 17.826 -2.855 15.972) 24.105 19.870 ( -33.104 0.735 -5.690) 33.598 20.215 ( -24.526 -0.375 -4.378) 24.916 ======================= Grid point 829 (298/343) ======================= q-point: ( 0.46 -0.23 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( -20.745 -0.000 -1.395) 20.792 2.326 ( -19.333 -0.000 -5.041) 19.980 2.422 ( -11.823 0.000 -5.232) 12.929 2.543 ( -15.982 -0.000 -6.290) 17.175 2.908 ( -3.465 -0.000 -0.352) 3.482 3.342 ( -0.165 -0.000 -1.205) 1.217 3.375 ( -6.650 -0.000 0.615) 6.679 3.570 ( -3.205 0.000 -2.196) 3.885 3.708 ( 2.314 -0.000 0.594) 2.389 5.500 ( -21.901 0.000 -3.342) 22.155 5.508 ( -11.083 -0.000 -7.026) 13.123 5.673 ( -4.421 -0.000 -2.748) 5.206 6.181 ( -3.432 -0.000 -3.746) 5.080 6.233 ( -17.166 -0.000 -1.164) 17.206 6.429 ( -2.885 -0.000 -7.575) 8.106 7.148 ( -11.928 -0.000 -4.051) 12.597 7.376 ( 18.277 -0.000 -0.802) 18.295 7.480 ( -15.393 -0.000 -6.581) 16.741 8.210 ( 10.168 -0.000 -4.911) 11.292 8.620 ( -37.026 -0.000 13.081) 39.269 8.667 ( -20.201 -0.000 -4.614) 20.721 8.964 ( -28.583 -0.000 -10.341) 30.396 9.855 ( -28.036 -0.000 10.197) 29.833 9.909 ( -16.133 -0.000 5.590) 17.074 10.387 ( -20.777 -0.000 -6.530) 21.779 11.231 ( -29.076 -0.000 2.960) 29.226 11.465 ( -26.975 -0.000 -12.225) 29.616 12.762 ( 7.140 -0.000 3.000) 7.745 13.298 ( 10.198 -0.000 -0.200) 10.200 13.616 ( 5.048 -0.000 -0.578) 5.081 14.090 ( 8.269 -0.000 -2.989) 8.792 14.211 ( 5.535 -0.000 1.699) 5.790 15.271 ( -13.664 -0.000 3.080) 14.006 15.520 ( 13.386 -0.000 5.619) 14.518 20.322 ( -36.754 -0.000 -0.004) 36.754 20.543 ( -25.334 -0.000 0.843) 25.348 ======================= Grid point 842 (299/343) ======================= q-point: ( 0.38 -0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( -17.133 11.190 -5.063) 21.081 1.725 ( -19.822 3.460 -14.831) 24.997 2.063 ( -17.911 -4.419 -5.596) 19.278 2.184 ( -10.895 -12.810 -9.628) 19.378 2.857 ( -2.294 5.926 -2.737) 6.919 3.083 ( -16.196 13.730 -2.887) 21.428 3.202 ( -5.321 1.722 0.136) 5.594 3.404 ( -8.667 -12.534 -2.335) 15.417 3.903 ( 12.536 0.317 1.020) 12.581 5.054 ( -8.782 -0.623 -8.217) 12.043 5.231 ( -7.562 -1.172 -8.505) 11.441 5.568 ( -8.603 4.354 -2.886) 10.064 5.647 ( -16.639 -5.725 -6.746) 18.845 5.929 ( -15.353 -2.312 -7.940) 17.439 6.421 ( -4.355 -3.965 -6.213) 8.561 6.744 ( -13.467 -1.767 -5.880) 14.800 7.191 ( -12.056 -2.325 -4.048) 12.928 7.440 ( -30.782 0.382 10.542) 32.539 7.839 ( -7.825 -0.980 6.370) 10.137 8.254 ( -9.944 1.533 -11.358) 15.174 8.303 ( -11.124 -2.666 -14.111) 18.165 8.540 ( 14.526 0.209 -2.279) 14.706 8.968 ( -34.829 -0.358 1.260) 34.854 9.473 ( -17.289 -0.449 2.814) 17.522 9.850 ( -18.134 -0.367 -3.699) 18.511 10.038 ( -53.326 -0.371 -6.847) 53.765 10.815 ( -22.939 0.421 -9.009) 24.648 12.905 ( 3.493 -2.493 3.058) 5.269 13.525 ( 6.758 1.269 0.717) 6.913 13.708 ( 3.493 1.520 -1.159) 3.982 14.193 ( 2.996 11.092 0.716) 11.512 14.310 ( -1.151 -5.478 2.526) 6.142 14.941 ( -9.420 0.754 5.267) 10.819 16.163 ( 30.398 -4.259 13.825) 33.664 19.334 ( -31.820 3.943 -5.100) 32.466 19.731 ( -34.646 -4.046 -7.830) 35.750 ======================= Grid point 843 (300/343) ======================= q-point: ( 0.46 -0.15 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.866 ( -19.493 2.227 -0.000) 19.620 1.961 ( -24.620 6.950 -0.000) 25.582 2.224 ( -13.314 -6.739 0.000) 14.922 2.278 ( -17.146 -3.713 0.000) 17.544 2.869 ( -1.560 1.130 -0.000) 1.926 3.284 ( -7.955 4.103 -0.000) 8.951 3.288 ( -6.415 1.144 -0.000) 6.516 3.476 ( -8.041 -2.500 0.000) 8.421 3.769 ( 7.166 -0.195 0.000) 7.168 5.186 ( -18.590 -0.260 -0.000) 18.592 5.301 ( -11.460 -0.859 0.000) 11.492 5.607 ( -2.674 0.896 -0.000) 2.821 5.888 ( -24.560 -1.622 0.000) 24.613 6.050 ( -11.489 -2.051 0.000) 11.671 6.401 ( -0.011 -1.471 0.000) 1.471 6.900 ( -16.304 -0.184 -0.000) 16.305 7.300 ( -8.597 -0.935 0.000) 8.647 7.609 ( 12.063 0.590 -0.000) 12.077 8.243 ( -33.193 -0.242 -0.000) 33.194 8.324 ( 8.374 0.129 0.000) 8.375 8.367 ( -16.993 0.572 -0.000) 17.002 8.450 ( -26.832 -1.611 0.000) 26.881 9.478 ( -35.607 0.731 -0.000) 35.615 9.731 ( -16.521 -0.288 -0.000) 16.524 10.076 ( -19.060 -0.272 -0.000) 19.062 10.716 ( -48.572 1.370 -0.000) 48.592 11.051 ( -21.353 0.132 -0.000) 21.353 12.864 ( 4.786 -1.204 0.000) 4.935 13.426 ( 8.823 0.480 -0.000) 8.836 13.658 ( 3.080 0.725 -0.000) 3.164 14.164 ( 7.150 10.193 -0.000) 12.450 14.294 ( 2.147 -8.074 0.000) 8.355 15.120 ( -11.677 0.666 -0.000) 11.696 15.841 ( 25.853 -2.370 0.000) 25.962 19.799 ( -38.222 1.311 -0.000) 38.244 20.148 ( -32.638 -1.034 0.000) 32.654 ======================= Grid point 856 (301/343) ======================= q-point: ( 0.38 -0.08 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -22.720 13.226 -0.000) 26.289 1.393 ( -13.389 21.634 -0.000) 25.442 1.831 ( -14.979 -15.956 0.000) 21.885 2.025 ( -7.239 -13.486 0.000) 15.306 2.582 ( -21.984 27.096 -0.000) 34.893 2.945 ( 1.420 -0.256 0.000) 1.443 3.133 ( -3.778 2.673 -0.000) 4.628 3.327 ( -8.549 -19.259 0.000) 21.072 4.110 ( 16.223 2.004 -0.000) 16.346 4.917 ( -2.427 -1.720 0.000) 2.975 5.120 ( -0.174 -0.409 0.000) 0.444 5.302 ( -18.928 -3.231 0.000) 19.202 5.486 ( -9.549 2.289 -0.000) 9.819 5.720 ( -7.415 -1.016 0.000) 7.484 6.271 ( -15.602 -11.126 0.000) 19.162 6.494 ( -19.911 -2.831 0.000) 20.111 6.985 ( -14.465 -1.928 0.000) 14.593 7.090 ( -37.593 -4.687 0.000) 37.884 7.633 ( -20.878 -2.105 0.000) 20.984 8.072 ( 0.513 5.598 -0.000) 5.622 8.189 ( 0.381 -4.631 0.000) 4.647 8.513 ( -30.075 -1.829 0.000) 30.131 8.789 ( 19.642 -0.153 0.000) 19.643 9.020 ( -50.259 -3.991 0.000) 50.417 9.442 ( -21.303 0.670 -0.000) 21.314 9.602 ( -15.133 -0.864 0.000) 15.158 10.436 ( -23.189 0.335 -0.000) 23.191 12.984 ( 3.020 -4.697 0.000) 5.584 13.607 ( 4.946 0.798 -0.000) 5.010 13.760 ( 7.046 3.812 -0.000) 8.011 14.193 ( 1.261 11.064 -0.000) 11.136 14.319 ( -2.697 -2.048 0.000) 3.386 14.879 ( -5.776 -0.300 0.000) 5.784 16.713 ( 29.308 -5.603 0.000) 29.839 18.892 ( -23.855 11.444 -0.000) 26.458 19.192 ( -34.268 -11.631 0.000) 36.189 ======================= Grid point 870 (302/343) ======================= q-point: ( 0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.989 ( -0.000 18.534 -0.000) 18.534 0.993 ( -0.000 18.682 -0.000) 18.682 1.943 ( 0.000 -13.482 0.000) 13.482 1.950 ( 0.000 -12.040 0.000) 12.040 1.995 ( -0.000 41.655 -0.000) 41.655 3.074 ( -0.000 2.634 -0.000) 2.634 3.079 ( -0.000 1.556 -0.000) 1.556 3.181 ( 0.000 -27.750 0.000) 27.750 4.451 ( -0.000 2.880 -0.000) 2.880 4.723 ( 0.000 -1.538 0.000) 1.538 4.986 ( 0.000 -1.363 0.000) 1.363 5.204 ( -0.000 0.032 -0.000) 0.032 5.331 ( -0.000 1.079 -0.000) 1.079 5.518 ( -0.000 0.796 -0.000) 0.796 5.726 ( 0.000 -7.770 0.000) 7.770 5.947 ( -0.000 1.007 -0.000) 1.007 6.344 ( -0.000 0.900 -0.000) 0.900 6.757 ( -0.000 0.013 -0.000) 0.013 7.473 ( -0.000 4.502 -0.000) 4.502 7.902 ( -0.000 6.326 -0.000) 6.326 8.057 ( 0.000 -6.222 0.000) 6.222 8.192 ( -0.000 5.941 -0.000) 5.941 8.331 ( 0.000 -5.429 0.000) 5.429 9.121 ( 0.000 -0.219 0.000) 0.219 9.323 ( 0.000 -0.204 0.000) 0.204 9.367 ( 0.000 -0.533 0.000) 0.533 9.978 ( -0.000 0.484 -0.000) 0.484 13.032 ( 0.000 -5.914 0.000) 5.914 13.671 ( -0.000 0.250 -0.000) 0.250 14.054 ( -0.000 8.284 -0.000) 8.284 14.061 ( 0.000 -0.133 0.000) 0.133 14.264 ( 0.000 -0.663 0.000) 0.663 14.802 ( 0.000 -0.252 0.000) 0.252 17.096 ( 0.000 -7.798 0.000) 7.798 18.352 ( -0.000 8.793 -0.000) 8.793 18.932 ( 0.000 -3.553 0.000) 3.553 ======================= Grid point 871 (303/343) ======================= q-point: ( 0.46 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( -8.907 13.196 17.677) 23.790 1.356 ( -19.398 13.398 17.204) 29.185 1.740 ( 8.868 -8.770 1.430) 12.554 2.006 ( -3.568 -9.837 9.979) 14.460 2.428 ( -20.949 28.113 8.070) 35.977 2.975 ( 3.270 -12.103 0.821) 12.564 3.098 ( -1.598 1.073 0.202) 1.935 3.194 ( -4.716 -11.105 3.443) 12.546 4.316 ( 15.536 2.226 -3.025) 15.984 4.881 ( -21.972 -2.267 -4.947) 22.636 5.061 ( -3.118 -0.953 7.635) 8.302 5.165 ( -2.394 -0.738 0.009) 2.505 5.414 ( -8.710 0.652 7.533) 11.534 5.681 ( -0.433 -0.272 0.742) 0.901 5.965 ( -27.572 -4.363 15.397) 31.880 6.274 ( -18.829 -0.814 14.933) 24.045 6.607 ( -19.709 -4.663 7.351) 21.546 6.904 ( -6.336 -0.585 11.265) 12.938 7.598 ( -0.618 1.080 12.828) 12.888 8.048 ( -12.966 2.118 1.639) 13.239 8.151 ( -10.898 -2.412 1.779) 11.302 8.336 ( -3.856 -0.916 11.994) 12.632 8.594 ( -23.988 -1.626 28.048) 36.943 8.974 ( 7.085 0.155 -11.241) 13.289 9.278 ( 0.262 -0.075 -0.536) 0.601 9.468 ( -8.624 -0.444 5.473) 10.224 10.225 ( -17.614 0.257 11.824) 21.217 12.979 ( 1.746 -3.531 -3.273) 5.121 13.654 ( 2.463 0.186 -0.318) 2.491 13.888 ( 10.581 3.186 -2.052) 11.239 14.173 ( -5.116 5.094 -3.715) 8.119 14.225 ( -4.234 -2.160 -6.303) 7.894 14.775 ( -2.782 1.963 -5.943) 6.849 16.871 ( 14.681 -4.314 -18.142) 23.734 18.733 ( -18.230 11.618 17.433) 27.771 18.926 ( -10.053 -10.645 8.085) 16.725 ======================= Grid point 872 (304/343) ======================= q-point: ( 0.54 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( -4.682 13.821 12.412) 