----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:04:18]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.295213240000289 0.000000000000000 0.000000000000000 b 0.000000000000000 5.744657780000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): *1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 2 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 *3 O 0.72931795166246 0.70819426194047 0.55437602588310 15.999 4 O 0.27068204833755 0.20819426194047 0.94562397411690 15.999 5 O 0.27068204833755 0.29180573805953 0.44562397411690 15.999 6 O 0.72931795166246 0.79180573805953 0.05437602588310 15.999 *7 O 0.35453179549158 0.97081503216984 0.25158745686714 15.999 8 O 0.64546820450842 0.47081503216984 0.24841254313286 15.999 *9 O 0.14492012560893 0.68691451390634 0.95093949700658 15.999 10 O 0.85507987439107 0.18691451390634 0.54906050299342 15.999 11 O 0.85507987439107 0.31308548609366 0.04906050299342 15.999 12 O 0.14492012560893 0.81308548609366 0.45093949700658 15.999 13 O 0.35453179549158 0.52918496783016 0.75158745686714 15.999 14 O 0.64546820450842 0.02918496783016 0.74841254313286 15.999 *15 Sm 0.22563161575041 0.92063905232223 0.74740879253808 150.360 16 Sm 0.77436838424959 0.42063905232223 0.75259120746192 150.360 17 Sm 0.22563161575041 0.57936094767777 0.24740879253808 150.360 18 Sm 0.77436838424959 0.07936094767777 0.25259120746192 150.360 *19 Os 0.50000000000000 0.50000000000000 0.00000000000000 190.230 20 Os 0.50000000000000 0.00000000000000 0.50000000000000 190.230 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.295213240000289 0.000000000000000 0.000000000000000 b 0.000000000000000 5.744657780000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): *1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 2 *3 O 0.72931795166246 0.70819426194047 0.55437602588310 15.999 > 3 4 O 0.27068204833755 0.20819426194047 0.94562397411690 15.999 > 4 5 O 0.27068204833755 0.29180573805953 0.44562397411690 15.999 > 5 6 O 0.72931795166246 0.79180573805953 0.05437602588310 15.999 > 6 *7 O 0.35453179549158 0.97081503216984 0.25158745686714 15.999 > 7 8 O 0.64546820450842 0.47081503216984 0.24841254313286 15.999 > 8 *9 O 0.14492012560893 0.68691451390634 0.95093949700658 15.999 > 9 10 O 0.85507987439107 0.18691451390634 0.54906050299342 15.999 > 10 11 O 0.85507987439107 0.31308548609366 0.04906050299342 15.999 > 11 12 O 0.14492012560893 0.81308548609366 0.45093949700658 15.999 > 12 13 O 0.35453179549158 0.52918496783016 0.75158745686714 15.999 > 13 14 O 0.64546820450842 0.02918496783016 0.74841254313286 15.999 > 14 *15 Sm 0.22563161575041 0.92063905232223 0.74740879253808 150.360 > 15 16 Sm 0.77436838424959 0.42063905232223 0.75259120746192 150.360 > 16 17 Sm 0.22563161575041 0.57936094767777 0.24740879253808 150.360 > 17 18 Sm 0.77436838424959 0.07936094767777 0.25259120746192 150.360 > 18 *19 Os 0.50000000000000 0.50000000000000 0.00000000000000 190.230 > 19 20 Os 0.50000000000000 0.00000000000000 0.50000000000000 190.230 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.590426480000579 0.000000000000000 0.000000000000000 b 0.000000000000000 11.489315560000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): *1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 > 1 5 Li 0.00000000000000 0.25000000000000 0.50000000000000 6.941 > 2 6 Li 0.50000000000000 0.25000000000000 0.50000000000000 6.941 > 2 7 Li 0.00000000000000 0.75000000000000 0.50000000000000 6.941 > 2 8 Li 0.50000000000000 0.75000000000000 0.50000000000000 6.941 > 2 *9 O 0.36465897583123 0.35409713097024 0.55437602588310 15.999 > 3 10 O 0.86465897583123 0.35409713097024 0.55437602588310 15.999 > 3 11 O 0.36465897583123 0.85409713097024 0.55437602588310 15.999 > 3 12 O 0.86465897583123 0.85409713097024 0.55437602588310 15.999 > 3 13 O 0.13534102416877 0.10409713097024 0.94562397411690 15.999 > 4 14 O 0.63534102416877 0.10409713097024 0.94562397411690 15.999 > 4 15 O 0.13534102416877 0.60409713097024 0.94562397411690 15.999 > 4 16 O 0.63534102416877 0.60409713097024 0.94562397411690 15.999 > 4 17 O 0.13534102416877 0.14590286902976 0.44562397411690 15.999 > 5 18 O 0.63534102416877 0.14590286902976 0.44562397411690 15.999 > 5 19 O 0.13534102416877 0.64590286902976 0.44562397411690 15.999 > 5 20 O 0.63534102416877 0.64590286902976 0.44562397411690 15.999 > 5 21 O 0.36465897583123 0.39590286902976 0.05437602588310 15.999 > 6 22 O 0.86465897583123 0.39590286902976 0.05437602588310 15.999 > 6 23 O 0.36465897583123 0.89590286902976 0.05437602588310 15.999 > 6 24 O 0.86465897583123 0.89590286902976 0.05437602588310 15.999 > 6 *25 O 0.17726589774579 0.48540751608492 0.25158745686714 15.999 > 7 26 O 0.67726589774579 0.48540751608492 0.25158745686714 15.999 > 7 27 O 0.17726589774579 0.98540751608492 0.25158745686714 15.999 > 7 28 O 0.67726589774579 0.98540751608492 0.25158745686714 15.999 > 7 29 O 0.32273410225421 0.23540751608492 0.24841254313286 15.999 > 8 30 O 0.82273410225421 0.23540751608492 0.24841254313286 15.999 > 8 31 O 0.32273410225421 0.73540751608492 0.24841254313286 15.999 > 8 32 O 0.82273410225421 0.73540751608492 0.24841254313286 15.999 > 8 *33 O 0.07246006280447 0.34345725695317 0.95093949700658 15.999 > 9 34 O 0.57246006280447 0.34345725695317 0.95093949700658 15.999 > 9 35 O 0.07246006280447 0.84345725695317 0.95093949700658 15.999 > 9 36 O 0.57246006280447 0.84345725695317 0.95093949700658 15.999 > 9 37 O 0.42753993719553 0.09345725695317 0.54906050299342 15.999 > 10 38 O 0.92753993719553 0.09345725695317 0.54906050299342 15.999 > 10 39 O 0.42753993719553 0.59345725695317 0.54906050299342 15.999 > 10 40 O 0.92753993719553 0.59345725695317 0.54906050299342 15.999 > 10 41 O 0.42753993719553 0.15654274304683 0.04906050299342 15.999 > 11 42 O 0.92753993719553 0.15654274304683 0.04906050299342 15.999 > 11 43 O 0.42753993719553 0.65654274304683 0.04906050299342 15.999 > 11 44 O 0.92753993719553 0.65654274304683 0.04906050299342 15.999 > 11 45 O 0.07246006280447 0.40654274304683 0.45093949700658 15.999 > 12 46 O 0.57246006280447 0.40654274304683 0.45093949700658 15.999 > 12 47 O 0.07246006280447 0.90654274304683 0.45093949700658 15.999 > 12 48 O 0.57246006280447 0.90654274304683 0.45093949700658 15.999 > 12 49 O 0.17726589774579 0.26459248391508 0.75158745686714 15.999 > 13 50 O 0.67726589774579 0.26459248391508 0.75158745686714 15.999 > 13 51 O 0.17726589774579 0.76459248391508 0.75158745686714 15.999 > 13 52 O 0.67726589774579 0.76459248391508 0.75158745686714 15.999 > 13 53 O 0.32273410225421 0.01459248391508 0.74841254313286 15.999 > 14 54 O 0.82273410225421 0.01459248391508 0.74841254313286 15.999 > 14 55 O 0.32273410225421 0.51459248391508 0.74841254313286 15.999 > 14 56 O 0.82273410225421 0.51459248391508 0.74841254313286 15.999 > 14 *57 Sm 0.11281580787521 0.46031952616111 0.74740879253808 150.360 > 15 58 Sm 0.61281580787521 0.46031952616111 0.74740879253808 150.360 > 15 59 Sm 0.11281580787521 0.96031952616111 0.74740879253808 150.360 > 15 60 Sm 0.61281580787521 0.96031952616111 0.74740879253808 150.360 > 15 61 Sm 0.38718419212479 0.21031952616111 0.75259120746192 150.360 > 16 62 Sm 0.88718419212479 0.21031952616111 0.75259120746192 150.360 > 16 63 Sm 0.38718419212479 0.71031952616111 0.75259120746192 150.360 > 16 64 Sm 0.88718419212479 0.71031952616111 0.75259120746192 150.360 > 16 65 Sm 0.11281580787521 0.28968047383889 0.24740879253808 150.360 > 17 66 Sm 0.61281580787521 0.28968047383889 0.24740879253808 150.360 > 17 67 Sm 0.11281580787521 0.78968047383889 0.24740879253808 150.360 > 17 68 Sm 0.61281580787521 0.78968047383889 0.24740879253808 150.360 > 17 69 Sm 0.38718419212479 0.03968047383889 0.25259120746192 150.360 > 18 70 Sm 0.88718419212479 0.03968047383889 0.25259120746192 150.360 > 18 71 Sm 0.38718419212479 0.53968047383889 0.25259120746192 150.360 > 18 72 Sm 0.88718419212479 0.53968047383889 0.25259120746192 150.360 > 18 *73 Os 0.25000000000000 0.25000000000000 0.00000000000000 190.230 > 19 74 Os 0.75000000000000 0.25000000000000 0.00000000000000 190.230 > 19 75 Os 0.25000000000000 0.75000000000000 0.00000000000000 190.230 > 19 76 Os 0.75000000000000 0.75000000000000 0.00000000000000 190.230 > 19 77 Os 0.25000000000000 0.00000000000000 0.50000000000000 190.230 > 20 78 Os 0.75000000000000 0.00000000000000 0.50000000000000 190.230 > 20 79 Os 0.25000000000000 0.50000000000000 0.50000000000000 190.230 > 20 80 Os 0.75000000000000 0.50000000000000 0.50000000000000 190.230 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 191.8604536 0.0000000 157.0463460 0.0000000 978.7267600 0.0000000 157.0453822 0.0000000 340.4075957 -------------------------- Born effective charges -------------------------- 1 Li 1.4694750 -0.3042147 -0.4097176 0.9416031 1.8103257 -1.0383179 0.7879426 -0.0539138 1.1440826 2 Li 1.4694750 0.3042147 -0.4097176 -0.9416031 1.8103257 1.0383179 0.7879426 0.0539138 1.1440826 3 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 4 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 5 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 6 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 7 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 8 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 9 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 10 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 11 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 12 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 13 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 14 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 15 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 16 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 17 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 18 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 19 Os 3.4052490 4.5115626 -0.3985152 8.5724392 13.7914484 -2.3855178 1.8225764 3.5782459 3.5283307 20 Os 3.4052490 -4.5115626 -0.3985152 -8.5724392 13.7914484 2.3855178 1.8225764 -3.5782459 3.5283307 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 640 - Time: 2.348 Solver_block: 200 / 640 - Time: 2.339 Solver_block: 300 / 640 - Time: 2.352 Solver_block: 400 / 640 - Time: 2.363 Solver_block: 500 / 640 - Time: 2.422 Solver_block: 600 / 640 - Time: 2.300 Solver_block: 640 / 640 - Time: 1.009 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 15.556 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 00:05:13]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:05:13]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.295213240000289 0.000000000000000 0.000000000000000 b 0.000000000000000 5.744657780000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): 1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 2 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 3 O 0.72931795166246 0.70819426194047 0.55437602588310 15.999 4 O 0.27068204833755 0.20819426194047 0.94562397411690 15.999 5 O 0.27068204833755 0.29180573805953 0.44562397411690 15.999 6 O 0.72931795166246 0.79180573805953 0.05437602588310 15.999 7 O 0.35453179549158 0.97081503216984 0.25158745686714 15.999 8 O 0.64546820450842 0.47081503216984 0.24841254313286 15.999 9 O 0.14492012560893 0.68691451390634 0.95093949700658 15.999 10 O 0.85507987439107 0.18691451390634 0.54906050299342 15.999 11 O 0.85507987439107 0.31308548609366 0.04906050299342 15.999 12 O 0.14492012560893 0.81308548609366 0.45093949700658 15.999 13 O 0.35453179549158 0.52918496783016 0.75158745686714 15.999 14 O 0.64546820450842 0.02918496783016 0.74841254313286 15.999 15 Sm 0.22563161575041 0.92063905232223 0.74740879253808 150.360 16 Sm 0.77436838424959 0.42063905232223 0.75259120746192 150.360 17 Sm 0.22563161575041 0.57936094767777 0.24740879253808 150.360 18 Sm 0.77436838424959 0.07936094767777 0.25259120746192 150.360 19 Os 0.50000000000000 0.50000000000000 0.00000000000000 190.230 20 Os 0.50000000000000 0.00000000000000 0.50000000000000 190.230 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.590426480000579 0.000000000000000 0.000000000000000 b 0.000000000000000 11.489315560000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): 1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 > 1 5 Li 0.00000000000000 0.25000000000000 0.50000000000000 6.941 > 5 6 Li 0.50000000000000 0.25000000000000 0.50000000000000 6.941 > 5 7 Li 0.00000000000000 0.75000000000000 0.50000000000000 6.941 > 5 8 Li 0.50000000000000 0.75000000000000 0.50000000000000 6.941 > 5 9 O 0.36465897583123 0.35409713097024 0.55437602588310 15.999 > 9 10 O 0.86465897583123 0.35409713097024 0.55437602588310 15.999 > 9 11 O 0.36465897583123 0.85409713097024 0.55437602588310 15.999 > 9 12 O 0.86465897583123 0.85409713097024 0.55437602588310 15.999 > 9 13 O 0.13534102416877 0.10409713097024 0.94562397411690 15.999 > 13 14 O 0.63534102416877 0.10409713097024 0.94562397411690 15.999 > 13 15 O 0.13534102416877 0.60409713097024 0.94562397411690 15.999 > 13 16 O 0.63534102416877 0.60409713097024 0.94562397411690 15.999 > 13 17 O 0.13534102416877 0.14590286902976 0.44562397411690 15.999 > 17 18 O 0.63534102416877 0.14590286902976 0.44562397411690 15.999 > 17 19 O 0.13534102416877 0.64590286902976 0.44562397411690 15.999 > 17 20 O 0.63534102416877 0.64590286902976 0.44562397411690 15.999 > 17 21 O 0.36465897583123 0.39590286902976 0.05437602588310 15.999 > 21 22 O 0.86465897583123 0.39590286902976 0.05437602588310 15.999 > 21 23 O 0.36465897583123 0.89590286902976 0.05437602588310 15.999 > 21 24 O 0.86465897583123 0.89590286902976 0.05437602588310 15.999 > 21 25 O 0.17726589774579 0.48540751608492 0.25158745686714 15.999 > 25 26 O 0.67726589774579 0.48540751608492 0.25158745686714 15.999 > 25 27 O 0.17726589774579 0.98540751608492 0.25158745686714 15.999 > 25 28 O 0.67726589774579 0.98540751608492 0.25158745686714 15.999 > 25 29 O 0.32273410225421 0.23540751608492 0.24841254313286 15.999 > 29 30 O 0.82273410225421 0.23540751608492 0.24841254313286 15.999 > 29 31 O 0.32273410225421 0.73540751608492 0.24841254313286 15.999 > 29 32 O 0.82273410225421 0.73540751608492 0.24841254313286 15.999 > 29 33 O 0.07246006280447 0.34345725695317 0.95093949700658 15.999 > 33 34 O 0.57246006280447 0.34345725695317 0.95093949700658 15.999 > 33 35 O 0.07246006280447 0.84345725695317 0.95093949700658 15.999 > 33 36 O 0.57246006280447 0.84345725695317 0.95093949700658 15.999 > 33 37 O 0.42753993719553 0.09345725695317 0.54906050299342 15.999 > 37 38 O 0.92753993719553 0.09345725695317 0.54906050299342 15.999 > 37 39 O 0.42753993719553 0.59345725695317 0.54906050299342 15.999 > 37 40 O 0.92753993719553 0.59345725695317 0.54906050299342 15.999 > 37 41 O 0.42753993719553 0.15654274304683 0.04906050299342 15.999 > 41 42 O 0.92753993719553 0.15654274304683 0.04906050299342 15.999 > 41 43 O 0.42753993719553 0.65654274304683 0.04906050299342 15.999 > 41 44 O 0.92753993719553 0.65654274304683 0.04906050299342 15.999 > 41 45 O 0.07246006280447 0.40654274304683 0.45093949700658 15.999 > 45 46 O 0.57246006280447 0.40654274304683 0.45093949700658 15.999 > 45 47 O 0.07246006280447 0.90654274304683 0.45093949700658 15.999 > 45 48 O 0.57246006280447 0.90654274304683 0.45093949700658 15.999 > 45 49 O 0.17726589774579 0.26459248391508 0.75158745686714 15.999 > 49 50 O 0.67726589774579 0.26459248391508 0.75158745686714 15.999 > 49 51 O 0.17726589774579 0.76459248391508 0.75158745686714 15.999 > 49 52 O 0.67726589774579 0.76459248391508 0.75158745686714 15.999 > 49 53 O 0.32273410225421 0.01459248391508 0.74841254313286 15.999 > 53 54 O 0.82273410225421 0.01459248391508 0.74841254313286 15.999 > 53 55 O 0.32273410225421 0.51459248391508 0.74841254313286 15.999 > 53 56 O 0.82273410225421 0.51459248391508 0.74841254313286 15.999 > 53 57 Sm 0.11281580787521 0.46031952616111 0.74740879253808 150.360 > 57 58 Sm 0.61281580787521 0.46031952616111 0.74740879253808 150.360 > 57 59 Sm 0.11281580787521 0.96031952616111 0.74740879253808 150.360 > 57 60 Sm 0.61281580787521 0.96031952616111 0.74740879253808 150.360 > 57 61 Sm 0.38718419212479 0.21031952616111 0.75259120746192 150.360 > 61 62 Sm 0.88718419212479 0.21031952616111 0.75259120746192 150.360 > 61 63 Sm 0.38718419212479 0.71031952616111 0.75259120746192 150.360 > 61 64 Sm 0.88718419212479 0.71031952616111 0.75259120746192 150.360 > 61 65 Sm 0.11281580787521 0.28968047383889 0.24740879253808 150.360 > 65 66 Sm 0.61281580787521 0.28968047383889 0.24740879253808 150.360 > 65 67 Sm 0.11281580787521 0.78968047383889 0.24740879253808 150.360 > 65 68 Sm 0.61281580787521 0.78968047383889 0.24740879253808 150.360 > 65 69 Sm 0.38718419212479 0.03968047383889 0.25259120746192 150.360 > 69 70 Sm 0.88718419212479 0.03968047383889 0.25259120746192 150.360 > 69 71 Sm 0.38718419212479 0.53968047383889 0.25259120746192 150.360 > 69 72 Sm 0.88718419212479 0.53968047383889 0.25259120746192 150.360 > 69 73 Os 0.25000000000000 0.25000000000000 0.00000000000000 190.230 > 73 74 Os 0.75000000000000 0.25000000000000 0.00000000000000 190.230 > 73 75 Os 0.25000000000000 0.75000000000000 0.00000000000000 190.230 > 73 76 Os 0.75000000000000 0.75000000000000 0.00000000000000 190.230 > 73 77 Os 0.25000000000000 0.00000000000000 0.50000000000000 190.230 > 77 78 Os 0.75000000000000 0.00000000000000 0.50000000000000 190.230 > 77 79 Os 0.25000000000000 0.50000000000000 0.50000000000000 190.230 > 77 80 Os 0.75000000000000 0.50000000000000 0.50000000000000 190.230 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 191.8604536 0.0000000 157.0463460 0.0000000 978.7267600 0.0000000 157.0453822 0.0000000 340.4075957 -------------------------- Born effective charges -------------------------- 1 Li 1.4694750 -0.3042147 -0.4097176 0.9416031 1.8103257 -1.0383179 0.7879426 -0.0539138 1.1440826 2 Li 1.4694750 0.3042147 -0.4097176 -0.9416031 1.8103257 1.0383179 0.7879426 0.0539138 1.1440826 3 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 4 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 5 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 6 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 7 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 8 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 9 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 10 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 11 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 12 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 13 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 14 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 15 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 16 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 17 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 18 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 19 Os 3.4052490 4.5115626 -0.3985152 8.5724392 13.7914484 -2.3855178 1.8225764 3.5782459 3.5283307 20 Os 3.4052490 -4.5115626 -0.3985152 -8.5724392 13.7914484 2.3855178 1.8225764 -3.5782459 3.5283307 ---------------------------------------------------------------------------- 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 9, 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 57, 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000010 (zzz) -0.00000010 (zzz) -0.00000010 (zzz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000061 (yx) 0.00000061 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:05:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:05:31]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.295213240000289 0.000000000000000 0.000000000000000 b 0.000000000000000 5.744657780000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): 1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 2 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 3 O 0.72931795166246 0.70819426194047 0.55437602588310 15.999 4 O 0.27068204833755 0.20819426194047 0.94562397411690 15.999 5 O 0.27068204833755 0.29180573805953 0.44562397411690 15.999 6 O 0.72931795166246 0.79180573805953 0.05437602588310 15.999 7 O 0.35453179549158 0.97081503216984 0.25158745686714 15.999 8 O 0.64546820450842 0.47081503216984 0.24841254313286 15.999 9 O 0.14492012560893 0.68691451390634 0.95093949700658 15.999 10 O 0.85507987439107 0.18691451390634 0.54906050299342 15.999 11 O 0.85507987439107 0.31308548609366 0.04906050299342 15.999 12 O 0.14492012560893 0.81308548609366 0.45093949700658 15.999 13 O 0.35453179549158 0.52918496783016 0.75158745686714 15.999 14 O 0.64546820450842 0.02918496783016 0.74841254313286 15.999 15 Sm 0.22563161575041 0.92063905232223 0.74740879253808 150.360 16 Sm 0.77436838424959 0.42063905232223 0.75259120746192 150.360 17 Sm 0.22563161575041 0.57936094767777 0.24740879253808 150.360 18 Sm 0.77436838424959 0.07936094767777 0.25259120746192 150.360 19 Os 0.50000000000000 0.50000000000000 0.00000000000000 190.230 20 Os 0.50000000000000 0.00000000000000 0.50000000000000 190.230 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.590426480000579 0.000000000000000 0.000000000000000 b 0.000000000000000 11.489315560000000 0.000000000000000 c -5.167747687676619 0.000000000000000 7.571621367874685 Atomic positions (fractional): 1 Li 0.00000000000000 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.00000000000000 0.00000000000000 6.941 > 1 3 Li 0.00000000000000 0.50000000000000 0.00000000000000 6.941 > 1 4 Li 0.50000000000000 0.50000000000000 0.00000000000000 6.941 > 1 5 Li 0.00000000000000 0.25000000000000 0.50000000000000 6.941 > 5 6 Li 0.50000000000000 0.25000000000000 0.50000000000000 6.941 > 5 7 Li 0.00000000000000 0.75000000000000 0.50000000000000 6.941 > 5 8 Li 0.50000000000000 0.75000000000000 0.50000000000000 6.941 > 5 9 O 0.36465897583123 0.35409713097024 0.55437602588310 15.999 > 9 10 O 0.86465897583123 0.35409713097024 0.55437602588310 15.999 > 9 11 O 0.36465897583123 0.85409713097024 0.55437602588310 15.999 > 9 12 O 0.86465897583123 0.85409713097024 0.55437602588310 15.999 > 9 13 O 0.13534102416877 0.10409713097024 0.94562397411690 15.999 > 13 14 O 0.63534102416877 0.10409713097024 0.94562397411690 15.999 > 13 15 O 0.13534102416877 0.60409713097024 0.94562397411690 15.999 > 13 16 O 0.63534102416877 0.60409713097024 0.94562397411690 15.999 > 13 17 O 0.13534102416877 0.14590286902976 0.44562397411690 15.999 > 17 18 O 0.63534102416877 0.14590286902976 0.44562397411690 15.999 > 17 19 O 0.13534102416877 0.64590286902976 0.44562397411690 15.999 > 17 20 O 0.63534102416877 0.64590286902976 0.44562397411690 15.999 > 17 21 O 0.36465897583123 0.39590286902976 0.05437602588310 15.999 > 21 22 O 0.86465897583123 0.39590286902976 0.05437602588310 15.999 > 21 23 O 0.36465897583123 0.89590286902976 0.05437602588310 15.999 > 21 24 O 0.86465897583123 0.89590286902976 0.05437602588310 15.999 > 21 25 O 0.17726589774579 0.48540751608492 0.25158745686714 15.999 > 25 26 O 0.67726589774579 0.48540751608492 0.25158745686714 15.999 > 25 27 O 0.17726589774579 0.98540751608492 0.25158745686714 15.999 > 25 28 O 0.67726589774579 0.98540751608492 0.25158745686714 15.999 > 25 29 O 0.32273410225421 0.23540751608492 0.24841254313286 15.999 > 29 30 O 0.82273410225421 0.23540751608492 0.24841254313286 15.999 > 29 31 O 0.32273410225421 0.73540751608492 0.24841254313286 15.999 > 29 32 O 0.82273410225421 0.73540751608492 0.24841254313286 15.999 > 29 33 O 0.07246006280447 0.34345725695317 0.95093949700658 15.999 > 33 34 O 0.57246006280447 0.34345725695317 0.95093949700658 15.999 > 33 35 O 0.07246006280447 0.84345725695317 0.95093949700658 15.999 > 33 36 O 0.57246006280447 0.84345725695317 0.95093949700658 15.999 > 33 37 O 0.42753993719553 0.09345725695317 0.54906050299342 15.999 > 37 38 O 0.92753993719553 0.09345725695317 0.54906050299342 15.999 > 37 39 O 0.42753993719553 0.59345725695317 0.54906050299342 15.999 > 37 40 O 0.92753993719553 0.59345725695317 0.54906050299342 15.999 > 37 41 O 0.42753993719553 0.15654274304683 0.04906050299342 15.999 > 41 42 O 0.92753993719553 0.15654274304683 0.04906050299342 15.999 > 41 43 O 0.42753993719553 0.65654274304683 0.04906050299342 15.999 > 41 44 O 0.92753993719553 0.65654274304683 0.04906050299342 15.999 > 41 45 O 0.07246006280447 0.40654274304683 0.45093949700658 15.999 > 45 46 O 0.57246006280447 0.40654274304683 0.45093949700658 15.999 > 45 47 O 0.07246006280447 0.90654274304683 0.45093949700658 15.999 > 45 48 O 0.57246006280447 0.90654274304683 0.45093949700658 15.999 > 45 49 O 0.17726589774579 0.26459248391508 0.75158745686714 15.999 > 49 50 O 0.67726589774579 0.26459248391508 0.75158745686714 15.999 > 49 51 O 0.17726589774579 0.76459248391508 0.75158745686714 15.999 > 49 52 O 0.67726589774579 0.76459248391508 0.75158745686714 15.999 > 49 53 O 0.32273410225421 0.01459248391508 0.74841254313286 15.999 > 53 54 O 0.82273410225421 0.01459248391508 0.74841254313286 15.999 > 53 55 O 0.32273410225421 0.51459248391508 0.74841254313286 15.999 > 53 56 O 0.82273410225421 0.51459248391508 0.74841254313286 15.999 > 53 57 Sm 0.11281580787521 0.46031952616111 0.74740879253808 150.360 > 57 58 Sm 0.61281580787521 0.46031952616111 0.74740879253808 150.360 > 57 59 Sm 0.11281580787521 0.96031952616111 0.74740879253808 150.360 > 57 60 Sm 0.61281580787521 0.96031952616111 0.74740879253808 150.360 > 57 61 Sm 0.38718419212479 0.21031952616111 0.75259120746192 150.360 > 61 62 Sm 0.88718419212479 0.21031952616111 0.75259120746192 150.360 > 61 63 Sm 0.38718419212479 0.71031952616111 0.75259120746192 150.360 > 61 64 Sm 0.88718419212479 0.71031952616111 0.75259120746192 150.360 > 61 65 Sm 0.11281580787521 0.28968047383889 0.24740879253808 150.360 > 65 66 Sm 0.61281580787521 0.28968047383889 0.24740879253808 150.360 > 65 67 Sm 0.11281580787521 0.78968047383889 0.24740879253808 150.360 > 65 68 Sm 0.61281580787521 0.78968047383889 0.24740879253808 150.360 > 65 69 Sm 0.38718419212479 0.03968047383889 0.25259120746192 150.360 > 69 70 Sm 0.88718419212479 0.03968047383889 0.25259120746192 150.360 > 69 71 Sm 0.38718419212479 0.53968047383889 0.25259120746192 150.360 > 69 72 Sm 0.88718419212479 0.53968047383889 0.25259120746192 150.360 > 69 73 Os 0.25000000000000 0.25000000000000 0.00000000000000 190.230 > 73 74 Os 0.75000000000000 0.25000000000000 0.00000000000000 190.230 > 73 75 Os 0.25000000000000 0.75000000000000 0.00000000000000 190.230 > 73 76 Os 0.75000000000000 0.75000000000000 0.00000000000000 190.230 > 73 77 Os 0.25000000000000 0.00000000000000 0.50000000000000 190.230 > 77 78 Os 0.75000000000000 0.00000000000000 0.50000000000000 190.230 > 77 79 Os 0.25000000000000 0.50000000000000 0.50000000000000 190.230 > 77 80 Os 0.75000000000000 0.50000000000000 0.50000000000000 190.230 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 191.8604536 0.0000000 157.0463460 0.0000000 978.7267600 0.0000000 157.0453822 0.0000000 340.4075957 -------------------------- Born effective charges -------------------------- 1 Li 1.4694750 -0.3042147 -0.4097176 0.9416031 1.8103257 -1.0383179 0.7879426 -0.0539138 1.1440826 2 Li 1.4694750 0.3042147 -0.4097176 -0.9416031 1.8103257 1.0383179 0.7879426 0.0539138 1.1440826 3 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 4 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 5 O -1.8956470 1.5154483 -0.7288598 4.9895711 -1.7697898 -3.8099601 -1.4284792 1.4706491 0.2455153 6 O -1.8956470 -1.5154483 -0.7288598 -4.9895711 -1.7697898 3.8099601 -1.4284792 -1.4706491 0.2455153 7 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 8 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 9 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 10 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 11 O -2.5473402 0.0619410 -0.1907177 -3.7981078 -3.0466744 -1.7226715 -0.8937347 -0.6450664 -1.8586205 12 O -2.5473402 -0.0619410 -0.1907177 3.7981078 -3.0466744 1.7226715 -0.8937347 0.6450664 -1.8586205 13 O -2.0765113 0.1591181 1.1372775 3.4513733 -6.4465792 -1.0536244 -0.4980369 -0.1358151 -2.1097633 14 O -2.0765113 -0.1591181 1.1372775 -3.4513733 -6.4465792 1.0536244 -0.4980369 0.1358151 -2.1097633 15 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 16 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 17 Sm 4.0821365 -1.2313191 0.1864165 0.1514230 3.4621564 0.5200506 1.5149913 -0.6270470 1.3866620 18 Sm 4.0821365 1.2313191 0.1864165 -0.1514230 3.4621564 -0.5200506 1.5149913 0.6270470 1.3866620 19 Os 3.4052490 4.5115626 -0.3985152 8.5724392 13.7914484 -2.3855178 1.8225764 3.5782459 3.5283307 20 Os 3.4052490 -4.5115626 -0.3985152 -8.5724392 13.7914484 2.3855178 1.8225764 -3.5782459 3.5283307 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000010 (zzz) -0.00000010 (zzz) -0.00000010 (zzz) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 9 7 ] 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: 0.68, Number of G-points: 303, Lambda: 1.58 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/195) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 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 2.168 ( 0.000 0.000 0.000) 0.000 2.799 ( 0.000 0.000 0.000) 0.000 2.812 ( 0.000 0.000 0.000) 0.000 3.083 ( 0.000 0.000 0.000) 0.000 3.113 ( 0.000 0.000 0.000) 0.000 3.512 ( 0.000 0.000 0.000) 0.000 3.643 ( 0.000 0.000 0.000) 0.000 3.960 ( 0.000 0.000 0.000) 0.000 4.048 ( 0.000 0.000 0.000) 0.000 4.200 ( 0.000 0.000 0.000) 0.000 4.336 ( 0.000 0.000 0.000) 0.000 4.450 ( 0.000 0.000 0.000) 0.000 4.452 ( 0.000 0.000 0.000) 0.000 5.000 ( 0.000 0.000 0.000) 0.000 5.230 ( 0.000 0.000 0.000) 0.000 7.290 ( 0.000 0.000 0.000) 0.000 7.411 ( 0.000 0.000 0.000) 0.000 7.546 ( 0.000 0.000 0.000) 0.000 8.055 ( 0.000 0.000 0.000) 0.000 8.127 ( 0.000 0.000 0.000) 0.000 8.505 ( 0.000 0.000 0.000) 0.000 8.583 ( 0.000 0.000 0.000) 0.000 8.615 ( 0.000 0.000 0.000) 0.000 8.738 ( 0.000 0.000 0.000) 0.000 8.942 ( 0.000 0.000 0.000) 0.000 9.105 ( 0.000 0.000 0.000) 0.000 9.360 ( 0.000 0.000 0.000) 0.000 9.664 ( 0.000 0.000 0.000) 0.000 9.811 ( 0.000 0.000 0.000) 0.000 9.979 ( 0.000 0.000 0.000) 0.000 10.267 ( 0.000 0.000 0.000) 0.000 10.380 ( 0.000 0.000 0.000) 0.000 10.744 ( 0.000 0.000 0.000) 0.000 10.775 ( 0.000 0.000 0.000) 0.000 10.962 ( 0.000 0.000 0.000) 0.000 11.546 ( 0.000 0.000 0.000) 0.000 11.713 ( 0.000 0.000 0.000) 0.000 12.221 ( 0.000 0.000 0.000) 0.000 12.308 ( 0.000 0.000 0.000) 0.000 12.535 ( 0.000 0.000 0.000) 0.000 12.747 ( 0.000 0.000 0.000) 0.000 13.600 ( 0.000 0.000 0.000) 0.000 13.813 ( 0.000 0.000 0.000) 0.000 14.152 ( 0.000 0.000 0.000) 0.000 14.191 ( 0.000 0.000 0.000) 0.000 14.407 ( 0.000 0.000 0.000) 0.000 15.459 ( 0.000 0.000 0.000) 0.000 16.031 ( 0.000 0.000 0.000) 0.000 16.705 ( 0.000 0.000 0.000) 0.000 16.765 ( 0.000 0.000 0.000) 0.000 16.847 ( 0.000 0.000 0.000) 0.000 16.923 ( 0.000 0.000 0.000) 0.000 17.362 ( 0.000 0.000 0.000) 0.000 17.698 ( 0.000 0.000 0.000) 0.000 18.129 ( 0.000 0.000 0.000) 0.000 18.390 ( 0.000 0.000 0.000) 0.000 20.806 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/195) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.446 ( 20.452 0.000 7.948) 21.943 0.533 ( 18.471 0.000 18.497) 26.140 0.974 ( 37.734 0.000 24.529) 45.006 2.290 ( 9.354 0.000 5.041) 10.626 2.732 ( -9.613 0.000 1.459) 9.723 2.795 ( -0.151 0.000 -0.312) 0.347 2.904 ( -4.513 0.000 -11.151) 12.030 3.244 ( 1.758 0.000 4.577) 4.903 3.455 ( -3.241 0.000 -4.373) 5.444 3.587 ( -6.342 0.000 0.778) 6.390 3.858 ( -6.861 0.000 -4.355) 8.127 4.116 ( 3.042 0.000 -1.035) 3.214 4.221 ( -0.972 0.000 2.880) 3.040 4.286 ( 0.956 0.000 -5.795) 5.874 4.432 ( -2.492 0.000 0.275) 2.507 4.508 ( 2.071 0.000 3.633) 4.182 5.001 ( -0.564 0.000 1.170) 1.299 5.205 ( -2.178 0.000 -0.677) 2.280 7.167 ( -10.867 0.000 -2.282) 11.105 7.310 ( -10.519 0.000 -0.573) 10.535 7.529 ( 0.644 0.000 -3.948) 4.001 8.038 ( -7.629 0.000 -1.240) 7.729 8.119 ( 1.908 0.000 6.702) 6.968 8.468 ( 0.188 0.000 -6.911) 6.914 8.531 ( -6.821 0.000 3.205) 7.536 8.635 ( 6.360 0.000 -6.282) 8.940 8.884 ( 15.092 0.000 -3.631) 15.522 8.901 ( 1.542 0.000 -1.230) 1.972 9.273 ( 8.207 0.000 4.290) 9.260 9.474 ( 8.463 0.000 8.401) 11.925 9.745 ( 1.273 0.000 9.060) 9.149 9.870 ( 1.599 0.000 3.585) 3.926 10.014 ( 1.998 0.000 -1.518) 2.509 10.159 ( -8.493 0.000 -1.699) 8.662 10.327 ( -2.893 0.000 -3.324) 4.406 10.696 ( -0.730 0.000 -6.011) 6.055 10.872 ( 4.305 0.000 6.571) 7.856 10.983 ( 1.088 0.000 0.292) 1.127 11.558 ( -1.776 0.000 1.548) 2.356 11.764 ( 3.216 0.000 1.391) 3.504 12.147 ( -5.197 0.000 -4.540) 6.900 12.348 ( 1.145 0.000 4.100) 4.257 12.537 ( 2.298 0.000 -2.436) 3.349 12.750 ( -1.420 0.000 1.265) 1.902 13.587 ( -0.340 0.000 -1.552) 1.588 13.802 ( -0.687 0.000 -0.972) 1.191 14.113 ( -9.515 0.000 4.693) 10.610 14.125 ( -1.785 0.000 -1.962) 2.652 14.535 ( 14.602 0.000 -3.491) 15.014 15.553 ( 6.650 0.000 5.088) 8.374 16.003 ( -3.314 0.000 0.344) 3.331 16.617 ( -5.195 0.000 -3.291) 6.150 16.778 ( -1.072 0.000 0.244) 1.100 16.889 ( -0.283 0.000 3.645) 3.656 16.923 ( -1.002 0.000 0.090) 1.006 17.323 ( 1.249 0.000 -9.986) 10.063 17.699 ( 0.844 0.000 -0.691) 1.091 17.987 ( 7.847 0.000 -22.961) 24.265 18.617 ( -0.745 0.000 28.263) 28.272 20.727 ( -5.686 0.000 -4.882) 7.494 ======================= Grid point 2 (3/195) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.881 ( 19.273 0.000 7.526) 20.690 1.067 ( 18.631 0.000 18.147) 26.008 1.823 ( 29.951 0.000 18.439) 35.172 2.452 ( -0.170 0.000 -6.218) 6.220 2.629 ( -3.764 0.000 12.050) 12.624 2.696 ( -4.023 0.000 -11.183) 11.885 2.804 ( 0.544 0.000 4.386) 4.419 3.193 ( -9.821 0.000 -3.119) 10.305 3.313 ( -4.770 0.000 -7.524) 8.908 3.512 ( -3.385 0.000 3.185) 4.648 3.671 ( -8.547 0.000 -3.438) 9.212 4.140 ( -3.340 0.000 -7.603) 8.304 4.154 ( 2.949 0.000 -0.673) 3.025 4.326 ( 0.199 0.000 7.050) 7.053 4.395 ( -2.894 0.000 2.127) 3.591 4.559 ( 2.214 0.000 -2.326) 3.211 5.013 ( -0.341 0.000 2.423) 2.447 5.162 ( -2.155 0.000 0.816) 2.305 6.931 ( -12.080 0.000 -2.424) 12.321 7.084 ( -13.870 0.000 -0.053) 13.870 7.464 ( -0.850 0.000 -7.087) 7.138 7.877 ( -5.641 0.000 -6.102) 8.309 8.257 ( 3.010 0.000 9.243) 9.720 8.392 ( 0.424 0.000 -4.996) 5.014 8.503 ( -4.275 0.000 8.905) 9.878 8.660 ( 3.866 0.000 -4.226) 5.727 8.951 ( 3.670 0.000 0.114) 3.672 9.096 ( 14.818 0.000 -6.510) 16.185 9.360 ( -1.448 0.000 -1.654) 2.198 9.820 ( 17.119 0.000 9.973) 19.812 9.849 ( -2.234 0.000 5.618) 6.046 9.926 ( 0.335 0.000 4.929) 4.941 10.020 ( 0.485 0.000 -2.958) 2.998 10.071 ( -1.289 0.000 5.209) 5.366 10.221 ( -4.068 0.000 -3.414) 5.311 10.634 ( 1.595 0.000 -5.811) 6.026 10.990 ( 0.563 0.000 0.282) 0.630 11.025 ( 3.356 0.000 7.655) 8.359 11.634 ( 5.315 0.000 7.196) 8.946 11.832 ( 1.741 0.000 2.956) 3.430 11.959 ( -7.766 0.000 -7.361) 10.701 12.415 ( 0.221 0.000 4.350) 4.356 12.546 ( 1.632 0.000 -4.184) 4.491 12.714 ( -3.167 0.000 1.055) 3.338 13.558 ( -0.062 0.000 -2.647) 2.648 13.773 ( -0.855 0.000 -1.567) 1.785 14.018 ( -7.116 0.000 4.078) 8.201 14.049 ( -3.082 0.000 -3.610) 4.747 14.789 ( 17.422 0.000 -0.511) 17.429 15.758 ( 8.962 0.000 4.620) 10.083 15.937 ( -3.807 0.000 -0.817) 3.894 16.494 ( -5.988 0.000 -0.485) 6.008 16.729 ( -6.081 0.000 1.060) 6.172 16.891 ( -3.534 0.000 2.426) 4.286 16.933 ( 1.063 0.000 2.487) 2.704 17.150 ( -0.140 0.000 -20.087) 20.087 17.726 ( 3.560 0.000 -0.179) 3.565 17.947 ( 11.923 0.000 -13.990) 18.381 18.940 ( 0.494 0.000 26.115) 26.120 20.507 ( -10.178 0.000 -8.867) 13.499 ======================= Grid point 3 (4/195) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( 14.845 0.000 5.971) 16.001 1.589 ( 17.603 0.000 16.821) 24.347 2.298 ( -6.632 0.000 -0.894) 6.692 2.335 ( 11.842 0.000 1.903) 11.994 2.532 ( -0.531 0.000 -7.601) 7.620 2.655 ( -2.382 0.000 -0.684) 2.479 2.941 ( -12.851 0.000 -0.807) 12.876 2.968 ( -0.779 0.000 13.155) 13.178 3.142 ( -1.096 0.000 -7.870) 7.946 3.474 ( -7.729 0.000 -0.304) 7.735 3.550 ( 0.271 0.000 2.031) 2.049 3.949 ( -7.022 0.000 -10.048) 12.259 4.228 ( 6.138 0.000 1.054) 6.228 4.392 ( -1.932 0.000 4.396) 4.802 4.400 ( -2.214 0.000 6.277) 6.656 4.540 ( 2.111 0.000 -4.476) 4.949 5.049 ( 0.574 0.000 3.200) 3.252 5.165 ( 0.206 0.000 2.398) 2.407 6.715 ( -9.747 0.000 -2.370) 10.031 6.864 ( -11.395 0.000 0.048) 11.395 7.343 ( -2.147 0.000 -8.271) 8.545 7.723 ( -3.158 0.000 -6.333) 7.076 8.373 ( 1.630 0.000 -1.248) 2.053 8.429 ( 2.790 0.000 10.230) 10.603 8.584 ( -0.270 0.000 10.789) 10.792 8.675 ( 2.119 0.000 -1.738) 2.740 9.013 ( 3.634 0.000 -0.354) 3.651 9.191 ( 4.128 0.000 -6.468) 7.673 9.228 ( -6.641 0.000 -4.554) 8.052 9.724 ( -9.133 0.000 -6.709) 11.332 9.967 ( 1.998 0.000 -0.960) 2.217 10.070 ( -5.540 0.000 -0.566) 5.569 10.085 ( 3.414 0.000 7.573) 8.307 10.226 ( 14.259 0.000 7.331) 16.034 10.290 ( 12.499 0.000 8.880) 15.332 10.559 ( -0.900 0.000 -7.619) 7.672 11.034 ( 3.128 0.000 -0.369) 3.150 11.162 ( 2.652 0.000 7.131) 7.609 11.732 ( -7.495 0.000 -7.938) 10.917 11.877 ( 3.154 0.000 10.416) 10.883 11.917 ( 8.233 0.000 6.704) 10.617 12.428 ( -8.480 0.000 -4.750) 9.720 12.442 ( -1.871 0.000 2.601) 3.205 12.735 ( 3.768 0.000 0.973) 3.892 13.519 ( -0.339 0.000 -3.726) 3.742 13.741 ( -0.870 0.000 -0.920) 1.266 13.938 ( -4.003 0.000 -4.893) 6.322 13.966 ( -3.858 0.000 2.863) 4.805 15.112 ( 18.469 0.000 2.430) 18.628 15.861 ( -2.470 0.000 -2.510) 3.521 15.922 ( 6.377 0.000 -0.119) 6.378 16.411 ( -5.965 0.000 3.872) 7.112 16.594 ( -9.989 0.000 -0.100) 9.989 16.832 ( -5.108 0.000 0.527) 5.135 16.894 ( 0.182 0.000 -21.905) 21.906 17.007 ( 1.421 0.000 5.092) 5.286 17.843 ( 8.621 0.000 3.095) 9.159 18.023 ( 10.751 0.000 -7.819) 13.293 19.229 ( 1.118 0.000 20.385) 20.415 20.189 ( -12.523 0.000 -11.149) 16.767 ======================= Grid point 4 (5/195) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( 7.041 0.000 4.301) 8.251 1.995 ( 7.660 0.000 10.475) 12.977 2.321 ( 8.001 0.000 6.172) 10.105 2.331 ( 0.739 0.000 -9.855) 9.883 2.464 ( -1.815 0.000 -5.927) 6.199 2.594 ( -2.508 0.000 0.641) 2.589 2.810 ( -5.469 0.000 6.014) 8.128 2.853 ( -9.756 0.000 -4.420) 10.711 3.235 ( 3.424 0.000 6.769) 7.586 3.311 ( -8.415 0.000 -2.894) 8.899 3.644 ( 3.956 0.000 4.000) 5.626 3.658 ( -11.158 0.000 -12.925) 17.075 4.375 ( -2.151 0.000 -1.286) 2.506 4.382 ( 6.941 0.000 2.598) 7.411 4.432 ( 0.655 0.000 5.550) 5.589 4.573 ( 1.865 0.000 2.365) 3.012 5.101 ( 1.035 0.000 2.881) 3.061 5.208 ( 1.435 0.000 1.790) 2.294 6.545 ( -6.733 0.000 -2.237) 7.094 6.698 ( -7.561 0.000 -0.629) 7.587 7.223 ( -1.374 0.000 -6.230) 6.380 7.637 ( 0.169 0.000 -3.700) 3.703 8.394 ( 1.747 0.000 -0.474) 1.810 8.577 ( 0.187 0.000 9.621) 9.622 8.684 ( 2.960 0.000 -1.860) 3.496 8.743 ( 0.747 0.000 12.750) 12.772 9.040 ( -2.937 0.000 0.523) 2.984 