19.157 1.756 ( -11.859 -10.767 20.198) 25.778 1.959 ( -19.188 2.361 19.234) 27.271 2.209 ( -5.755 -6.274 13.688) 16.119 2.891 ( -11.259 19.073 7.735) 23.460 2.995 ( -7.445 -6.051 6.307) 11.481 3.138 ( -3.719 -0.451 0.433) 3.771 3.293 ( -7.360 -8.518 4.767) 12.225 4.064 ( 14.463 0.571 -2.600) 14.706 5.109 ( -8.272 -0.377 7.940) 11.473 5.287 ( -8.134 3.832 9.696) 13.223 5.370 ( -22.702 -4.927 9.139) 24.964 5.643 ( -0.713 -0.681 7.601) 7.665 5.794 ( -18.737 -0.316 5.389) 19.499 6.480 ( -9.760 -1.257 20.064) 22.347 6.696 ( -12.502 -0.634 13.967) 18.756 6.899 ( -24.179 -0.909 -1.970) 24.276 7.148 ( -8.048 -0.753 12.272) 14.695 7.742 ( -2.912 -0.518 2.475) 3.856 8.284 ( -12.862 0.806 6.478) 14.424 8.345 ( -9.761 -1.018 7.835) 12.558 8.657 ( -14.335 -0.191 15.380) 21.026 8.706 ( 7.017 -0.096 -4.660) 8.424 9.263 ( -6.612 -0.154 -1.776) 6.848 9.592 ( -40.332 -0.607 30.218) 50.400 9.713 ( -13.251 -0.610 8.463) 15.735 10.678 ( -21.004 0.239 15.110) 25.876 12.879 ( 2.515 -1.309 -5.744) 6.406 13.592 ( 5.107 0.652 -1.499) 5.362 13.774 ( 4.709 1.229 -1.089) 4.987 14.132 ( -4.942 0.613 -8.467) 9.823 14.255 ( -3.935 0.670 -0.613) 4.039 14.748 ( -5.752 1.837 -7.085) 9.309 16.223 ( 23.458 -2.232 -30.976) 38.921 19.123 ( -18.933 2.234 13.566) 23.399 19.507 ( -25.168 -2.439 23.312) 34.392 ======================= Grid point 873 (305/343) ======================= q-point: ( 0.62 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( -8.446 -0.000 11.907) 14.598 2.192 ( -13.874 -0.000 14.528) 20.089 2.454 ( -13.306 -0.000 19.296) 23.439 2.461 ( -6.037 -0.000 13.207) 14.521 2.994 ( 3.774 0.000 5.619) 6.769 3.205 ( -5.115 -0.000 0.424) 5.132 3.276 ( -10.572 -0.000 5.772) 12.045 3.477 ( -10.400 -0.000 6.238) 12.128 3.868 ( 11.137 0.000 -1.312) 11.214 5.343 ( -7.263 -0.000 11.435) 13.547 5.519 ( -7.016 -0.000 6.573) 9.614 5.777 ( -1.154 -0.000 15.014) 15.059 5.870 ( -26.437 -0.000 10.537) 28.460 6.172 ( -18.308 -0.000 8.435) 20.157 6.694 ( 1.927 -0.000 8.642) 8.855 6.955 ( -6.802 -0.000 6.812) 9.627 7.265 ( -21.436 -0.000 3.970) 21.801 7.504 ( -12.817 -0.000 18.654) 22.633 7.771 ( -3.833 -0.000 0.760) 3.908 8.566 ( -13.381 -0.000 7.321) 15.252 8.573 ( -10.425 -0.000 0.982) 10.471 8.712 ( -3.264 -0.000 12.499) 12.918 9.051 ( -13.208 -0.000 12.351) 18.083 9.303 ( -9.263 -0.000 -6.287) 11.195 10.043 ( -16.583 -0.000 10.752) 19.764 10.470 ( -33.148 -0.000 22.309) 39.956 11.198 ( -23.181 -0.000 17.164) 28.844 12.745 ( 3.433 0.000 -7.976) 8.683 13.481 ( 6.135 0.000 -3.828) 7.231 13.703 ( 2.985 0.000 -3.513) 4.610 14.122 ( -5.993 -0.000 -4.275) 7.361 14.322 ( -2.628 -0.000 4.698) 5.383 14.770 ( -9.459 -0.000 -5.026) 10.711 15.538 ( 15.764 0.000 -26.782) 31.077 19.630 ( -22.895 -0.000 15.911) 27.880 20.046 ( -17.241 -0.000 13.740) 22.046 ======================= Grid point 885 (306/343) ======================= q-point: ( 0.46 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -0.000 14.793 18.358) 23.577 1.541 ( -0.000 13.372 32.790) 35.412 1.983 ( -0.000 1.641 10.792) 10.916 2.045 ( 0.000 -13.162 7.593) 15.195 2.392 ( -0.000 20.666 19.217) 28.221 3.027 ( 0.000 -6.996 -0.005) 6.996 3.123 ( -0.000 2.622 3.490) 4.365 3.266 ( 0.000 -17.437 4.998) 18.139 4.392 ( -0.000 3.864 -4.726) 6.105 4.589 ( 0.000 -1.691 0.391) 1.736 5.026 ( -0.000 1.305 -2.694) 2.993 5.241 ( 0.000 -2.110 12.848) 13.021 5.494 ( -0.000 0.014 11.386) 11.386 5.718 ( 0.000 -1.166 4.774) 4.914 6.157 ( -0.000 2.994 33.647) 33.780 6.447 ( -0.000 -2.523 23.444) 23.579 6.679 ( 0.000 -10.472 10.014) 14.489 7.070 ( -0.000 -1.065 15.176) 15.213 7.833 ( -0.000 -1.276 13.789) 13.848 7.944 ( -0.000 5.405 4.446) 6.998 8.068 ( 0.000 -4.943 2.198) 5.409 8.575 ( -0.000 -2.444 23.122) 23.251 8.752 ( 0.000 0.044 -20.561) 20.561 9.008 ( -0.000 -4.092 45.208) 45.393 9.329 ( -0.000 0.294 4.579) 4.588 9.524 ( -0.000 -0.409 10.537) 10.545 10.319 ( -0.000 0.103 18.914) 18.914 12.941 ( 0.000 -4.718 -6.261) 7.840 13.673 ( -0.000 0.207 0.766) 0.793 13.878 ( -0.000 8.811 -10.053) 13.368 14.055 ( 0.000 -2.135 -12.586) 12.766 14.096 ( -0.000 -0.091 2.948) 2.950 14.642 ( -0.000 8.440 -7.581) 11.345 16.614 ( 0.000 -5.616 -37.003) 37.426 18.830 ( -0.000 9.913 17.519) 20.130 19.167 ( 0.000 -10.692 32.882) 34.577 ======================= Grid point 886 (307/343) ======================= q-point: ( 0.54 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( -12.099 13.151 19.545) 26.483 1.946 ( 2.348 -4.296 15.683) 16.429 2.119 ( -5.499 1.412 26.561) 27.161 2.313 ( -10.199 -8.940 13.580) 19.192 2.791 ( -9.405 22.363 15.274) 28.668 3.047 ( -3.439 -7.139 4.623) 9.173 3.164 ( 2.620 1.521 4.576) 5.489 3.320 ( -4.622 -12.807 5.443) 14.663 4.215 ( 13.299 1.945 -3.581) 13.910 4.854 ( -25.184 -1.444 8.211) 26.528 5.218 ( -16.797 2.258 6.512) 18.156 5.445 ( -2.989 -1.903 16.735) 17.106 5.639 ( -6.892 -1.802 3.591) 7.978 5.859 ( 2.231 -0.182 19.119) 19.250 6.676 ( -10.742 5.553 23.221) 26.181 6.742 ( -1.940 -3.763 9.932) 10.797 6.800 ( -8.572 -6.894 12.477) 16.634 7.271 ( -2.885 -0.579 13.862) 14.171 7.845 ( 9.252 -1.382 5.841) 11.028 8.183 ( -10.984 1.356 10.237) 15.076 8.247 ( -13.911 -1.693 5.565) 15.078 8.529 ( -7.832 0.179 -15.288) 17.178 8.920 ( 0.792 -0.917 27.911) 27.937 9.265 ( 3.027 -0.104 3.663) 4.753 9.730 ( -6.276 0.040 13.819) 15.177 9.805 ( -11.573 -0.754 43.646) 45.161 10.674 ( -12.695 0.189 18.847) 22.725 12.820 ( 1.498 -2.577 -7.975) 8.514 13.636 ( 6.346 2.094 -2.643) 7.186 13.771 ( 1.616 3.765 -5.368) 6.753 13.918 ( -6.968 -2.622 -9.850) 12.347 14.191 ( -4.878 0.455 3.585) 6.070 14.596 ( -2.567 6.186 -5.306) 8.545 15.962 ( 10.018 -4.771 -41.326) 42.790 19.194 ( -7.933 2.722 24.672) 26.059 19.671 ( -8.663 -3.336 30.463) 31.846 ======================= Grid point 887 (308/343) ======================= q-point: ( 0.62 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.016 ( 1.217 3.821 15.695) 16.199 2.213 ( -11.707 -5.043 14.428) 19.252 2.538 ( -7.427 6.510 14.897) 17.874 2.607 ( -7.447 -7.059 18.277) 20.961 3.100 ( -3.586 3.657 6.415) 8.209 3.190 ( 2.461 0.624 4.109) 4.830 3.223 ( -8.834 6.440 8.808) 14.040 3.442 ( -8.318 -7.520 5.520) 12.498 4.012 ( 12.294 0.498 -1.457) 12.390 5.326 ( -19.712 -0.381 11.859) 23.008 5.496 ( -7.689 1.108 5.781) 9.683 5.776 ( -11.336 -2.355 18.790) 22.071 5.866 ( -17.352 -0.481 7.349) 18.850 6.125 ( -3.408 -0.022 17.210) 17.544 6.761 ( 2.078 -0.382 -0.820) 2.266 6.970 ( -8.531 -0.376 7.085) 11.096 7.219 ( -13.063 0.478 15.803) 20.509 7.550 ( -10.682 -1.162 13.220) 17.036 7.804 ( 3.418 -1.285 5.596) 6.682 8.383 ( -10.758 0.449 -4.977) 11.862 8.499 ( -10.587 -0.056 11.512) 15.640 8.675 ( -17.212 -0.262 4.776) 17.864 9.253 ( 1.914 0.417 23.011) 23.094 9.298 ( 3.322 -0.149 9.591) 10.152 10.052 ( -10.550 -0.213 17.213) 20.190 10.519 ( -15.425 1.081 32.268) 35.781 11.150 ( -19.172 0.692 18.857) 26.900 12.667 ( 2.588 -1.056 -9.642) 10.039 13.476 ( 5.860 2.744 -8.534) 10.710 13.665 ( 2.004 -1.866 -7.440) 7.928 13.979 ( -9.414 -0.362 0.646) 9.443 14.299 ( -4.320 0.436 2.084) 4.816 14.649 ( -6.793 3.191 2.851) 8.029 15.307 ( 8.493 -3.540 -31.719) 33.026 19.685 ( -11.340 0.368 25.818) 28.201 20.120 ( -6.923 -0.240 20.289) 21.439 ======================= Grid point 888 (309/343) ======================= q-point: ( 0.69 0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.226 ( -2.686 -0.000 12.803) 13.081 2.516 ( -9.946 -0.000 10.086) 14.165 2.796 ( -4.911 -0.000 11.358) 12.374 2.915 ( -5.945 -0.000 13.018) 14.311 3.153 ( 6.884 0.000 5.706) 8.942 3.241 ( -2.762 -0.000 2.484) 3.714 3.412 ( -3.915 -0.000 3.630) 5.339 3.638 ( -10.323 -0.000 4.884) 11.420 3.838 ( 11.333 0.000 -0.835) 11.364 5.639 ( -5.282 -0.000 4.590) 6.998 5.671 ( -6.657 -0.000 13.464) 15.020 6.122 ( -7.764 -0.000 4.751) 9.102 6.177 ( -8.696 -0.000 9.511) 12.887 6.389 ( -11.495 -0.000 6.212) 13.066 6.768 ( -7.525 -0.000 3.086) 8.133 7.188 ( -4.329 -0.000 12.097) 12.849 7.445 ( -6.157 -0.000 0.417) 6.171 7.873 ( -15.918 -0.000 6.991) 17.386 7.984 ( -8.764 -0.000 13.158) 15.809 8.480 ( -12.640 -0.000 -4.786) 13.516 8.743 ( -4.210 -0.000 8.885) 9.832 8.937 ( -10.111 -0.000 4.593) 11.106 9.467 ( 0.836 -0.000 19.440) 19.458 9.497 ( 0.409 -0.000 15.742) 15.747 10.459 ( -11.127 -0.000 19.907) 22.806 11.091 ( -14.758 -0.000 22.188) 26.648 11.688 ( -21.416 -0.000 18.443) 28.263 12.482 ( 3.636 0.000 -10.995) 11.581 13.278 ( 4.696 0.000 -10.831) 11.805 13.506 ( 2.620 0.000 -10.261) 10.590 14.134 ( -6.288 -0.000 4.989) 8.026 14.370 ( -6.844 -0.000 -2.228) 7.197 14.873 ( -7.767 -0.000 12.767) 14.944 14.891 ( 1.089 0.000 -18.458) 18.490 20.163 ( -9.930 -0.000 22.424) 24.524 20.405 ( -2.467 -0.000 12.949) 13.182 ======================= Grid point 900 (310/343) ======================= q-point: ( 0.54 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.851 ( 0.000 12.542 22.837) 26.054 2.217 ( -0.000 12.732 18.971) 22.848 2.334 ( 0.000 -13.861 12.869) 18.914 2.520 ( 0.000 -6.881 21.169) 22.259 2.884 ( -0.000 14.006 15.512) 20.900 3.103 ( -0.000 -0.390 5.312) 5.327 3.255 ( 0.000 2.522 6.018) 6.525 3.412 ( 0.000 -15.424 4.969) 16.205 4.243 ( 0.000 3.005 -5.308) 6.099 4.895 ( -0.000 -1.725 21.126) 21.197 5.212 ( 0.000 1.768 15.022) 15.125 5.574 ( -0.000 4.419 6.204) 7.617 5.761 ( -0.000 -8.282 16.684) 18.626 6.155 ( -0.000 0.193 19.490) 19.490 6.742 ( -0.000 2.917 4.643) 5.483 6.837 ( -0.000 -6.030 1.958) 6.340 7.000 ( 0.000 -2.997 16.035) 16.313 7.441 ( -0.000 0.085 15.371) 15.372 8.041 ( -0.000 1.090 -7.335) 7.415 8.171 ( -0.000 -5.077 12.702) 13.680 8.301 ( -0.000 0.300 0.491) 0.575 8.328 ( 0.000 -0.722 15.207) 15.224 9.331 ( -0.000 0.859 27.188) 27.201 9.376 ( 0.000 -0.276 11.087) 11.091 9.883 ( -0.000 -0.033 15.468) 15.468 10.310 ( -0.000 4.199 39.547) 39.769 10.848 ( 0.000 -0.207 19.355) 19.356 12.723 ( 0.000 -3.701 -9.572) 10.263 13.570 ( -0.000 7.940 -13.146) 15.358 13.740 ( 0.000 -5.322 -9.854) 11.200 13.768 ( 0.000 0.105 7.455) 7.456 14.251 ( -0.000 0.004 9.086) 9.086 14.486 ( -0.000 8.827 -3.338) 9.437 15.485 ( 0.000 -7.683 -39.245) 39.990 19.523 ( 0.000 1.645 31.279) 31.322 20.029 ( 0.000 -1.964 26.832) 26.904 ======================= Grid point 901 (311/343) ======================= q-point: ( 0.62 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( -1.897 11.781 17.137) 20.882 2.392 ( 2.808 -11.584 16.012) 19.961 2.597 ( -8.441 4.417 13.813) 16.780 2.779 ( -4.401 -4.483 14.938) 16.205 3.112 ( -3.880 3.942 8.107) 9.814 3.232 ( -3.249 7.860 8.256) 11.853 3.323 ( 3.593 1.528 6.599) 7.668 3.455 ( -4.259 -11.411 3.889) 12.785 4.125 ( 8.040 1.376 -3.087) 8.722 5.319 ( -13.275 -0.974 23.934) 27.387 5.503 ( -6.014 0.815 11.785) 13.257 5.722 ( -12.768 1.091 6.202) 14.236 5.997 ( -0.382 -3.907 18.914) 19.317 6.348 ( 2.627 -0.155 11.715) 12.007 6.775 ( 2.584 1.411 -2.117) 3.626 6.873 ( -11.172 -3.054 0.577) 11.596 7.176 ( -9.609 -0.967 0.074) 9.658 7.700 ( -0.534 0.350 20.991) 21.001 7.871 ( -1.224 -0.473 -8.643) 8.743 8.306 ( 0.550 -2.026 11.799) 11.985 8.560 ( -6.811 0.662 13.029) 14.717 8.579 ( -12.096 -1.612 13.640) 18.302 9.521 ( 2.073 0.353 16.545) 16.678 9.657 ( 8.826 1.437 24.634) 26.206 10.181 ( -9.117 0.006 19.832) 21.828 10.843 ( -2.562 4.397 32.456) 32.852 11.192 ( -12.039 0.845 19.264) 22.732 12.562 ( 1.486 -2.505 -10.977) 11.357 13.379 ( 3.633 4.843 -13.131) 14.459 13.576 ( 1.055 -5.052 -10.507) 11.706 13.948 ( -5.599 -0.238 10.931) 12.283 14.336 ( 4.600 1.771 4.785) 6.870 14.587 ( -10.067 5.414 6.213) 13.009 14.973 ( 1.206 -7.252 -28.412) 29.347 19.980 ( -3.362 0.210 30.987) 31.169 20.365 ( -0.575 0.103 21.509) 21.517 ======================= Grid point 902 (312/343) ======================= q-point: ( 0.69 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( 3.470 2.125 13.037) 13.657 2.566 ( -3.932 -3.915 11.525) 12.791 2.878 ( -5.400 1.524 11.471) 12.770 2.999 ( -4.567 -1.140 9.157) 10.296 3.248 ( -2.147 0.180 5.746) 6.137 3.343 ( 6.773 0.753 6.152) 9.181 3.409 ( -3.596 4.389 4.495) 7.239 3.559 ( -8.953 -3.150 3.103) 9.985 3.975 ( 9.963 0.209 -1.297) 10.050 5.654 ( -2.884 0.139 6.227) 6.864 5.790 ( -9.012 -1.082 20.755) 22.653 6.039 ( -17.409 0.418 3.803) 17.825 6.146 ( 2.698 -0.781 1.816) 3.344 6.430 ( 0.860 0.240 4.983) 5.062 6.761 ( -2.827 -0.698 5.994) 6.664 7.104 ( -19.803 0.381 0.830) 19.824 7.249 ( -12.074 -1.432 -9.525) 15.446 7.865 ( -13.126 0.195 -8.688) 15.742 7.982 ( 3.463 0.297 21.838) 22.112 8.488 ( 0.201 -1.157 15.934) 15.977 8.782 ( -7.227 0.035 6.773) 9.905 8.929 ( -8.757 -0.143 15.031) 17.397 9.775 ( 1.288 0.737 23.136) 23.184 9.811 ( 10.507 0.095 19.430) 22.089 10.616 ( -10.427 0.154 22.332) 24.647 11.277 ( -4.712 1.438 23.742) 24.248 11.677 ( -17.544 2.191 19.843) 26.577 12.373 ( 2.474 -1.424 -11.675) 12.019 13.166 ( 3.686 2.571 -12.912) 13.672 13.383 ( 1.302 -3.989 -12.653) 13.331 14.161 ( -2.764 0.608 8.946) 9.383 14.321 ( 2.360 0.489 0.619) 2.488 14.652 ( -3.554 0.451 -12.762) 13.255 14.927 ( -12.185 -1.642 13.767) 18.458 20.426 ( -2.948 -0.079 27.721) 27.878 20.615 ( 2.299 0.342 17.099) 17.256 ======================= Grid point 903 (313/343) ======================= q-point: ( 0.77 0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 2.013 -0.000 9.583) 9.792 2.747 ( -4.854 -0.000 6.977) 8.499 3.066 ( -2.288 -0.000 8.286) 8.596 3.125 ( -2.379 -0.000 2.825) 3.694 3.297 ( 8.723 0.000 4.906) 10.008 3.349 ( 0.337 -0.000 5.025) 5.037 3.462 ( 0.726 0.000 0.316) 0.791 3.736 ( -9.811 -0.000 2.968) 10.250 3.826 ( 10.409 0.000 -0.016) 10.409 5.780 ( -4.151 -0.000 5.226) 6.674 5.966 ( 7.262 0.000 -4.763) 8.684 6.149 ( -2.901 -0.000 12.585) 12.915 6.250 ( -13.542 -0.000 -3.741) 14.049 6.471 ( -0.372 -0.000 1.429) 1.477 6.971 ( -10.027 -0.000 6.362) 11.876 7.266 ( -11.915 -0.000 -10.075) 15.603 7.372 ( -19.905 -0.000 -3.519) 20.214 7.940 ( -18.724 -0.000 -13.301) 22.968 8.168 ( 9.418 0.000 17.850) 20.182 8.706 ( 0.974 -0.000 17.274) 17.302 8.943 ( -5.178 -0.000 4.978) 7.183 9.213 ( -1.678 -0.000 16.503) 16.588 9.914 ( 9.235 0.000 16.526) 18.931 10.094 ( 2.049 -0.000 24.316) 24.403 11.022 ( -6.454 -0.000 19.464) 20.506 11.643 ( -7.044 -0.000 18.446) 19.745 12.163 ( -15.476 -0.000 15.715) 22.056 12.177 ( 3.028 0.000 -10.927) 11.339 12.956 ( 2.583 0.000 -11.778) 12.058 13.199 ( -0.998 0.000 -11.224) 11.268 14.207 ( -0.322 0.000 -3.540) 3.555 14.296 ( -1.250 -0.000 -2.915) 3.171 14.703 ( -5.979 -0.000 6.678) 8.963 15.275 ( -9.078 -0.000 14.720) 17.294 20.773 ( 5.794 -0.000 14.576) 15.686 20.794 ( 0.133 -0.000 23.360) 23.360 ======================= Grid point 915 (314/343) ======================= q-point: ( 0.62 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.385 ( -0.000 12.238 16.177) 20.285 2.692 ( -0.000 -14.179 12.849) 19.135 2.694 ( -0.000 7.248 15.802) 17.385 2.925 ( 0.000 -3.869 9.672) 10.417 3.191 ( 0.000 1.961 8.226) 8.457 3.286 ( -0.000 6.824 6.652) 9.530 3.433 ( 0.000 2.292 6.833) 7.207 3.511 ( 0.000 -10.693 2.447) 10.969 4.126 ( 0.000 1.798 -3.355) 3.806 5.601 ( -0.000 -0.229 27.400) 27.400 5.669 ( 0.000 -0.025 15.182) 15.182 5.687 ( -0.000 0.316 3.761) 3.774 6.220 ( -0.000 -2.818 9.185) 9.607 6.470 ( 0.000 0.959 3.546) 3.674 6.727 ( -0.000 3.950 -3.162) 5.059 6.842 ( -0.000 -6.153 3.128) 6.902 7.021 ( 0.000 -3.939 -10.682) 11.386 7.673 ( -0.000 0.619 -13.407) 13.421 8.042 ( -0.000 1.974 27.878) 27.948 8.547 ( -0.000 -6.280 15.022) 16.282 8.653 ( 0.000 0.023 7.019) 7.019 8.757 ( -0.000 0.048 23.701) 23.701 9.794 ( -0.000 0.370 22.147) 22.150 10.075 ( -0.000 5.204 24.534) 25.080 10.351 ( -0.000 0.297 18.645) 18.648 11.243 ( 0.000 8.649 30.256) 31.468 11.348 ( 0.000 -0.332 17.303) 17.306 12.428 ( 0.000 -4.316 -11.874) 12.634 13.197 ( 0.000 5.697 -13.979) 15.095 13.454 ( -0.000 -9.235 -12.139) 15.253 14.117 ( 0.000 0.029 18.134) 18.134 14.425 ( -0.000 10.434 -4.440) 11.339 14.603 ( -0.000 0.069 16.572) 16.572 14.681 ( 0.000 -10.142 -17.302) 20.056 20.388 ( 0.000 -0.178 31.162) 31.163 20.647 ( 0.000 0.767 20.118) 20.133 ======================= Grid point 916 (315/343) ======================= q-point: ( 0.69 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( 2.400 9.236 12.147) 15.447 2.768 ( 4.376 -11.141 11.632) 16.691 2.950 ( -4.866 4.429 11.295) 13.072 3.050 ( -3.589 -3.140 5.986) 7.653 3.313 ( -1.575 0.227 7.271) 7.443 3.403 ( -2.362 7.600 4.252) 9.024 3.499 ( 3.920 0.556 5.724) 6.960 3.532 ( -3.011 -6.740 2.692) 7.857 4.054 ( 5.071 0.518 -2.165) 5.538 5.719 ( 0.249 -0.635 4.785) 4.833 5.897 ( -9.928 0.088 3.660) 10.582 5.998 ( -5.008 0.367 21.881) 22.450 6.182 ( 5.540 -1.576 -7.148) 9.180 6.483 ( 1.338 2.159 1.075) 2.759 6.768 ( -8.318 6.744 -4.881) 11.768 6.881 ( -7.942 -8.112 -2.313) 11.585 6.980 ( -7.332 -4.017 0.910) 8.410 7.552 ( -8.364 0.404 -13.105) 15.552 8.401 ( 5.321 2.082 27.621) 28.206 8.733 ( 0.347 -3.523 15.848) 16.239 8.767 ( -5.010 -0.729 5.427) 7.422 9.113 ( -3.603 0.403 23.205) 23.487 10.118 ( 0.950 0.795 25.617) 25.647 10.263 ( 14.635 2.165 20.675) 25.422 10.740 ( -13.165 1.423 19.876) 23.883 11.551 ( 0.755 1.223 19.472) 19.525 11.748 ( -10.907 5.773 22.254) 25.447 12.245 ( 0.896 -3.921 -11.646) 12.320 13.014 ( 1.938 4.187 -13.273) 14.052 13.237 ( 0.667 -8.225 -13.896) 16.162 14.263 ( 5.833 3.691 -1.549) 7.075 14.426 ( 5.705 0.094 5.202) 7.721 14.504 ( -5.822 -2.996 4.362) 7.868 14.951 ( -12.477 -0.387 16.110) 20.380 20.794 ( -0.034 -0.175 28.271) 28.272 20.895 ( 2.687 0.585 18.471) 18.675 ======================= Grid point 917 (316/343) ======================= q-point: ( 0.77 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.713 ( 5.211 1.654 9.126) 10.638 2.831 ( 1.773 -3.246 7.889) 8.713 3.121 ( -2.043 1.751 2.392) 3.600 3.147 ( -1.934 -1.616 6.350) 6.832 3.411 ( 0.465 0.045 5.518) 5.538 3.481 ( 2.293 1.900 2.685) 4.010 3.493 ( 5.369 -0.927 3.687) 6.578 3.646 ( -8.709 1.328 3.939) 9.650 3.946 ( 7.486 -0.414 -0.850) 7.545 5.792 ( -3.190 -0.654 2.967) 4.405 5.916 ( 5.459 1.077 -12.617) 13.789 6.038 ( -9.436 -2.037 -3.101) 10.139 6.337 ( -3.987 2.160 14.599) 15.287 6.492 ( 0.329 -0.471 1.028) 1.178 6.793 ( -10.846 0.610 -10.519) 15.121 6.980 ( -19.565 -1.273 -10.908) 22.437 7.091 ( -3.899 -1.082 2.163) 4.588 7.552 ( -13.563 -0.211 -8.945) 16.248 8.620 ( 13.142 1.078 21.040) 24.830 8.930 ( -5.622 