9.087 ( -7.219 0.000 -4.880) 8.714 9.117 ( 2.817 0.000 -4.653) 5.439 9.485 ( -5.129 0.000 -11.145) 12.269 9.978 ( -3.555 0.000 -0.753) 3.634 9.982 ( 0.139 0.000 -0.319) 0.348 10.212 ( 0.940 0.000 4.520) 4.617 10.468 ( 6.745 0.000 5.533) 8.724 10.501 ( 4.135 0.000 -3.518) 5.429 10.656 ( 13.782 0.000 8.091) 15.981 11.041 ( -0.142 0.000 -3.015) 3.019 11.295 ( 5.415 0.000 4.411) 6.984 11.545 ( -4.504 0.000 -5.164) 6.852 11.964 ( 1.508 0.000 4.462) 4.710 12.195 ( -12.251 0.000 -3.199) 12.661 12.210 ( 6.891 0.000 8.187) 10.701 12.438 ( -0.417 0.000 3.461) 3.486 12.828 ( 5.151 0.000 0.892) 5.228 13.456 ( -1.339 0.000 -4.473) 4.669 13.733 ( -0.204 0.000 1.496) 1.509 13.807 ( -4.027 0.000 -4.772) 6.244 13.938 ( -2.050 0.000 0.277) 2.069 15.466 ( 18.248 0.000 3.714) 18.622 15.800 ( -1.256 0.000 -2.190) 2.525 15.981 ( 3.105 0.000 -2.671) 4.096 16.375 ( -4.468 0.000 4.676) 6.468 16.390 ( -12.670 0.000 -1.475) 12.755 16.678 ( 1.645 0.000 -16.155) 16.238 16.739 ( -5.266 0.000 -0.736) 5.317 17.074 ( -0.013 0.000 3.807) 3.807 18.082 ( 11.286 0.000 6.500) 13.024 18.110 ( 7.139 0.000 -3.958) 8.162 19.446 ( 1.084 0.000 12.966) 13.011 19.843 ( -11.821 0.000 -10.741) 15.972 ======================= Grid point 5 (6/195) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( 2.765 0.000 3.367) 4.357 2.158 ( 2.778 0.000 5.551) 6.208 2.199 ( -2.519 0.000 -6.826) 7.276 2.379 ( -1.118 0.000 -2.263) 2.524 2.435 ( 0.939 0.000 -3.833) 3.946 2.655 ( -5.964 0.000 -2.483) 6.460 2.799 ( 13.161 0.000 14.943) 19.913 2.889 ( 4.066 0.000 6.585) 7.739 3.123 ( -7.460 0.000 -4.650) 8.791 3.248 ( -11.796 0.000 -10.909) 16.067 3.349 ( -1.533 0.000 -0.966) 1.812 3.727 ( 1.546 0.000 1.354) 2.055 4.339 ( -0.437 0.000 -0.861) 0.965 4.447 ( 0.297 0.000 1.610) 1.637 4.553 ( 3.527 0.000 2.367) 4.247 4.620 ( 0.592 0.000 1.431) 1.549 5.141 ( 0.527 0.000 1.239) 1.347 5.243 ( 0.746 0.000 0.587) 0.949 6.443 ( -2.511 0.000 -0.982) 2.696 6.599 ( -2.798 0.000 -0.519) 2.846 7.158 ( -0.315 0.000 -2.266) 2.287 7.627 ( 1.035 0.000 -1.021) 1.454 8.413 ( 0.719 0.000 -0.147) 0.734 8.652 ( -0.628 0.000 4.015) 4.064 8.713 ( 1.946 0.000 -0.292) 1.967 8.906 ( 1.098 0.000 4.025) 4.172 8.909 ( -5.288 0.000 2.349) 5.787 8.988 ( -1.866 0.000 0.174) 1.874 9.145 ( 2.686 0.000 -1.812) 3.240 9.298 ( -2.338 0.000 -8.305) 8.627 9.936 ( -1.030 0.000 -0.070) 1.032 9.968 ( -0.836 0.000 -0.121) 0.845 10.230 ( -0.094 0.000 -0.091) 0.130 10.580 ( 1.748 0.000 1.549) 2.335 10.590 ( 4.147 0.000 1.496) 4.408 10.885 ( 4.090 0.000 3.560) 5.422 10.983 ( -1.598 0.000 -2.373) 2.861 11.449 ( 8.432 0.000 -3.642) 9.185 11.474 ( -1.526 0.000 3.956) 4.240 11.966 ( -9.299 0.000 -1.408) 9.405 12.036 ( 1.460 0.000 2.306) 2.729 12.264 ( -1.347 0.000 -0.337) 1.388 12.542 ( 2.875 0.000 3.882) 4.831 12.911 ( 2.602 0.000 0.695) 2.693 13.383 ( -1.267 0.000 -2.664) 2.950 13.713 ( -1.714 0.000 -1.911) 2.567 13.767 ( 0.585 0.000 2.626) 2.691 13.898 ( -1.201 0.000 -1.709) 2.089 15.770 ( -0.389 0.000 -0.618) 0.730 15.812 ( 16.765 0.000 3.393) 17.104 15.987 ( 0.642 0.000 -1.256) 1.411 16.129 ( -14.535 0.000 -2.641) 14.773 16.351 ( -1.612 0.000 0.435) 1.670 16.598 ( 2.973 0.000 -4.459) 5.359 16.646 ( -4.295 0.000 -0.538) 4.328 17.100 ( -0.218 0.000 1.265) 1.284 18.165 ( 2.526 0.000 -1.146) 2.774 18.313 ( 5.922 0.000 4.060) 7.181 19.563 ( 0.472 0.000 4.476) 4.501 19.581 ( -5.754 0.000 -5.268) 7.801 ======================= Grid point 11 (7/195) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.454 ( 0.000 23.304 0.000) 23.304 0.638 ( 0.000 32.346 0.000) 32.346 0.762 ( 0.000 39.011 0.000) 39.011 2.174 ( 0.000 0.282 0.000) 0.282 2.783 ( 0.000 -3.159 0.000) 3.159 2.818 ( 0.000 0.247 0.000) 0.247 3.023 ( 0.000 -5.029 0.000) 5.029 3.095 ( 0.000 -1.383 0.000) 1.383 3.499 ( 0.000 -1.563 0.000) 1.563 3.620 ( 0.000 -2.288 0.000) 2.288 3.889 ( 0.000 -6.881 0.000) 6.881 4.056 ( 0.000 0.644 0.000) 0.644 4.206 ( 0.000 -0.213 0.000) 0.213 4.345 ( 0.000 -6.234 0.000) 6.234 4.386 ( 0.000 4.342 0.000) 4.342 4.509 ( 0.000 1.356 0.000) 1.356 4.987 ( 0.000 -1.306 0.000) 1.306 5.181 ( 0.000 -5.013 0.000) 5.013 7.272 ( 0.000 -1.957 0.000) 1.957 7.348 ( 0.000 -6.199 0.000) 6.199 7.512 ( 0.000 -3.165 0.000) 3.165 8.031 ( 0.000 -7.650 0.000) 7.650 8.141 ( 0.000 3.333 0.000) 3.333 8.501 ( 0.000 -6.614 0.000) 6.614 8.598 ( 0.000 1.306 0.000) 1.306 8.633 ( 0.000 1.090 0.000) 1.090 8.709 ( 0.000 -2.829 0.000) 2.829 8.870 ( 0.000 -6.806 0.000) 6.806 9.140 ( 0.000 2.819 0.000) 2.819 9.480 ( 0.000 2.948 0.000) 2.948 9.617 ( 0.000 -4.660 0.000) 4.660 9.839 ( 0.000 1.054 0.000) 1.054 9.975 ( 0.000 1.030 0.000) 1.030 10.331 ( 0.000 3.907 0.000) 3.907 10.368 ( 0.000 -0.657 0.000) 0.657 10.760 ( 0.000 -0.468 0.000) 0.468 10.798 ( 0.000 4.807 0.000) 4.807 10.929 ( 0.000 -3.445 0.000) 3.445 11.564 ( 0.000 1.763 0.000) 1.763 11.707 ( 0.000 0.152 0.000) 0.152 12.248 ( 0.000 -5.140 0.000) 5.140 12.400 ( 0.000 12.938 0.000) 12.938 12.516 ( 0.000 -2.003 0.000) 2.003 12.855 ( 0.000 3.860 0.000) 3.860 13.577 ( 0.000 -1.770 0.000) 1.770 13.854 ( 0.000 3.070 0.000) 3.070 14.135 ( 0.000 -5.066 0.000) 5.066 14.158 ( 0.000 -0.189 0.000) 0.189 14.499 ( 0.000 9.398 0.000) 9.398 15.449 ( 0.000 -0.927 0.000) 0.927 15.930 ( 0.000 -8.879 0.000) 8.879 16.603 ( 0.000 -6.899 0.000) 6.899 16.757 ( 0.000 -3.666 0.000) 3.666 16.855 ( 0.000 0.759 0.000) 0.759 16.980 ( 0.000 4.317 0.000) 4.317 17.327 ( 0.000 -3.649 0.000) 3.649 17.725 ( 0.000 2.748 0.000) 2.748 18.279 ( 0.000 14.778 0.000) 14.778 18.360 ( 0.000 -3.410 0.000) 3.410 20.742 ( 0.000 -6.491 0.000) 6.491 ======================= Grid point 12 (8/195) ======================= q-point: ( 0.09 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.700 ( 13.438 18.035 8.595) 24.077 0.735 ( 16.058 21.629 1.677) 26.991 1.234 ( 25.510 23.181 22.739) 41.293 2.290 ( 9.109 -0.076 4.600) 10.205 2.714 ( -5.938 -5.076 -3.020) 8.375 2.756 ( -4.084 0.133 -3.463) 5.356 2.912 ( -4.225 -0.085 -3.263) 5.339 3.202 ( 1.849 -3.437 5.203) 6.504 3.456 ( -2.724 -0.497 -3.286) 4.297 3.564 ( -6.351 -2.325 0.778) 6.808 3.794 ( -6.037 -6.249 -4.570) 9.818 4.097 ( 2.614 -0.466 0.870) 2.794 4.198 ( -3.692 -3.461 -6.492) 8.231 4.249 ( 0.045 -1.282 3.270) 3.512 4.472 ( 1.680 2.130 0.632) 2.785 4.507 ( -0.173 0.069 2.015) 2.024 4.989 ( -0.577 -1.209 1.480) 1.996 5.161 ( -1.664 -4.403 -0.509) 4.734 7.160 ( -10.356 -1.240 -1.905) 10.602 7.260 ( -9.075 -4.955 -0.660) 10.361 7.496 ( -0.161 -3.191 -2.864) 4.291 7.971 ( -5.461 -6.140 -1.222) 8.307 8.164 ( 0.217 3.178 5.126) 6.035 8.438 ( -5.934 -3.331 -7.446) 10.087 8.483 ( -2.829 -5.294 1.463) 6.178 8.647 ( 5.442 1.301 -4.331) 7.076 8.836 ( 11.447 -4.069 -4.619) 12.998 8.917 ( 4.852 -0.799 -0.027) 4.918 9.319 ( 12.310 1.816 6.138) 13.874 9.483 ( 0.969 0.203 2.143) 2.361 9.687 ( 0.723 -5.435 8.520) 10.132 9.913 ( 3.798 0.125 4.245) 5.697 9.970 ( -0.777 1.223 0.117) 1.453 10.234 ( -6.387 6.307 -0.164) 8.978 10.344 ( -1.866 1.052 -2.818) 3.540 10.711 ( -0.016 1.915 -5.725) 6.037 10.879 ( 1.259 0.068 6.820) 6.936 10.957 ( 3.129 -1.607 0.177) 3.522 11.555 ( -0.940 1.583 2.020) 2.733 11.734 ( 1.582 -1.592 0.964) 2.443 12.252 ( -3.482 1.008 -0.891) 3.733 12.318 ( -2.791 3.665 -0.139) 4.609 12.550 ( 4.026 1.480 -2.680) 5.058 12.844 ( -0.657 5.847 -0.347) 5.894 13.576 ( -0.171 -0.724 0.002) 0.744 13.840 ( -0.810 3.258 -1.205) 3.566 14.061 ( -8.083 -4.848 2.526) 9.758 14.133 ( -2.118 0.078 -1.576) 2.641 14.607 ( 12.176 7.784 -1.686) 14.549 15.536 ( 5.715 -1.542 4.862) 7.660 15.941 ( 0.716 -6.240 0.920) 6.348 16.494 ( -7.948 -7.507 -3.615) 11.515 16.772 ( 0.239 -4.615 1.422) 4.835 16.885 ( -2.160 -1.549 1.860) 3.244 16.915 ( -1.690 2.468 -2.456) 3.871 17.382 ( 7.906 2.294 -4.860) 9.560 17.725 ( 0.788 3.581 -2.397) 4.380 18.043 ( 2.652 5.460 -22.202) 23.017 18.635 ( -0.816 2.472 27.833) 27.955 20.663 ( -5.806 -6.487 -4.702) 9.895 ======================= Grid point 13 (9/195) ======================= q-point: ( 0.18 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( 18.006 14.712 4.052) 23.603 1.131 ( 14.739 7.088 15.495) 22.529 1.935 ( 24.809 10.491 16.819) 31.755 2.461 ( 2.234 0.686 -5.833) 6.283 2.567 ( -3.250 -7.279 -7.603) 11.016 2.653 ( -4.063 0.567 9.853) 10.673 2.847 ( -1.638 1.065 1.626) 2.542 3.162 ( -9.922 -2.643 -2.567) 10.584 3.350 ( -3.249 2.442 -4.780) 6.275 3.486 ( -3.600 -2.229 3.188) 5.300 3.622 ( -7.729 -5.039 -3.626) 9.914 4.028 ( -4.869 -7.979 -7.690) 12.104 4.153 ( 3.002 -0.185 0.567) 3.061 4.330 ( 0.367 0.265 7.358) 7.372 4.457 ( -1.777 3.696 0.323) 4.114 4.528 ( 0.923 -2.826 -2.352) 3.791 5.007 ( -0.036 -0.685 2.453) 2.547 5.128 ( -1.768 -3.444 0.795) 3.952 6.933 ( -11.820 -0.153 -2.512) 12.085 7.060 ( -12.400 -2.579 -0.309) 12.669 7.431 ( -1.717 -3.225 -5.735) 6.800 7.840 ( -4.583 -3.480 -5.695) 8.096 8.261 ( 1.784 -0.023 6.516) 6.756 8.302 ( -2.369 -7.442 -1.968) 8.054 8.479 ( -1.704 -3.851 4.925) 6.480 8.678 ( 3.168 2.071 -2.712) 4.656 8.908 ( 4.779 -5.200 -3.405) 7.840 9.071 ( 11.688 -1.046 -4.012) 12.401 9.421 ( -2.718 3.288 -0.789) 4.339 9.706 ( 11.495 -5.918 7.820) 15.110 9.798 ( 1.266 -4.844 6.606) 8.289 9.955 ( 0.527 -1.088 -1.328) 1.796 9.982 ( 1.878 0.475 3.045) 3.609 10.194 ( -4.421 4.637 1.275) 6.532 10.296 ( 2.243 9.946 1.939) 10.378 10.661 ( 1.689 2.822 -5.449) 6.364 10.920 ( -1.033 -4.724 2.857) 5.616 11.067 ( 4.686 1.939 5.072) 7.172 11.622 ( 3.006 -0.733 6.367) 7.080 11.762 ( 0.190 -2.415 0.945) 2.600 12.101 ( -5.865 8.821 -4.935) 11.685 12.300 ( -4.617 -8.217 1.537) 9.549 12.606 ( 6.067 4.601 -2.052) 7.886 12.826 ( -0.978 8.363 -0.147) 8.421 13.568 ( -0.597 1.046 -0.525) 1.313 13.800 ( -1.564 2.567 -2.045) 3.635 13.965 ( -6.186 -4.951 2.841) 8.418 14.056 ( -3.548 0.132 -3.075) 4.697 14.844 ( 15.660 6.026 0.788) 16.798 15.692 ( 4.613 -4.645 3.302) 7.332 15.990 ( 4.176 1.972 0.751) 4.679 16.303 ( -9.726 -11.733 -1.469) 15.310 16.751 ( -3.522 -2.262 -8.587) 9.553 16.779 ( -1.928 -6.729 1.568) 7.174 16.968 ( 1.520 2.988 5.868) 6.758 17.391 ( 0.749 17.427 -11.208) 20.734 17.688 ( 3.494 -3.070 -4.994) 6.825 17.952 ( 8.321 0.911 -10.176) 13.177 18.940 ( -0.351 0.163 25.323) 25.325 20.443 ( -10.425 -6.505 -8.544) 14.966 ======================= Grid point 14 (10/195) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( 13.259 10.425 4.586) 17.479 1.573 ( 14.940 -0.679 15.362) 21.440 2.244 ( -4.863 -2.594 -0.861) 5.579 2.421 ( 6.438 4.521 -2.527) 8.263 2.432 ( -0.501 -6.436 -6.621) 9.247 2.695 ( -2.194 0.819 -1.743) 2.919 2.940 ( -1.618 -2.258 8.966) 9.387 2.948 ( -8.234 1.856 4.503) 9.567 3.237 ( -1.314 8.041 -5.047) 9.584 3.431 ( -8.295 -4.378 -1.440) 9.490 3.517 ( 0.087 -3.102 2.866) 4.224 3.850 ( -6.114 -8.512 -7.331) 12.790 4.233 ( 5.408 0.209 1.358) 5.580 4.385 ( -2.782 -1.738 3.366) 4.700 4.449 ( -1.685 4.600 3.295) 5.904 4.516 ( 3.042 -1.957 -1.461) 3.901 5.035 ( 0.064 -1.595 1.976) 2.540 5.136 ( 0.354 -2.910 2.505) 3.856 6.717 ( -9.585 0.185 -2.613) 9.937 6.856 ( -10.520 -0.921 -0.219) 10.562 7.313 ( -2.306 -2.731 -7.486) 8.295 7.704 ( -2.616 -1.780 -5.897) 6.692 8.266 ( -0.133 -10.361 0.824) 10.395 8.381 ( 1.212 -4.310 5.888) 7.397 8.545 ( 0.171 -4.455 7.914) 9.083 8.707 ( 3.014 2.712 -0.369) 4.072 8.954 ( 4.775 -6.013 -3.059) 8.265 9.135 ( 1.321 -0.790 -4.290) 4.558 9.311 ( -7.681 3.410 -1.164) 8.484 9.753 ( -4.050 3.193 -5.621) 7.629 9.922 ( 2.647 -7.933 8.327) 11.802 9.970 ( 3.717 -1.959 -0.672) 4.255 10.080 ( -5.409 0.555 -2.265) 5.890 10.248 ( 17.202 -1.438 6.958) 18.612 10.441 ( 5.755 12.479 6.834) 15.348 10.598 ( -0.506 3.832 -6.266) 7.363 10.981 ( 2.600 -3.770 3.977) 6.066 11.193 ( 3.725 1.569 3.570) 5.393 11.662 ( -5.173 -4.370 -1.434) 6.922 11.856 ( 5.890 -2.849 7.883) 10.244 12.008 ( -1.012 7.471 0.119) 7.540 12.187 ( -7.619 -11.022 -0.132) 13.400 12.677 ( 2.714 10.139 -0.767) 10.524 12.833 ( 2.594 9.259 0.611) 9.635 13.537 ( -1.383 1.836 -2.066) 3.090 13.749 ( -1.800 0.523 -1.080) 2.163 13.914 ( -3.091 -3.234 0.331) 4.486 13.948 ( -4.150 -0.700 -2.339) 4.815 15.149 ( 16.622 3.982 3.192) 17.388 15.744 ( 1.071 -6.372 -1.387) 6.608 16.034 ( -0.478 4.291 -4.648) 6.344 16.188 ( -3.516 -13.480 5.084) 14.830 16.591 ( -2.339 -1.783 -9.589) 10.030 16.750 ( -2.396 -5.578 0.696) 6.110 17.082 ( 1.488 6.967 7.108) 10.064 17.171 ( -6.372 19.830 -13.223) 24.672 17.787 ( 9.392 -5.734 1.417) 11.095 18.018 ( 9.262 -0.251 -6.239) 11.170 19.205 ( 0.045 -2.333 20.000) 20.136 20.124 ( -12.889 -6.611 -10.756) 18.042 ======================= Grid point 15 (11/195) ======================= q-point: ( 0.36 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( 4.836 6.209 4.166) 8.905 1.940 ( 6.425 -4.601 9.251) 12.167 2.159 ( 1.576 -8.240 -0.996) 8.448 2.375 ( -1.711 -4.629 -7.013) 8.575 2.439 ( 5.627 1.549 0.835) 5.896 2.584 ( -2.829 -2.008 -5.524) 6.523 2.897 ( -9.610 2.379 0.621) 9.919 2.918 ( -3.220 9.621 6.468) 12.032 3.249 ( -9.049 -5.878 -3.794) 11.438 3.271 ( 3.432 4.125 3.170) 6.232 3.571 ( -2.663 -5.136 -1.710) 6.033 3.650 ( -3.761 -2.615 -3.840) 5.978 4.326 ( 0.098 -3.771 0.569) 3.815 4.386 ( 3.735 -0.353 1.135) 3.919 4.487 ( 1.649 4.896 4.832) 7.074 4.587 ( 2.412 1.260 2.868) 3.953 5.060 ( 0.273 -4.127 1.834) 4.525 5.180 ( 1.318 -2.811 1.759) 3.568 6.548 ( -6.512 0.307 -2.367) 6.936 6.697 ( -7.215 -0.160 -0.809) 7.262 7.202 ( -0.952 -1.809 -5.910) 6.254 7.628 ( 0.015 -0.965 -3.301) 3.439 8.291 ( 0.648 -10.785 1.974) 10.984 8.437 ( 0.286 -10.254 1.980) 10.447 8.636 ( 0.256 -7.530 6.066) 9.673 8.785 ( 2.522 4.983 4.462) 7.149 8.980 ( 2.029 -8.475 -4.690) 9.897 9.076 ( -2.513 1.244 -2.382) 3.679 9.159 ( -7.317 5.862 2.040) 9.595 9.596 ( -3.176 8.052 -9.827) 13.096 9.964 ( -1.116 -2.491 0.548) 2.784 9.974 ( -2.957 0.066 -1.092) 3.153 10.108 ( 3.762 -6.766 5.276) 9.368 10.543 ( 4.431 3.100 -2.958) 6.164 10.562 ( 7.225 4.105 0.835) 8.351 10.665 ( 10.380 3.353 9.850) 14.697 11.049 ( 1.277 1.056 0.820) 1.849 11.286 ( 4.646 -1.489 0.833) 4.949 11.529 ( -4.984 -0.612 -2.951) 5.824 11.917 ( -9.145 -14.242 -1.684) 17.009 12.003 ( 1.132 -0.287 5.662) 5.781 12.198 ( 3.335 -0.934 5.588) 6.574 12.691 ( 0.771 15.128 0.452) 15.154 12.920 ( 4.895 8.705 1.260) 10.066 13.470 ( -2.369 1.349 -3.533) 4.463 13.719 ( -1.783 -1.752 0.687) 2.592 13.813 ( -3.080 0.580 -4.029) 5.105 13.914 ( -1.256 -2.043 0.987) 2.594 15.462 ( 14.184 -0.864 2.794) 14.482 15.747 ( 3.186 -4.267 -1.449) 5.519 15.920 ( -5.790 -6.916 -1.895) 9.216 16.205 ( -2.083 -5.550 1.554) 6.129 16.455 ( -1.161 0.065 -8.120) 8.203 16.733 ( -0.328 1.223 0.643) 1.420 16.907 ( -6.932 17.908 -9.984) 21.643 17.164 ( -1.279 7.892 5.305) 9.595 18.011 ( 10.383 -6.304 4.746) 13.041 18.108 ( 7.978 -0.991 -2.896) 8.545 19.401 ( 0.134 -4.387 12.830) 13.560 19.776 ( -12.225 -6.863 -10.414) 17.465 ======================= Grid point 16 (12/195) ======================= q-point: ( 0.45 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 1.881 3.576 3.555) 5.382 1.994 ( -0.850 -10.538 1.074) 10.626 2.144 ( -2.883 -5.160 -5.462) 8.048 2.359 ( 2.934 -3.738 2.396) 5.322 2.525 ( 6.300 3.696 -6.042) 9.479 2.652 ( 0.666 -1.544 6.843) 7.046 2.719 ( -1.225 -0.141 2.508) 2.795 3.012 ( -10.646 -7.722 -6.851) 14.829 3.035 ( 5.268 8.248 8.783) 13.150 3.296 ( -7.227 2.826 -7.530) 10.813 3.369 ( -1.398 1.683 -0.965) 2.392 3.673 ( 0.799 -4.802 1.009) 4.972 4.323 ( 0.001 -1.657 0.084) 1.659 4.443 ( 0.859 -0.717 1.029) 1.520 4.589 ( 2.720 3.851 2.378) 5.281 4.641 ( 0.759 1.945 1.313) 2.466 5.083 ( 0.273 -5.717 0.926) 5.797 5.211 ( 0.614 -3.190 0.517) 3.289 6.450 ( -2.314 0.679 -0.976) 2.602 6.599 ( -2.786 -0.072 -0.614) 2.854 7.147 ( -0.014 -0.837 -2.135) 2.294 7.615 ( 0.703 -1.279 -0.915) 1.723 8.320 ( 0.225 -9.434 1.221) 9.516 8.454 ( 0.624 -13.874 -0.076) 13.888 8.690 ( 0.033 -11.764 2.471) 12.021 8.857 ( 0.508 7.343 2.490) 7.770 8.884 ( -4.031 -4.257 -2.370) 6.324 9.041 ( 0.505 -3.228 -1.155) 3.465 9.170 ( 0.451 9.111 5.174) 10.487 9.431 ( -2.286 8.048 -8.009) 11.582 9.934 ( -0.724 -0.767 0.127) 1.062 9.943 ( -1.158 -1.133 -0.355) 1.659 10.191 ( 1.210 -3.855 1.511) 4.313 10.596 ( 1.905 1.790 2.390) 3.542 10.631 ( 2.416 3.353 -2.706) 4.940 10.923 ( 5.351 3.553 6.796) 9.351 11.046 ( -0.744 5.603 -1.551) 5.861 11.360 ( 6.063 -9.721 -5.601) 12.753 11.474 ( -1.545 -0.229 3.636) 3.958 11.736 ( -7.804 -11.525 -0.716) 13.937 12.081 ( 0.905 -1.481 3.476) 3.885 12.259 ( 0.112 -0.477 -0.010) 0.490 12.733 ( 1.488 14.592 1.516) 14.746 12.998 ( 2.300 8.411 0.656) 8.745 13.392 ( -1.701 0.597 -2.328) 2.944 13.680 ( -1.694 -3.038 -0.802) 3.570 13.775 ( 0.036 0.566 0.690) 0.893 13.901 ( -0.485 0.386 -0.497) 0.795 15.624 ( 3.641 -9.592 -0.669) 10.282 15.815 ( -2.230 -14.063 -1.199) 14.289 15.896 ( 9.451 3.658 3.887) 10.854 16.122 ( -7.479 0.059 -1.472) 7.623 16.372 ( -0.317 1.260 -3.373) 3.614 16.721 ( -2.459 8.784 -2.575) 9.478 16.756 ( -0.094 12.244 -0.870) 12.275 17.179 ( -1.132 7.598 1.721) 7.872 18.130 ( 2.458 -3.403 -0.544) 4.233 18.270 ( 6.153 -4.392 3.106) 8.173 19.495 ( -3.081 -7.081 1.077) 7.797 19.520 ( -2.878 -5.798 -1.776) 6.712 ======================= Grid point 22 (13/195) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( 0.000 22.598 0.000) 22.598 1.236 ( 0.000 28.965 0.000) 28.965 1.499 ( 0.000 36.731 0.000) 36.731 2.173 ( 0.000 -0.723 0.000) 0.723 2.701 ( 0.000 -4.938 0.000) 4.938 2.795 ( 0.000 -2.736 0.000) 2.736 2.961 ( 0.000 -0.010 0.000) 0.010 3.080 ( 0.000 0.116 0.000) 0.116 3.445 ( 0.000 -3.941 0.000) 3.941 3.557 ( 0.000 -4.130 0.000) 4.130 3.713 ( 0.000 -10.913 0.000) 10.913 4.040 ( 0.000 -4.022 0.000) 4.022 4.185 ( 0.000 -1.820 0.000) 1.820 4.241 ( 0.000 -2.935 0.000) 2.935 4.484 ( 0.000 5.067 0.000) 5.067 4.498 ( 0.000 -2.472 0.000) 2.472 4.950 ( 0.000 -2.528 0.000) 2.528 5.048 ( 0.000 -8.266 0.000) 8.266 7.192 ( 0.000 -9.209 0.000) 9.209 7.208 ( 0.000 -4.818 0.000) 4.818 7.443 ( 0.000 -3.409 0.000) 3.409 7.845 ( 0.000 -10.571 0.000) 10.571 8.229 ( 0.000 4.799 0.000) 4.799 8.364 ( 0.000 -6.057 0.000) 6.057 8.573 ( 0.000 -7.164 0.000) 7.164 8.652 ( 0.000 0.850 0.000) 0.850 8.670 ( 0.000 1.307 0.000) 1.307 8.728 ( 0.000 -6.249 0.000) 6.249 9.186 ( 0.000 1.542 0.000) 1.542 9.503 ( 0.000 -6.690 0.000) 6.690 9.556 ( 0.000 4.495 0.000) 4.495 9.808 ( 0.000 -3.343 0.000) 3.343 10.040 ( 0.000 4.496 0.000) 4.496 10.370 ( 0.000 -0.707 0.000) 0.707 10.378 ( 0.000 2.010 0.000) 2.010 10.802 ( 0.000 2.821 0.000) 2.821 10.848 ( 0.000 -2.208 0.000) 2.208 10.901 ( 0.000 5.320 0.000) 5.320 11.608 ( 0.000 2.652 0.000) 2.652 11.730 ( 0.000 2.009 0.000) 2.009 12.128 ( 0.000 -6.357 0.000) 6.357 12.453 ( 0.000 -4.554 0.000) 4.554 12.701 ( 0.000 16.935 0.000) 16.935 12.952 ( 0.000 5.911 0.000) 5.911 13.542 ( 0.000 -1.996 0.000) 1.996 13.863 ( 0.000 -3.982 0.000) 3.982 14.052 ( 0.000 -1.686 0.000) 1.686 14.153 ( 0.000 -0.361 0.000) 0.361 14.758 ( 0.000 16.930 0.000) 16.930 15.430 ( 0.000 -0.790 0.000) 0.790 15.750 ( 0.000 -8.817 0.000) 8.817 16.483 ( 0.000 -4.847 0.000) 4.847 16.625 ( 0.000 -9.717 0.000) 9.717 16.871 ( 0.000 0.676 0.000) 0.676 17.039 ( 0.000 1.511 0.000) 1.511 17.223 ( 0.000 -6.978 0.000) 6.978 17.795 ( 0.000 4.175 0.000) 4.175 18.272 ( 0.000 -5.403 0.000) 5.403 18.654 ( 0.000 22.640 0.000) 22.640 20.563 ( 0.000 -11.813 0.000) 11.813 ======================= Grid point 23 (14/195) ======================= q-point: ( 0.09 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( 9.860 19.221 7.320) 22.808 1.249 ( 9.141 27.873 -6.918) 30.138 1.743 ( 12.275 