0.479 9.418) 10.979 8.945 ( -1.228 -2.592 15.023) 15.294 9.460 ( -1.571 0.479 21.843) 21.905 10.320 ( 14.170 1.776 18.091) 23.049 10.459 ( 2.251 -1.156 25.209) 25.335 11.163 ( -9.942 0.923 17.050) 19.759 11.818 ( -3.384 0.510 16.526) 16.876 12.060 ( 0.861 -0.225 -9.988) 10.028 12.203 ( -10.460 1.994 17.083) 20.130 12.830 ( 2.058 1.277 -10.824) 11.092 13.029 ( -1.216 -4.015 -12.258) 12.956 14.149 ( 2.288 1.542 -6.039) 6.640 14.312 ( 6.853 -1.063 -2.464) 7.359 14.787 ( -5.026 -0.441 16.474) 17.229 15.327 ( -11.163 0.057 14.524) 18.318 21.075 ( 6.215 0.333 16.883) 17.994 21.140 ( 1.990 -0.177 24.246) 24.328 ======================= Grid point 918 (317/343) ======================= q-point: ( 0.85 0.23 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( 5.347 0.000 6.324) 8.281 2.889 ( 0.961 -0.000 3.172) 3.314 3.134 ( 0.229 0.000 -0.967) 0.994 3.219 ( 0.879 -0.000 2.459) 2.611 3.406 ( 9.746 0.000 3.200) 10.258 3.470 ( 4.273 0.000 1.354) 4.483 3.475 ( 2.443 0.000 4.069) 4.746 3.825 ( -8.239 -0.000 3.466) 8.939 3.832 ( 8.261 0.000 0.170) 8.263 5.716 ( 0.915 0.000 -9.122) 9.168 5.870 ( -5.070 -0.000 -0.091) 5.071 6.085 ( -5.951 -0.000 -5.557) 8.143 6.489 ( 0.251 0.000 -0.278) 0.374 6.496 ( -2.343 -0.000 0.613) 2.422 6.832 ( -6.543 -0.000 -1.501) 6.713 7.065 ( -20.809 -0.000 -16.445) 26.522 7.127 ( -10.465 -0.000 -9.159) 13.907 7.646 ( -11.103 -0.000 -3.511) 11.645 8.624 ( 18.180 0.000 12.014) 21.791 9.142 ( -2.507 -0.000 12.089) 12.346 9.163 ( -0.486 -0.000 15.805) 15.812 9.730 ( 3.525 -0.000 19.284) 19.603 10.364 ( 13.449 0.000 15.158) 20.264 10.714 ( 6.826 -0.000 20.570) 21.673 11.428 ( -0.393 -0.000 8.933) 8.942 11.928 ( -0.217 0.000 -6.259) 6.262 12.085 ( -4.716 -0.000 14.028) 14.799 12.443 ( 0.117 -0.000 2.409) 2.412 12.699 ( -0.640 0.000 -6.212) 6.245 13.010 ( -12.627 -0.000 0.109) 12.627 14.050 ( 0.951 0.000 -6.240) 6.312 14.181 ( 3.108 0.000 -6.225) 6.957 15.027 ( 0.059 -0.000 13.418) 13.418 15.621 ( -6.523 -0.000 10.652) 12.491 21.186 ( 9.398 0.000 15.268) 17.929 21.387 ( 5.788 -0.000 19.598) 20.435 ======================= Grid point 930 (318/343) ======================= q-point: ( 0.69 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.743 ( -0.000 10.169 10.700) 14.762 3.004 ( -0.000 -12.171 9.960) 15.726 3.027 ( 0.000 4.022 7.068) 8.132 3.105 ( -0.000 -2.525 5.545) 6.093 3.388 ( 0.000 3.123 5.996) 6.761 3.424 ( -0.000 3.414 4.530) 5.673 3.566 ( 0.000 -7.042 2.061) 7.337 3.608 ( 0.000 1.945 5.787) 6.105 4.054 ( -0.000 0.551 -2.134) 2.204 5.763 ( -0.000 -0.853 1.197) 1.470 5.870 ( 0.000 -0.077 0.684) 0.688 6.069 ( -0.000 -2.211 -14.838) 15.002 6.182 ( -0.000 3.475 7.663) 8.414 6.482 ( -0.000 4.167 -0.634) 4.215 6.581 ( 0.000 3.382 -3.445) 4.828 6.723 ( 0.000 -7.107 -11.094) 13.176 7.149 ( -0.000 -6.841 14.724) 16.236 7.311 ( -0.000 0.823 -12.196) 12.224 8.795 ( -0.000 4.224 25.464) 25.812 8.818 ( 0.000 -0.763 8.067) 8.103 8.972 ( -0.000 -6.365 16.108) 17.320 9.411 ( -0.000 0.839 23.649) 23.664 10.473 ( -0.000 3.210 25.407) 25.609 10.671 ( -0.000 4.555 19.684) 20.205 10.843 ( 0.000 0.327 16.811) 16.814 11.772 ( -0.000 -0.314 13.798) 13.802 11.951 ( 0.000 9.638 17.874) 20.307 12.136 ( 0.000 -6.626 -5.034) 8.321 12.838 ( 0.000 5.331 -11.449) 12.629 13.090 ( -0.000 -11.840 -13.663) 18.080 14.193 ( 0.000 3.041 -7.600) 8.186 14.493 ( 0.000 -2.233 -4.527) 5.048 14.689 ( 0.000 0.024 22.429) 22.429 15.102 ( -0.000 0.065 19.086) 19.087 21.154 ( 0.000 1.083 20.641) 20.669 21.173 ( 0.000 -0.643 23.085) 23.094 ======================= Grid point 931 (319/343) ======================= q-point: ( 0.77 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( 3.817 7.034 8.046) 11.348 3.014 ( 6.040 -7.080 5.772) 10.952 3.119 ( -1.807 -1.072 2.687) 3.411 3.203 ( -1.936 -1.186 4.965) 5.460 3.486 ( 0.061 1.716 4.833) 5.128 3.508 ( -2.541 4.675 4.504) 6.972 3.582 ( -0.190 -4.509 2.773) 5.296 3.663 ( 2.365 1.502 4.732) 5.499 4.003 ( 3.329 -0.459 -1.679) 3.756 5.765 ( -0.597 0.400 -3.572) 3.643 5.799 ( 3.357 -0.692 -11.756) 12.246 5.914 ( -6.036 -1.119 -3.158) 6.904 6.239 ( -9.103 1.701 -9.046) 12.945 6.491 ( 0.252 3.515 -0.731) 3.599 6.598 ( -10.576 -1.917 -13.836) 17.520 6.624 ( -7.095 -1.234 -2.275) 7.552 7.131 ( 6.559 -0.962 -0.171) 6.631 7.393 ( -8.140 -2.393 7.049) 11.030 8.942 ( 2.258 0.201 10.474) 10.717 9.104 ( 1.834 2.810 20.688) 20.958 9.164 ( 0.972 -4.730 15.879) 16.597 9.733 ( -1.280 0.773 21.382) 21.434 10.725 ( 12.695 5.954 15.441) 20.858 10.843 ( 3.978 -3.491 23.296) 23.890 11.203 ( -13.458 1.814 13.716) 19.302 11.931 ( 0.514 -0.667 -7.615) 7.662 11.973 ( -3.654 -1.417 10.112) 10.845 12.336 ( -2.884 6.466 17.260) 18.655 12.720 ( 0.874 2.803 -6.799) 7.406 12.885 ( -0.566 -9.410 -9.658) 13.496 14.095 ( 1.848 0.873 -5.658) 6.016 14.361 ( 6.640 -0.444 -6.468) 9.280 14.996 ( -1.525 -0.197 19.639) 19.699 15.403 ( -6.864 0.109 15.924) 17.341 21.370 ( 3.702 0.443 16.312) 16.732 21.480 ( 1.475 -0.240 21.669) 21.720 ======================= Grid point 932 (320/343) ======================= q-point: ( 0.85 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.913 ( 6.580 1.770 5.650) 8.852 2.976 ( 5.053 -2.661 2.428) 6.206 3.140 ( 1.158 -0.704 0.960) 1.661 3.250 ( 0.381 -1.118 0.913) 1.493 3.534 ( 2.906 3.594 3.816) 5.993 3.565 ( 4.327 -0.970 3.586) 5.703 3.585 ( 4.505 -1.766 3.017) 5.702 3.756 ( -6.781 3.466 3.524) 8.391 3.923 ( 5.249 -1.437 -0.972) 5.528 5.586 ( -0.365 -0.367 -10.579) 10.592 5.768 ( -3.756 -0.755 -3.985) 5.528 5.980 ( -6.142 0.891 -0.997) 6.285 6.220 ( -11.254 -0.710 -13.725) 17.763 6.457 ( -3.135 1.056 -7.781) 8.455 6.596 ( -13.729 0.956 -10.110) 17.076 6.695 ( -14.669 -0.716 -10.415) 18.004 7.083 ( 7.994 -0.492 8.218) 11.476 7.563 ( -5.476 -0.730 4.583) 7.178 8.971 ( 12.941 0.130 8.017) 15.223 9.343 ( -1.546 -0.567 13.398) 13.499 9.352 ( 2.235 -0.668 17.507) 17.662 10.006 ( 0.679 0.446 17.155) 17.174 10.726 ( 13.127 0.468 10.900) 17.069 11.071 ( 5.834 -0.583 18.740) 19.636 11.496 ( -4.873 0.841 6.493) 8.162 11.817 ( -3.607 -0.737 -6.441) 7.419 12.190 ( -5.502 -0.290 10.705) 12.040 12.479 ( 3.231 3.383 -0.962) 4.776 12.649 ( 1.533 -0.185 -1.936) 2.476 12.900 ( -8.952 -2.347 7.600) 11.975 13.996 ( 2.277 0.177 -5.295) 5.767 14.157 ( 7.038 -0.039 -9.084) 11.491 15.230 ( 1.454 -0.358 14.271) 14.349 15.677 ( -5.916 0.195 10.751) 12.273 21.501 ( 7.204 0.063 13.750) 15.523 21.704 ( 4.059 -0.017 16.808) 17.291 ======================= Grid point 933 (321/343) ======================= q-point: (-0.08 0.31 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.876 ( 7.732 0.000 3.277) 8.398 2.909 ( 6.181 0.000 -1.060) 6.271 3.127 ( 1.774 0.000 0.591) 1.870 3.222 ( 2.747 0.000 -1.040) 2.937 3.473 ( 10.775 0.000 1.671) 10.904 3.542 ( 6.112 0.000 3.098) 6.852 3.569 ( 3.393 0.000 2.737) 4.359 3.822 ( 7.063 0.000 -0.920) 7.123 3.905 ( -7.082 -0.000 2.214) 7.420 5.534 ( -6.842 -0.000 -3.999) 7.925 5.765 ( -4.850 -0.000 -4.862) 6.867 6.023 ( -0.802 -0.000 -0.872) 1.184 6.183 ( -10.595 -0.000 -13.008) 16.776 6.406 ( -4.723 -0.000 -7.236) 8.641 6.682 ( -16.037 -0.000 -7.455) 17.685 6.727 ( -13.671 -0.000 -12.791) 18.722 7.122 ( 5.744 0.000 10.486) 11.956 7.654 ( -2.796 -0.000 0.822) 2.915 8.827 ( 19.678 0.000 4.458) 20.176 9.522 ( 4.311 -0.000 12.885) 13.588 9.529 ( -2.447 -0.000 10.351) 10.637 10.165 ( 5.247 0.000 11.748) 12.867 10.666 ( 13.683 0.000 6.517) 15.156 11.162 ( 11.544 0.000 11.691) 16.430 11.457 ( 7.782 0.000 -4.082) 8.788 11.898 ( -6.508 -0.000 2.289) 6.899 12.303 ( 5.111 0.000 -2.376) 5.636 12.457 ( -4.141 -0.000 6.795) 7.958 12.643 ( -1.612 -0.000 1.345) 2.100 13.156 ( -9.712 -0.000 7.064) 12.009 13.892 ( 2.464 0.000 -5.044) 5.614 13.960 ( 1.269 0.000 -9.177) 9.264 15.332 ( 5.754 0.000 8.258) 10.065 15.846 ( -2.434 -0.000 5.797) 6.288 21.546 ( 10.227 0.000 10.155) 14.412 21.814 ( 8.215 0.000 11.304) 13.973 ======================= Grid point 934 (322/343) ======================= q-point: ( 0.00 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( 8.024 0.000 -0.000) 8.024 2.921 ( 8.773 0.000 -0.000) 8.773 3.139 ( 2.679 0.000 -0.000) 2.679 3.204 ( 3.179 0.000 -0.000) 3.179 3.495 ( 11.088 0.000 -0.000) 11.088 3.593 ( 6.284 0.000 -0.000) 6.284 3.609 ( 3.849 0.000 -0.000) 3.849 3.802 ( 7.126 0.000 -0.000) 7.126 3.936 ( -6.765 -0.000 0.000) 6.765 5.488 ( -12.016 -0.000 0.000) 12.016 5.694 ( -3.501 -0.000 0.000) 3.501 5.986 ( -8.218 -0.000 0.000) 8.218 5.999 ( 0.164 0.000 -0.000) 0.164 6.266 ( -12.567 -0.000 0.000) 12.567 6.535 ( -13.836 -0.000 0.000) 13.836 6.615 ( -8.837 -0.000 0.000) 8.837 7.284 ( 5.990 0.000 -0.000) 5.990 7.657 ( -0.488 -0.000 0.000) 0.488 8.888 ( 21.083 0.000 -0.000) 21.083 9.677 ( -3.408 -0.000 0.000) 3.408 9.717 ( 6.181 0.000 -0.000) 6.181 10.328 ( 5.743 0.000 -0.000) 5.743 10.740 ( 13.096 0.000 -0.000) 13.096 11.321 ( 13.047 0.000 -0.000) 13.047 11.383 ( 8.365 0.000 -0.000) 8.365 11.939 ( -7.082 -0.000 0.000) 7.082 12.243 ( 7.043 0.000 -0.000) 7.043 12.585 ( -8.375 -0.000 0.000) 8.375 12.682 ( -0.480 -0.000 0.000) 0.480 13.274 ( 2.607 0.000 -0.000) 2.607 13.798 ( -5.907 -0.000 0.000) 5.907 13.814 ( 2.859 0.000 -0.000) 2.859 15.447 ( 7.903 0.000 -0.000) 7.903 15.926 ( -0.628 -0.000 0.000) 0.628 21.690 ( 10.217 0.000 -0.000) 10.217 21.971 ( 8.832 0.000 -0.000) 8.832 ======================= Grid point 944 (323/343) ======================= q-point: ( 0.77 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.976 ( -0.000 8.402 6.546) 10.651 3.084 ( 0.000 -1.077 -0.221) 1.099 3.225 ( -0.000 -10.373 6.281) 12.127 3.244 ( 0.000 -0.991 3.053) 3.210 3.507 ( 0.000 6.046 3.473) 6.972 3.549 ( 0.000 1.692 3.733) 4.099 3.649 ( 0.000 -4.138 4.138) 5.852 3.735 ( 0.000 1.497 3.472) 3.781 4.001 ( 0.000 -0.634 -1.855) 1.961 5.629 ( -0.000 -4.394 -15.173) 15.797 5.749 ( -0.000 -1.454 -2.201) 2.638 5.769 ( 0.000 10.501 -6.631) 12.420 6.068 ( 0.000 -6.175 -7.097) 9.408 6.310 ( 0.000 -3.813 -16.929) 17.354 6.478 ( -0.000 -0.471 -11.053) 11.063 6.482 ( -0.000 7.281 0.569) 7.303 7.218 ( -0.000 0.891 5.270) 5.344 7.487 ( -0.000 -4.799 9.523) 10.664 9.111 ( 0.000 -0.955 11.762) 11.801 9.324 ( -0.000 -0.915 13.270) 13.301 9.439 ( -0.000 -0.188 17.861) 17.862 9.992 ( -0.000 1.076 18.230) 18.262 10.981 ( -0.000 9.632 10.288) 14.093 11.189 ( -0.000 -4.879 18.126) 18.771 11.228 ( 0.000 0.184 11.240) 11.241 11.812 ( -0.000 -2.361 -9.981) 10.256 12.083 ( -0.000 -0.229 8.954) 8.957 12.465 ( 0.000 8.641 5.217) 10.094 12.663 ( 0.000 2.611 -0.617) 2.683 12.874 ( 0.000 -11.496 4.820) 12.465 14.033 ( -0.000 0.576 -5.170) 5.202 14.290 ( 0.000 -0.035 -10.566) 10.566 15.244 ( 0.000 0.048 17.221) 17.221 15.570 ( -0.000 0.026 14.400) 14.400 21.600 ( 0.000 0.375 13.837) 13.842 21.756 ( 0.000 -0.200 17.204) 17.205 ======================= Grid point 945 (324/343) ======================= q-point: ( 0.85 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.035 ( 4.258 3.467 2.630) 6.089 3.066 ( 2.748 0.493 1.209) 3.042 3.222 ( 4.213 -5.610 3.430) 7.810 3.270 ( 0.123 -3.397 0.808) 3.493 3.593 ( 0.052 6.380 3.106) 7.096 3.609 ( -2.478 2.556 2.456) 4.324 3.679 ( 1.820 -4.042 3.766) 5.816 3.757 ( 2.035 1.874 2.210) 3.541 3.959 ( 2.010 -1.609 -1.500) 2.980 5.432 ( -1.354 -3.214 -10.678) 11.233 5.696 ( 0.281 0.920 -3.321) 3.458 5.806 ( -7.804 11.658 -4.971) 14.883 5.997 ( -7.114 -10.290 -6.051) 13.897 6.134 ( -7.244 -3.463 -14.236) 16.344 6.372 ( -8.011 -0.005 -11.599) 14.096 6.516 ( -0.289 5.239 0.618) 5.284 7.280 ( 3.320 0.541 7.042) 7.804 7.591 ( -1.494 -2.333 5.272) 5.955 9.212 ( 6.570 -0.361 8.165) 10.486 9.478 ( -1.113 -1.133 9.226) 9.361 9.630 ( 3.932 -0.159 14.658) 15.177 10.211 ( -0.104 0.734 12.921) 12.942 10.995 ( 10.752 1.429 4.811) 11.866 11.358 ( 3.364 0.395 13.094) 13.525 11.471 ( -10.019 -0.409 6.295) 11.840 11.682 ( -1.376 -0.907 -7.855) 8.026 12.227 ( -5.630 -0.230 6.608) 8.684 12.451 ( 1.385 2.805 -5.312) 6.165 12.684 ( 2.367 2.258 3.559) 4.834 13.019 ( -1.259 -4.743 15.965) 16.702 13.954 ( 1.673 0.916 -5.056) 5.404 14.097 ( 4.796 -0.353 -12.066) 12.989 15.433 ( 1.673 -0.130 11.669) 11.789 15.757 ( -2.692 0.108 9.407) 9.785 21.738 ( 3.697 0.079 10.056) 10.714 21.941 ( 1.901 -0.021 11.898) 12.049 ======================= Grid point 946 (325/343) ======================= q-point: (-0.08 0.38 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 1099 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.983 ( 5.441 -0.529 -0.309) 5.475 3.024 ( 7.751 0.293 1.991) 8.008 3.180 ( 4.080 -1.525 1.165) 4.509 3.246 ( 1.900 -1.856 -0.454) 2.695 3.614 ( 6.000 2.283 1.455) 6.583 3.625 ( 4.212 4.543 1.314) 6.333 3.668 ( 3.468 -5.331 2.149) 6.713 3.818 ( -5.323 5.925 0.987) 8.026 3.896 ( 3.342 -3.800 -0.688) 5.107 5.380 ( -7.216 -1.741 -4.155) 8.507 5.672 ( -1.960 0.115 -2.102) 2.876 5.892 ( -8.062 11.520 -4.971) 14.914 6.002 ( -5.155 -11.985 -1.564) 13.140 6.115 ( -15.153 -0.332 -8.607) 17.430 6.391 ( -13.509 0.240 -7.141) 15.282 6.548 ( -1.986 2.422 0.121) 3.134 7.316 ( 4.660 0.310 5.470) 7.193 7.644 ( -0.910 -0.710 1.200) 1.665 9.129 ( 16.253 -0.410 3.204) 16.571 9.599 ( -2.396 0.185 5.206) 5.734 9.731 ( 4.219 -1.159 8.291) 9.374 10.335 ( 1.899 0.335 6.428) 6.711 10.892 ( 11.197 -0.717 2.015) 11.399 11.417 ( 7.675 0.517 6.241) 9.905 11.496 ( 4.955 -0.686 -2.641) 5.656 11.777 ( -13.889 0.111 1.156) 13.937 12.328 ( 2.778 0.614 -1.388) 3.165 12.437 ( -8.096 -0.196 2.481) 8.470 12.692 ( 3.792 1.462 2.672) 4.864 13.220 ( -0.564 -1.133 11.093) 11.165 13.853 ( 3.258 4.065 -8.327) 9.822 13.885 ( 3.516 -3.671 -4.925) 7.078 15.503 ( 4.988 -0.297 5.313) 7.293 15.882 ( -2.142 0.187 3.987) 4.529 21.770 ( 7.075 -0.055 5.383) 8.890 22.020 ( 4.644 0.050 6.050) 7.627 ======================= Grid point 958 (326/343) ======================= q-point: ( 0.85 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.071 ( 0.000 -2.266 -0.357) 2.294 3.097 ( 0.000 7.629 2.296) 7.967 3.282 ( 0.000 -3.011 0.378) 3.035 3.341 ( -0.000 -9.597 2.199) 9.846 3.570 ( 0.000 5.227 1.120) 5.345 3.625 ( 0.000 6.265 1.716) 6.496 3.749 ( -0.000 -3.634 2.360) 4.333 3.795 ( 0.000 1.122 1.051) 1.537 3.959 ( 0.000 -1.767 -1.035) 2.048 5.315 ( -0.000 -6.842 -6.585) 9.496 5.617 ( 0.000 16.601 -3.177) 16.902 5.696 ( -0.000 -0.693 -1.238) 1.419 5.835 ( 0.000 -0.519 -8.156) 8.173 6.035 ( 0.000 -15.752 -2.865) 16.010 6.190 ( -0.000 -0.657 -6.794) 6.825 6.497 ( -0.000 8.946 0.367) 8.954 7.361 ( -0.000 1.661 3.230) 3.632 7.656 ( -0.000 -3.360 3.080) 4.558 9.356 ( 0.000 -0.831 5.096) 5.163 9.570 ( -0.000 -0.956 4.720) 4.816 9.820 ( -0.000 -0.468 8.547) 8.560 10.343 ( -0.000 1.060 6.917) 6.997 11.105 ( -0.000 2.625 0.556) 2.683 11.437 ( 0.000 0.060 3.952) 3.952 11.527 ( -0.000 -0.310 5.053) 5.063 11.595 ( -0.000 -1.485 -3.470) 3.775 12.248 ( -0.000 -0.163 3.122) 3.126 12.387 ( 0.000 2.461 -3.442) 4.232 12.757 ( 0.000 1.051 4.116) 4.248 13.254 ( 0.000 -4.571 14.971) 15.653 13.873 ( 0.000 4.998 -8.273) 9.666 13.988 ( 0.000 -3.174 -7.483) 8.128 15.571 ( 0.000 0.068 6.314) 6.314 15.842 ( -0.000 -0.005 5.238) 5.238 21.868 ( 0.000 0.040 5.289) 5.289 22.076 ( 0.000 0.008 6.094) 6.094 ======================= Grid point 959 (327/343) ======================= q-point: (-0.08 0.46 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.042 ( 2.862 -1.654 0.000) 3.306 3.110 ( 4.068 5.434 -0.000) 6.788 3.260 ( 2.789 -2.699 0.000) 3.881 3.287 ( 3.577 -7.077 0.000) 7.930 3.632 ( -3.389 4.047 -0.000) 5.279 3.649 ( 1.513 6.342 -0.000) 6.520 3.738 ( 1.980 -4.145 0.000) 4.593 3.785 ( 2.047 2.252 -0.000) 3.043 3.935 ( 1.414 -2.530 0.000) 2.899 5.277 ( -4.242 -4.622 0.000) 6.273 5.645 ( 0.562 4.869 -0.000) 4.901 5.724 ( -5.113 10.879 -0.000) 12.020 5.863 ( -11.463 -0.532 0.000) 11.476 5.984 ( -3.660 -15.833 0.000) 16.250 6.194 ( -7.777 -0.170 0.000) 7.779 6.526 ( 0.080 6.029 -0.000) 6.030 7.383 ( 1.025 1.190 -0.000) 1.571 7.661 ( 0.668 -2.087 0.000) 2.191 9.329 ( 8.807 -0.518 0.000) 8.823 9.608 ( -1.232 -0.187 0.000) 1.246 9.849 ( 3.497 -1.348 0.000) 3.747 10.392 ( 0.415 0.685 -0.000) 0.801 11.039 ( 8.567 -0.045 0.000) 8.567 11.503 ( 1.038 2.851 -0.000) 3.034 11.557 ( 3.612 -2.768 0.000) 4.550 11.595 ( -11.412 -0.113 -0.000) 11.413 12.317 ( -5.537 -0.299 0.000) 5.545 12.365 ( -0.124 2.012 -0.000) 2.016 12.765 ( 3.556 1.171 -0.000) 3.744 13.346 ( 1.727 -4.206 0.000) 4.546 13.798 ( 2.614 6.729 -0.000) 7.219 13.908 ( 2.387 -4.324 0.000) 4.939 15.595 ( 2.726 -0.106 0.000) 2.728 15.887 ( -1.312 0.091 -0.000) 1.315 21.879 ( 3.572 -0.036 0.000) 3.572 22.104 ( 1.954 0.051 -0.000) 1.954 ======================= Grid point 1022 (328/343) ======================= q-point: ( 0.46 -0.15 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -11.507 0.000 -2.446) 11.764 1.725 ( -23.970 -0.000 -14.826) 28.185 2.059 ( -20.682 -0.000 -8.081) 22.205 2.124 ( -9.137 -0.000 -9.459) 13.151 2.877 ( 0.242 -0.000 -2.471) 2.483 3.148 ( -16.199 -0.000 -2.835) 16.445 3.207 ( -5.549 0.000 0.362) 5.561 3.346 ( -10.918 0.000 -2.845) 11.283 3.904 ( 12.770 -0.000 1.061) 12.814 5.052 ( -8.879 -0.000 -8.447) 12.255 5.227 ( -7.295 -0.000 -8.564) 11.250 5.598 ( -1.753 0.000 -2.595) 3.132 5.612 ( -23.427 -0.000 -6.547) 24.324 5.920 ( -15.064 -0.000 -8.122) 17.114 6.406 ( -4.816 -0.000 -6.615) 8.183 6.738 ( -13.764 -0.000 -5.957) 14.998 7.182 ( -11.863 -0.000 -4.036) 12.531 7.441 ( -31.383 -0.000 10.680) 33.150 7.836 ( -7.919 -0.000 6.123) 10.010 8.262 ( -8.048 -0.000 -9.212) 12.233 8.290 ( -12.575 -0.000 -16.220) 20.524 8.540 ( 14.482 -0.000 -2.318) 14.666 8.967 ( -35.214 -0.000 1.214) 35.235 9.471 ( -17.467 -0.000 2.673) 17.670 9.848 ( -17.975 -0.000 -3.725) 18.357 10.037 ( -54.066 -0.000 -6.745) 54.485 10.817 ( -22.994 -0.000 -9.111) 24.734 12.896 ( 3.380 -0.000 2.973) 4.501 13.530 ( 6.676 -0.000 0.604) 6.703 13.713 ( 3.707 -0.000 -1.057) 3.855 14.261 ( -1.163 -0.000 3.737) 3.913 14.263 ( 3.197 0.000 -0.079) 3.198 14.943 ( -9.476 -0.000 4.914) 10.675 16.147 ( 30.558 -0.000 13.949) 33.591 19.349 ( -31.124 -0.000 -4.719) 31.479 19.716 ( -35.506 -0.000 -8.249) 36.451 ======================= Grid point 1036 (329/343) ======================= q-point: ( 0.46 -0.08 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( -21.692 5.950 -0.000) 22.493 1.544 ( -6.887 18.813 -0.000) 20.034 1.707 ( -18.718 -17.030 0.000) 25.306 1.950 ( -6.522 -6.136 0.000) 8.954 2.773 ( -17.540 24.010 -0.000) 29.735 2.908 ( -5.035 -11.312 0.000) 12.382 3.146 ( -3.926 0.747 -0.000) 3.997 3.214 ( -7.798 -9.379 0.000) 12.197 4.120 ( 16.712 0.641 -0.000) 16.724 4.909 ( -2.469 -0.572 0.000) 2.535 5.118 ( 0.593 -0.073 0.000) 0.598 5.286 ( -19.623 -1.095 0.000) 19.653 5.498 ( -9.732 0.829 -0.000) 9.768 5.713 ( -6.116 -0.636 0.000) 6.149 6.214 ( -17.792 -4.049 0.000) 18.247 6.480 ( -19.464 -1.019 0.000) 19.491 6.976 ( -13.750 -0.556 0.000) 13.761 7.067 ( -39.736 -1.545 0.000) 39.766 7.625 ( -18.495 -0.348 0.000) 18.499 8.113 ( -0.043 5.614 -0.000) 5.614 8.153 ( 0.363 -5.254 0.000) 5.266 8.504 ( -30.073 -0.611 0.000) 30.079 8.788 ( 19.434 -0.056 0.000) 19.434 9.002 ( -49.643 -1.168 0.000) 49.656 9.446 ( -21.346 0.262 -0.000) 21.348 9.597 ( -15.023 -0.308 0.000) 15.026 10.438 ( -23.175 0.120 -0.000) 23.175 12.960 ( 2.701 -1.621 0.000) 3.150 13.610 ( 4.590 0.218 -0.000) 4.595 13.778 ( 7.429 1.311 -0.000) 7.544 14.258 ( -0.429 6.973 -0.000) 6.986 14.298 ( -1.766 -3.953 0.000) 4.329 14.878 ( -5.811 -0.108 0.000) 5.812 16.685 ( 29.082 -1.996 0.000) 29.150 18.965 ( -18.790 7.362 -0.000) 20.181 19.119 ( -38.680 -7.301 0.000) 39.363 ======================= Grid point 1050 (330/343) ======================= q-point: ( 0.46 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( -0.000 7.441 -0.000) 7.441 1.092 ( -0.000 7.525 -0.000) 7.525 1.869 ( 0.000 -5.804 0.000) 5.804 1.877 ( 0.000 -5.783 0.000) 5.783 2.244 ( -0.000 21.570 -0.000) 21.570 2.995 ( 0.000 -16.139 0.000) 16.139 3.087 ( -0.000 0.905 -0.000) 0.905 3.098 ( -0.000 0.318 -0.000) 0.318 4.464 ( -0.000 0.956 -0.000) 0.956 4.716 ( 0.000 -0.539 0.000) 0.539 4.979 ( 0.000 -0.476 0.000) 0.476 5.204 ( 0.000 -0.007 0.000) 0.007 5.336 ( -0.000 0.372 -0.000) 0.372 5.522 ( -0.000 0.289 -0.000) 0.289 5.687 ( 0.000 -2.719 0.000) 2.719 5.952 ( -0.000 0.367 -0.000) 0.367 6.348 ( -0.000 0.310 -0.000) 0.310 6.757 ( -0.000 0.011 -0.000) 0.011 7.496 ( -0.000 1.563 -0.000) 1.563 7.947 ( -0.000 5.233 -0.000) 5.233 8.014 ( 0.000 -5.197 0.000) 5.197 8.234 ( -0.000 4.897 -0.000) 4.897 8.292 ( 0.000 -4.713 0.000) 4.713 9.120 ( 0.000 -0.079 0.000) 0.079 9.322 ( 0.000 -0.074 0.000) 0.074 9.364 ( 0.000 -0.191 0.000) 0.191 9.980 ( -0.000 0.173 -0.000) 0.173 13.003 ( 0.000 -2.010 0.000) 2.010 13.672 ( -0.000 0.091 -0.000) 0.091 14.061 ( 0.000 -0.048 0.000) 0.048 14.096 ( -0.000 3.059 -0.000) 3.059 14.260 ( 0.000 -0.419 0.000) 0.419 14.801 ( 0.000 -0.090 0.000) 0.090 17.057 ( 0.000 -2.711 0.000) 2.711 18.397 ( -0.000 3.229 -0.000) 3.229 18.912 ( 0.000 -1.457 0.000) 1.457 ======================= Grid point 1051 (331/343) ======================= q-point: ( 0.54 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.218 ( -8.675 -0.000 17.956) 19.942 1.411 ( -22.435 -0.000 15.805) 27.443 1.699 ( 12.909 0.000 0.885) 12.940 1.967 ( -3.505 -0.000 10.129) 10.718 2.561 ( -22.072 -0.000 8.179) 23.539 2.897 ( 2.378 0.000 0.669) 2.470 3.101 ( -1.136 -0.000 0.358) 1.191 3.161 ( -3.096 -0.000 3.265) 4.499 4.324 ( 15.761 0.000 -3.007) 16.045 4.873 ( -22.356 -0.000 -4.844) 22.875 5.058 ( -3.379 -0.000 8.277) 8.940 5.162 ( -1.666 -0.000 -0.775) 1.838 5.416 ( -8.787 -0.000 7.535) 11.576 5.679 ( -0.333 -0.000 -0.014) 0.333 5.949 ( -26.560 -0.000 17.899) 32.028 6.271 ( -18.453 -0.000 14.713) 23.601 6.591 ( -20.049 -0.000 6.473) 21.068 6.902 ( -6.168 -0.000 11.126) 12.721 7.602 ( -0.268 -0.000 12.413) 12.415 8.057 ( -12.555 -0.000 1.158) 12.609 8.141 ( -11.401 -0.000 2.163) 11.605 8.332 ( -3.265 -0.000 11.411) 11.869 8.588 ( -23.842 -0.000 27.838) 36.653 8.975 ( 7.040 0.000 -11.170) 13.204 9.277 ( 0.219 0.000 -0.558) 0.600 9.467 ( -8.582 -0.000 5.476) 10.180 10.226 ( -17.626 -0.000 11.813) 21.218 12.966 ( 1.631 0.000 -3.163) 3.559 13.655 ( 2.431 0.000 -0.297) 2.449 13.900 ( 10.637 0.000 -1.759) 10.781 14.201 ( -8.275 -0.000 -2.698) 8.704 14.208 ( -1.660 0.000 -7.896) 8.069 14.782 ( -2.585 -0.000 -5.011) 5.638 16.856 ( 14.501 0.000 -17.946) 23.073 18.793 ( -24.653 -0.000 24.958) 35.081 18.870 ( -3.228 -0.000 0.058) 3.228 ======================= Grid point 1065 (332/343) ======================= q-point: ( 0.54 0.08 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 0.000 6.295 17.539) 18.635 1.617 ( -0.000 6.367 33.539) 34.138 1.963 ( -0.000 -3.578 8.609) 9.323 1.972 ( 0.000 -5.717 7.572) 9.488 2.559 ( -0.000 18.932 18.258) 26.301 2.936 ( 0.000 -13.734 0.914) 13.765 3.135 ( 0.000 0.898 3.481) 3.595 3.191 ( 0.000 -3.971 4.238) 5.808 4.411 ( 0.000 1.310 -4.702) 4.881 4.581 ( -0.000 -0.587 0.351) 0.684 5.032 ( 0.000 0.445 -2.502) 2.541 5.232 ( -0.000 -0.619 13.515) 13.530 5.494 ( -0.000 -0.063 10.663) 10.663 5.710 ( -0.000 -0.647 5.135) 5.176 6.173 ( -0.000 1.196 34.849) 34.869 6.433 ( 0.000 -1.022 21.978) 22.002 6.628 ( -0.000 -3.592 10.431) 11.033 7.065 ( -0.000 -0.348 15.163) 15.167 7.829 ( -0.000 -0.212 13.037) 13.039 7.983 ( -0.000 4.655 4.618) 6.557 8.033 ( 0.000 -4.489 2.174) 4.988 8.563 ( 0.000 -0.810 23.056) 23.070 8.753 ( 0.000 0.015 -20.535) 20.535 8.990 ( -0.000 -1.179 44.992) 45.008 9.331 ( -0.000 0.124 4.633) 4.634 9.522 ( -0.000 -0.148 10.589) 10.590 10.320 ( 0.000 0.037 18.838) 18.838 12.918 ( 0.000 -1.640 -5.953) 6.175 13.674 ( 0.000 0.075 0.750) 0.754 13.926 ( -0.000 3.744 -9.348) 10.070 14.040 ( 0.000 -1.483 -13.661) 13.741 14.096 ( -0.000 -0.033 2.963) 2.963 14.682 ( -0.000 2.790 -6.511) 7.084 16.586 ( 0.000 -2.028 -36.938) 36.993 18.890 ( 0.000 5.287 12.534) 13.604 19.104 ( 0.000 -5.467 37.140) 37.540 ======================= Grid point 1066 (333/343) ======================= q-point: ( 0.62 0.08 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -17.046 -0.000 19.849) 26.164 1.909 ( 10.990 0.000 13.432) 17.355 2.138 ( -7.614 -0.000 29.938) 30.891 2.272 ( -10.393 -0.000 11.832) 15.748 2.925 ( -10.439 -0.000 15.544) 18.724 2.971 ( -4.215 -0.000 4.689) 6.305 3.170 ( 2.591 0.000 4.502) 5.194 3.272 ( -3.785 -0.000 4.821) 6.130 4.223 ( 13.511 0.000 -3.643) 13.994 4.849 ( -25.157 -0.000 8.257) 26.477 5.227 ( -17.845 -0.000 6.313) 18.929 5.438 ( -0.812 -0.000 17.773) 17.792 5.632 ( -7.623 -0.000 2.632) 8.065 5.858 ( 2.139 -0.000 19.247) 19.365 6.700 ( -5.761 -0.000 25.046) 25.700 6.735 ( -8.977 -0.000 11.449) 14.549 6.765 ( -6.924 -0.000 9.624) 11.856 7.269 ( -2.788 -0.000 13.917) 14.193 7.840 ( 9.556 0.000 5.479) 11.015 8.189 ( -10.257 -0.000 10.976) 15.023 8.240 ( -14.772 -0.000 4.947) 15.578 8.530 ( -7.929 -0.000 -15.418) 17.338 8.917 ( 0.695 -0.000 28.190) 28.199 9.265 ( 3.023 0.000 3.779) 4.839 9.730 ( -6.333 -0.000 13.300) 14.731 9.802 ( -11.434 -0.000 44.952) 46.383 10.675 ( -12.814 -0.000 18.855) 22.798 12.811 ( 1.415 0.000 -7.886) 8.012 13.643 ( 5.955 0.000 -1.707) 6.195 13.786 ( 3.239 0.000 -6.397) 7.170 13.907 ( -8.055 -0.000 -10.090) 12.911 14.193 ( -5.086 -0.000 3.507) 6.177 14.619 ( -2.388 -0.000 -5.201) 5.723 15.944 ( 10.139 0.000 -41.651) 42.867 19.204 ( -7.738 -0.000 23.985) 25.202 19.658 ( -8.947 -0.000 31.260) 32.515 ======================= Grid point 1080 (334/343) ======================= q-point: ( 0.62 0.15 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( 0.000 6.647 23.267) 24.198 2.252 ( 0.000 -7.074 12.194) 14.097 2.291 ( -0.000 6.402 16.560) 17.754 2.473 ( 0.000 -4.664 23.040) 23.507 2.984 ( -0.000 11.516 9.650) 15.025 3.086 ( -0.000 -4.051 10.867) 11.598 3.267 ( 0.000 0.855 5.985) 6.046 3.322 ( 0.000 -7.708 5.079) 9.231 4.258 ( 0.000 1.023 -5.529) 5.623 4.886 ( -0.000 -0.588 21.194) 21.202 5.221 ( 0.000 0.603 14.971) 14.983 5.608 ( -0.000 3.906 3.450) 5.211 5.708 ( -0.000 -5.303 19.185) 19.904 6.156 ( -0.000 0.030 19.630) 19.630 6.758 ( -0.000 1.200 3.047) 3.275 6.807 ( -0.000 -2.180 2.608) 3.399 6.984 ( 0.000 -1.227 17.764) 17.806 7.441 ( -0.000 0.024 15.676) 15.676 8.046 ( -0.000 0.397 -8.153) 8.162 8.147 ( -0.000 -1.631 12.130) 12.239 8.302 ( -0.000 0.146 0.193) 0.242 8.324 ( 0.000 -0.304 16.138) 16.141 9.336 ( -0.000 0.346 29.992) 29.994 9.374 ( 0.000 -0.197 9.151) 9.153 9.882 ( -0.000 -0.012 15.546) 15.546 10.330 ( -0.000 1.470 41.170) 41.197 10.847 ( 0.000 -0.075 19.316) 19.316 12.705 ( 0.000 -1.286 -9.538) 9.625 13.618 ( -0.000 4.688 -14.577) 15.313 13.705 ( 0.000 -3.724 -9.428) 10.137 13.769 ( 0.000 0.038 7.435) 7.436 14.251 ( -0.000 0.001 9.104) 9.104 14.532 ( -0.000 3.300 -3.542) 4.841 15.445 ( 0.000 -2.976 -39.718) 39.830 19.532 ( 0.000 0.606 30.604) 30.610 20.019 ( 0.000 -0.712 27.823) 27.832 ======================= Grid point 1081 (335/343) ======================= q-point: ( 0.69 0.15 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -6.203 -0.000 17.979) 19.019 2.312 ( 8.101 0.000 14.618) 16.712 2.617 ( -8.654 -0.000 13.497) 16.034 2.760 ( -4.354 -0.000 15.759) 16.349 3.125 ( -3.499 -0.000 6.415) 7.307 3.275 ( -3.996 -0.000 9.444) 10.255 3.327 ( 3.616 0.000 6.670) 7.587 3.401 ( -4.665 -0.000 4.111) 6.218 4.130 ( 8.156 0.000 -3.186) 8.756 5.315 ( -13.296 -0.000 24.072) 27.500 5.506 ( -5.880 -0.000 11.425) 12.850 5.726 ( -12.596 -0.000 5.888) 13.904 5.982 ( -0.582 -0.000 19.572) 