27.351 17.004) 34.465 2.281 ( 8.665 -1.075 4.013) 9.609 2.596 ( -3.359 -5.575 -8.542) 10.739 2.777 ( -3.298 0.787 -0.937) 3.518 2.903 ( -6.221 0.084 1.744) 6.462 3.141 ( 1.640 -2.201 4.150) 4.976 3.418 ( -3.150 -3.661 -1.728) 5.129 3.498 ( -5.795 -4.688 0.234) 7.458 3.626 ( -4.126 -10.507 -5.371) 12.501 4.061 ( -0.212 -5.255 0.009) 5.259 4.153 ( -3.739 1.125 -4.516) 5.970 4.231 ( 1.288 -1.178 4.974) 5.271 4.488 ( 0.030 -1.309 0.858) 1.566 4.504 ( 0.079 0.174 -1.220) 1.234 4.955 ( -0.609 -2.396 2.225) 3.326 5.045 ( -0.341 -7.197 -0.196) 7.208 7.114 ( -8.854 -3.559 -1.230) 9.622 7.132 ( -6.245 -7.797 -0.644) 10.011 7.425 ( -1.296 -3.602 -1.468) 4.100 7.825 ( -1.494 -8.617 -1.653) 8.900 8.232 ( -1.888 2.804 4.249) 5.429 8.343 ( -8.057 -6.828 -3.738) 11.203 8.363 ( -3.851 -4.880 -3.717) 7.243 8.656 ( 6.054 -1.029 -1.686) 6.368 8.754 ( 6.399 -3.898 -4.314) 8.646 8.872 ( 8.113 -2.696 0.744) 8.582 9.353 ( 13.922 1.676 5.815) 15.181 9.503 ( -2.973 2.143 -0.643) 3.721 9.563 ( 0.629 -6.642 7.209) 9.822 9.855 ( 2.107 -3.703 1.561) 4.538 10.045 ( -1.796 3.442 1.538) 4.176 10.334 ( -3.186 0.912 -0.628) 3.372 10.386 ( 2.096 5.635 1.498) 6.196 10.776 ( -0.895 2.992 -2.638) 4.088 10.847 ( -0.317 -1.007 0.067) 1.058 10.965 ( 3.398 1.999 4.172) 5.740 11.608 ( -0.953 3.485 2.180) 4.220 11.731 ( 0.219 1.252 0.469) 1.355 12.155 ( -1.102 -6.208 3.964) 7.448 12.386 ( -3.990 -1.797 -4.576) 6.331 12.685 ( 2.263 12.464 -4.453) 13.428 12.955 ( 1.282 5.514 -1.393) 5.830 13.567 ( -0.033 -0.321 3.393) 3.408 13.868 ( -0.219 -3.210 1.062) 3.388 13.973 ( -7.475 -1.201 -0.282) 7.576 14.129 ( -2.016 -0.467 -1.526) 2.571 14.838 ( 8.731 15.755 -0.225) 18.014 15.504 ( 4.335 -1.455 4.370) 6.325 15.788 ( 3.266 -8.534 1.910) 9.335 16.395 ( -4.846 -2.438 -6.147) 8.198 16.627 ( -0.751 -9.770 1.244) 9.877 16.859 ( -5.001 -1.067 0.530) 5.141 16.948 ( -0.965 0.606 -3.415) 3.600 17.327 ( 12.066 -7.468 -5.389) 15.179 17.827 ( 2.913 5.769 0.193) 6.465 18.158 ( -1.975 4.311 -12.866) 13.712 18.766 ( -2.781 12.387 19.560) 23.318 20.484 ( -6.151 -11.794 -4.183) 13.944 ======================= Grid point 24 (15/195) ======================= q-point: ( 0.18 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.324 ( 8.703 13.712 10.798) 19.503 1.407 ( 13.852 20.739 -1.671) 24.996 2.163 ( 11.601 11.269 11.461) 19.822 2.436 ( -2.122 -5.360 -9.142) 10.808 2.469 ( 6.794 -0.227 -3.250) 7.534 2.700 ( -5.795 4.072 8.474) 11.044 2.829 ( -2.811 -2.204 -0.170) 3.576 3.113 ( -8.363 -1.623 -1.083) 8.588 3.336 ( -1.958 -4.633 2.913) 5.812 3.447 ( -1.804 -2.619 0.705) 3.258 3.487 ( -6.081 -7.725 -2.958) 10.266 3.901 ( -7.909 -4.329 -8.185) 12.178 4.167 ( 3.124 1.690 1.688) 3.932 4.325 ( 0.931 -0.927 6.402) 6.536 4.452 ( -1.162 -3.565 -4.056) 5.524 4.503 ( -0.578 -0.155 2.116) 2.199 4.982 ( 0.208 -2.061 2.034) 2.903 5.034 ( -0.902 -5.942 1.059) 6.103 6.918 ( -10.449 -1.442 -2.432) 10.825 6.987 ( -8.895 -4.726 -0.910) 10.113 7.361 ( -3.144 -3.303 -2.853) 5.380 7.753 ( -2.011 -5.414 -5.025) 7.655 8.117 ( -5.989 -10.010 -5.126) 12.741 8.284 ( -0.933 1.585 5.670) 5.961 8.344 ( 0.218 -9.742 0.231) 9.748 8.719 ( 1.100 0.889 -0.596) 1.535 8.792 ( 5.628 -5.026 -2.570) 7.971 9.035 ( 9.604 -3.283 -1.358) 10.240 9.449 ( -4.864 1.181 1.818) 5.325 9.650 ( 3.822 -2.266 7.548) 8.759 9.712 ( 12.999 -2.105 3.624) 13.657 9.901 ( 3.215 -3.095 -0.117) 4.464 10.011 ( -1.755 1.092 1.503) 2.556 10.239 ( -5.098 1.057 -3.083) 6.051 10.520 ( 5.900 10.651 5.860) 13.513 10.738 ( 0.632 4.631 -3.315) 5.730 10.829 ( -1.498 -3.872 2.267) 4.730 11.089 ( 3.933 0.414 5.324) 6.632 11.615 ( -2.474 0.305 2.582) 3.589 11.779 ( 3.169 3.769 3.123) 5.832 12.120 ( -7.454 -7.729 1.831) 10.893 12.242 ( -4.741 2.768 -5.592) 7.837 12.723 ( 7.369 7.366 -2.467) 10.707 12.966 ( 2.524 5.396 -2.103) 6.317 13.598 ( -2.181 1.974 4.472) 5.353 13.833 ( -7.578 -3.799 0.260) 8.481 13.875 ( -0.168 0.811 -0.233) 0.861 14.050 ( -3.848 -0.653 -2.904) 4.865 15.028 ( 11.905 12.650 1.503) 17.435 15.616 ( 2.269 -3.122 2.783) 4.758 15.896 ( 3.698 -9.698 4.062) 11.145 16.222 ( -3.499 2.045 -8.956) 9.831 16.625 ( -1.434 -7.687 2.356) 8.166 16.713 ( -2.454 -2.026 -10.164) 10.651 16.997 ( 3.077 -0.506 5.899) 6.673 17.474 ( 12.096 -9.210 -4.933) 15.983 17.822 ( -1.484 14.990 -9.881) 18.015 18.004 ( 0.527 5.099 -4.764) 6.998 18.963 ( -3.306 3.011 22.000) 22.450 20.263 ( -11.132 -11.776 -7.591) 17.895 ======================= Grid point 25 (16/195) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 4.870 5.907 11.017) 13.416 1.640 ( 13.901 13.762 1.696) 19.634 2.207 ( -8.706 -1.009 -3.899) 9.592 2.333 ( 0.801 -3.438 -3.273) 4.814 2.469 ( 0.121 -0.076 -6.670) 6.671 2.657 ( -4.728 -4.072 -4.343) 7.602 2.873 ( 1.019 -3.969 6.242) 7.466 3.063 ( -0.930 8.362 7.403) 11.206 3.307 ( -7.942 -7.025 -2.166) 10.822 3.374 ( -0.988 2.659 2.297) 3.650 3.459 ( 0.122 -1.856 2.553) 3.159 3.683 ( -6.674 -6.819 -5.968) 11.254 4.241 ( 2.577 0.444 0.445) 2.652 4.332 ( -1.557 -2.756 0.234) 3.174 4.468 ( 2.931 -2.753 2.427) 4.697 4.540 ( 0.972 3.738 4.711) 6.092 4.978 ( -1.134 -4.348 -0.492) 4.520 5.063 ( 0.741 -4.274 3.056) 5.306 6.718 ( -8.795 -0.235 -3.127) 9.337 6.825 ( -8.253 -2.340 -1.054) 8.643 7.259 ( -2.739 -2.153 -5.050) 6.135 7.659 ( -1.015 -2.863 -5.524) 6.305 8.017 ( -2.853 -14.054 0.522) 14.351 8.275 ( -1.859 -7.215 -1.457) 7.592 8.412 ( 2.534 -8.190 4.182) 9.538 8.717 ( 1.067 -3.108 -0.556) 3.333 8.885 ( 4.460 1.094 1.837) 4.946 9.120 ( 2.096 -1.798 -1.348) 3.073 9.361 ( -8.249 2.690 2.595) 9.056 9.770 ( 1.128 -6.337 6.329) 9.027 9.835 ( 1.305 4.180 -3.193) 5.419 9.950 ( 4.124 -0.819 -1.135) 4.355 10.084 ( -3.053 -0.679 -2.902) 4.267 10.209 ( 13.709 -2.148 3.840) 14.398 10.624 ( 1.350 4.626 -0.941) 4.910 10.716 ( 1.017 7.930 0.708) 8.026 10.929 ( 4.126 -0.654 8.744) 9.691 11.203 ( 3.270 -0.415 2.566) 4.177 11.581 ( -4.309 -3.915 1.963) 6.144 11.822 ( -4.318 -1.090 -1.072) 4.580 12.013 ( -2.302 -4.543 -0.461) 5.114 12.151 ( -1.749 5.522 2.575) 6.339 12.844 ( 6.890 7.580 -0.225) 10.246 13.005 ( 5.008 6.785 -1.161) 8.513 13.582 ( -4.708 2.305 2.482) 5.799 13.723 ( -5.298 -4.129 0.021) 6.717 13.864 ( -0.869 0.032 -0.064) 0.872 13.942 ( -3.650 -0.041 -3.526) 5.075 15.260 ( 11.288 6.874 2.767) 13.503 15.638 ( 0.232 -4.681 -1.581) 4.946 15.915 ( -7.570 -8.662 3.741) 12.096 16.131 ( 5.414 0.843 -8.550) 10.155 16.559 ( -0.144 -1.770 -11.642) 11.776 16.675 ( 3.429 -0.668 3.972) 5.290 17.164 ( 4.287 1.429 9.597) 10.607 17.568 ( -6.525 11.757 -10.962) 17.348 17.645 ( 9.192 -1.241 -2.379) 9.576 18.031 ( 5.284 2.059 -3.259) 6.541 19.151 ( -2.989 -2.876 18.686) 19.141 19.942 ( -13.947 -11.850 -9.541) 20.639 ======================= Grid point 26 (17/195) ======================= q-point: ( 0.36 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -0.977 6.585 6.153) 9.065 1.876 ( 3.728 -0.489 3.032) 4.830 2.043 ( -0.437 -2.828 -1.783) 3.371 2.293 ( -2.164 -3.734 -5.399) 6.912 2.403 ( 1.429 -4.563 0.842) 4.855 2.556 ( 2.721 -0.771 -7.404) 7.926 2.895 ( -6.366 -2.362 3.749) 7.756 3.069 ( -5.827 -2.550 -0.929) 6.428 3.137 ( -6.741 1.990 0.476) 7.045 3.395 ( 1.674 6.814 0.530) 7.036 3.475 ( -2.941 -3.682 -3.091) 5.636 3.568 ( -1.999 -5.049 2.158) 5.844 4.249 ( 0.206 -3.457 1.262) 3.686 4.382 ( 3.552 0.330 0.506) 3.603 4.563 ( 3.807 0.920 4.644) 6.075 4.631 ( 2.140 4.093 4.489) 6.441 4.952 ( -1.161 -6.457 -0.185) 6.563 5.107 ( 0.837 -4.538 1.692) 4.915 6.555 ( -5.748 0.336 -2.785) 6.396 6.685 ( -6.285 -1.254 -1.364) 6.553 7.171 ( -0.388 -0.853 -4.673) 4.766 7.601 ( -0.075 -1.777 -2.898) 3.400 8.016 ( -0.680 -15.730 4.032) 16.253 8.219 ( 0.277 -12.362 -5.314) 13.459 8.473 ( -0.690 -8.743 3.208) 9.339 8.746 ( 1.666 -7.608 -0.007) 7.788 8.965 ( 1.485 5.978 2.148) 6.523 9.108 ( -2.053 1.884 0.243) 2.797 9.261 ( -5.746 4.344 4.303) 8.391 9.717 ( -2.729 3.309 -8.861) 9.845 9.869 ( -1.349 -5.672 5.068) 7.725 9.996 ( -0.900 1.194 -2.826) 3.197 10.030 ( 4.169 -1.034 1.477) 4.542 10.520 ( 14.875 -4.561 1.323) 15.615 10.625 ( 1.982 2.972 0.147) 3.575 10.773 ( 1.945 4.833 3.392) 6.217 11.094 ( 3.281 3.733 6.493) 8.176 11.247 ( 0.767 -1.622 -1.448) 2.306 11.519 ( -4.007 -1.593 -0.180) 4.316 11.662 ( -8.579 -10.226 -1.031) 13.388 12.014 ( 1.719 1.702 0.164) 2.424 12.216 ( 0.681 2.277 5.584) 6.068 12.927 ( 3.576 9.634 -0.209) 10.279 13.108 ( 6.229 8.906 0.391) 10.875 13.496 ( -5.782 0.866 -1.311) 5.992 13.651 ( -3.827 -5.548 1.105) 6.829 13.819 ( -1.936 0.156 -2.794) 3.403 13.894 ( -0.102 0.531 0.756) 0.929 15.423 ( 4.110 -2.942 0.184) 5.058 15.615 ( -0.184 -9.302 -3.279) 9.865 15.840 ( -1.570 0.056 2.660) 3.089 16.141 ( 1.524 -2.037 -1.885) 3.167 16.453 ( 2.826 1.144 -9.039) 9.540 16.813 ( 6.923 6.536 2.365) 9.810 17.243 ( -8.041 13.575 -5.044) 16.564 17.343 ( -2.700 11.585 3.203) 12.319 17.851 ( 10.905 -9.758 4.401) 15.281 18.085 ( 6.397 -0.757 -4.569) 7.897 19.289 ( -2.415 -6.832 12.459) 14.413 19.588 ( -13.355 -12.051 -9.271) 20.237 ======================= Grid point 27 (18/195) ======================= q-point: ( 0.45 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( -0.091 4.812 4.067) 6.301 1.829 ( -2.855 -5.862 -0.186) 6.523 2.051 ( -2.114 -3.412 -4.361) 5.927 2.262 ( 2.029 -6.073 1.441) 6.563 2.493 ( 8.269 -3.439 -0.276) 8.960 2.627 ( 9.330 -2.104 0.715) 9.591 2.752 ( -11.878 -0.040 0.818) 11.906 2.861 ( -9.658 -6.244 -5.163) 12.606 3.159 ( 2.353 2.709 5.650) 6.693 3.326 ( -5.340 0.551 -6.377) 8.336 3.434 ( 1.340 5.558 0.451) 5.735 3.580 ( -0.486 -4.216 1.188) 4.407 4.286 ( 0.826 -1.506 1.679) 2.402 4.422 ( 1.104 -1.055 -0.231) 1.544 4.671 ( 2.597 2.179 2.029) 3.951 4.695 ( 0.625 4.824 1.959) 5.244 4.940 ( -0.348 -8.374 0.230) 8.385 5.128 ( 0.261 -5.105 0.399) 5.127 6.467 ( -1.773 0.955 -1.041) 2.267 6.590 ( -2.691 -1.019 -0.838) 2.997 7.138 ( 0.504 0.179 -1.692) 1.775 7.579 ( -0.111 -2.410 -0.840) 2.555 8.074 ( 0.148 -14.707 5.476) 15.694 8.162 ( 0.990 -15.354 -6.214) 16.593 8.481 ( -1.059 -9.643 1.564) 9.826 8.743 ( -0.815 -8.590 -0.755) 8.662 8.998 ( 1.750 6.868 0.165) 7.089 9.058 ( -3.469 3.683 0.500) 5.084 9.314 ( 1.447 5.699 7.745) 9.724 9.548 ( -3.240 3.785 -8.808) 10.119 9.873 ( -1.084 -3.716 0.912) 3.977 9.973 ( 0.218 1.419 -1.002) 1.751 10.109 ( 1.675 -3.237 1.752) 4.044 10.630 ( 2.140 2.116 -0.803) 3.115 10.714 ( 2.638 3.976 -0.336) 4.783 10.925 ( 8.063 -7.772 8.039) 13.786 11.154 ( -3.527 0.518 -4.633) 5.846 11.183 ( -0.671 2.393 -1.068) 2.705 11.460 ( -2.207 -0.933 0.852) 2.543 11.574 ( -2.064 -7.331 0.895) 7.668 12.053 ( 1.025 0.543 1.064) 1.574 12.260 ( -0.090 0.570 1.357) 1.475 12.973 ( 1.369 9.809 0.447) 9.914 13.194 ( 3.022 10.207 -0.063) 10.645 13.388 ( -3.337 -1.368 -1.495) 3.904 13.610 ( -1.839 -3.846 0.306) 4.274 13.783 ( -0.080 0.283 -0.536) 0.611 13.908 ( 0.226 0.033 0.654) 0.693 15.449 ( 1.146 -7.745 -0.511) 7.846 15.540 ( -2.908 -12.922 -2.021) 13.399 15.923 ( 4.325 -0.812 1.472) 4.640 16.120 ( -2.163 -1.595 0.139) 2.691 16.459 ( 4.104 9.647 -2.108) 10.694 16.915 ( 1.791 10.828 -0.983) 11.019 17.032 ( -4.281 15.011 -3.170) 15.928 17.358 ( -1.915 9.770 2.639) 10.299 18.038 ( 2.942 -6.250 3.177) 7.603 18.157 ( 5.996 -6.599 -1.611) 9.060 19.297 ( -6.655 -12.633 -2.355) 14.472 19.377 ( -1.111 -8.768 2.152) 9.096 ======================= Grid point 33 (19/195) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 0.000 20.955 0.000) 20.955 1.737 ( 0.000 22.344 0.000) 22.344 2.084 ( 0.000 6.525 0.000) 6.525 2.186 ( 0.000 15.526 0.000) 15.526 2.623 ( 0.000 -0.530 0.000) 0.530 2.778 ( 0.000 2.754 0.000) 2.754 2.997 ( 0.000 2.655 0.000) 2.655 3.104 ( 0.000 2.451 0.000) 2.451 3.358 ( 0.000 -4.624 0.000) 4.624 3.463 ( 0.000 -5.972 0.000) 5.972 3.480 ( 0.000 -12.230 0.000) 12.230 3.874 ( 0.000 -12.297 0.000) 12.297 4.148 ( 0.000 -1.518 0.000) 1.518 4.240 ( 0.000 0.793 0.000) 0.793 4.430 ( 0.000 -3.318 0.000) 3.318 4.557 ( 0.000 1.732 0.000) 1.732 4.890 ( 0.000 -6.990 0.000) 6.990 4.893 ( 0.000 -3.058 0.000) 3.058 7.021 ( 0.000 -7.629 0.000) 7.629 7.090 ( 0.000 -6.960 0.000) 6.960 7.397 ( 0.000 -1.013 0.000) 1.013 7.649 ( 0.000 -9.197 0.000) 9.197 8.218 ( 0.000 -3.886 0.000) 3.886 8.384 ( 0.000 -10.045 0.000) 10.045 8.387 ( 0.000 6.283 0.000) 6.283 8.638 ( 0.000 -3.462 0.000) 3.462 8.672 ( 0.000 1.467 0.000) 1.467 8.720 ( 0.000 2.718 0.000) 2.718 9.194 ( 0.000 -0.553 0.000) 0.553 9.364 ( 0.000 -7.584 0.000) 7.584 9.635 ( 0.000 3.357 0.000) 3.357 9.744 ( 0.000 -2.765 0.000) 2.765 10.121 ( 0.000 3.795 0.000) 3.795 10.325 ( 0.000 -3.195 0.000) 3.195 10.444 ( 0.000 4.356 0.000) 4.356 10.723 ( 0.000 -5.440 0.000) 5.440 10.959 ( 0.000 6.941 0.000) 6.941 10.993 ( 0.000 4.092 0.000) 4.092 11.659 ( 0.000 2.404 0.000) 2.404 11.760 ( 0.000 0.290 0.000) 0.290 12.043 ( 0.000 -1.329 0.000) 1.329 12.344 ( 0.000 -6.525 0.000) 6.525 13.023 ( 0.000 15.927 0.000) 15.927 13.079 ( 0.000 7.081 0.000) 7.081 13.483 ( 0.000 -4.480 0.000) 4.480 13.725 ( 0.000 -8.835 0.000) 8.835 14.059 ( 0.000 1.335 0.000) 1.335 14.143 ( 0.000 -0.742 0.000) 0.742 15.128 ( 0.000 20.142 0.000) 20.142 15.434 ( 0.000 1.950 0.000) 1.950 15.602 ( 0.000 -6.503 0.000) 6.503 16.361 ( 0.000 -13.981 0.000) 13.981 16.467 ( 0.000 0.177 0.000) 0.177 16.862 ( 0.000 -2.645 0.000) 2.645 17.044 ( 0.000 -0.639 0.000) 0.639 17.079 ( 0.000 -6.643 0.000) 6.643 17.878 ( 0.000 4.351 0.000) 4.351 18.163 ( 0.000 -5.700 0.000) 5.700 19.112 ( 0.000 23.894 0.000) 23.894 20.294 ( 0.000 -15.824 0.000) 15.824 ======================= Grid point 34 (20/195) ======================= q-point: ( 0.09 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.427 ( 7.691 19.043 4.175) 20.958 1.750 ( 5.461 22.482 -5.231) 23.720 2.186 ( 6.344 7.697 6.129) 11.707 2.271 ( 4.451 7.869 5.774) 10.728 2.522 ( -3.201 -1.439 -8.117) 8.844 2.797 ( -0.653 3.212 1.484) 3.598 2.938 ( -7.385 2.845 1.291) 8.019 3.141 ( 1.483 2.810 2.856) 4.272 3.301 ( -6.929 -9.534 -6.024) 13.236 3.372 ( -1.928 -7.341 -1.489) 7.734 3.443 ( -3.335 -6.709 -0.211) 7.495 3.917 ( -0.047 -9.382 2.949) 9.834 4.193 ( 0.389 0.600 2.767) 2.857 4.220 ( -0.242 1.881 0.883) 2.092 4.417 ( -0.070 -4.947 0.431) 4.966 4.510 ( -2.769 -0.724 -4.120) 5.017 4.892 ( -0.690 -4.320 3.194) 5.417 4.918 ( 1.175 -4.555 -0.153) 4.707 6.984 ( -3.770 -6.706 -0.621) 7.718 7.027 ( -6.281 -5.181 -0.654) 8.168 7.376 ( -1.766 -1.070 -0.830) 2.225 7.650 ( 0.895 -9.141 -1.899) 9.379 8.170 ( -6.022 -6.170 -0.570) 8.640 8.212 ( -8.163 -6.445 -5.399) 11.718 8.403 ( -3.985 7.059 1.144) 8.186 8.623 ( 4.961 -1.425 -0.287) 5.170 8.685 ( 4.483 -3.206 -2.812) 6.187 8.830 ( 5.147 -2.602 -0.123) 5.769 9.367 ( 14.650 -0.495 4.602) 15.363 9.447 ( 4.570 -4.410 6.040) 8.765 9.569 ( -3.940 4.003 -0.847) 5.680 9.784 ( 1.216 -3.545 1.947) 4.224 10.095 ( -2.782 2.200 -0.686) 3.612 10.303 ( -1.601 -3.157 -1.537) 3.859 10.511 ( 5.280 6.201 4.148) 9.140 10.738 ( -0.284 -3.402 1.173) 3.609 10.934 ( -1.206 5.872 -3.048) 6.725 11.005 ( -0.055 1.839 3.855) 4.271 11.679 ( -0.406 3.599 2.954) 4.674 11.770 ( 0.717 2.119 1.423) 2.652 12.058 ( -1.440 -3.074 2.829) 4.419 12.301 ( -1.352 -6.015 -4.054) 7.379 12.933 ( -2.268 11.555 -7.761) 14.103 13.053 ( 0.437 4.478 -3.982) 6.009 13.557 ( 0.720 -0.639 8.019) 8.076 13.752 ( -0.451 -6.559 3.924) 7.657 13.998 ( -4.989 2.064 -1.084) 5.507 14.113 ( -2.671 -1.177 -1.234) 3.169 15.191 ( 7.416 19.765 -1.528) 21.165 15.489 ( 2.955 0.325 3.783) 4.811 15.639 ( 2.277 -6.554 2.751) 7.464 16.346 ( 0.307 -10.203 -4.211) 11.042 16.456 ( 0.707 -0.245 -1.199) 1.414 16.843 ( -5.265 -0.803 1.463) 5.523 16.943 ( -1.908 -0.943 -4.922) 5.362 17.132 ( 10.266 -11.693 -9.430) 18.195 17.932 ( 3.025 5.146 3.459) 6.899 18.176 ( 0.059 -1.775 0.857) 1.972 19.098 ( -5.756 20.332 6.675) 22.160 20.216 ( -6.609 -15.686 -3.306) 17.340 ======================= Grid point 35 (21/195) ======================= q-point: ( 0.18 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 4.711 15.382 6.812) 17.470 1.815 ( 9.580 20.076 -5.561) 22.929 2.317 ( 0.293 3.311 -0.206) 3.330 2.368 ( -3.090 -1.065 -1.822) 3.742 2.452 ( 7.175 -1.303 0.183) 7.295 2.751 ( -10.045 -1.298 -1.219) 10.202 2.798 ( -3.835 0.102 -1.621) 4.165 3.104 ( -2.315 -3.109 -0.350) 3.892 3.257 ( 1.945 1.595 6.872) 7.318 3.335 ( -4.397 -4.896 -0.148) 6.582 3.376 ( -2.899 -5.606 1.206) 6.426 3.852 ( -6.533 -2.027 -4.361) 8.112 4.209 ( 2.324 2.154 2.156) 3.832 4.300 ( 0.702 -1.012 4.767) 4.924 4.386 ( -3.379 -3.121 -5.015) 6.805 4.467 ( 2.008 -3.490 4.875) 6.323 4.916 ( -0.499 -4.916 -0.486) 4.965 4.933 ( 0.207 -3.393 3.311) 4.745 6.878 ( -7.720 -2.733 -1.998) 8.429 6.893 ( -5.928 -4.350 -1.850) 7.582 7.322 ( -3.503 -0.472 -0.585) 3.582 7.625 ( -0.155 -8.076 -3.368) 8.752 7.946 ( -6.906 -6.528 -8.752) 12.919 8.131 ( -0.348 -10.760 -3.327) 11.268 8.343 ( -5.506 4.479 3.397) 7.869 8.673 ( -2.042 -3.818 -0.838) 4.410 8.760 ( 7.114 -0.089 3.776) 8.055 8.943 ( 6.785 -6.054 0.902) 9.138 9.507 ( -4.751 4.634 2.190) 6.988 9.600 ( 4.956 -1.165 5.482) 7.481 9.712 ( 16.766 0.309 2.547) 16.961 9.836 ( 3.920 -3.757 1.337) 5.592 10.028 ( -2.813 1.140 -1.082) 3.223 10.230 ( -3.006 -2.303 -4.128) 5.602 10.666 ( 4.023 4.215 1.939) 6.140 10.744 ( 0.303 -1.594 3.873) 4.199 10.877 ( -1.294 6.369 0.617) 6.529 11.084 ( 2.107 -0.861 5.393) 5.854 11.643 ( -5.292 2.605 0.025) 5.899 11.878 ( 5.957 4.648 5.573) 9.389 11.980 ( -9.412 -4.930 -1.190) 10.692 12.250 ( -0.252 -1.849 -2.148) 2.846 12.864 ( 4.287 6.528 -4.253) 8.893 13.028 ( 2.954 1.134 -4.287) 5.328 13.633 ( -4.474 1.494 8.755) 9.945 13.748 ( -5.172 -3.003 2.205) 6.374 13.922 ( -1.178 2.331 -1.298) 2.916 14.030 ( -4.006 -1.393 -2.317) 4.833 15.306 ( 7.404 14.851 -2.071) 16.723 15.570 ( 0.682 -1.672 2.592) 3.159 15.739 ( 2.912 -4.967 5.918) 8.257 16.249 ( -0.187 -2.859 -11.616) 11.965 16.506 ( 4.536 -1.248 2.134) 5.166 16.708 ( -2.137 1.472 -8.866) 9.238 16.951 ( 3.511 -3.841 3.353) 6.190 17.232 ( 11.924 -14.638 -6.165) 19.861 18.023 ( 3.451 6.744 0.743) 7.612 18.145 ( -2.820 6.699 -2.892) 7.823 19.089 ( -8.534 10.483 13.231) 18.915 19.999 ( -12.080 -15.282 -5.879) 20.348 ======================= Grid point 36 (22/195) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( -0.534 9.224 7.874) 12.139 1.932 ( 9.853 14.033 -5.441) 17.989 2.212 ( -6.525 0.429 -6.030) 8.894 2.290 ( -5.339 -0.393 3.388) 6.336 2.421 ( -6.976 -4.470 -7.986) 11.507 2.575 ( -1.507 -3.730 -3.613) 5.407 2.808 ( 2.624 -2.107 1.974) 3.902 3.087 ( -4.135 -7.241 -1.957) 8.565 3.258 ( -3.867 -0.576 2.228) 4.500 3.362 ( -1.649 -7.542 2.233) 8.037 3.404 ( 2.269 5.787 9.177) 11.084 3.667 ( -5.811 2.883 -6.001) 8.837 4.225 ( -2.816 -1.582 -1.440) 3.537 4.331 ( 4.229 1.813 3.101) 5.549 4.402 ( 2.435 -3.172 3.320) 5.197 4.582 ( 2.882 0.158 6.541) 7.150 4.886 ( -1.500 -4.179 -1.194) 4.598 4.978 ( 0.419 -4.506 3.023) 5.442 6.708 ( -7.313 -0.668 -3.711) 8.228 6.769 ( -5.725 -3.158 -2.281) 6.925 7.246 ( -3.291 0.964 -1.913) 3.927 7.578 ( 0.010 -6.543 -3.827) 7.580 7.786 ( -2.893 -7.720 -3.641) 9.012 8.071 ( 0.347 -12.584 -7.774) 14.796 8.318 ( -2.174 -0.871 3.974) 4.613 8.626 ( -3.133 -5.778 0.906) 6.635 8.937 ( 6.341 2.648 5.897) 9.055 9.060 ( 3.414 -3.752 3.703) 6.281 9.434 ( -7.372 4.861 2.656) 9.221 9.683 ( -1.455 -2.812 4.376) 5.401 9.903 ( 2.416 2.721 -4.198) 5.555 9.937 ( 6.944 -0.408 -0.976) 7.024 10.050 ( 3.421 -2.314 -2.244) 4.701 10.162 ( 6.761 -3.325 -1.069) 7.610 10.671 ( -0.726 1.630 0.026) 1.784 10.800 ( 0.900 0.710 2.019) 2.321 10.988 ( 4.093 5.415 10.066) 12.140 11.181 ( 2.477 -1.838 3.569) 4.717 11.536 ( -6.146 -0.142 -0.350) 6.157 11.760 ( -10.528 -4.923 -4.733) 12.549 12.031 ( 4.819 5.298 2.201) 7.492 12.231 ( -1.352 2.489 2.441) 3.739 12.964 ( 7.835 4.453 0.014) 9.012 13.077 ( 7.300 0.872 -1.166) 7.443 13.590 ( -8.967 -1.753 5.331) 10.578 13.652 ( -7.430 -1.686 -0.096) 7.620 13.898 ( -0.703 2.476 -1.571) 3.015 13.947 ( -1.986 0.508 -2.158) 2.976 15.374 ( 2.696 4.071 -1.462) 5.097 15.555 ( -3.152 -4.046 -1.317) 5.295 15.842 ( -0.148 1.186 5.451) 5.580 16.125 ( 2.814 -1.656 -10.374) 10.876 16.534 ( 3.533 1.225 -9.855) 10.541 16.734 ( 9.155 5.342 4.006) 11.331 17.131 ( 8.441 -4.606 8.367) 12.747 17.378 ( 10.271 -13.541 -2.278) 17.148 17.959 ( -4.652 15.478 -10.662) 19.361 18.101 ( 0.813 4.813 -0.163) 4.884 19.116 ( -7.976 0.024 15.063) 17.045 19.682 ( -15.369 -14.600 -7.096) 22.355 ======================= Grid point 37 (23/195) ======================= q-point: ( 0.36 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.798 ( -3.526 3.851 9.852) 11.150 1.915 ( -4.852 2.840 -6.030) 8.245 2.071 ( -0.997 3.575 -2.944) 4.737 2.222 ( -3.745 -3.653 -5.955) 7.926 2.317 ( 2.898 -2.524 2.568) 4.622 2.541 ( 3.194 -0.776 -4.828) 5.841 2.829 ( -4.397 -4.102 1.486) 6.194 2.929 ( -7.737 -6.721 -3.715) 10.901 3.190 ( -4.402 -1.115 -1.288) 4.720 3.374 ( -1.282 -5.437 2.107) 5.971 3.489 ( -0.399 1.089 2.095) 2.395 3.559 ( -1.195 4.472 -1.381) 4.831 4.222 ( 1.476 1.192 2.933) 3.493 4.413 ( 2.365 3.215 -0.150) 3.994 4.527 ( 5.176 -4.105 6.228) 9.079 4.696 ( 2.166 0.725 4.722) 5.246 4.846 ( -1.432 -2.958 -0.842) 3.392 5.013 ( 0.159 -4.944 1.967) 5.323 6.560 ( -4.548 0.244 -3.438) 5.706 6.648 ( -5.008 -2.421 -2.275) 6.010 7.182 ( -0.654 2.100 -2.599) 3.405 7.540 ( -0.578 -5.838 -2.055) 6.216 7.759 ( 0.639 -8.653 1.631) 8.829 7.974 ( -0.022 -12.140 -8.245) 14.675 8.335 ( -0.969 -4.580 2.200) 5.172 8.591 ( -1.915 -8.423 0.512) 8.653 9.080 ( 2.870 4.833 2.133) 6.012 9.158 ( 1.180 3.484 7.739) 8.568 9.330 ( -6.594 3.347 2.475) 7.798 9.686 ( -2.281 -5.276 0.455) 5.766 9.828 ( -2.418 0.933 -2.616) 3.682 9.967 ( -0.643 -2.803 -4.431) 5.282 10.069 ( 5.892 2.946 -1.844) 6.841 10.392 ( 13.498 -8.210 1.026) 15.832 10.681 ( 0.126 3.609 2.303) 4.283 10.841 ( 0.834 2.334 1.802) 3.064 11.159 ( 1.525 1.769 8.551) 8.865 11.238 ( 1.890 -0.107 -0.147) 1.898 11.445 ( -4.634 -3.631 1.394) 6.050 11.550 ( -6.738 -2.789 -4.374) 8.504 12.089 ( 2.683 5.581 -1.399) 6.349 12.260 ( -1.191 1.760 4.369) 4.858 13.079 ( 5.076 6.114 0.295) 7.952 13.229 ( 8.301 3.743 0.750) 9.137 13.490 ( -8.850 -1.880 -1.606) 9.189 13.520 ( -4.520 -6.658 4.258) 9.104 13.843 ( -2.192 2.253 -2.944) 4.307 13.915 ( -0.612 1.045 -0.678) 1.388 15.368 ( -1.248 -2.376 -1.032) 2.875 15.452 ( -4.810 -6.740 -3.286) 8.909 15.865 ( 1.588 1.871 -0.773) 2.573 16.094 ( 0.358 -3.559 -3.067) 4.712 16.561 ( 9.684 10.746 -3.271) 14.831 16.956 ( 10.554 7.621 2.502) 13.256 17.360 ( 3.564 0.544 7.137) 7.996 17.512 ( 3.508 -5.549 1.930) 6.843 17.754 ( -1.057 8.451 -7.560) 11.388 18.097 ( 2.277 1.894 -5.443) 6.197 19.152 ( -6.379 -6.820 11.264) 14.632 19.334 ( -14.628 -13.405 -6.342) 20.830 ======================= Grid point 38 (24/195) ======================= q-point: ( 0.45 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.770 ( -3.882 -0.036 -1.864) 4.307 1.852 ( -1.748 4.330 7.687) 8.994 2.029 ( -1.941 0.568 -5.418) 5.783 2.131 ( 1.055 -7.016 -1.168) 7.191 2.447 ( 7.432 -1.527 0.962) 7.648 2.567 ( 4.277 -3.089 -2.233) 5.729 2.683 ( -10.455 -4.825 -0.112) 11.515 2.795 ( -4.348 -2.364 -1.582) 5.196 3.133 ( -0.996 -3.284 0.058) 3.432 3.341 ( -1.754 -0.639 -1.090) 2.162 3.504 ( 1.389 -1.634 -0.119) 2.148 3.549 ( -0.972 3.558 0.870) 3.790 4.295 ( 1.482 2.963 2.829) 4.357 4.425 ( 0.461 1.891 -1.261) 2.320 4.669 ( 3.414 -2.771 3.596) 5.680 4.745 ( -0.302 -3.959 0.360) 3.987 4.829 ( -0.225 1.317 0.454) 1.411 5.028 ( -0.093 -4.896 0.586) 4.931 6.483 ( -1.129 0.709 -1.290) 1.855 6.559 ( -2.399 -1.995 -1.105) 3.310 7.164 ( 0.601 2.717 -0.983) 2.951 7.510 ( -0.828 -5.264 -0.508) 5.353 7.817 ( 0.826 -10.273 4.889) 11.407 7.890 ( 0.671 -12.033 -7.078) 13.977 8.331 ( -1.053 -5.200 0.770) 5.361 8.569 ( -0.719 -9.234 -0.166) 9.264 9.115 ( 2.022 5.798 -0.764) 6.188 9.174 ( -4.684 7.604 1.873) 9.125 9.387 ( 3.085 1.712 9.065) 9.728 9.581 ( -3.649 -0.520 -7.515) 8.370 9.805 ( -0.848 -2.939 1.482) 3.399 9.925 ( 0.398 -5.250 -2.138) 5.683 10.123 ( 1.857 3.516 -0.415) 3.998 10.590 ( 7.673 -13.632 -0.198) 15.644 10.708 ( -0.851 4.894 2.459) 5.542 10.863 ( 0.295 3.507 0.403) 3.542 11.175 ( -2.334 1.400 -0.553) 2.777 11.286 ( 1.071 3.928 2.004) 4.538 11.416 ( -1.199 -7.259 1.517) 7.512 11.449 ( -1.341 -0.921 -1.501) 2.214 12.114 ( 1.234 4.977 -0.282) 5.135 12.274 ( -0.765 0.654 1.337) 1.674 13.129 ( 0.699 6.710 0.173) 6.749 13.326 ( 1.679 0.094 -2.466) 2.985 13.364 ( -1.500 2.396 0.949) 2.982 13.535 ( -0.934 -4.154 2.872) 5.136 13.791 ( -0.236 0.693 -0.982) 1.225 13.891 ( -1.033 -1.802 -0.725) 2.200 15.333 ( -1.258 -4.490 -0.176) 4.666 15.352 ( -2.029 -5.965 -2.128) 6.650 15.897 ( 2.231 -1.104 -0.454) 2.530 16.050 ( -1.485 -4.922 -1.249) 5.291 16.734 ( 7.892 17.346 1.951) 19.157 17.119 ( 5.349 9.827 0.633) 11.207 17.311 ( -6.238 12.911 -4.139) 14.924 17.515 ( -1.235 5.903 1.953) 6.339 17.879 ( 6.249 -9.970 8.809) 14.698 18.045 ( 1.446 -4.857 -9.626) 10.879 19.049 ( -8.017 -11.543 -1.681) 14.154 19.190 ( -1.975 -10.243 3.064) 10.873 ======================= Grid point 44 (25/195) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.695 ( 0.000 17.153 0.000) 17.153 1.968 ( 0.000 -10.727 0.000) 10.727 2.090 ( 0.000 14.332 0.000) 14.332 2.302 ( 0.000 -6.974 0.000) 6.974 2.855 ( 0.000 16.830 0.000) 16.830 2.920 ( 0.000 10.970 0.000) 10.970 3.026 ( 0.000 -0.832 0.000) 0.832 3.152 ( 0.000 -4.322 0.000) 4.322 3.256 ( 0.000 -2.704 0.000) 2.704 3.289 ( 0.000 -1.884 0.000) 1.884 3.385 ( 0.000 -0.762 0.000) 0.762 3.585 ( 0.000 -16.751 0.000) 16.751 4.145 ( 0.000 1.476 0.000) 1.476 4.204 ( 0.000 -3.939 0.000) 3.939 4.435 ( 0.000 3.767 0.000) 3.767 4.527 ( 0.000 -4.451 0.000) 4.451 4.818 ( 0.000 -0.445 0.000) 0.445 4.841 ( 0.000 -2.215 0.000) 2.215 6.927 ( 0.000 -1.570 0.000) 1.570 6.965 ( 0.000 -5.059 0.000) 5.059 7.413 ( 0.000 2.676 0.000) 2.676 7.499 ( 0.000 -6.192 0.000) 6.192 8.177 ( 0.000 0.112 0.000) 0.112 8.230 ( 0.000 -5.478 0.000) 5.478 8.502 ( 0.000 5.000 0.000) 5.000 8.578 ( 0.000 -3.136 0.000) 3.136 8.715 ( 0.000 2.806 0.000) 2.806 8.751 ( 0.000 -0.092 0.000) 0.092 9.183 ( 0.000 0.113 0.000) 0.113 9.231 ( 0.000 -5.216 0.000) 5.216 9.681 ( 0.000 1.569 0.000) 1.569 9.706 ( 0.000 -1.316 0.000) 1.316 10.191 ( 0.000 3.580 0.000) 3.580 10.260 ( 0.000 -3.461 0.000) 3.461 10.533 ( 0.000 4.669 0.000) 4.669 10.623 ( 0.000 -4.819 0.000) 4.819 11.052 ( 0.000 2.345 0.000) 2.345 11.053 ( 0.000 1.866 0.000) 1.866 11.700 ( 0.000 1.914 0.000) 1.914 11.737 ( 0.000 -1.975 0.000) 1.975 12.087 ( 0.000 5.155 0.000) 5.155 12.210 ( 0.000 -7.007 0.000) 7.007 13.222 ( 0.000 7.676 0.000) 7.676 13.307 ( 0.000 13.279 0.000) 13.279 13.368 ( 0.000 -7.119 0.000) 7.119 13.537 ( 0.000 -10.653 0.000) 10.653 14.090 ( 0.000 1.769 0.000) 1.769 14.122 ( 0.000 -1.407 0.000) 1.407 15.400 ( 0.000 5.714 0.000) 5.714 15.492 ( 0.000 -4.985 0.000) 4.985 15.625 ( 0.000 19.514 0.000) 19.514 16.022 ( 0.000 -19.834 0.000) 19.834 16.557 ( 0.000 7.848 0.000) 7.848 16.736 ( 0.000 -9.437 0.000) 9.437 17.015 ( 0.000 -0.447 0.000) 0.447 17.025 ( 0.000 -1.069 0.000) 1.069 17.964 ( 0.000 4.562 0.000) 4.562 18.057 ( 0.000 -5.135 0.000) 5.135 19.558 ( 0.000 21.963 0.000) 21.963 19.955 ( 0.000 -19.073 0.000) 19.073 ======================= Grid point 45 (26/195) ======================= q-point: ( 0.09 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( 6.251 15.985 1.973) 17.277 1.999 ( 4.611 -3.552 -2.035) 6.166 2.182 ( 6.821 6.582 4.565) 10.521 2.337 ( 2.282 -5.949 2.149) 6.724 2.672 ( -7.679 14.672 -11.042) 19.904 2.898 ( -7.031 -0.058 -2.037) 7.321 2.963 ( -5.889 0.971 -0.902) 6.036 3.066 ( -4.454 -9.022 -4.863) 11.175 3.247 ( -1.118 1.894 2.388) 3.247 3.269 ( -1.734 -3.102 -0.081) 3.555 3.416 ( 1.475 8.587 4.168) 9.658 3.687 ( 2.966 -14.525 6.292) 16.105 4.200 ( 2.366 1.241 5.126) 5.781 4.242 ( 2.149 -1.958 3.145) 4.283 4.371 ( -3.738 2.392 -3.236) 5.493 4.456 ( -4.322 -4.598 -4.361) 7.670 4.837 ( 0.562 -0.560 1.674) 1.852 4.857 ( 0.491 -2.217 1.195) 2.566 6.901 ( -2.552 -1.392 -0.651) 2.979 6.931 ( -3.478 -4.032 -0.564) 5.354 7.392 ( -1.484 2.903 -0.942) 3.394 7.489 ( -0.164 -6.975 -1.501) 7.137 8.090 ( -7.541 -1.488 -2.889) 8.211 8.112 ( -7.418 -3.451 -4.067) 9.137 8.564 ( -1.860 8.855 1.395) 9.155 8.614 ( 2.512 0.503 -0.997) 2.749 8.636 ( 4.057 -1.736 -1.872) 4.793 8.735 ( -2.073 -7.357 0.481) 7.658 9.358 ( 13.850 0.529 4.014) 14.430 9.389 ( 12.192 -2.251 4.882) 13.324 9.647 ( -2.783 3.887 0.679) 4.829 9.717 ( -0.715 -3.445 1.920) 4.009 10.147 ( -2.657 3.452 -2.235) 4.896 10.226 ( -1.799 -4.427 -2.273) 5.292 10.613 ( 4.993 4.229 3.957) 7.646 10.679 ( 2.656 -2.908 2.509) 4.670 11.015 ( -2.871 2.318 -1.127) 3.858 11.030 ( -2.411 0.478 1.686) 2.981 11.742 ( 0.720 2.911 3.813) 4.850 11.784 ( 1.698 -1.012 3.790) 4.275 12.064 ( -1.667 3.793 -0.795) 4.219 12.174 ( -0.975 -6.701 -2.989) 7.402 13.096 ( -5.050 4.746 -10.170) 12.307 13.118 ( -2.900 1.805 -7.860) 8.570 13.561 ( 2.712 1.818 11.163) 11.630 13.635 ( 2.032 -5.351 7.954) 9.800 14.040 ( -4.348 2.282 -0.981) 5.007 14.083 ( -3.622 -1.973 -1.015) 4.248 15.462 ( 6.796 4.012 -1.645) 8.062 15.524 ( 3.918 -3.110 -2.060) 5.409 15.653 ( -0.078 18.040 6.081) 19.037 16.034 ( 0.889 -19.039 0.670) 19.071 16.583 ( 4.984 10.092 -3.079) 11.669 16.783 ( 2.757 -7.877 3.373) 9.002 16.922 ( -3.024 -0.825 -8.364) 8.932 16.943 ( 0.422 -4.831 -11.970) 12.915 18.029 ( 2.455 4.795 5.660) 7.814 18.116 ( 1.673 -4.064 5.668) 7.172 19.502 ( -6.839 20.685 0.779) 21.801 19.884 ( -6.944 -18.595 -1.866) 19.936 ======================= Grid point 46 (27/195) ======================= q-point: ( 0.18 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( 3.857 13.258 2.164) 13.976 2.065 ( 5.837 0.057 -3.027) 6.576 2.333 ( 0.914 4.865 -0.533) 4.978 2.414 ( 1.601 -0.527 -3.554) 3.933 2.430 ( -2.975 4.169 0.277) 5.129 2.624 ( -12.268 -10.745 -8.981) 18.618 2.861 ( -4.978 5.973 -0.530) 7.794 2.988 ( -2.817 -6.499 0.559) 7.105 3.222 ( -3.155 -2.307 1.451) 4.169 3.246 ( -1.720 -4.740 0.499) 5.068 3.515 ( 1.867 14.568 6.158) 15.926 3.757 ( -1.560 -8.980 2.183) 9.373 4.246 ( -1.957 2.393 -1.079) 3.275 4.301 ( -3.402 -1.106 -0.892) 3.687 4.335 ( 2.034 -0.300 2.303) 3.087 4.388 ( 3.754 -4.008 6.451) 8.472 4.857 ( -0.354 -0.876 0.774) 1.221 4.875 ( -0.245 -2.355 1.789) 2.967 6.826 ( -4.229 -1.336 -1.987) 4.860 6.836 ( -5.458 -1.954 -2.350) 6.255 7.349 ( -2.636 3.461 -0.189) 4.355 7.460 ( -1.180 -7.843 -1.387) 8.051 7.889 ( -4.829 0.623 -9.485) 10.662 7.960 ( -2.718 -6.478 -7.272) 10.111 8.458 ( -8.337 7.047 2.600) 11.222 8.588 ( -6.497 -5.555 1.223) 8.635 8.766 ( 8.220 1.137 4.314) 9.353 8.824 ( 7.030 -5.154 3.288) 9.317 9.598 ( -1.332 3.504 2.175) 4.334 9.614 ( 4.603 1.790 4.206) 6.487 9.708 ( 15.372 0.105 1.972) 15.499 9.758 ( 6.047 -4.070 2.361) 7.662 10.069 ( -2.482 3.342 -3.227) 5.267 10.154 ( -2.108 -4.901 -4.409) 6.921 10.710 ( 0.169 1.439 0.573) 1.558 10.731 ( 1.447 -0.602 2.807) 3.215 10.987 ( -0.369 4.637 3.912) 6.078 11.054 ( 0.641 -2.370 5.041) 5.607 11.715 ( -5.943 4.758 -0.629) 7.639 11.821 ( -4.973 -5.950 0.615) 7.779 12.052 ( 2.458 7.229 2.086) 7.915 12.178 ( 2.866 -5.375 0.930) 6.162 12.964 ( 1.298 3.854 -5.263) 6.652 13.019 ( 1.309 -1.817 -5.296) 5.751 13.665 ( -4.934 2.028 8.088) 9.688 13.706 ( -3.998 -1.968 5.116) 6.785 13.962 ( -2.023 1.907 -1.103) 2.991 13.998 ( -3.297 -1.846 -1.586) 4.098 15.505 ( 1.493 3.917 -5.600) 6.996 15.543 ( 0.140 -1.409 -0.621) 1.546 15.789 ( 5.260 11.534 7.676) 14.820 16.062 ( 1.722 -13.951 -0.794) 14.079 16.630 ( 7.784 11.309 -9.445) 16.664 16.755 ( 0.173 2.372 -8.669) 8.989 16.866 ( 2.999 -4.292 0.610) 5.272 16.942 ( 10.838 -13.885 -1.864) 17.712 18.134 ( 1.961 4.823 4.340) 6.778 18.196 ( 0.505 -1.021 3.109) 3.311 19.356 ( -12.102 16.236 3.044) 20.478 19.683 ( -12.732 -17.009 -2.831) 21.434 ======================= Grid point 47 (28/195) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( -3.664 10.517 3.084) 11.556 2.099 ( 2.295 -3.807 -4.294) 6.180 2.181 ( -6.236 4.383 -6.865) 10.258 2.303 ( -5.306 -5.337 -9.398) 12.040 2.387 ( -6.375 6.316 4.219) 9.917 2.504 ( -0.088 -4.550 0.863) 4.632 2.818 ( 0.954 3.757 -1.844) 4.292 2.937 ( -3.504 -7.497 -1.887) 8.488 3.205 ( -1.693 -2.230 1.758) 3.306 3.224 ( -1.699 -4.685 2.134) 5.422 3.582 ( -1.342 8.705 2.879) 9.267 3.688 ( -4.494 -1.869 -2.851) 5.641 4.220 ( -0.583 1.541 1.388) 2.155 4.283 ( 2.660 -4.529 4.246) 6.754 4.442 ( 3.259 5.065 3.509) 6.971 4.538 ( 3.899 -4.278 5.928) 8.285 4.850 ( -0.924 0.584 0.736) 1.318 4.895 ( -0.252 -3.691 2.476) 4.451 6.699 ( -5.582 -0.029 -3.997) 6.866 6.717 ( -4.675 -1.968 -3.398) 6.105 7.298 ( -3.185 4.365 0.019) 5.404 7.419 ( -2.257 -8.103 -0.401) 8.421 7.744 ( 0.738 2.334 -8.729) 9.066 7.854 ( 1.613 -8.887 -9.444) 13.067 8.363 ( -6.183 5.160 3.007) 8.596 8.494 ( -6.296 -7.507 2.052) 10.010 8.972 ( 7.342 1.264 7.360) 10.472 9.001 ( 5.937 -2.099 7.319) 9.655 9.539 ( -6.934 5.553 2.139) 9.137 9.630 ( -5.074 -3.524 2.835) 6.797 9.941 ( 9.021 1.279 -2.977) 9.585 9.947 ( 5.297 1.273 -3.595) 6.528 10.017 ( 4.371 -0.158 -2.322) 4.952 10.075 ( 3.709 -5.010 -3.204) 7.009 10.717 ( -0.225 3.168 2.799) 4.233 10.778 ( 0.824 -2.588 3.537) 4.460 11.079 ( 1.817 3.716 6.990) 8.122 11.137 ( 1.430 -2.537 4.876) 5.680 11.575 ( -6.842 3.674 -2.727) 8.231 11.661 ( -8.143 -4.998 -4.026) 10.368 12.153 ( 3.452 6.144 2.270) 7.404 12.237 ( 0.940 -2.065 2.486) 3.366 13.021 ( 7.199 2.024 0.603) 7.502 13.060 ( 7.150 -1.954 0.522) 7.430 13.580 ( -10.110 1.263 2.212) 10.426 13.620 ( -9.496 -2.192 1.109) 9.809 13.939 ( -0.443 1.514 -1.138) 1.945 13.954 ( -0.692 -0.063 -1.089) 1.292 15.428 ( -3.177 2.324 -3.463) 5.242 15.482 ( -4.697 -3.365 -2.431) 6.269 15.926 ( 2.388 6.338 1.229) 6.884 16.051 ( 1.478 -5.788 -5.090) 7.848 16.653 ( 9.028 10.209 -6.173) 14.961 16.812 ( 11.099 -1.108 0.823) 11.184 17.028 ( 10.658 -2.334 4.110) 11.658 17.132 ( 11.112 -10.523 0.819) 15.326 18.164 ( -0.842 5.453 -4.896) 7.376 18.186 ( -1.598 2.735 -0.637) 3.230 19.185 ( -13.774 7.647 6.727) 17.131 19.400 ( -16.109 -13.746 -2.148) 21.285 ======================= Grid point 48 (29/195) ======================= q-point: ( 0.36 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( -6.227 5.558 7.461) 11.195 1.968 ( -11.396 0.586 -0.296) 11.415 2.063 ( 1.779 -0.891 -6.737) 7.025 2.137 ( -1.802 -5.508 -9.818) 11.401 2.385 ( 0.257 7.722 3.595) 8.521 2.510 ( 0.723 -3.775 -0.211) 3.850 2.769 ( -4.835 -0.319 -2.974) 5.686 2.826 ( -4.474 -4.717 -3.602) 7.432 3.166 ( -2.352 1.032 -1.008) 2.759 3.246 ( -0.361 -6.459 2.156) 6.819 3.550 ( -2.317 3.659 -0.653) 4.380 3.598 ( -1.745 -0.687 -1.949) 2.705 4.293 ( 2.954 5.613 5.267) 8.244 4.415 ( 3.667 -6.397 6.396) 9.761 4.512 ( 2.404 6.130 0.457) 6.601 4.634 ( 1.897 -5.739 1.445) 6.215 4.858 ( -0.058 2.722 2.424) 3.645 4.924 ( -0.061 -4.044 2.712) 4.869 6.569 ( -3.675 0.925 -3.794) 5.362 6.600 ( -3.903 -2.251 -3.260) 5.561 7.253 ( -1.271 5.242 -0.405) 5.409 7.385 ( -1.518 -8.254 0.518) 8.409 7.700 ( 2.368 1.079 -4.509) 5.206 7.780 ( 1.347 -7.289 -7.860) 10.804 8.317 ( -2.857 2.807 1.917) 4.440 8.428 ( -3.621 -7.849 1.363) 8.751 9.154 ( 4.016 3.292 5.305) 7.423 9.198 ( 5.169 -0.474 9.729) 11.027 9.424 ( -7.719 6.693 0.842) 10.251 9.564 ( -4.974 -7.102 2.229) 8.953 9.858 ( -2.217 2.030 -5.593) 6.350 9.908 ( -1.473 -3.006 -6.255) 7.094 10.133 ( 8.135 4.059 -1.900) 9.288 10.238 ( 10.067 -6.938 -0.888) 12.258 10.771 ( 0.970 5.184 4.498) 6.932 10.849 ( 1.524 -1.979 4.201) 4.888 11.173 ( -0.333 0.575 5.568) 5.607 11.203 ( 1.103 -2.550 2.502) 3.739 11.447 ( -4.275 2.620 -1.750) 5.311 11.501 ( -4.515 -2.611 -3.475) 6.267 12.201 ( 1.532 5.196 -0.521) 5.442 12.267 ( -0.471 -1.400 1.891) 2.399 13.173 ( 6.765 4.213 2.955) 8.499 13.248 ( 9.224 -2.457 4.430) 10.523 13.423 ( -8.402 -0.644 -0.682) 8.455 13.456 ( -7.783 -2.555 -0.347) 8.199 13.890 ( -2.476 2.277 -2.847) 4.407 13.920 ( -1.733 -0.665 -1.989) 2.721 15.340 ( -3.204 -0.326 -1.607) 3.600 15.361 ( -4.993 -2.728 -2.428) 6.186 15.918 ( 0.572 3.775 -3.654) 5.285 16.006 ( -0.325 -5.031 -4.290) 6.620 16.836 ( 13.079 15.972 2.405) 20.783 17.057 ( 12.172 -1.102 3.355) 12.674 17.293 ( 11.740 -6.764 7.529) 15.500 17.320 ( 8.166 -5.739 2.301) 10.243 17.994 ( -6.198 11.077 -11.146) 16.893 18.117 ( -2.108 -1.507 -7.555) 7.987 19.056 ( -11.216 -1.981 7.602) 13.694 19.113 ( -14.477 -8.066 0.085) 16.573 ======================= Grid point 49 (30/195) ======================= q-point: ( 0.45 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( -4.881 4.428 -0.167) 6.592 1.904 ( -4.881 -1.696 10.576) 11.771 2.003 ( 1.418 -0.323 -10.420) 10.521 2.052 ( 1.540 -2.217 -1.895) 3.298 2.440 ( 1.511 2.243 1.473) 3.080 2.522 ( 1.870 -3.949 -1.077) 4.501 2.632 ( -5.934 1.881 -1.077) 6.318 2.723 ( -2.712 -5.332 -1.979) 6.300 3.125 ( -0.880 3.675 -0.632) 3.831 3.249 ( -0.417 -7.524 0.078) 7.536 3.522 ( -0.269 2.958 -0.265) 2.982 3.573 ( -0.197 -1.319 -0.353) 1.379 4.394 ( 1.728 6.619 3.553) 7.708 4.487 ( 0.121 1.813 -0.023) 1.818 4.574 ( 2.490 -3.363 2.781) 5.024 4.645 ( -0.054 -5.620 -1.591) 5.841 4.889 ( 0.232 3.136 1.567) 3.514 4.949 ( -0.025 -3.305 1.227) 3.526 6.497 ( -1.017 0.828 -1.517) 2.005 6.521 ( -1.734 -1.745 -1.369) 2.815 7.246 ( 0.276 5.644 -0.080) 5.652 7.377 ( -0.381 -7.595 0.525) 7.623 7.699 ( 0.444 -2.334 -0.105) 2.378 7.722 ( 0.589 -4.949 -4.314) 6.592 8.300 ( -0.922 2.122 0.549) 2.378 8.401 ( -0.884 -7.635 0.346) 7.694 9.235 ( 1.819 6.241 1.122) 6.597 9.304 ( -3.638 2.608 0.078) 4.477 9.397 ( 2.857 2.331 7.736) 8.570 9.514 ( -3.032 -6.202 -0.904) 6.962 9.781 ( -1.055 0.705 -1.717) 2.135 9.828 ( -0.557 -4.034 -3.587) 5.427 10.208 ( 2.758 5.460 -1.009) 6.200 10.351 ( 3.917 -9.839 -0.665) 10.611 10.831 ( 0.615 6.489 2.249) 6.895 10.907 ( 0.807 -0.409 1.693) 1.920 11.188 ( -1.195 0.502 0.917) 1.588 11.236 ( -0.022 -5.151 1.263) 5.304 11.396 ( -0.786 2.580 -0.123) 2.700 11.433 ( -0.791 -1.178 -1.027) 1.751 12.212 ( 0.560 4.478 -0.327) 4.524 12.271 ( -0.426 -1.424 0.480) 1.562 13.237 ( -1.139 4.418 0.220) 4.568 13.295 ( -3.809 -1.764 -1.018) 4.319 13.409 ( 4.968 1.334 0.939) 5.229 13.453 ( 2.221 -3.721 4.088) 5.958 13.813 ( -1.819 1.527 -1.929) 3.060 13.849 ( -2.666 -2.202 -2.277) 4.140 15.279 ( -1.975 -0.837 -0.774) 2.281 15.289 ( -1.151 -1.650 -0.609) 2.102 15.898 ( 0.688 1.488 -1.437) 2.180 15.956 ( -0.740 -4.300 -1.802) 4.720 17.073 ( 7.815 15.966 2.785) 17.993 17.250 ( 6.036 0.610 1.263) 6.197 17.460 ( 4.307 3.663 4.689) 7.346 17.574 ( 5.065 -4.461 7.736) 10.266 17.760 ( -2.894 4.825 -5.938) 8.181 17.931 ( -5.419 -8.075 -12.476) 15.818 18.917 ( -6.710 -0.859 1.184) 6.868 19.002 ( -3.871 -8.279 2.950) 9.604 ======================= Grid point 99 (31/195) ======================= q-point: ( 0.00 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.491 ( -11.354 0.000 25.760) 28.151 0.559 ( -0.921 0.000 29.425) 29.439 0.868 ( 1.033 0.000 44.374) 44.386 2.165 ( 6.172 0.000 -1.448) 6.339 2.748 ( 2.988 0.000 -0.612) 3.050 2.877 ( -3.460 0.000 -14.357) 14.768 2.900 ( -4.320 