19.580 6.348 ( 2.801 -0.000 11.722) 12.052 6.780 ( 3.688 0.000 -2.031) 4.211 6.862 ( -12.596 -0.000 0.630) 12.612 7.172 ( -9.643 -0.000 -0.150) 9.644 7.701 ( -0.350 -0.000 21.265) 21.268 7.870 ( -0.911 0.000 -8.242) 8.292 8.299 ( -0.010 -0.000 11.201) 11.201 8.564 ( -5.660 -0.000 12.130) 13.386 8.571 ( -13.190 -0.000 14.686) 19.740 9.523 ( 2.125 -0.000 16.472) 16.608 9.662 ( 8.864 -0.000 25.011) 26.535 10.181 ( -9.049 -0.000 19.945) 21.902 10.859 ( -2.222 -0.000 32.644) 32.719 11.196 ( -12.473 -0.000 19.540) 23.182 12.553 ( 1.431 0.000 -11.051) 11.143 13.399 ( 3.685 0.000 -13.331) 13.831 13.555 ( 1.030 0.000 -10.974) 11.022 13.947 ( -5.507 -0.000 10.987) 12.290 14.342 ( 4.472 0.000 5.301) 6.935 14.609 ( -10.425 -0.000 6.576) 12.326 14.945 ( 1.698 0.000 -29.344) 29.393 19.981 ( -3.334 -0.000 30.839) 31.019 20.365 ( -0.639 -0.000 21.725) 21.734 ======================= Grid point 1095 (336/343) ======================= q-point: ( 0.69 0.23 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( -0.000 11.744 16.368) 20.145 2.592 ( -0.000 -12.386 12.621) 17.683 2.733 ( -0.000 3.091 15.251) 15.561 2.902 ( 0.000 -1.932 9.844) 10.031 3.199 ( 0.000 0.401 7.667) 7.677 3.344 ( -0.000 7.984 6.552) 10.328 3.437 ( 0.000 -8.942 3.246) 9.513 3.444 ( 0.000 0.769 6.779) 6.822 4.134 ( 0.000 0.571 -3.593) 3.638 5.600 ( -0.000 -0.080 28.276) 28.276 5.669 ( 0.000 -0.011 14.227) 14.227 5.689 ( -0.000 0.154 3.349) 3.353 6.205 ( -0.000 -1.155 10.212) 10.277 6.477 ( 0.000 0.581 4.076) 4.117 6.749 ( -0.000 1.656 -1.388) 2.161 6.810 ( -0.000 -2.350 2.296) 3.285 7.000 ( 0.000 -1.649 -12.539) 12.647 7.676 ( -0.000 0.219 -13.297) 13.299 8.052 ( -0.000 0.701 28.278) 28.287 8.516 ( -0.000 -2.102 15.018) 15.164 8.653 ( 0.000 0.008 6.910) 6.910 8.757 ( -0.000 0.018 23.848) 23.848 9.796 ( -0.000 0.123 22.096) 22.096 10.100 ( -0.000 1.626 25.351) 25.403 10.352 ( -0.000 0.108 18.680) 18.680 11.288 ( -0.000 3.343 30.561) 30.743 11.346 ( 0.000 -0.120 17.295) 17.295 12.407 ( 0.000 -1.561 -12.200) 12.300 13.229 ( 0.000 2.609 -14.053) 14.293 13.404 ( -0.000 -3.884 -13.113) 13.676 14.117 ( 0.000 0.011 18.127) 18.127 14.493 ( -0.000 7.224 -1.807) 7.447 14.603 ( -0.000 0.025 16.577) 16.577 14.613 ( 0.000 -7.239 -19.715) 21.002 20.387 ( 0.000 -0.062 31.049) 31.050 20.651 ( 0.000 0.274 20.261) 20.263 ======================= Grid point 1096 (337/343) ======================= q-point: ( 0.77 0.23 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.660 ( 5.907 0.000 11.039) 12.520 2.705 ( 1.254 -0.000 12.744) 12.805 2.968 ( -4.452 -0.000 11.552) 12.380 3.036 ( -3.918 -0.000 5.591) 6.827 3.314 ( -1.435 -0.000 7.179) 7.321 3.446 ( -0.938 -0.000 3.984) 4.093 3.481 ( -2.950 -0.000 2.523) 3.882 3.513 ( 1.770 -0.000 6.348) 6.590 4.055 ( 5.174 0.000 -2.299) 5.662 5.717 ( 0.362 -0.000 4.661) 4.675 5.897 ( -10.132 -0.000 3.643) 10.767 5.999 ( -4.992 -0.000 22.388) 22.938 6.176 ( 5.794 0.000 -7.326) 9.340 6.492 ( 1.433 0.000 1.316) 1.946 6.809 ( -2.237 -0.000 -4.070) 4.645 6.834 ( -13.967 -0.000 -3.318) 14.356 6.965 ( -7.702 -0.000 0.924) 7.757 7.553 ( -8.298 -0.000 -13.141) 15.541 8.408 ( 5.397 -0.000 27.870) 28.387 8.719 ( 0.246 -0.000 16.156) 16.158 8.765 ( -5.048 -0.000 4.926) 7.053 9.114 ( -3.642 -0.000 23.314) 23.597 10.120 ( 0.656 -0.000 25.954) 25.962 10.271 ( 15.327 0.000 20.361) 25.485 10.745 ( -13.246 -0.000 20.074) 24.050 11.555 ( 0.511 -0.000 18.930) 18.937 11.771 ( -10.849 -0.000 23.163) 25.578 12.230 ( 0.891 0.000 -12.110) 12.143 13.031 ( 2.095 0.000 -13.354) 13.517 13.205 ( 0.524 0.000 -14.146) 14.155 14.277 ( 5.692 0.000 -0.806) 5.749 14.427 ( 8.766 0.000 0.875) 8.810 14.492 ( -8.796 -0.000 7.780) 11.743 14.950 ( -12.383 -0.000 16.341) 20.503 20.794 ( -0.047 -0.000 28.306) 28.306 20.897 ( 2.693 -0.000 18.415) 18.611 ======================= Grid point 1110 (338/343) ======================= q-point: ( 0.77 0.31 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.818 ( 0.000 9.715 9.831) 13.821 2.919 ( -0.000 -10.382 10.831) 15.003 3.053 ( 0.000 2.876 4.339) 5.206 3.086 ( 0.000 -2.444 7.842) 8.214 3.396 ( 0.000 0.226 6.578) 6.582 3.465 ( -0.000 6.667 3.480) 7.520 3.516 ( 0.000 -6.854 3.006) 7.484 3.617 ( 0.000 0.647 5.713) 5.750 4.056 ( -0.000 0.083 -2.372) 2.374 5.759 ( -0.000 -0.307 1.108) 1.150 5.870 ( 0.000 -0.008 1.431) 1.431 6.058 ( -0.000 -0.780 -15.261) 15.281 6.200 ( -0.000 1.249 8.621) 8.711 6.504 ( -0.000 1.603 -0.067) 1.604 6.608 ( -0.000 3.405 -7.293) 8.049 6.677 ( 0.000 -4.753 -8.852) 10.047 7.114 ( -0.000 -2.565 15.101) 15.318 7.315 ( -0.000 0.285 -12.218) 12.222 8.814 ( 0.000 -0.272 7.951) 7.956 8.819 ( -0.000 2.031 26.215) 26.294 8.938 ( -0.000 -2.725 15.655) 15.890 9.415 ( -0.000 0.299 23.747) 23.749 10.487 ( -0.000 0.795 26.809) 26.821 10.695 ( -0.000 1.778 18.245) 18.332 10.845 ( 0.000 0.118 16.794) 16.794 11.771 ( -0.000 -0.114 13.811) 13.811 12.016 ( -0.000 7.448 19.201) 20.595 12.089 ( 0.000 -5.819 -6.204) 8.506 12.868 ( 0.000 2.487 -11.678) 11.940 13.025 ( -0.000 -5.172 -13.917) 14.847 14.207 ( 0.000 0.951 -8.554) 8.606 14.482 ( 0.000 -0.740 -3.619) 3.694 14.689 ( 0.000 0.009 22.432) 22.432 15.102 ( -0.000 0.023 19.081) 19.081 21.161 ( -0.000 0.968 21.768) 21.789 21.168 ( 0.000 -0.809 21.903) 21.918 ======================= Grid point 1111 (339/343) ======================= q-point: ( 0.85 0.31 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.913 ( 5.355 0.000 7.669) 9.354 2.977 ( 5.309 0.000 6.894) 8.702 3.116 ( -2.345 -0.000 1.561) 2.817 3.199 ( -1.820 -0.000 4.960) 5.283 3.490 ( -0.375 -0.000 5.703) 5.715 3.541 ( 1.161 -0.000 3.869) 4.039 3.552 ( -3.699 -0.000 2.902) 4.702 3.668 ( 2.068 0.000 4.810) 5.236 4.001 ( 3.479 0.000 -1.828) 3.930 5.767 ( -1.427 -0.000 -1.138) 1.825 5.796 ( 4.125 0.000 -15.500) 16.040 5.910 ( -5.419 -0.000 -1.078) 5.525 6.245 ( -9.775 -0.000 -10.537) 14.373 6.504 ( 0.650 0.000 -0.304) 0.718 6.591 ( -10.940 -0.000 -14.320) 18.021 6.620 ( -6.823 -0.000 -1.353) 6.956 7.127 ( 6.775 0.000 0.273) 6.780 7.384 ( -8.529 -0.000 6.734) 10.866 8.943 ( 1.748 -0.000 10.270) 10.418 9.121 ( 3.975 -0.000 22.269) 22.621 9.140 ( -0.603 -0.000 14.550) 14.563 9.736 ( -1.316 -0.000 21.391) 21.432 10.749 ( 15.073 0.000 14.162) 20.682 10.827 ( 2.171 -0.000 24.447) 24.543 11.209 ( -13.755 -0.000 13.586) 19.333 11.928 ( 0.412 0.000 -10.089) 10.097 11.968 ( -3.404 -0.000 12.285) 12.748 12.362 ( -3.196 -0.000 18.495) 18.769 12.731 ( 1.464 0.000 -7.154) 7.302 12.847 ( -1.169 0.000 -10.170) 10.237 14.098 ( 1.773 0.000 -5.898) 6.159 14.359 ( 6.688 0.000 -6.270) 9.167 14.995 ( -1.409 -0.000 19.651) 19.702 15.404 ( -6.905 -0.000 15.933) 17.365 21.372 ( 3.726 -0.000 16.239) 16.661 21.479 ( 1.455 -0.000 21.714) 21.763 ======================= Grid point 1125 (340/343) ======================= q-point: ( 0.85 0.38 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.033 ( 0.000 6.197 6.120) 8.710 3.079 ( 0.000 -0.322 -0.539) 0.628 3.158 ( -0.000 -6.860 6.710) 9.596 3.237 ( 0.000 -0.629 2.562) 2.638 3.538 ( 0.000 1.905 3.610) 4.082 3.569 ( -0.000 3.510 4.244) 5.508 3.619 ( 0.000 -3.727 4.484) 5.831 3.742 ( 0.000 0.495 3.389) 3.425 3.997 ( 0.000 -0.416 -2.099) 2.140 5.607 ( -0.000 -1.483 -15.878) 15.947 5.742 ( -0.000 -0.529 -1.916) 1.988 5.833 ( 0.000 5.881 -3.126) 6.661 6.025 ( 0.000 -4.507 -10.299) 11.242 6.292 ( 0.000 -1.182 -17.385) 17.425 6.476 ( -0.000 -0.172 -10.951) 10.953 6.518 ( -0.000 2.601 1.020) 2.793 7.222 ( -0.000 0.313 5.403) 5.412 7.462 ( -0.000 -1.797 9.880) 10.042 9.106 ( 0.000 -0.341 11.782) 11.786 9.319 ( -0.000 -0.390 12.483) 12.489 9.438 ( -0.000 0.012 18.702) 18.702 9.997 ( -0.000 0.384 18.236) 18.240 11.036 ( -0.000 4.609 7.826) 9.082 11.157 ( -0.000 -3.017 19.720) 19.950 11.229 ( 0.000 0.067 11.210) 11.210 11.801 ( -0.000 -0.796 -9.594) 9.627 12.082 ( -0.000 -0.083 8.971) 8.971 12.519 ( 0.000 4.855 3.175) 5.801 12.682 ( -0.000 2.506 -0.708) 2.604 12.799 ( 0.000 -7.416 7.004) 10.201 14.036 ( -0.000 0.136 -5.196) 5.198 14.291 ( 0.000 0.065 -10.482) 10.482 15.244 ( 0.000 0.017 17.226) 17.226 15.570 ( -0.000 0.010 14.393) 14.393 21.602 ( 0.000 0.137 13.741) 13.741 21.755 ( 0.000 -0.074 17.263) 17.263 ======================= Grid point 1126 (341/343) ======================= q-point: ( 0.92 0.38 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.045 ( 3.280 0.000 -0.302) 3.294 3.075 ( 5.356 0.000 4.227) 6.823 3.197 ( 2.956 0.000 3.499) 4.581 3.258 ( 0.088 -0.000 0.392) 0.402 3.618 ( -2.945 -0.000 2.690) 3.989 3.625 ( 0.387 -0.000 3.133) 3.157 3.655 ( 2.166 0.000 3.848) 4.416 3.765 ( 1.167 0.000 2.290) 2.570 3.953 ( 2.317 0.000 -1.706) 2.877 5.420 ( -1.660 0.000 -11.042) 11.166 5.698 ( 0.662 0.000 -2.760) 2.838 5.880 ( -7.564 -0.000 -1.046) 7.636 5.927 ( -6.338 -0.000 -9.266) 11.227 6.123 ( -8.408 -0.000 -15.387) 17.534 6.372 ( -8.174 -0.000 -11.656) 14.237 6.536 ( 0.019 -0.000 0.872) 0.872 7.282 ( 3.503 0.000 7.205) 8.012 7.582 ( -1.747 -0.000 5.334) 5.613 9.210 ( 6.477 0.000 8.125) 10.391 9.474 ( -1.112 -0.000 9.364) 9.430 9.630 ( 4.164 -0.000 14.514) 15.099 10.214 ( -0.100 -0.000 12.910) 12.910 11.000 ( 11.357 0.000 4.342) 