0.000 5.243) 6.793 3.229 ( 3.860 0.000 4.485) 5.917 3.430 ( 0.860 0.000 -7.776) 7.823 3.644 ( 0.929 0.000 0.308) 0.979 3.896 ( -1.853 0.000 -6.362) 6.626 4.072 ( 1.137 0.000 2.137) 2.420 4.220 ( -1.381 0.000 -7.272) 7.402 4.271 ( 0.279 0.000 4.521) 4.530 4.469 ( -0.893 0.000 1.497) 1.743 4.503 ( 1.551 0.000 2.651) 3.072 5.030 ( -0.973 0.000 2.986) 3.141 5.220 ( -0.249 0.000 -0.910) 0.943 7.266 ( -1.521 0.000 -2.709) 3.106 7.396 ( 0.091 0.000 -1.614) 1.617 7.480 ( 1.080 0.000 -4.029) 4.171 7.993 ( 9.545 0.000 -11.357) 14.836 8.159 ( 0.351 0.000 8.429) 8.437 8.452 ( -5.066 0.000 -5.204) 7.263 8.497 ( -0.511 0.000 -7.428) 7.446 8.663 ( -2.627 0.000 0.507) 2.676 8.798 ( -6.213 0.000 6.649) 9.101 8.904 ( -2.782 0.000 -1.538) 3.179 9.209 ( 4.979 0.000 8.603) 9.940 9.448 ( 1.260 0.000 8.334) 8.428 9.766 ( 2.831 0.000 5.399) 6.097 9.840 ( 4.865 0.000 5.909) 7.654 9.985 ( 0.445 0.000 0.127) 0.463 10.272 ( -4.209 0.000 0.523) 4.241 10.347 ( -2.545 0.000 -2.773) 3.764 10.616 ( 2.019 0.000 -10.331) 10.526 10.827 ( 5.579 0.000 4.828) 7.378 10.991 ( -0.699 0.000 1.461) 1.619 11.591 ( 0.028 0.000 1.180) 1.181 11.789 ( -3.445 0.000 6.857) 7.674 12.183 ( -2.446 0.000 -3.949) 4.645 12.355 ( 1.817 0.000 4.711) 5.049 12.508 ( -1.525 0.000 -3.154) 3.503 12.723 ( 4.061 0.000 -2.096) 4.570 13.613 ( -2.718 0.000 1.293) 3.010 13.801 ( -0.188 0.000 -1.787) 1.797 14.094 ( 9.420 0.000 -6.857) 11.651 14.128 ( -0.490 0.000 -2.482) 2.530 14.571 ( -13.341 0.000 13.525) 18.998 15.512 ( 2.720 0.000 5.647) 6.268 16.008 ( 2.227 0.000 -3.162) 3.868 16.651 ( -1.414 0.000 -4.545) 4.760 16.777 ( 0.887 0.000 1.098) 1.411 16.879 ( 3.005 0.000 2.217) 3.734 16.944 ( -0.265 0.000 1.569) 1.592 17.323 ( -7.632 0.000 -4.286) 8.753 17.673 ( 0.005 0.000 -4.436) 4.436 17.705 ( 4.464 0.000 -25.475) 25.863 18.828 ( 0.043 0.000 27.990) 27.990 20.737 ( -0.468 0.000 -7.284) 7.299 ======================= Grid point 100 (32/195) ======================= q-point: ( 0.09 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.737 ( 6.032 0.000 20.155) 21.038 0.978 ( 9.545 0.000 26.062) 27.755 1.561 ( 19.716 0.000 32.850) 38.312 2.286 ( 9.951 0.000 -6.483) 11.876 2.648 ( -2.215 0.000 -15.996) 16.149 2.814 ( -0.524 0.000 9.663) 9.677 2.848 ( -6.228 0.000 3.752) 7.271 3.275 ( -2.297 0.000 -1.268) 2.624 3.313 ( -2.050 0.000 -9.830) 10.041 3.618 ( -4.807 0.000 2.772) 5.549 3.751 ( -4.441 0.000 -7.090) 8.366 4.108 ( -0.577 0.000 -8.916) 8.935 4.113 ( 1.342 0.000 0.712) 1.519 4.355 ( 1.620 0.000 5.666) 5.893 4.457 ( -2.466 0.000 2.247) 3.336 4.530 ( -0.020 0.000 -0.720) 0.720 5.049 ( -1.186 0.000 3.423) 3.623 5.196 ( -1.357 0.000 -0.101) 1.361 7.118 ( -10.405 0.000 -2.441) 10.687 7.291 ( -9.389 0.000 -1.471) 9.504 7.435 ( -1.241 0.000 -4.465) 4.634 7.899 ( -3.190 0.000 -11.111) 11.560 8.271 ( 2.063 0.000 6.694) 7.005 8.352 ( 0.317 0.000 -3.621) 3.634 8.500 ( 9.602 0.000 -5.316) 10.975 8.632 ( -3.324 0.000 2.448) 4.128 8.858 ( 6.417 0.000 1.262) 6.540 8.911 ( 1.980 0.000 2.129) 2.908 9.377 ( 1.300 0.000 6.386) 6.517 9.644 ( 10.011 0.000 8.501) 13.133 9.877 ( 3.709 0.000 3.240) 4.925 9.956 ( -0.981 0.000 2.986) 3.143 10.001 ( 0.911 0.000 0.479) 1.029 10.152 ( -5.126 0.000 1.123) 5.248 10.279 ( -4.333 0.000 -1.340) 4.535 10.547 ( 2.713 0.000 -5.889) 6.484 11.000 ( 5.606 0.000 6.578) 8.642 11.002 ( -0.620 0.000 0.827) 1.033 11.609 ( 1.879 0.000 4.394) 4.779 11.849 ( 0.010 0.000 6.611) 6.611 12.032 ( -6.631 0.000 -7.427) 9.957 12.447 ( 0.722 0.000 5.904) 5.948 12.471 ( 2.506 0.000 -4.642) 5.276 12.743 ( 0.202 0.000 -1.874) 1.885 13.570 ( -2.759 0.000 -0.202) 2.766 13.774 ( -0.480 0.000 -1.657) 1.725 14.067 ( -2.101 0.000 -4.089) 4.597 14.112 ( -0.117 0.000 -3.717) 3.719 14.627 ( 2.309 0.000 12.288) 12.503 15.681 ( 5.806 0.000 8.413) 10.222 15.971 ( -1.179 0.000 -4.511) 4.663 16.570 ( -2.731 0.000 -2.411) 3.643 16.799 ( -0.952 0.000 1.532) 1.804 16.917 ( 0.764 0.000 -3.641) 3.720 16.950 ( -0.931 0.000 2.784) 2.935 17.075 ( -7.254 0.000 -11.535) 13.626 17.625 ( 12.065 0.000 -14.807) 19.100 17.651 ( 3.277 0.000 -4.420) 5.502 19.147 ( -1.068 0.000 27.294) 27.315 20.571 ( -5.693 0.000 -11.594) 12.916 ======================= Grid point 101 (33/195) ======================= q-point: ( 0.18 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( 10.943 0.000 14.482) 18.151 1.461 ( 12.991 0.000 22.241) 25.757 2.169 ( 13.994 0.000 15.954) 21.222 2.286 ( 2.922 0.000 -10.437) 10.838 2.439 ( 0.421 0.000 -16.030) 16.035 2.762 ( -7.005 0.000 3.678) 7.912 3.021 ( 4.781 0.000 14.770) 15.525 3.119 ( -9.359 0.000 -3.916) 10.145 3.139 ( -4.635 0.000 -9.714) 10.763 3.579 ( -4.830 0.000 -0.256) 4.836 3.610 ( -4.170 0.000 1.055) 4.301 3.968 ( -3.494 0.000 -9.971) 10.565 4.155 ( 3.059 0.000 1.427) 3.376 4.447 ( 3.963 0.000 -0.264) 3.972 4.452 ( -1.860 0.000 3.443) 3.913 4.485 ( -3.101 0.000 -0.104) 3.102 5.073 ( -0.573 0.000 3.503) 3.550 5.184 ( -0.685 0.000 1.222) 1.401 6.895 ( -12.380 0.000 -1.128) 12.431 7.077 ( -12.854 0.000 -0.759) 12.876 7.335 ( -2.997 0.000 -5.680) 6.422 7.717 ( -2.772 0.000 -9.493) 9.889 8.327 ( 2.295 0.000 -1.636) 2.818 8.442 ( 4.410 0.000 9.397) 10.381 8.579 ( 3.835 0.000 -3.998) 5.540 8.664 ( 2.397 0.000 6.564) 6.988 8.970 ( 1.345 0.000 1.840) 2.279 9.006 ( 10.394 0.000 -2.934) 10.800 9.345 ( -7.897 0.000 0.177) 7.899 9.824 ( -7.561 0.000 -9.717) 12.313 9.936 ( 0.761 0.000 -0.576) 0.954 9.978 ( 17.132 0.000 6.879) 18.462 10.081 ( 3.632 0.000 7.638) 8.458 10.166 ( -4.611 0.000 -2.366) 5.183 10.216 ( 3.655 0.000 9.248) 9.944 10.527 ( -0.971 0.000 -4.766) 4.864 10.999 ( 0.777 0.000 -0.288) 0.829 11.152 ( 3.852 0.000 4.884) 6.221 11.805 ( 9.717 0.000 10.212) 14.097 11.811 ( -7.808 0.000 -7.704) 10.969 11.926 ( -0.059 0.000 6.789) 6.789 12.458 ( 0.959 0.000 -5.014) 5.105 12.499 ( -1.657 0.000 4.011) 4.340 12.697 ( -0.555 0.000 -2.885) 2.937 13.520 ( -2.122 0.000 -1.133) 2.405 13.751 ( -0.666 0.000 -0.250) 0.711 13.965 ( -3.324 0.000 -5.136) 6.118 14.048 ( -3.411 0.000 -0.699) 3.482 14.889 ( 11.090 0.000 10.835) 15.504 15.859 ( 3.818 0.000 6.397) 7.449 15.880 ( -2.125 0.000 -5.108) 5.532 16.500 ( -1.867 0.000 -3.734) 4.174 16.745 ( -6.899 0.000 0.657) 6.930 16.754 ( -2.106 0.000 -15.214) 15.359 16.930 ( -5.512 0.000 1.020) 5.605 17.011 ( 2.062 0.000 4.977) 5.387 17.704 ( 8.124 0.000 -1.743) 8.309 17.716 ( 14.929 0.000 -10.829) 18.443 19.418 ( -2.824 0.000 24.248) 24.411 20.285 ( -9.229 0.000 -14.462) 17.156 ======================= Grid point 102 (34/195) ======================= q-point: ( 0.27 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( 8.442 0.000 9.243) 12.518 1.904 ( 11.393 0.000 13.556) 17.708 2.245 ( 4.374 0.000 -1.493) 4.621 2.258 ( 0.133 0.000 -10.274) 10.275 2.386 ( 3.502 0.000 -6.284) 7.194 2.689 ( -5.577 0.000 2.893) 6.283 2.927 ( -5.955 0.000 -9.824) 11.488 2.962 ( -7.390 0.000 2.251) 7.725 3.264 ( 2.369 0.000 13.315) 13.524 3.426 ( -7.216 0.000 -4.387) 8.445 3.656 ( 0.109 0.000 8.332) 8.333 3.740 ( -8.446 0.000 -11.683) 14.416 4.274 ( 7.000 0.000 3.861) 7.994 4.381 ( -0.944 0.000 -6.353) 6.422 4.471 ( -0.791 0.000 3.387) 3.478 4.541 ( 2.427 0.000 2.380) 3.399 5.110 ( 0.288 0.000 2.906) 2.920 5.198 ( 0.678 0.000 0.886) 1.116 6.684 ( -10.681 0.000 -0.685) 10.703 6.857 ( -11.287 0.000 -0.829) 11.317 7.222 ( -2.896 0.000 -3.921) 4.875 7.599 ( 0.031 0.000 -6.281) 6.281 8.351 ( 1.910 0.000 -0.788) 2.066 8.597 ( 4.292 0.000 -3.905) 5.803 8.644 ( 3.070 0.000 11.813) 12.205 8.806 ( 2.119 0.000 10.004) 10.226 8.997 ( 2.084 0.000 -1.348) 2.482 9.092 ( 3.344 0.000 -4.102) 5.293 9.196 ( -8.807 0.000 1.045) 8.869 9.535 ( -9.318 0.000 -11.931) 15.138 9.954 ( 2.148 0.000 -0.873) 2.319 10.043 ( -4.749 0.000 -1.770) 5.068 10.234 ( 1.609 0.000 6.511) 6.707 10.344 ( 13.334 0.000 4.872) 14.196 10.420 ( 0.041 0.000 -5.641) 5.641 10.468 ( 12.614 0.000 9.255) 15.645 11.004 ( 1.401 0.000 -3.415) 3.691 11.232 ( 3.025 0.000 -1.809) 3.524 11.621 ( -6.401 0.000 -2.199) 6.768 11.982 ( 0.793 0.000 4.953) 5.016 12.132 ( 9.070 0.000 10.521) 13.891 12.337 ( -7.607 0.000 -5.100) 9.158 12.492 ( -2.619 0.000 2.655) 3.729 12.716 ( 6.445 0.000 -2.767) 7.014 13.466 ( -2.450 0.000 -1.475) 2.860 13.752 ( -0.406 0.000 2.066) 2.106 13.840 ( -3.868 0.000 -5.013) 6.331 13.987 ( -3.155 0.000 -0.438) 3.185 15.230 ( 13.888 0.000 9.858) 17.031 15.797 ( -0.920 0.000 -4.211) 4.310 15.956 ( 0.608 0.000 4.447) 4.488 16.389 ( 1.721 0.000 -14.058) 14.163 16.592 ( -11.089 0.000 0.123) 11.089 16.620 ( -3.545 0.000 0.699) 3.614 16.838 ( -6.264 0.000 0.623) 6.295 17.086 ( 0.955 0.000 2.199) 2.398 17.857 ( 14.695 0.000 -9.327) 17.405 17.908 ( 13.383 0.000 4.214) 14.030 19.609 ( -4.920 0.000 19.252) 19.871 19.939 ( -10.052 0.000 -15.177) 18.204 ======================= Grid point 103 (35/195) ======================= q-point: ( 0.36 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.591 ( 4.102 0.000 3.323) 5.279 2.096 ( 6.387 0.000 -0.989) 6.463 2.167 ( 1.527 0.000 -7.025) 7.189 2.326 ( 1.372 0.000 -7.373) 7.499 2.416 ( 3.051 0.000 6.100) 6.820 2.694 ( -0.154 0.000 -5.473) 5.475 2.749 ( -0.149 0.000 8.763) 8.765 2.918 ( -2.068 0.000 5.151) 5.551 3.234 ( -8.630 0.000 -4.951) 9.949 3.382 ( -5.154 0.000 5.174) 7.303 3.412 ( -10.355 0.000 -10.625) 14.837 3.753 ( -0.686 0.000 7.295) 7.327 4.319 ( 1.015 0.000 -3.787) 3.921 4.425 ( 3.783 0.000 1.261) 3.987 4.513 ( 2.593 0.000 3.014) 3.976 4.588 ( 2.388 0.000 -1.686) 2.923 5.142 ( 0.323 0.000 1.281) 1.321 5.221 ( 1.498 0.000 -0.461) 1.567 6.524 ( -7.205 0.000 0.255) 7.210 6.683 ( -7.450 0.000 -0.818) 7.495 7.161 ( -1.236 0.000 -0.002) 1.236 7.574 ( 2.998 0.000 -2.779) 4.087 8.369 ( 2.056 0.000 -1.986) 2.859 8.636 ( 5.000 0.000 -3.227) 5.951 8.755 ( -4.792 0.000 8.008) 9.332 8.934 ( -0.553 0.000 3.942) 3.980 9.035 ( -5.570 0.000 2.070) 5.942 9.047 ( 2.629 0.000 0.433) 2.664 9.093 ( -3.359 0.000 2.709) 4.315 9.284 ( -3.448 0.000 -8.643) 9.305 9.965 ( -2.607 0.000 -0.761) 2.716 9.966 ( 0.437 0.000 -1.708) 1.762 10.220 ( -0.003 0.000 -3.388) 3.388 10.512 ( 6.274 0.000 4.662) 7.817 10.527 ( 5.162 0.000 0.590) 5.195 10.803 ( 10.824 0.000 7.417) 13.122 10.961 ( 0.497 0.000 -5.895) 5.916 11.247 ( 8.445 0.000 -7.887) 11.555 11.553 ( -3.834 0.000 4.248) 5.723 12.049 ( 0.242 0.000 4.804) 4.810 12.112 ( -10.235 0.000 -6.298) 12.017 12.266 ( 0.116 0.000 -1.649) 1.653 12.540 ( 1.759 0.000 6.121) 6.369 12.818 ( 7.442 0.000 -1.758) 7.647 13.408 ( -2.678 0.000 -0.061) 2.679 13.735 ( -2.616 0.000 -2.506) 3.622 13.777 ( 0.026 0.000 1.710) 1.710 13.928 ( -2.858 0.000 -0.016) 2.858 15.579 ( 14.292 0.000 7.758) 16.262 15.751 ( 0.757 0.000 -3.571) 3.650 16.007 ( -1.216 0.000 5.815) 5.941 16.289 ( 4.039 0.000 -10.058) 10.839 16.374 ( -14.310 0.000 0.135) 14.311 16.600 ( -2.442 0.000 2.989) 3.859 16.747 ( -6.220 0.000 3.361) 7.070 17.097 ( 0.330 0.000 -1.638) 1.671 17.989 ( 12.359 0.000 -8.284) 14.879 18.201 ( 11.348 0.000 5.885) 12.783 19.623 ( -6.405 0.000 -12.286) 13.855 19.694 ( -7.126 0.000 12.776) 14.629 ======================= Grid point 104 (36/195) ======================= q-point: ( 0.45 0.00 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 0.313 0.000 -4.099) 4.111 2.132 ( 0.206 0.000 -5.627) 5.631 2.188 ( 4.286 0.000 4.293) 6.066 2.310 ( 4.790 0.000 -3.965) 6.218 2.480 ( 4.310 0.000 2.620) 5.044 2.568 ( -2.161 0.000 -2.156) 3.053 2.935 ( -11.174 0.000 -9.979) 14.982 2.948 ( -4.927 0.000 -2.484) 5.517 3.075 ( -0.154 0.000 2.015) 2.021 3.153 ( 7.558 0.000 11.966) 14.154 3.382 ( -3.763 0.000 2.115) 4.317 3.787 ( -3.720 0.000 4.734) 6.021 4.319 ( 1.860 0.000 -1.031) 2.127 4.427 ( 0.102 0.000 -3.967) 3.968 4.579 ( -0.021 0.000 0.564) 0.565 4.582 ( 1.880 0.000 -5.317) 5.639 5.142 ( -0.565 0.000 -1.129) 1.263 5.232 ( 1.031 0.000 -1.762) 2.042 6.453 ( -2.430 0.000 1.984) 3.137 6.596 ( -2.099 0.000 0.231) 2.112 7.178 ( 0.054 0.000 4.371) 4.372 7.613 ( 2.858 0.000 -0.394) 2.885 8.375 ( 2.384 0.000 -3.437) 4.183 8.683 ( 4.046 0.000 -3.207) 5.163 8.697 ( -6.117 0.000 0.205) 6.120 8.861 ( -2.146 0.000 -4.563) 5.043 8.934 ( -5.700 0.000 -3.065) 6.472 9.013 ( -3.762 0.000 2.602) 4.574 9.181 ( 1.601 0.000 5.615) 5.839 9.316 ( 3.462 0.000 9.705) 10.304 9.930 ( -0.628 0.000 -0.415) 0.753 9.944 ( 0.842 0.000 -2.375) 2.520 10.216 ( 1.627 0.000 -1.191) 2.016 10.563 ( 1.564 0.000 -3.090) 3.463 10.615 ( 0.317 0.000 0.316) 0.448 10.910 ( -1.344 0.000 -1.427) 1.960 10.936 ( 3.945 0.000 -2.076) 4.458 11.390 ( 9.634 0.000 -1.052) 9.691 11.558 ( -1.964 0.000 4.131) 4.574 11.878 ( -3.830 0.000 -7.881) 8.762 12.070 ( -3.136 0.000 0.807) 3.238 12.229 ( 1.491 0.000 -2.456) 2.873 12.581 ( -2.931 0.000 0.110) 2.933 12.892 ( 3.316 0.000 -2.636) 4.236 13.402 ( -0.464 0.000 4.599) 4.623 13.705 ( 0.375 0.000 1.017) 1.084 13.760 ( -0.863 0.000 -2.903) 3.029 13.914 ( -1.114 0.000 2.924) 3.129 15.739 ( 2.412 0.000 -2.517) 3.486 15.889 ( 13.074 0.000 3.977) 13.665 16.039 ( -6.678 0.000 3.587) 7.581 16.132 ( -12.606 0.000 6.441) 14.156 16.281 ( 3.226 0.000 -3.917) 5.075 16.595 ( 1.393 0.000 -0.704) 1.561 16.730 ( -4.757 0.000 10.624) 11.640 17.071 ( 0.807 0.000 -4.168) 4.245 18.077 ( 8.794 0.000 -7.829) 11.774 18.345 ( 0.195 0.000 -0.996) 1.015 19.502 ( 4.386 0.000 -2.885) 5.250 19.659 ( -9.378 0.000 5.415) 10.829 ======================= Grid point 105 (37/195) ======================= q-point: (-0.45 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.560 ( -1.827 0.000 -2.721) 3.277 2.004 ( -3.154 0.000 -8.739) 9.291 2.382 ( 6.254 0.000 9.138) 11.073 2.389 ( 6.781 0.000 -0.245) 6.785 2.475 ( -16.277 0.000 -9.772) 18.986 2.593 ( 1.990 0.000 0.315) 2.015 2.662 ( 9.917 0.000 -0.049) 9.917 2.756 ( -5.537 0.000 -6.285) 8.376 3.202 ( 6.377 0.000 3.560) 7.303 3.284 ( -4.720 0.000 -0.501) 4.747 3.552 ( 11.879 0.000 13.533) 18.007 3.732 ( -6.921 0.000 1.464) 7.074 4.342 ( 1.559 0.000 -1.084) 1.899 4.366 ( 0.802 0.000 -6.654) 6.702 4.506 ( -6.762 0.000 -2.209) 7.114 4.545 ( 2.028 0.000 -5.311) 5.685 5.102 ( -1.279 0.000 -2.574) 2.874 5.211 ( -0.425 0.000 -2.721) 2.754 6.486 ( 2.384 0.000 3.217) 4.004 6.612 ( 2.970 0.000 0.750) 3.063 7.258 ( 0.597 0.000 7.954) 7.976 7.650 ( 1.081 0.000 1.388) 1.760 8.370 ( 2.437 0.000 -4.685) 5.281 8.581 ( -5.248 0.000 -2.811) 5.954 8.651 ( 0.302 0.000 -11.515) 11.519 8.731 ( -2.376 0.000 -3.296) 4.063 8.978 ( 7.313 0.000 4.566) 8.621 9.005 ( -0.143 0.000 1.677) 1.684 9.233 ( -4.054 0.000 7.078) 8.156 9.508 ( 2.658 0.000 12.147) 12.434 9.936 ( 1.705 0.000 0.072) 1.707 9.957 ( 2.700 0.000 -0.913) 2.850 10.206 ( -1.149 0.000 -2.770) 2.999 10.511 ( -2.591 0.000 -5.192) 5.802 10.569 ( -2.139 0.000 -1.034) 2.376 10.778 ( -7.126 0.000 -8.079) 10.773 11.029 ( 4.200 0.000 2.958) 5.137 11.366 ( -7.570 0.000 -5.856) 9.571 11.556 ( -0.698 0.000 6.037) 6.077 11.964 ( 15.622 0.000 -0.325) 15.625 11.978 ( -3.795 0.000 -4.163) 5.633 12.230 ( -0.964 0.000 -4.495) 4.598 12.457 ( -5.683 0.000 -3.573) 6.713 12.867 ( -1.222 0.000 -3.805) 3.996 13.480 ( 0.578 0.000 6.593) 6.618 13.722 ( 0.021 0.000 -1.212) 1.212 13.772 ( 3.651 0.000 3.927) 5.362 13.923 ( -0.488 0.000 0.206) 0.530 15.768 ( -17.931 0.000 -1.629) 18.005 15.778 ( 3.044 0.000 0.655) 3.114 16.077 ( 0.172 0.000 6.552) 6.554 16.220 ( 5.873 0.000 7.993) 9.919 16.272 ( 2.186 0.000 -5.092) 5.541 16.657 ( 4.927 0.000 0.846) 4.999 16.833 ( -1.913 0.000 16.377) 16.488 17.030 ( 1.134 0.000 -5.547) 5.661 18.111 ( 5.447 0.000 -6.845) 8.748 18.202 ( -8.544 0.000 -7.577) 11.420 19.501 ( -11.258 0.000 -1.936) 11.423 19.687 ( 13.118 0.000 5.595) 14.262 ======================= Grid point 106 (38/195) ======================= q-point: (-0.36 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -9.921 0.000 0.671) 9.943 1.783 ( -14.012 0.000 -10.583) 17.560 2.163 ( 0.838 0.000 -9.162) 9.200 2.497 ( 3.949 0.000 3.178) 5.069 2.505 ( -2.115 0.000 0.094) 2.117 2.672 ( 0.678 0.000 6.319) 6.355 2.737 ( 8.808 0.000 0.656) 8.832 2.803 ( 8.114 0.000 -8.612) 11.832 3.209 ( -3.352 0.000 3.474) 4.827 3.343 ( 7.086 0.000 0.896) 7.142 3.606 ( -6.841 0.000 -0.287) 6.847 3.877 ( 9.420 0.000 9.828) 13.613 4.319 ( 2.147 0.000 -5.429) 5.838 4.320 ( 1.371 0.000 -6.923) 7.058 4.341 ( -7.735 0.000 -2.128) 8.022 4.565 ( 2.314 0.000 2.099) 3.124 5.047 ( -1.460 0.000 -2.373) 2.786 5.159 ( -1.170 0.000 -3.230) 3.435 6.598 ( 6.089 0.000 3.128) 6.846 6.703 ( 7.081 0.000 -0.121) 7.082 7.378 ( 1.138 0.000 9.414) 9.483 7.705 ( 2.693 0.000 3.153) 4.146 8.341 ( 1.603 0.000 -7.037) 7.217 8.468 ( -4.992 0.000 -0.206) 4.996 8.487 ( 0.189 0.000 -13.678) 13.680 8.709 ( -0.412 0.000 0.728) 0.837 9.033 ( 1.317 0.000 -0.315) 1.354 9.191 ( 8.249 0.000 5.612) 9.977 9.248 ( -3.271 0.000 9.077) 9.649 9.673 ( 2.642 0.000 8.184) 8.600 9.989 ( 0.340 0.000 -0.509) 0.612 9.992 ( 3.957 0.000 0.551) 3.995 10.104 ( -3.971 0.000 -4.469) 5.979 10.344 ( -7.990 0.000 -6.491) 10.294 10.483 ( -13.944 0.000 -10.655) 17.549 10.581 ( 1.795 0.000 3.505) 3.938 11.099 ( -1.781 0.000 3.940) 4.324 11.165 ( -4.899 0.000 -7.495) 8.954 11.681 ( 4.837 0.000 7.856) 9.225 11.856 ( -2.938 0.000 -8.126) 8.641 12.010 ( -8.926 0.000 -10.492) 13.775 12.256 ( 14.589 0.000 3.602) 15.027 12.415 ( 0.031 0.000 0.776) 0.777 12.781 ( -3.059 0.000 -3.923) 4.974 13.552 ( -0.341 0.000 5.119) 5.130 13.733 ( 1.019 0.000 1.101) 1.500 13.898 ( 4.525 0.000 4.446) 6.344 13.903 ( 0.576 0.000 -3.230) 3.281 15.436 ( -19.096 0.000 0.014) 19.096 15.842 ( 1.844 0.000 2.176) 2.852 16.084 ( -8.967 0.000 7.436) 11.649 16.278 ( 5.652 0.000 -3.677) 6.743 16.419 ( 10.085 0.000 1.244) 10.162 16.748 ( 4.485 0.000 0.211) 4.490 16.982 ( 0.333 0.000 -4.682) 4.694 17.039 ( 0.770 0.000 19.206) 19.221 17.953 ( -8.504 0.000 -7.303) 11.210 18.116 ( 2.627 0.000 -3.566) 4.430 19.235 ( -12.414 0.000 -8.647) 15.129 20.018 ( 15.135 0.000 7.521) 16.901 ======================= Grid point 107 (39/195) ======================= q-point: (-0.27 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -20.170 0.000 0.643) 20.180 1.325 ( -22.039 0.000 -10.101) 24.244 2.225 ( -24.455 0.000 -7.733) 25.648 2.249 ( 15.207 0.000 -5.631) 16.217 2.651 ( 8.091 0.000 5.250) 9.645 2.657 ( -6.803 0.000 -7.467) 10.101 2.779 ( 1.896 0.000 0.748) 2.038 2.993 ( 14.821 0.000 3.877) 15.319 3.283 ( 3.475 0.000 5.607) 6.597 3.464 ( 3.193 0.000 -0.590) 3.247 3.555 ( 3.665 0.000 1.245) 3.870 4.100 ( 6.142 0.000 4.918) 7.868 4.215 ( -4.268 0.000 -1.041) 4.394 4.264 ( 1.987 0.000 -5.483) 5.832 4.326 ( 3.418 0.000 -2.062) 3.992 4.617 ( -1.429 0.000 2.540) 2.915 5.006 ( -0.873 0.000 -0.982) 1.314 5.121 ( 1.166 0.000 -1.816) 2.158 6.763 ( 9.309 0.000 2.440) 9.624 6.856 ( 11.579 0.000 -0.843) 11.610 7.497 ( 0.963 0.000 6.635) 6.705 7.808 ( 5.201 0.000 1.516) 5.417 8.248 ( -2.358 0.000 -6.548) 6.959 8.371 ( 3.128 0.000 -9.727) 10.218 8.438 ( -1.271 0.000 4.500) 4.676 8.719 ( -0.525 0.000 2.259) 2.319 9.016 ( -2.668 0.000 0.155) 2.672 9.324 ( -2.825 0.000 7.168) 7.704 9.359 ( 1.992 0.000 8.906) 9.126 9.773 ( 1.957 0.000 -0.603) 2.047 9.893 ( -1.573 0.000 -8.256) 8.404 9.999 ( -5.192 0.000 -9.014) 10.403 10.072 ( -2.215 0.000 5.329) 5.771 10.085 ( -13.191 0.000 -7.629) 15.239 10.207 ( -0.790 0.000 1.811) 1.976 10.664 ( 1.714 0.000 2.431) 2.975 11.018 ( -2.672 0.000 -7.548) 8.007 11.047 ( -6.128 0.000 1.251) 6.254 11.665 ( -4.327 0.000 -8.522) 9.558 11.851 ( -2.120 0.000 -2.357) 3.170 11.880 ( 7.251 0.000 7.391) 10.354 12.408 ( -1.485 0.000 -0.598) 1.601 12.516 ( 9.474 0.000 4.210) 10.368 12.684 ( -2.519 0.000 -3.859) 4.608 