12.159 11.360 ( 3.739 -0.000 13.730) 14.230 11.470 ( -10.771 -0.000 5.762) 12.215 11.679 ( -1.350 0.000 -7.655) 7.773 12.226 ( -5.585 -0.000 6.637) 8.674 12.461 ( 1.551 0.000 -5.985) 6.182 12.694 ( 2.395 0.000 3.319) 4.093 13.000 ( -1.763 -0.000 16.798) 16.890 13.958 ( 1.687 0.000 -4.562) 4.864 14.096 ( 4.843 0.000 -12.438) 13.347 15.433 ( 1.766 -0.000 11.675) 11.808 15.757 ( -2.746 -0.000 9.403) 9.796 21.739 ( 3.716 -0.000 10.024) 10.690 21.941 ( 1.886 -0.000 11.918) 12.066 ======================= Grid point 1128 (342/343) ======================= q-point: ( 0.00 0.46 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 343 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.036 ( 2.866 0.000 -0.000) 2.866 3.134 ( 5.283 0.000 -0.000) 5.283 3.248 ( 4.505 0.000 -0.000) 4.505 3.258 ( 0.948 0.000 -0.000) 0.948 3.647 ( -3.295 -0.000 0.000) 3.295 3.681 ( 1.485 0.000 -0.000) 1.485 3.714 ( 2.433 0.000 -0.000) 2.433 3.795 ( 0.706 0.000 -0.000) 0.706 3.924 ( 1.931 0.000 -0.000) 1.931 5.260 ( -4.377 -0.000 0.000) 4.377 5.656 ( 1.500 0.000 -0.000) 1.500 5.799 ( -4.379 -0.000 0.000) 4.379 5.854 ( -11.828 -0.000 0.000) 11.828 5.903 ( -4.833 -0.000 0.000) 4.833 6.194 ( -7.860 -0.000 0.000) 7.860 6.548 ( 0.234 0.000 -0.000) 0.234 7.387 ( 1.057 0.000 -0.000) 1.057 7.654 ( 0.548 0.000 -0.000) 0.548 9.327 ( 8.819 0.000 -0.000) 8.819 9.608 ( -1.361 -0.000 0.000) 1.361 9.844 ( 3.785 0.000 -0.000) 3.785 10.394 ( 0.437 0.000 -0.000) 0.437 11.039 ( 8.955 0.000 -0.000) 8.955 11.516 ( 0.230 0.000 -0.000) 0.230 11.544 ( 4.285 0.000 -0.000) 4.285 11.595 ( -11.379 -0.000 0.000) 11.379 12.316 ( -5.554 -0.000 0.000) 5.554 12.373 ( 0.001 0.000 -0.000) 0.001 12.770 ( 3.320 0.000 -0.000) 3.320 13.329 ( 1.379 0.000 -0.000) 1.379 13.831 ( 3.529 0.000 -0.000) 3.529 13.884 ( 1.695 0.000 -0.000) 1.695 15.595 ( 2.810 0.000 -0.000) 2.810 15.887 ( -1.364 -0.000 0.000) 1.364 21.879 ( 3.591 0.000 -0.000) 3.591 22.105 ( 1.940 0.000 -0.000) 1.940 ======================= Grid point 1140 (343/343) ======================= q-point: ( 0.92 0.46 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 2.86e-04 2.86e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 595 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.060 ( 0.000 -0.765 -0.488) 0.907 3.147 ( 0.000 5.165 2.191) 5.611 3.266 ( 0.000 -1.231 0.230) 1.253 3.281 ( -0.000 -5.833 2.301) 6.270 3.599 ( 0.000 2.278 1.087) 2.524 3.666 ( 0.000 4.329 2.219) 4.865 3.722 ( -0.000 -3.346 2.387) 4.110 3.800 ( 0.000 0.371 1.011) 1.077 3.947 ( 0.000 -0.967 -1.238) 1.571 5.282 ( -0.000 -2.342 -6.839) 7.229 5.693 ( -0.000 -0.254 -1.161) 1.188 5.736 ( 0.000 15.331 -2.707) 15.569 5.820 ( 0.000 -5.056 -5.778) 7.677 5.932 ( 0.000 -10.240 -5.703) 11.721 6.187 ( -0.000 -0.142 -6.843) 6.845 6.542 ( -0.000 3.158 0.513) 3.199 7.369 ( -0.000 0.580 3.318) 3.369 7.639 ( -0.000 -1.276 3.230) 3.473 9.352 ( 0.000 -0.297 5.111) 5.119 9.565 ( -0.000 -0.328 4.965) 4.976 9.817 ( -0.000 -0.190 8.164) 8.167 10.348 ( -0.000 0.379 6.912) 6.923 11.116 ( -0.000 0.668 -0.039) 0.669 11.437 ( 0.000 0.022 3.938) 3.939 11.527 ( 0.000 0.254 6.657) 6.662 11.587 ( -0.000 -0.661 -4.601) 4.648 12.247 ( -0.000 -0.059 3.129) 3.129 12.401 ( 0.000 1.088 -3.562) 3.724 12.765 ( 0.000 0.790 3.708) 3.791 13.225 ( 0.000 -2.432 14.905) 15.102 13.909 ( -0.000 4.106 -4.807) 6.322 13.963 ( 0.000 -3.235 -10.252) 10.750 15.571 ( 0.000 0.025 6.316) 6.316 15.842 ( -0.000 -0.002 5.234) 5.234 21.868 ( 0.000 0.014 5.258) 5.258 22.076 ( 0.000 0.003 6.113) 6.113 =================== 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 3/79092 10.0 933.710 5464.362 1326.131 -0.000 -0.000 -0.000 3/79092 20.0 529.818 447.955 607.970 -0.000 -0.000 0.000 3/79092 30.0 277.829 153.333 306.752 -0.000 -0.000 0.000 3/79092 40.0 150.335 77.387 166.807 -0.000 -0.000 0.000 3/79092 50.0 86.694 45.389 96.723 -0.000 -0.000 0.000 3/79092 60.0 54.980 29.623 61.328 -0.000 -0.000 0.000 3/79092 70.0 38.120 21.003 42.352 -0.000 -0.000 0.000 3/79092 80.0 28.390 15.860 31.363 -0.000 -0.000 0.000 3/79092 90.0 22.329 12.561 24.518 -0.000 -0.000 0.000 3/79092 100.0 18.301 10.318 19.977 -0.000 -0.000 0.000 3/79092 110.0 15.476 8.716 16.803 -0.000 -0.000 0.000 3/79092 120.0 13.406 7.528 14.486 -0.000 -0.000 0.000 3/79092 130.0 11.831 6.618 12.733 -0.000 -0.000 0.000 3/79092 140.0 10.598 5.902 11.366 -0.000 -0.000 0.000 3/79092 150.0 9.607 5.325 10.272 -0.000 -0.000 0.000 3/79092 160.0 8.794 4.852 9.379 -0.000 -0.000 0.000 3/79092 170.0 8.115 4.457 8.636 -0.000 -0.000 0.000 3/79092 180.0 7.540 4.123 8.008 -0.000 -0.000 0.000 3/79092 190.0 7.045 3.837 7.471 -0.000 -0.000 0.000 3/79092 200.0 6.615 3.589 7.005 -0.000 -0.000 0.000 3/79092 210.0 6.237 3.372 6.597 -0.000 -0.000 0.000 3/79092 220.0 5.903 3.181 6.237 -0.000 -0.000 0.000 3/79092 230.0 5.605 3.011 5.917 -0.000 -0.000 0.000 3/79092 240.0 5.337 2.859 5.630 -0.000 -0.000 0.000 3/79092 250.0 5.095 2.723 5.371 -0.000 -0.000 0.000 3/79092 260.0 4.876 2.599 5.136 -0.000 -0.000 0.000 3/79092 270.0 4.675 2.486 4.922 -0.000 -0.000 0.000 3/79092 280.0 4.491 2.383 4.726 -0.000 -0.000 0.000 3/79092 290.0 4.322 2.289 4.545 -0.000 -0.000 0.000 3/79092 300.0 4.165 2.202 4.379 -0.000 -0.000 0.000 3/79092 310.0 4.020 2.122 4.225 -0.000 -0.000 0.000 3/79092 320.0 3.885 2.047 4.082 -0.000 -0.000 0.000 3/79092 330.0 3.759 1.978 3.949 -0.000 -0.000 0.000 3/79092 340.0 3.642 1.914 3.824 -0.000 -0.000 0.000 3/79092 350.0 3.532 1.853 3.707 -0.000 -0.000 0.000 3/79092 360.0 3.428 1.797 3.598 -0.000 -0.000 0.000 3/79092 370.0 3.331 1.744 3.495 -0.000 -0.000 0.000 3/79092 380.0 3.239 1.694 3.398 -0.000 -0.000 0.000 3/79092 390.0 3.152 1.647 3.306 -0.000 -0.000 0.000 3/79092 400.0 3.070 1.602 3.219 -0.000 -0.000 0.000 3/79092 410.0 2.992 1.560 3.137 -0.000 -0.000 0.000 3/79092 420.0 2.918 1.520 3.059 -0.000 -0.000 0.000 3/79092 430.0 2.848 1.483 2.985 -0.000 -0.000 0.000 3/79092 440.0 2.781 1.447 2.915 -0.000 -0.000 0.000 3/79092 450.0 2.717 1.413 2.847 -0.000 -0.000 0.000 3/79092 460.0 2.656 1.380 2.783 -0.000 -0.000 0.000 3/79092 470.0 2.598 1.349 2.722 -0.000 -0.000 0.000 3/79092 480.0 2.542 1.319 2.664 -0.000 -0.000 0.000 3/79092 490.0 2.489 1.291 2.608 -0.000 -0.000 0.000 3/79092 500.0 2.438 1.264 2.554 -0.000 -0.000 0.000 3/79092 510.0 2.389 1.238 2.502 -0.000 -0.000 0.000 3/79092 520.0 2.342 1.213 2.453 -0.000 -0.000 0.000 3/79092 530.0 2.297 1.189 2.406 -0.000 -0.000 0.000 3/79092 540.0 2.254 1.166 2.360 -0.000 -0.000 0.000 3/79092 550.0 2.212 1.144 2.316 -0.000 -0.000 0.000 3/79092 560.0 2.172 1.123 2.274 -0.000 -0.000 0.000 3/79092 570.0 2.133 1.102 2.233 -0.000 -0.000 0.000 3/79092 580.0 2.095 1.083 2.194 -0.000 -0.000 0.000 3/79092 590.0 2.059 1.064 2.156 -0.000 -0.000 0.000 3/79092 600.0 2.025 1.045 2.119 -0.000 -0.000 0.000 3/79092 610.0 1.991 1.027 2.084 -0.000 -0.000 0.000 3/79092 620.0 1.958 1.010 2.050 -0.000 -0.000 0.000 3/79092 630.0 1.927 0.994 2.017 -0.000 -0.000 0.000 3/79092 640.0 1.896 0.978 1.985 -0.000 -0.000 0.000 3/79092 650.0 1.867 0.962 1.954 -0.000 -0.000 0.000 3/79092 660.0 1.838 0.947 1.924 -0.000 -0.000 0.000 3/79092 670.0 1.810 0.933 1.894 -0.000 -0.000 0.000 3/79092 680.0 1.783 0.919 1.866 -0.000 -0.000 0.000 3/79092 690.0 1.757 0.905 1.839 -0.000 -0.000 0.000 3/79092 700.0 1.732 0.892 1.812 -0.000 -0.000 0.000 3/79092 710.0 1.707 0.879 1.786 -0.000 -0.000 0.000 3/79092 720.0 1.683 0.866 1.761 -0.000 -0.000 0.000 3/79092 730.0 1.660 0.854 1.737 -0.000 -0.000 0.000 3/79092 740.0 1.637 0.842 1.713 -0.000 -0.000 0.000 3/79092 750.0 1.615 0.831 1.690 -0.000 -0.000 0.000 3/79092 760.0 1.594 0.820 1.667 -0.000 -0.000 0.000 3/79092 770.0 1.573 0.809 1.646 -0.000 -0.000 0.000 3/79092 780.0 1.553 0.798 1.624 -0.000 -0.000 0.000 3/79092 790.0 1.533 0.788 1.603 -0.000 -0.000 0.000 3/79092 800.0 1.514 0.778 1.583 -0.000 -0.000 0.000 3/79092 810.0 1.495 0.768 1.564 -0.000 -0.000 0.000 3/79092 820.0 1.476 0.759 1.544 -0.000 -0.000 0.000 3/79092 830.0 1.458 0.749 1.526 -0.000 -0.000 0.000 3/79092 840.0 1.441 0.740 1.507 -0.000 -0.000 0.000 3/79092 850.0 1.424 0.731 1.489 -0.000 -0.000 0.000 3/79092 860.0 1.407 0.723 1.472 -0.000 -0.000 0.000 3/79092 870.0 1.391 0.714 1.455 -0.000 -0.000 0.000 3/79092 880.0 1.375 0.706 1.438 -0.000 -0.000 0.000 3/79092 890.0 1.359 0.698 1.422 -0.000 -0.000 0.000 3/79092 900.0 1.344 0.690 1.406 -0.000 -0.000 0.000 3/79092 910.0 1.329 0.682 1.390 -0.000 -0.000 0.000 3/79092 920.0 1.315 0.675 1.375 -0.000 -0.000 0.000 3/79092 930.0 1.301 0.668 1.360 -0.000 -0.000 0.000 3/79092 940.0 1.287 0.660 1.346 -0.000 -0.000 0.000 3/79092 950.0 1.273 0.653 1.331 -0.000 -0.000 0.000 3/79092 960.0 1.260 0.646 1.317 -0.000 -0.000 0.000 3/79092 970.0 1.247 0.640 1.304 -0.000 -0.000 0.000 3/79092 980.0 1.234 0.633 1.290 -0.000 -0.000 0.000 3/79092 990.0 1.221 0.627 1.277 -0.000 -0.000 0.000 3/79092 1000.0 1.209 0.620 1.264 -0.000 -0.000 0.000 3/79092 Thermal conductivity related properties were written into "kappa-m131313.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-09 02:01:06]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|