13.590 ( -0.895 0.000 3.463) 3.577 13.768 ( 0.958 0.000 1.383) 1.683 13.885 ( 3.693 0.000 -5.352) 6.502 14.015 ( 3.720 0.000 3.192) 4.902 15.129 ( -18.732 0.000 3.688) 19.092 15.884 ( 2.008 0.000 -0.203) 2.018 15.935 ( -13.548 0.000 0.763) 13.569 16.387 ( 7.595 0.000 1.851) 7.818 16.588 ( 9.186 0.000 -0.760) 9.217 16.808 ( 3.609 0.000 -2.079) 4.165 16.939 ( -1.000 0.000 -1.256) 1.605 17.273 ( 1.465 0.000 15.819) 15.887 17.776 ( -3.982 0.000 -4.287) 5.851 18.137 ( 0.352 0.000 4.098) 4.113 18.880 ( -12.590 0.000 -14.855) 19.473 20.352 ( 13.903 0.000 5.963) 15.128 ======================= Grid point 108 (40/195) ======================= q-point: (-0.18 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( -24.286 0.000 3.202) 24.497 0.839 ( -23.854 0.000 -4.168) 24.216 1.579 ( -39.266 0.000 -4.704) 39.547 2.368 ( -2.186 0.000 -13.177) 13.357 2.509 ( 9.555 0.000 -0.362) 9.562 2.828 ( -0.705 0.000 4.971) 5.020 2.866 ( 7.879 0.000 7.037) 10.564 3.210 ( 4.168 0.000 -2.135) 4.683 3.398 ( 4.791 0.000 0.829) 4.863 3.463 ( 4.929 0.000 -1.842) 5.263 3.735 ( 9.993 0.000 3.275) 10.516 4.161 ( -1.607 0.000 0.015) 1.607 4.175 ( 2.192 0.000 -1.878) 2.886 4.315 ( 3.184 0.000 4.798) 5.758 4.382 ( 3.544 0.000 0.683) 3.609 4.546 ( -5.572 0.000 -3.409) 6.533 4.997 ( -0.179 0.000 0.834) 0.853 5.160 ( 3.307 0.000 0.537) 3.351 6.975 ( 12.172 0.000 1.969) 12.330 7.079 ( 14.912 0.000 -0.705) 14.928 7.545 ( 0.142 0.000 0.030) 0.145 7.884 ( 6.721 0.000 -6.214) 9.154 8.140 ( -3.959 0.000 -1.614) 4.276 8.390 ( 6.819 0.000 -2.039) 7.117 8.518 ( 0.987 0.000 8.157) 8.216 8.739 ( -1.706 0.000 3.956) 4.308 8.965 ( -3.988 0.000 1.586) 4.292 9.243 ( -16.976 0.000 8.312) 18.902 9.412 ( -7.004 0.000 3.980) 8.056 9.607 ( -14.973 0.000 -12.096) 19.248 9.691 ( -0.185 0.000 -9.051) 9.053 9.848 ( 0.780 0.000 -2.989) 3.089 10.029 ( 6.604 0.000 0.448) 6.619 10.073 ( -3.553 0.000 2.785) 4.515 10.301 ( 3.361 0.000 5.246) 6.231 10.678 ( 1.563 0.000 -1.851) 2.423 10.883 ( -2.993 0.000 -7.138) 7.740 11.009 ( -0.584 0.000 1.347) 1.468 11.556 ( -2.663 0.000 -0.472) 2.705 11.823 ( -1.865 0.000 2.062) 2.780 12.078 ( 6.501 0.000 5.157) 8.298 12.352 ( -2.612 0.000 -2.084) 3.341 12.601 ( -3.027 0.000 0.688) 3.104 12.670 ( 5.408 0.000 -2.600) 6.001 13.611 ( -0.819 0.000 2.872) 2.987 13.793 ( 0.842 0.000 0.319) 0.900 13.912 ( 7.446 0.000 -6.423) 9.833 14.098 ( 2.673 0.000 1.538) 3.084 14.887 ( -18.169 0.000 8.835) 20.204 15.681 ( -12.363 0.000 -3.340) 12.806 15.922 ( 4.165 0.000 -1.927) 4.590 16.551 ( 5.876 0.000 5.143) 7.809 16.714 ( 6.091 0.000 -0.081) 6.091 16.823 ( 2.963 0.000 -4.846) 5.680 16.924 ( -0.669 0.000 1.185) 1.361 17.422 ( -0.458 0.000 7.032) 7.047 17.706 ( -0.386 0.000 -2.036) 2.072 18.255 ( -0.065 0.000 16.317) 16.317 18.466 ( -11.027 0.000 -20.597) 23.363 20.614 ( 10.411 0.000 2.410) 10.686 ======================= Grid point 109 (41/195) ======================= q-point: (-0.09 0.00 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.473 ( -21.490 0.000 14.127) 25.717 0.510 ( -22.934 0.000 15.717) 27.803 0.895 ( -42.929 0.000 17.132) 46.221 2.177 ( -2.976 0.000 -5.844) 6.558 2.677 ( 9.134 0.000 -3.298) 9.711 2.875 ( -1.391 0.000 6.073) 6.230 3.066 ( 4.608 0.000 4.114) 6.177 3.103 ( -2.579 0.000 -8.782) 9.153 3.457 ( 3.987 0.000 -4.017) 5.659 3.584 ( 6.302 0.000 -0.062) 6.303 3.903 ( 5.711 0.000 -0.548) 5.738 4.161 ( -0.630 0.000 -1.259) 1.407 4.201 ( 0.968 0.000 2.335) 2.528 4.378 ( -5.899 0.000 -4.101) 7.184 4.428 ( 3.041 0.000 1.866) 3.567 4.443 ( 1.669 0.000 1.202) 2.057 5.012 ( -0.292 0.000 2.168) 2.187 5.213 ( 1.908 0.000 -0.009) 1.908 7.196 ( 10.075 0.000 0.621) 10.094 7.310 ( 11.177 0.000 -0.729) 11.200 7.519 ( 0.604 0.000 -4.660) 4.699 7.930 ( 11.140 0.000 -10.686) 15.437 8.095 ( -2.471 0.000 4.269) 4.932 8.499 ( 6.190 0.000 -1.721) 6.424 8.577 ( -5.312 0.000 3.792) 6.527 8.731 ( -4.799 0.000 2.208) 5.282 8.954 ( -0.445 0.000 3.453) 3.481 8.985 ( -19.359 0.000 5.207) 20.047 9.187 ( -10.451 0.000 -4.717) 11.466 9.407 ( -4.245 0.000 2.860) 5.118 9.663 ( 2.498 0.000 2.990) 3.896 9.815 ( 0.127 0.000 -3.720) 3.723 10.050 ( -2.886 0.000 -2.755) 3.990 10.203 ( 7.733 0.000 2.812) 8.228 10.393 ( 0.157 0.000 3.143) 3.147 10.691 ( 3.910 0.000 -6.871) 7.906 10.770 ( -0.984 0.000 -3.622) 3.753 11.003 ( -1.633 0.000 1.432) 2.172 11.538 ( -0.776 0.000 -0.565) 0.960 11.804 ( -5.734 0.000 5.204) 7.743 12.198 ( 2.728 0.000 0.865) 2.862 12.306 ( -0.105 0.000 -0.006) 0.105 12.566 ( -2.655 0.000 0.727) 2.753 12.692 ( 3.674 0.000 -4.863) 6.094 13.626 ( -1.471 0.000 2.565) 2.957 13.807 ( 0.930 0.000 -0.004) 0.930 13.991 ( 10.833 0.000 -6.226) 12.495 14.139 ( 1.261 0.000 -0.451) 1.339 14.704 ( -18.008 0.000 12.779) 22.081 15.498 ( -5.036 0.000 -0.463) 5.057 15.977 ( 4.767 0.000 -2.498) 5.382 16.676 ( 2.407 0.000 1.670) 2.930 16.800 ( 2.545 0.000 -0.149) 2.550 16.816 ( 2.985 0.000 -2.886) 4.152 16.929 ( -0.568 0.000 -1.085) 1.225 17.429 ( -3.831 0.000 1.411) 4.082 17.728 ( 3.911 0.000 3.684) 5.373 18.039 ( -5.660 0.000 -26.424) 27.023 18.508 ( 0.195 0.000 25.407) 25.408 20.752 ( 5.279 0.000 -2.289) 5.754 ======================= Grid point 110 (42/195) ======================= q-point: ( 0.00 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.614 ( -2.127 17.653 14.263) 22.795 0.698 ( -2.186 15.629 19.605) 25.167 1.256 ( -1.804 28.706 33.475) 44.134 2.169 ( 5.842 0.263 -1.455) 6.026 2.706 ( -1.016 -5.877 -8.135) 10.087 2.801 ( -0.487 -1.532 -2.637) 3.089 2.974 ( -3.596 2.451 1.016) 4.469 3.189 ( 4.191 -3.607 5.169) 7.569 3.435 ( 0.909 0.101 -6.381) 6.446 3.618 ( 1.050 -2.566 -0.034) 2.773 3.814 ( -1.619 -7.944 -7.516) 11.055 4.074 ( 1.077 -0.051 1.837) 2.130 4.213 ( -3.442 -1.183 -6.234) 7.219 4.265 ( 0.206 -0.536 2.567) 2.630 4.465 ( 1.053 0.792 3.700) 3.927 4.522 ( -0.008 0.625 1.213) 1.365 5.017 ( -0.722 -1.391 2.914) 3.309 5.173 ( -0.141 -4.750 -0.670) 4.799 7.247 ( -0.459 -2.356 -2.879) 3.749 7.333 ( -0.014 -6.118 -1.574) 6.317 7.463 ( 0.868 -2.092 -3.188) 3.911 7.935 ( 6.982 -5.750 -9.458) 13.087 8.197 ( 1.198 2.190 5.497) 6.037 8.422 ( 0.788 -3.432 -5.588) 6.605 8.531 ( -10.138 0.500 -8.471) 13.221 8.655 ( -1.179 -0.013 1.277) 1.738 8.746 ( -5.540 -4.757 4.633) 8.648 8.882 ( 0.650 -3.880 1.239) 4.125 9.221 ( 4.556 1.237 7.518) 8.878 9.507 ( -1.743 2.067 3.352) 4.307 9.724 ( 1.980 -4.695 8.041) 9.519 9.857 ( 5.426 0.198 2.749) 6.086 9.989 ( -0.504 2.622 1.841) 3.244 10.335 ( -5.523 2.160 -2.149) 6.307 10.341 ( 0.974 1.441 0.017) 1.739 10.641 ( 0.928 2.914 -8.648) 9.173 10.856 ( 5.922 2.961 4.420) 7.961 10.959 ( -1.747 -2.973 1.920) 3.947 11.582 ( 0.038 1.223 1.982) 2.329 11.769 ( -3.264 -0.940 5.538) 6.496 12.275 ( 0.983 -3.210 1.161) 3.553 12.361 ( -2.161 10.366 -2.167) 10.809 12.502 ( -1.322 -1.370 -1.800) 2.620 12.803 ( 3.291 4.622 -4.568) 7.284 13.600 ( -1.692 -0.997 2.209) 2.956 13.841 ( -0.295 3.301 -1.412) 3.602 14.062 ( 7.214 -2.916 -5.695) 9.642 14.134 ( -0.390 0.127 -2.500) 2.534 14.638 ( -11.032 7.162 12.535) 18.169 15.499 ( 2.979 -1.308 5.275) 6.198 15.930 ( 1.013 -6.920 -0.858) 7.046 16.554 ( -2.114 -7.652 -3.915) 8.851 16.774 ( 0.634 -3.121 1.385) 3.473 16.850 ( 6.947 -0.701 -1.636) 7.172 16.959 ( -4.709 0.637 -2.245) 5.255 17.296 ( -3.639 -3.378 -3.091) 5.848 17.680 ( 1.091 3.549 -5.812) 6.897 17.850 ( 2.268 11.649 -19.601) 22.914 18.842 ( 0.206 1.763 27.232) 27.289 20.676 ( -0.488 -6.176 -6.964) 9.321 ======================= Grid point 111 (43/195) ======================= q-point: ( 0.09 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.855 ( 8.341 12.527 14.859) 21.149 1.045 ( 9.876 7.789 21.283) 24.722 1.759 ( 13.398 17.468 28.952) 36.371 2.288 ( 9.861 0.217 -5.808) 11.446 2.528 ( -2.081 -8.213 -13.753) 16.153 2.816 ( -2.084 -0.044 8.469) 8.722 2.910 ( -5.530 2.718 2.306) 6.579 3.251 ( -2.373 -2.305 -0.670) 3.375 3.343 ( -0.943 2.731 -8.342) 8.828 3.589 ( -4.674 -3.149 2.386) 6.120 3.674 ( -2.695 -7.386 -7.712) 11.013 4.052 ( -4.274 -4.128 -7.664) 9.698 4.117 ( 1.522 0.266 1.329) 2.038 4.345 ( 2.515 -0.700 4.574) 5.266 4.485 ( -1.443 1.116 1.283) 2.230 4.526 ( -1.022 -0.120 -0.244) 1.057 5.038 ( -0.988 -1.164 3.207) 3.552 5.157 ( -1.020 -3.932 0.226) 4.068 7.111 ( -9.782 -1.273 -2.977) 10.304 7.236 ( -8.188 -5.221 -1.841) 9.884 7.424 ( -1.565 -1.323 -3.361) 3.937 7.851 ( -2.406 -4.668 -9.914) 11.219 8.265 ( -0.092 -1.814 0.294) 1.840 8.327 ( -1.864 -1.219 0.540) 2.292 8.484 ( 9.007 -2.221 -2.498) 9.607 8.633 ( -2.966 0.226 2.377) 3.808 8.776 ( 5.000 -6.099 -1.409) 8.011 8.934 ( 3.470 0.125 1.795) 3.909 9.427 ( 4.233 3.385 5.521) 7.737 9.572 ( 6.373 -4.806 6.382) 10.220 9.828 ( 1.581 -4.818 4.558) 6.818 9.936 ( 0.136 -3.963 -1.682) 4.307 10.027 ( -1.516 4.026 4.199) 6.012 10.265 ( -0.592 8.687 4.294) 9.709 10.294 ( -3.343 1.465 -3.011) 4.732 10.582 ( 2.293 4.038 -4.867) 6.727 10.959 ( -1.326 -3.907 1.435) 4.369 11.021 ( 5.558 1.779 5.679) 8.143 11.618 ( 1.617 1.646 4.941) 5.453 11.793 ( -1.673 -2.922 4.054) 5.270 12.161 ( -5.671 8.628 -6.185) 12.036 12.388 ( -3.139 -4.979 4.125) 7.188 12.485 ( 5.420 1.836 -3.189) 6.551 12.806 ( 1.999 4.708 -3.313) 6.094 13.591 ( -1.925 2.170 1.464) 3.250 13.808 ( -1.039 3.240 -1.919) 3.906 14.048 ( -2.120 -3.523 -3.022) 5.103 14.084 ( -1.256 -0.935 -3.659) 3.980 14.706 ( 2.473 7.884 11.415) 14.092 15.658 ( 4.369 -2.071 7.940) 9.296 15.937 ( 2.256 -3.513 -2.550) 4.892 16.445 ( -6.576 -10.300 -0.422) 12.228 16.730 ( -3.897 -3.861 -12.807) 13.933 16.822 ( -1.695 -7.002 2.305) 7.564 16.957 ( 3.692 1.776 1.687) 4.430 17.276 ( 4.594 6.884 -5.407) 9.886 17.575 ( 1.470 3.513 -11.695) 12.299 17.773 ( 5.060 8.069 -6.997) 11.818 19.149 ( -1.314 0.369 26.316) 26.352 20.513 ( -5.849 -5.848 -11.121) 13.859 ======================= Grid point 112 (44/195) ======================= q-point: ( 0.18 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.195 ( 11.605 9.518 12.027) 19.233 1.471 ( 11.417 1.998 19.347) 22.554 2.229 ( 8.148 4.398 9.417) 13.207 2.297 ( 3.341 -0.830 -10.666) 11.208 2.357 ( 1.268 -3.062 -10.127) 10.655 2.805 ( -7.736 2.288 4.412) 9.195 2.990 ( 2.800 -3.987 11.799) 12.765 3.099 ( -7.627 -0.779 -3.075) 8.260 3.222 ( -1.844 7.867 -7.940) 11.329 3.528 ( -4.496 -5.691 -4.647) 8.614 3.581 ( -3.394 -2.403 5.247) 6.696 3.891 ( -4.680 -6.473 -7.053) 10.656 4.167 ( 3.036 0.925 1.600) 3.554 4.433 ( 2.527 -1.636 -4.223) 5.186 4.460 ( -1.661 -1.475 4.504) 5.022 4.496 ( -1.548 2.951 1.698) 3.740 5.057 ( -0.754 -1.770 2.595) 3.230 5.153 ( -0.498 -3.066 1.516) 3.456 6.890 ( -11.879 -0.712 -1.668) 12.016 7.042 ( -11.153 -3.483 -1.586) 11.791 7.325 ( -4.194 -0.909 -4.520) 6.233 7.692 ( -2.029 -2.585 -8.729) 9.327 8.246 ( 1.334 -7.930 -2.133) 8.319 8.406 ( 2.288 -2.711 6.460) 7.370 8.602 ( 0.737 -7.254 6.532) 9.790 8.634 ( 3.189 4.348 -1.484) 5.593 8.856 ( 5.963 -6.649 -1.793) 9.110 9.030 ( 5.752 0.619 -0.740) 5.832 9.426 ( -5.576 5.443 1.182) 7.881 9.778 ( -1.209 -4.104 -4.162) 5.969 9.892 ( 7.047 -4.985 5.103) 10.028 9.924 ( 2.867 -1.106 -0.198) 3.079 10.066 ( 5.655 -0.730 5.461) 7.895 10.164 ( -5.990 -0.403 -2.682) 6.575 10.400 ( 4.742 13.001 6.903) 15.465 10.568 ( -0.463 4.416 -3.360) 5.569 10.961 ( 1.198 -3.296 0.713) 3.579 11.162 ( 3.777 0.776 4.085) 5.618 11.742 ( -4.135 -4.513 0.466) 6.138 11.799 ( 6.098 0.369 7.288) 9.510 12.041 ( -2.534 8.135 -0.134) 8.521 12.304 ( -6.284 -9.632 -1.659) 11.620 12.594 ( 6.234 5.430 0.858) 8.312 12.792 ( 1.426 6.897 -3.359) 7.803 13.564 ( -2.567 4.385 0.233) 5.086 13.770 ( -1.309 1.810 -0.688) 2.338 13.958 ( -3.425 -1.228 -4.065) 5.455 14.010 ( -3.397 -3.079 -0.970) 4.686 14.952 ( 10.175 6.313 10.403) 15.862 15.753 ( -1.196 -5.101 2.385) 5.756 15.967 ( 4.056 2.870 -2.153) 5.415 16.345 ( -8.149 -15.230 5.654) 18.175 16.510 ( 0.143 -4.325 -16.735) 17.285 16.799 ( -2.949 -7.529 -0.036) 8.086 17.068 ( 4.764 7.466 3.217) 9.422 17.212 ( -4.926 18.877 -4.341) 19.987 17.589 ( 11.727 -7.384 -4.916) 14.704 17.806 ( 7.774 5.493 -6.411) 11.476 19.403 ( -3.335 -1.501 23.404) 23.688 20.229 ( -9.552 -5.638 -13.905) 17.787 ======================= Grid point 113 (45/195) ======================= q-point: ( 0.27 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( 8.222 7.622 7.724) 13.615 1.863 ( 10.404 -3.439 13.090) 17.071 2.136 ( -1.550 -5.881 -9.339) 11.145 2.307 ( 6.906 -1.844 -6.345) 9.557 2.348 ( -0.985 0.846 -3.408) 3.647 2.691 ( -9.162 -2.156 1.886) 9.600 3.002 ( -3.559 7.800 -4.225) 9.557 3.025 ( -5.006 3.288 1.758) 6.243 3.246 ( 3.328 0.375 8.350) 8.996 3.368 ( -7.347 -5.632 -4.817) 10.436 3.618 ( -2.196 -3.618 4.170) 5.941 3.716 ( -6.136 -2.481 -4.244) 7.862 4.276 ( 5.867 -0.141 3.315) 6.740 4.352 ( -0.858 -2.613 -4.881) 5.603 4.507 ( 0.145 2.869 2.746) 3.974 4.547 ( 3.011 1.173 2.196) 3.907 5.073 ( -0.352 -3.714 1.868) 4.172 5.172 ( 0.650 -2.608 1.039) 2.882 6.681 ( -10.315 -0.387 -0.989) 10.369 6.838 ( -9.941 -1.917 -1.710) 10.267 7.206 ( -3.496 -1.295 -3.144) 4.876 7.594 ( 0.309 -0.670 -5.381) 5.431 8.256 ( 1.977 -9.044 -1.391) 9.362 8.490 ( -0.898 -9.563 4.505) 10.609 8.656 ( 0.528 -4.991 3.257) 5.984 8.744 ( 6.204 -2.564 4.393) 8.023 8.924 ( 1.742 -2.687 0.745) 3.288 9.076 ( 1.849 0.793 -2.117) 2.920 9.319 ( -8.530 6.773 1.928) 11.061 9.594 ( -4.771 5.065 -10.295) 12.426 9.945 ( 1.986 -0.774 -0.865) 2.301 10.035 ( -3.958 -0.619 -2.459) 4.701 10.098 ( 2.612 -8.751 7.735) 11.968 10.350 ( 15.639 -2.743 3.846) 16.337 10.485 ( 0.515 5.886 -2.698) 6.495 10.584 ( 6.142 9.620 5.492) 12.666 11.001 ( 3.296 0.148 -2.051) 3.885 11.231 ( 1.980 -0.053 -1.521) 2.497 11.610 ( -5.888 -0.492 -1.629) 6.129 12.016 ( 3.049 -10.265 7.314) 12.968 12.031 ( -3.395 1.055 2.144) 4.151 12.199 ( -1.398 -3.657 1.038) 4.050 12.669 ( 1.946 10.119 -0.459) 10.314 12.819 ( 6.100 8.761 -1.823) 10.830 13.507 ( -3.603 4.052 -0.794) 5.480 13.752 ( -1.329 -0.232 1.218) 1.817 13.840 ( -3.553 0.015 -4.705) 5.896 13.958 ( -2.658 -2.641 0.644) 3.802 15.263 ( 12.071 3.161 8.475) 15.084 15.729 ( -0.816 -4.966 -0.337) 5.044 15.969 ( -1.995 -1.134 -1.228) 2.603 16.294 ( -2.399 -11.700 -0.295) 11.947 16.369 ( -0.305 -3.019 -6.584) 7.250 16.747 ( -1.454 -3.711 -1.204) 4.164 17.000 ( -8.099 19.952 -4.082) 21.916 17.208 ( 0.154 8.504 4.372) 9.564 17.802 ( 15.109 -5.738 -1.660) 16.247 17.900 ( 11.160 -0.120 -3.432) 11.677 19.574 ( -5.530 -3.372 18.622) 19.716 19.882 ( -10.563 -5.706 -14.668) 18.955 ======================= Grid point 114 (46/195) ======================= q-point: ( 0.36 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 3.227 4.961 2.177) 6.306 1.981 ( 0.539 -7.984 -4.588) 9.224 2.141 ( 2.730 -4.087 -1.003) 5.016 2.269 ( 5.697 -3.692 -4.569) 8.183 2.430 ( 2.746 0.461 1.070) 2.983 2.636 ( 0.916 -6.668 8.964) 11.210 2.827 ( -6.718 9.502 -6.006) 13.095 3.040 ( 0.565 7.976 6.228) 10.135 3.155 ( -10.307 -6.591 -5.672) 13.485 3.361 ( -1.569 -1.626 4.682) 5.199 3.420 ( -8.645 -0.077 -9.421) 12.787 3.717 ( -2.370 -3.223 6.397) 7.545 4.307 ( 1.079 -1.304 -2.337) 2.885 4.409 ( 3.895 -1.539 1.149) 4.342 4.560 ( 2.478 4.145 2.337) 5.366 4.603 ( 2.843 1.760 -1.528) 3.677 5.087 ( -0.075 -5.426 0.870) 5.495 5.193 ( 1.245 -2.818 -0.402) 3.107 6.526 ( -6.812 0.076 0.208) 6.815 6.673 ( -6.617 -0.998 -1.571) 6.874 7.150 ( -1.186 -0.885 0.625) 1.606 7.574 ( 2.342 -0.116 -2.201) 3.216 8.270 ( 2.522 -9.342 -3.247) 10.207 8.505 ( -2.315 -13.021 4.270) 13.897 8.700 ( 0.722 -9.328 1.728) 9.515 8.873 ( -2.637 3.862 0.782) 4.741 8.908 ( 3.209 -9.949 -0.411) 10.462 9.071 ( -4.078 3.073 2.278) 5.591 9.235 ( -3.722 8.494 5.064) 10.566 9.415 ( -2.347 8.283 -7.872) 11.666 9.952 ( -0.356 -0.474 -0.963) 1.131 9.955 ( -1.992 -1.486 -1.720) 3.022 10.178 ( 1.402 -3.981 1.210) 4.391 10.519 ( 5.182 -0.333 -0.822) 5.257 10.570 ( 5.426 4.805 1.844) 7.479 10.834 ( 11.983 1.905 7.820) 14.435 11.011 ( 2.199 4.728 -4.616) 6.964 11.199 ( 3.819 -3.476 -9.283) 10.623 11.549 ( -3.308 -0.301 3.831) 5.071 11.886 ( -9.975 -12.153 -1.933) 15.841 12.103 ( -0.159 -3.491 3.906) 5.241 12.248 ( 1.283 0.909 0.323) 1.605 12.702 ( 2.647 12.152 0.300) 12.441 12.920 ( 6.352 8.913 -0.927) 10.984 13.433 ( -3.778 2.284 0.003) 4.415 13.707 ( -2.673 -2.519 -2.343) 4.356 13.785 ( -0.540 0.402 0.632) 0.923 13.928 ( -2.082 0.013 1.329) 2.470 15.505 ( 7.994 -5.743 0.627) 9.863 15.788 ( 5.373 -0.706 5.977) 8.068 15.899 ( -4.641 -6.929 0.845) 8.382 16.260 ( 1.560 -1.578 -3.306) 3.981 16.297 ( -5.384 -3.909 -0.064) 6.653 16.733 ( 1.109 5.105 -0.918) 5.304 16.835 ( -8.187 13.001 1.760) 15.464 17.210 ( -1.951 9.841 -0.562) 10.048 17.959 ( 11.783 -2.638 -8.431) 14.727 18.150 ( 11.657 -5.198 5.997) 14.102 19.559 ( -7.159 -6.415 -12.007) 15.381 19.645 ( -7.571 -4.849 12.235) 15.183 ======================= Grid point 115 (47/195) ======================= q-point: ( 0.45 0.11 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 0.003 2.881 -4.773) 5.575 1.943 ( 1.409 -11.720 -5.392) 12.978 2.141 ( 1.463 -4.470 4.984) 6.853 2.389 ( 2.451 1.150 -4.644) 5.376 2.456 ( 8.831 -1.886 2.167) 9.287 2.663 ( -6.258 8.590 -0.846) 10.661 2.818 ( -4.865 -5.749 -1.294) 7.642 2.931 ( 0.174 -8.520 4.172) 9.488 3.089 ( -7.689 6.857 -8.825) 13.566 3.238 ( 5.630 3.857 8.620) 10.994 3.379 ( -2.119 0.048 0.575) 2.196 3.730 ( -3.732 -5.106 4.559) 7.796 4.308 ( 1.158 -1.244 -1.451) 2.235 4.430 ( 0.472 -0.053 -2.788) 2.829 4.601 ( 1.675 2.222 -3.556) 4.515 4.610 ( 0.231 2.973 -1.637) 3.401 5.083 ( -0.498 -5.836 -0.947) 5.933 5.201 ( 0.874 -3.071 -1.544) 3.547 6.460 ( -2.252 0.678 1.995) 3.084 6.590 ( -1.573 -0.620 -0.233) 1.707 7.172 ( -0.088 -0.398 4.663) 4.681 7.604 ( 2.162 -0.917 -0.094) 2.351 8.262 ( 2.308 -10.412 -5.087) 11.816 8.519 ( -2.582 -11.557 4.589) 12.700 8.686 ( -2.180 -11.994 -3.058) 12.568 8.805 ( 0.964 1.693 -3.499) 4.005 8.922 ( -3.683 1.454 1.299) 4.167 9.049 ( 0.001 -2.049 1.786) 2.718 9.185 ( -3.923 6.293 -1.813) 7.634 9.447 ( 3.277 7.744 9.068) 12.366 9.917 ( 0.266 -2.574 -2.364) 3.505 9.934 ( -0.183 1.189 -0.018) 1.203 10.197 ( -0.109 -2.609 -0.668) 2.695 10.552 ( 3.158 0.097 -4.011) 5.106 10.668 ( 1.147 4.349 3.087) 5.455 10.941 ( -1.874 3.809 -5.816) 7.200 11.015 ( 2.296 6.175 -1.440) 6.743 11.293 ( 13.566 -10.508 0.180) 17.161 11.539 ( -4.772 -2.699 2.891) 6.198 11.693 ( -5.503 -8.877 -4.021) 11.192 12.087 ( -2.432 -2.569 -2.816) 4.522 12.258 ( 0.139 1.549 0.400) 1.606 12.729 ( 0.481 12.685 -1.816) 12.823 12.986 ( 2.560 8.567 -1.898) 9.141 13.410 ( -1.008 0.502 4.093) 4.245 13.663 ( 0.140 -3.520 -0.895) 3.635 13.776 ( -0.461 1.002 -0.441) 1.188 13.921 ( -1.523 0.582 2.176) 2.719 15.589 ( 5.456 -10.130 -2.755) 11.831 15.842 ( -4.220 -13.409 3.065) 14.388 15.995 ( 4.592 1.659 6.257) 7.937 16.146 ( -11.032 2.100 4.601) 12.136 16.303 ( 6.061 3.196 -2.206) 7.198 16.744 ( 0.606 12.024 -0.655) 12.058 16.794 ( -3.418 6.487 9.253) 11.806 17.152 ( -0.798 7.825 -4.389) 9.007 18.037 ( 8.729 -3.688 -8.371) 12.644 18.310 ( 0.491 -3.587 0.266) 3.630 19.424 ( 3.724 -7.895 -3.360) 9.353 19.603 ( -9.140 -5.500 5.314) 11.918 ======================= Grid point 116 (48/195) ======================= q-point: (-0.45 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -0.788 2.320 -3.777) 4.502 1.910 ( 2.254 -7.395 -6.510) 10.106 2.221 ( -4.262 -9.163 -1.335) 10.194 2.364 ( 1.518 -2.542 1.476) 3.308 2.553 ( -3.373 -1.001 1.108) 3.689 2.618 ( -1.496 4.489 1.838) 5.076 2.706 ( 8.226 2.853 1.280) 8.800 2.855 ( -3.382 9.510 -9.798) 14.067 3.131 ( 7.700 -6.687 5.225) 11.459 3.312 ( -3.325 2.913 -1.411) 4.640 3.512 ( 8.614 -3.547 9.719) 13.462 3.690 ( -5.244 -4.248 2.180) 7.093 4.309 ( 0.792 -3.056 -1.121) 3.350 4.387 ( 0.600 1.440 -5.087) 5.321 4.531 ( -5.487 2.872 -3.551) 7.139 4.567 ( 1.011 1.880 -5.377) 5.785 5.055 ( -0.597 -4.698 -1.727) 5.040 5.182 ( -0.420 -2.895 -2.489) 3.841 6.492 ( 2.254 0.675 3.203) 3.975 6.610 ( 3.333 -0.226 0.568) 3.388 7.246 ( -0.056 -1.016 7.853) 7.919 7.638 ( 0.996 -1.185 1.526) 2.174 8.237 ( 2.202 -11.896 -5.587) 13.326 8.497 ( -4.994 -7.110 2.063) 8.930 8.586 ( -0.551 -7.911 -8.428) 11.572 8.778 ( 0.010 4.110 -3.936) 5.691 8.963 ( 5.672 -2.480 4.333) 7.556 9.056 ( 0.727 2.780 -0.979) 3.036 9.141 ( -3.622 -3.168 4.875) 6.850 9.624 ( 2.361 7.732 10.762) 13.460 9.909 ( 2.312 -3.560 -2.662) 5.011 9.954 ( 1.543 1.199 1.067) 2.226 10.144 ( -3.517 -4.606 -2.838) 6.452 10.564 ( 1.974 3.621 -1.108) 4.271 10.646 ( -3.553 6.990 -2.734) 8.304 10.778 ( -8.354 -0.218 -7.365) 11.139 11.032 ( 2.067 0.685 -1.911) 2.898 11.375 ( -7.758 -1.105 -4.771) 9.175 11.494 ( 3.315 -5.296 6.066) 8.708 11.749 ( 10.724 -12.543 1.234) 16.549 11.993 ( -2.132 0.501 -4.771) 5.249 12.217 ( -3.378 -1.116 -5.022) 6.155 12.694 ( -0.576 16.450 -1.659) 16.543 12.959 ( -1.603 8.846 -3.396) 9.610 13.477 ( 0.826 -0.596 5.690) 5.780 13.681 ( 2.143 -3.698 -0.429) 4.296 13.795 ( 1.898 1.512 2.827) 3.726 13.910 ( -1.273 -1.009 -0.132) 1.630 15.628 ( -3.043 -9.211 0.095) 9.701 15.798 ( 0.658 -5.516 -4.233) 6.984 15.919 ( -9.599 -5.423 6.723) 12.913 16.217 ( 0.289 -0.430 8.849) 8.864 16.414 ( 6.691 7.103 1.766) 9.916 16.733 ( -0.908 7.765 -0.930) 7.873 16.925 ( 1.935 9.693 14.601) 17.633 17.094 ( 1.577 6.032 -6.682) 9.139 18.052 ( 2.875 -5.498 -7.741) 9.920 18.197 ( -6.187 -0.783 -5.614) 8.391 19.437 ( -9.685 -6.387 -2.092) 11.789 19.616 ( 12.414 -7.220 5.286) 15.303 ======================= Grid point 117 (49/195) ======================= q-point: (-0.36 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( -5.833 3.821 -1.583) 7.151 1.754 ( -14.000 -0.732 -8.146) 16.214 2.098 ( 5.690 -4.726 -6.653) 9.949 2.433 ( 2.455 -4.644 3.525) 6.326 2.575 ( -5.327 2.302 8.553) 10.335 2.700 ( 4.330 -0.299 4.884) 6.534 2.766 ( 5.764 6.840 -7.753) 11.837 2.818 ( 4.530 1.396 -7.166) 8.592 3.257 ( -0.969 4.280 1.351) 4.591 3.299 ( 7.451 -4.165 1.957) 8.758 3.560 ( -5.943 -3.980 -0.254) 7.157 3.785 ( 7.426 -8.246 7.106) 13.178 4.300 ( -0.629 -1.705 -2.413) 3.021 4.335 ( -1.886 0.491 -4.070) 4.513 4.399 ( -0.613 5.200 -4.473) 6.886 4.541 ( 0.806 -2.031 -0.527) 2.247 5.029 ( -0.440 -2.043 -1.157) 2.388 5.131 ( -1.265 -2.753 -3.191) 4.400 6.604 ( 6.035 0.495 3.164) 6.832 6.703 ( 7.007 -0.076 -0.143) 7.008 7.349 ( 0.387 -2.702 8.725) 9.142 7.692 ( 2.448 -1.221 3.110) 4.142 8.215 ( 2.519 -11.353 -4.584) 12.500 8.397 ( -3.635 -4.842 -5.701) 8.316 8.497 ( -0.771 -1.878 -4.508) 4.943 8.736 ( -0.781 2.276 -1.375) 2.771 9.045 ( -1.761 -1.214 0.057) 2.140 9.141 ( 4.305 -6.297 6.578) 10.072 9.197 ( 4.797 0.083 5.395) 7.220 9.749 ( 1.018 5.765 5.157) 7.801 9.904 ( -0.593 -7.686 -5.206) 9.302 10.004 ( 2.483 0.934 1.912) 3.270 10.055 ( -2.817 -1.476 1.072) 3.356 10.472 ( -11.921 0.813 -10.014) 15.590 10.502 ( -8.554 9.935 -5.270) 14.130 10.618 ( 1.749 3.245 3.240) 4.908 10.992 ( -2.789 -5.905 -4.037) 7.678 11.245 ( -3.793 2.948 -1.636) 5.075 11.598 ( 3.050 -5.825 1.909) 6.847 11.864 ( 0.249 -5.540 -4.775) 7.318 12.001 ( 1.819 1.596 1.830) 3.033 12.067 ( 2.556 -5.151 -4.916) 7.566 12.696 ( 0.641 15.908 1.114) 15.960 12.871 ( -3.199 8.872 -3.784) 10.162 13.544 ( 0.288 -1.091 3.606) 3.779 13.720 ( 2.398 -1.933 0.683) 3.155 13.874 ( 0.483 -1.976 -1.150) 2.337 13.902 ( 3.510 0.151 2.988) 4.612 15.417 ( -15.284 -1.354 -2.090) 15.486 15.820 ( -3.493 -1.418 5.595) 6.747 15.948 ( 7.230 -13.401 1.537) 15.304 16.243 ( -7.204 3.207 4.798) 9.231 16.560 ( 6.437 5.459 3.542) 9.153 16.713 ( 0.894 -1.828 -1.166) 2.345 17.033 ( 0.825 5.117 -7.244) 8.907 17.183 ( 5.185 13.688 16.839) 22.311 17.904 ( -7.337 -4.968 -6.074) 10.742 18.108 ( 1.054 -0.629 -3.758) 3.953 19.187 ( -11.106 -4.650 -9.036) 15.054 19.944 ( 15.426 -7.446 7.288) 18.615 ======================= Grid point 118 (50/195) ======================= q-point: (-0.27 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.299 ( -14.525 4.209 -6.694) 16.538 1.363 ( -20.478 9.271 -1.926) 22.561 2.190 ( 2.415 -0.754 -4.953) 5.562 2.387 ( -10.455 10.158 -5.647) 15.633 2.566 ( 4.984 -5.872 6.575) 10.126 2.664 ( -6.609 0.108 -7.610) 10.080 2.800 ( 3.126 0.601 0.404) 3.209 2.957 ( 14.709 -2.925 2.769) 15.251 3.319 ( 3.314 2.294 3.321) 5.222 3.433 ( 2.748 -2.526 -1.149) 3.906 3.507 ( 4.437 -4.763 0.687) 6.546 3.984 ( 6.520 -9.038 7.003) 13.163 4.208 ( -4.351 -0.296 -1.693) 4.678 4.267 ( 1.058 1.052 -7.158) 7.312 4.407 ( 3.322 4.771 -0.906) 5.884 4.571 ( -0.694 -4.342 2.947) 5.293 5.004 ( -1.124 -0.415 -1.349) 1.804 5.093 ( 1.092 -2.884 -1.448) 3.407 6.766 ( 9.219 0.220 2.239) 9.489 6.850 ( 10.909 -0.647 -0.792) 10.957 7.447 ( 0.798 -4.664 5.439) 7.210 7.787 ( 4.513 -1.970 1.666) 5.198 8.235 ( 3.034 -5.365 -0.287) 6.171 8.261 ( -1.539 -4.365 -7.837) 9.101 8.456 ( -0.803 -1.058 0.169) 1.339 8.723 ( -0.645 0.576 0.993) 1.317 9.003 ( -3.658 -2.477 1.771) 4.759 9.261 ( -3.249 -4.727 9.141) 10.791 9.351 ( 6.568 -1.946 2.690) 7.360 9.745 ( -2.595 -8.000 -8.422) 11.902 9.809 ( -1.490 3.084 -0.425) 3.451 10.019 ( -4.248 -1.743 3.088) 5.534 10.094 ( -12.929 -0.032 -7.755) 15.077 10.117 ( 2.050 3.394 0.404) 3.985 10.335 ( -4.498 11.915 -3.311) 13.159 10.691 ( 1.404 2.525 1.568) 3.287 10.897 ( -1.172 -6.123 -3.236) 7.024 11.130 ( -6.726 2.465 -3.205) 7.848 11.608 ( 0.423 -4.393 -4.534) 6.327 11.783 ( -2.801 -0.567 -0.968) 3.018 12.026 ( 6.013 6.234 1.650) 8.817 12.217 ( 5.505 -9.289 3.263) 11.280 12.706 ( -3.196 8.808 2.129) 9.609 12.792 ( 0.581 11.098 -3.516) 11.656 13.571 ( -0.125 -1.934 1.284) 2.324 13.778 ( 2.805 -0.093 1.195) 3.050 13.861 ( 2.231 -1.529 -3.242) 4.222 14.013 ( 3.946 -0.326 2.988) 4.961 15.136 ( -16.088 1.520 1.253) 16.209 15.783 ( -6.651 -4.794 2.884) 8.691 16.098 ( -9.297 9.259 -0.380) 13.127 16.144 ( 10.145 -14.263 2.151) 17.634 16.712 ( 5.929 -1.065 3.277) 6.858 16.738 ( 2.354 -1.361 0.570) 2.778 16.947 ( -1.361 1.847 -6.078) 6.497 17.451 ( 3.702 15.961 12.349) 20.517 17.757 ( -3.427 -1.865 -1.438) 4.159 18.106 ( -0.247 -2.938 3.193) 4.346 18.855 ( -10.518 -2.317 -15.468) 18.848 20.281 ( 14.181 -7.154 5.805) 16.911 ======================= Grid point 119 (51/195) ======================= q-point: (-0.18 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.924 ( -17.567 9.070 -5.047) 20.404 1.042 ( -19.125 18.475 3.302) 26.795 1.716 ( -34.946 13.029 -3.382) 37.449 2.375 ( -3.821 0.647 -12.323) 12.918 2.527 ( 10.111 1.470 -0.329) 10.222 2.763 ( 3.811 -4.892 9.120) 11.028 2.866 ( 3.216 -1.216 2.399) 4.192 3.162 ( 4.317 -3.572 -3.216) 6.460 3.402 ( 4.134 -1.548 1.039) 4.535 3.434 ( 5.673 -1.554 -2.831) 6.528 3.683 ( 9.380 -4.930 2.888) 10.983 4.130 ( -1.700 -2.293 -2.037) 3.506 4.176 ( 4.224 -2.962 6.738) 8.486 4.214 ( 1.343 -2.297 -3.083) 4.073 4.460 ( 2.732 3.167 0.244) 4.189 4.540 ( -4.545 -0.504 -0.922) 4.664 4.979 ( -0.129 -1.730 -0.062) 1.735 5.127 ( 2.534 -3.331 0.510) 4.216 6.971 ( 11.920 -0.834 1.229) 12.013 7.056 ( 13.525 -2.410 -0.708) 13.756 7.492 ( 0.960 -4.923 -0.186) 5.019 7.855 ( 5.238 -2.729 -4.665) 7.526 8.153 ( -1.374 0.385 -3.286) 3.583 8.351 ( 6.093 -3.515 3.253) 7.750 8.484 ( 0.532 -4.072 4.955) 6.435 8.728 ( -1.398 -0.515 2.477) 2.891 8.971 ( -3.584 -1.477 3.084) 4.953 9.188 ( -15.859 -4.795 7.547) 18.205 9.462 ( 0.582 0.286 3.612) 3.669 9.539 ( -12.165 -3.025 -9.470) 15.710 9.655 ( -4.937 -2.580 -7.330) 9.206 9.911 ( 0.536 3.651 -2.992) 4.751 9.994 ( -3.647 -4.493 1.625) 6.011 10.138 ( 3.139 9.130 -2.360) 9.939 10.331 ( 2.028 2.175 4.004) 4.987 10.695 ( 2.171 2.068 -2.520) 3.916 10.868 ( -1.727 -0.884 -3.620) 4.108 11.007 ( -2.477 -0.343 -0.699) 2.596 11.555 ( -2.110 0.734 -0.420) 2.273 11.768 ( -0.765 -3.039 2.159) 3.805 12.174 ( 6.495 2.117 1.744) 7.050 12.289 ( 1.014 -0.561 1.589) 1.967 12.648 ( -4.835 4.188 1.702) 6.620 12.798 ( 2.848 9.062 -2.960) 9.950 13.583 ( 0.020 -2.519 1.176) 2.780 13.831 ( 1.343 3.178 0.915) 3.569 13.887 ( 6.766 -2.894 -4.912) 8.847 14.099 ( 2.978 -0.148 1.454) 3.317 14.908 ( -15.867 3.138 6.805) 17.547 15.639 ( -9.883 -3.053 -2.076) 10.550 15.960 ( -3.215 0.803 -1.667) 3.709 16.362 ( 9.822 -9.097 3.765) 13.907 16.756 ( 1.309 -4.804 -0.972) 5.073 16.856 ( -1.379 -3.244 -3.587) 5.029 16.867 ( 5.395 4.769 2.360) 7.577 17.529 ( -3.672 6.749 2.775) 8.169 17.743 ( -0.136 5.343 -0.167) 5.348 18.225 ( 1.776 -2.785 15.595) 15.941 18.481 ( -8.313 2.116 -19.526) 21.327 20.547 ( 10.609 -6.847 2.367) 12.846 ======================= Grid point 120 (52/195) ======================= q-point: (-0.09 0.11 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.641 ( -13.617 17.348 4.717) 22.553 0.779 ( -17.475 21.623 4.272) 28.128 1.183 ( -29.583 25.194 18.934) 43.225 2.184 ( -3.071 0.525 -5.656) 6.457 2.691 ( 8.426 0.435 -2.934) 8.933 2.850 ( -1.472 -3.212 2.740) 4.472 2.999 ( 4.201 -5.512 3.820) 7.913 3.084 ( -0.726 -0.934 -4.806) 4.949 3.457 ( 3.071 -0.495 -3.262) 4.507 3.549 ( 7.182 -2.760 -0.759) 7.732 3.838 ( 5.199 -6.088 -0.310) 8.012 4.071 ( -1.547 -1.438 -1.623) 2.664 4.204 ( 0.737 -0.741 1.122) 1.533 4.336 ( 2.535 -5.031 3.425) 6.593 4.416 ( -4.082 3.461 -2.600) 5.950 4.503 ( 0.893 1.955 1.041) 2.388 4.993 ( 0.065 -1.842 1.936) 2.673 5.167 ( 1.437 -4.556 -0.046) 4.778 7.175 ( 9.946 -2.384 -0.454) 10.238 7.260 ( 9.730 -4.927 -0.678) 10.928 7.486 ( 1.153 -3.306 -3.443) 4.910 7.886 ( 9.091 -3.432 -9.305) 13.454 8.140 ( -0.310 1.274 2.838) 3.126 8.459 ( 3.084 -4.327 -1.380) 5.490 8.574 ( 1.986 -3.063 5.169) 6.328 8.731 ( -3.140 -0.990 3.722) 4.969 8.910 ( -8.681 -4.638 -0.629) 9.862 8.944 ( -16.731 -3.080 4.155) 17.512 9.214 ( -9.125 2.813 -3.158) 10.058 9.499 ( -1.096 1.842 3.147) 3.807 9.610 ( 1.598 -4.291 2.788) 5.361 9.830 ( -1.297 1.524 -4.316) 4.757 9.981 ( -0.616 0.355 1.213) 1.406 10.253 ( 7.405 3.376 1.623) 8.299 10.396 ( -0.481 -0.295 2.121) 2.194 10.720 ( 3.669 4.083 -6.052) 8.170 10.765 ( -1.122 0.480 -2.240) 2.551 10.983 ( -2.676 -1.881 1.528) 3.610 11.548 ( 0.508 1.679 1.500) 2.308 11.775 ( -3.780 -1.597 5.045) 6.503 12.230 ( 1.708 -5.656 -0.588) 5.937 12.365 ( 3.407 10.661 1.921) 11.356 12.576 ( -5.248 0.881 0.028) 5.321 12.804 ( 3.241 5.654 -4.750) 8.065 13.597 ( -0.905 -2.556 2.230) 3.510 13.848 ( 0.554 3.092 -0.333) 3.159 13.971 ( 9.896 -1.871 -5.866) 11.655 14.144 ( 1.420 -0.071 -0.510) 1.511 14.743 ( -16.059 4.937 11.403) 20.305 15.481 ( -4.437 -1.454 -0.773) 4.732 15.927 ( 0.062 -5.137 -0.635) 5.177 16.544 ( 6.444 -7.478 1.157) 9.939 16.759 ( 0.457 -3.267 -0.408) 3.324 16.794 ( 1.852 -2.316 -4.849) 5.684 16.973 ( 2.425 3.564 1.917) 4.718 17.441 ( -9.085 -0.190 1.288) 9.178 17.713 ( 0.011 3.071 -3.098) 4.362 18.115 ( -0.802 6.722 -26.140) 27.003 18.517 ( 0.567 1.880 26.256) 26.330 20.687 ( 5.391 -6.524 -2.178) 8.739 ======================= Grid point 121 (53/195) ======================= q-point: ( 0.00 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( 0.081 19.892 10.358) 22.427 1.131 ( -0.181 27.686 -0.531) 27.692 1.821 ( -2.235 27.977 23.552) 36.639 2.173 ( 4.711 0.298 -0.366) 4.734 2.582 ( -3.046 -5.323 -10.452) 12.118 2.791 ( 1.268 -0.465 -0.178) 1.362 2.998 ( -2.821 0.676 2.302) 3.703 3.123 ( 4.119 -2.261 4.507) 6.511 3.418 ( 0.581 -2.215 -2.834) 3.643 3.547 ( 1.617 -4.714 -0.993) 5.082 3.613 ( -1.989 -12.291 -9.438) 15.623 4.043 ( 2.038 -3.839 0.252) 4.354 4.206 ( -4.090 1.280 -2.118) 4.780 4.244 ( 0.283 -1.650 3.345) 3.740 4.501 ( 0.275 -1.367 0.383) 1.446 4.503 ( -0.945 1.074 1.983) 2.445 4.975 ( 0.275 -2.990 2.430) 3.863 5.049 ( -0.156 -7.472 0.268) 7.478 7.172 ( 1.557 -6.209 -3.244) 7.177 7.180 ( -0.155 -8.260 -1.896) 8.476 7.412 ( 0.501 -2.765 -1.989) 3.442 7.785 ( 2.624 -9.136 -6.159) 11.326 8.236 ( 7.973 0.765 -0.509) 8.026 8.363 ( -1.384 -1.122 1.203) 2.150 8.496 ( -14.259 -4.863 -7.956) 17.037 8.643 ( -7.003 -3.083 2.582) 8.075 8.674 ( 3.325 0.294 -0.919) 3.462 8.777 ( 3.078 -5.474 3.038) 6.976 9.251 ( 2.768 1.254 6.385) 7.071 9.543 ( -0.978 1.060 2.215) 2.644 9.609 ( -0.477 -5.689 6.186) 8.418 9.820 ( 3.400 -2.948 1.099) 4.633 10.074 ( 0.365 4.196 3.403) 5.415 10.350 ( 1.435 0.976 -1.245) 2.136 10.367 ( -0.602 0.228 -1.646) 1.768 10.753 ( -0.638 7.753 -3.593) 8.569 10.867 ( 1.107 -3.277 3.021) 4.593 10.954 ( 0.396 4.254 3.436) 5.483 11.625 ( 0.922 2.869 2.204) 3.733 11.771 ( -2.999 1.036 3.452) 4.688 12.159 ( 3.495 -6.500 2.882) 7.923 12.434 ( -4.312 -4.563 -1.813) 6.534 12.644 ( -1.499 15.262 -5.517) 16.298 12.900 ( 2.100 5.614 -4.860) 7.717 13.588 ( 0.559 -0.440 4.254) 4.313 13.859 ( 1.386 -2.923 -0.236) 3.243 14.022 ( 2.020 0.198 -2.858) 3.506 14.135 ( -0.455 -0.020 -1.951) 2.003 14.846 ( -6.786 13.952 8.750) 17.812 15.469 ( 3.387 -1.529 4.163) 5.581 15.793 ( -1.143 -6.334 3.807) 7.478 16.411 ( -2.279 -6.216 -6.164) 9.045 16.646 ( 0.031 -9.416 2.218) 9.674 16.848 ( 9.291 -0.542 -5.243) 10.682 16.956 ( -5.926 -0.751 -6.876) 9.108 17.190 ( -3.726 -7.080 -3.417) 8.700 17.779 ( 2.373 5.984 -1.463) 6.602 18.074 ( 1.203 9.024 -12.204) 15.226 18.937 ( 0.331 9.274 21.346) 23.276 20.506 ( -0.559 -11.197 -6.019) 12.725 ======================= Grid point 122 (54/195) ======================= q-point: ( 0.09 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 8.778 21.134 4.241) 23.274 1.273 ( 6.868 15.445 14.137) 22.035 2.116 ( 5.317 16.073 16.700) 23.780 2.291 ( 9.364 0.031 -3.858) 10.128 2.413 ( -2.327 -1.933 -7.954) 8.510 2.810 ( -0.801 -0.607 4.844) 4.947 2.931 ( -7.136 0.509 1.765) 7.369 3.199 ( -2.500 -2.639 -0.035) 3.635 3.370 ( -0.723 -2.527 -2.391) 3.553 3.464 ( -1.159 -8.411 -4.807) 9.757 3.536 ( -1.995 -5.679 -1.314) 6.161 3.975 ( -6.300 -3.180 -7.481) 10.284 4.144 ( 0.452 2.502 2.165) 3.339 4.327 ( 2.751 -1.164 4.176) 5.134 4.475 ( -3.249 -1.502 -1.111) 3.748 4.519 ( 0.213 -1.477 1.637) 2.215 5.001 ( -0.540 -2.801 2.152) 3.574 5.055 ( -0.324 -6.132 1.476) 6.315 7.062 ( -7.667 -3.668 -3.920) 9.360 7.105 ( -5.910 -7.924 -2.136) 10.113 7.387 ( -1.348 -2.190 -1.509) 2.982 7.732 ( -0.117 -7.345 -7.540) 10.527 8.169 ( -7.409 -6.903 -7.622) 12.675 8.354 ( -2.067 3.138 4.850) 6.135 8.385 ( -0.033 -7.822 2.325) 8.160 8.626 ( 6.421 -1.329 -0.459) 6.574 8.700 ( 2.169 -0.930 -2.117) 3.171 8.893 ( 6.000 -3.837 1.315) 7.242 9.471 ( 10.627 0.960 6.011) 12.246 9.527 ( -0.720 0.651 3.240) 3.382 9.706 ( 0.945 -7.201 6.525) 9.764 9.869 ( 1.245 -2.871 -0.039) 3.130 10.075 ( -3.756 0.842 0.988) 3.974 10.285 ( -3.364 -1.383 -4.657) 5.909 10.454 ( 6.400 8.887 5.762) 12.374 10.708 ( -0.134 7.790 -2.281) 8.118 10.878 ( -2.146 -3.420 2.396) 4.695 11.058 ( 4.175 1.880 4.631) 6.513 11.671 ( -0.942 3.291 4.129) 5.364 11.772 ( -0.065 0.955 3.532) 3.659 12.229 ( -1.292 -3.013 1.906) 3.792 12.293 ( -7.096 -3.837 -4.108) 9.053 12.592 ( 4.483 9.319 -4.091) 11.121 12.889 ( 3.266 3.673 -5.022) 7.027 13.649 ( -0.160 3.481 4.712) 5.861 13.870 ( 0.007 1.631 -0.756) 1.798 13.959 ( -5.221 -3.364 -0.979) 6.288 14.081 ( -2.180 -0.010 -3.580) 4.192 14.916 ( 3.039 13.295 8.292) 15.961 15.614 ( 3.254 -2.285 7.262) 8.280 15.850 ( 3.528 -4.742 2.824) 6.550 16.263 ( -6.280 -7.266 -5.690) 11.163 16.667 ( -1.088 -7.831 -2.475) 8.284 16.684 ( -4.932 -2.624 -10.405) 11.810 16.957 ( 4.744 -1.752 0.580) 5.090 17.209 ( 11.403 -9.338 -6.425) 16.078 17.782 ( -0.218 12.233 -4.649) 13.088 17.966 ( -0.013 11.600 -6.005) 13.063 19.178 ( -2.365 3.293 22.387) 22.751 20.352 ( -6.302 -10.533 -9.717) 15.655 ======================= Grid point 123 (55/195) ======================= q-point: ( 0.18 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 11.340 14.859 5.774) 19.563 1.565 ( 7.010 7.681 12.998) 16.646 2.208 ( 3.833 -3.372 -11.852) 12.905 2.301 ( -0.658 2.657 -4.745) 5.478 2.422 ( 0.061 4.778 3.089) 5.690 2.800 ( -9.932 -3.416 0.180) 10.505 2.892 ( 0.535 -5.288 7.188) 8.940 3.116 ( -0.996 2.468 2.309) 3.523 3.371 ( 0.124 3.148 -1.291) 3.405 3.394 ( -2.444 -4.413 -4.752) 6.931 3.517 ( -2.279 -4.161 6.139) 7.758 3.765 ( -7.296 -5.232 -6.017) 10.808 4.197 ( 2.504 2.392 1.859) 3.931 4.374 ( -3.167 -3.739 -4.112) 6.396 4.430 ( 2.443 -1.970 4.071) 5.140 4.551 ( 0.884 2.126 2.766) 3.599 4.999 ( -1.392 -4.332 0.471) 4.575 5.077 ( 0.089 -4.391 2.458) 5.033 6.862 ( -10.027 -2.230 -3.097) 10.729 6.952 ( -7.951 -5.578 -2.669) 10.073 7.310 ( -5.458 -0.297 -1.914) 5.791 7.622 ( -0.431 -4.442 -7.567) 8.785 8.045 ( -1.032 -12.061 -2.959) 12.462 8.344 ( -5.447 -8.414 1.993) 10.220 8.400 ( 0.829 -6.877 3.877) 7.938 8.699 ( 0.867 0.839 -0.956) 1.540 8.801 ( 8.779 1.267 2.983) 9.358 9.017 ( 7.363 -1.949 -0.714) 7.650 9.498 ( -4.660 2.415 3.012) 6.051 9.731 ( 6.834 -0.631 -1.032) 6.940 9.797 ( 2.350 -4.911 6.160) 8.222 9.898 ( 3.899 -1.552 0.076) 4.197 10.041 ( 1.826 -1.700 1.852) 3.107 10.152 ( -4.305 -1.011 -5.547) 7.094 10.608 ( 1.961 7.161 3.194) 8.082 10.700 ( 0.801 8.142 0.088) 8.182 10.907 ( 2.947 -0.939 4.128) 5.158 11.173 ( 3.302 0.223 3.226) 4.622 11.662 ( -3.829 -3.277 1.936) 5.399 11.847 ( 1.392 4.671 3.417) 5.952 12.103 ( -8.821 -8.556 -3.954) 12.909 12.194 ( -1.416 4.693 1.642) 5.170 12.709 ( 8.700 6.333 1.113) 10.818 12.899 ( 4.868 3.826 -4.470) 7.636 13.672 ( -3.093 5.975 3.037) 7.382 13.808 ( -4.541 1.180 -1.794) 5.023 13.895 ( -2.436 -3.352 1.224) 4.321 13.980 ( -3.676 -0.433 -4.184) 5.586 15.116 ( 8.149 9.838 7.834) 14.985 15.681 ( -3.205 -2.599 3.836) 5.634 15.969 ( 7.635 -1.993 -2.885) 8.401 16.090 ( -9.139 -9.767 2.166) 13.550 16.457 ( 0.476 -1.882 -15.557) 15.678 16.672 ( -0.582 -4.978 1.719) 5.298 17.105 ( 8.881 -2.456 4.963) 10.466 17.382 ( 15.255 -9.735 -4.305) 18.601 17.634 ( -7.032 18.486 -8.039) 21.349 17.942 ( 2.070 8.528 -3.191) 9.337 19.371 ( -4.853 -1.451 20.677) 21.288 20.075 ( -10.464 -9.981 -12.197) 18.918 ======================= Grid point 124 (56/195) ======================= q-point: ( 0.27 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( 7.719 9.369 2.274) 12.350 1.814 ( 7.365 -0.669 9.421) 11.977 2.064 ( -3.956 -0.415 -8.883) 9.733 2.269 ( -0.431 -1.437 -4.765) 4.995 2.373 ( 1.633 1.003 -2.519) 3.165 2.612 ( -10.792 -5.170 0.520) 11.978 2.985 ( -0.607 -5.583 5.391) 7.785 3.136 ( -2.084 1.020 -0.312) 2.341 3.256 ( -6.785 -1.992 -2.531) 7.511 3.357 ( 0.776 8.568 -2.242) 8.891 3.532 ( -4.197 -4.686 -0.139) 6.292 3.646 ( -3.513 -4.432 4.383) 7.155 4.254 ( 0.452 -2.303 0.916) 2.519 4.314 ( 2.892 -0.140 -1.424) 3.227 4.522 ( 3.828 -0.814 2.458) 4.622 4.617 ( 2.311 4.502 3.044) 5.906 4.973 ( -1.540 -6.218 -0.134) 6.407 5.105 ( 0.488 -4.037 1.223) 4.246 6.664 ( -8.890 -1.441 -2.220) 9.275 6.786 ( -7.245 -3.278 -2.844) 8.445 7.191 ( -4.616 0.187 -1.547) 4.872 7.566 ( 1.375 -2.311 -3.875) 4.716 8.029 ( 0.807 -13.578 -0.142) 13.602 8.252 ( -5.861 -14.541 0.336) 15.681 8.476 ( 2.440 -8.888 2.360) 9.515 8.716 ( 1.594 -2.463 0.374) 2.957 8.950 ( 2.605 3.926 3.528) 5.886 9.107 ( 3.741 2.172 0.929) 4.424 9.416 ( -8.310 3.597 2.951) 9.524 9.682 ( -0.653 2.999 -8.983) 9.493 9.924 ( -0.147 -2.273 0.842) 2.428 9.955 ( 4.419 -4.566 6.331) 8.970 10.018 ( -3.445 -1.415 -3.398) 5.041 10.266 ( 15.708 -5.270 2.103) 16.702 10.608 ( -0.650 5.967 0.578) 6.030 10.741 ( 2.958 5.617 -0.267) 6.354 11.042 ( 5.951 4.505 2.437) 7.852 11.231 ( 0.858 -0.000 -0.182) 0.877 11.593 ( -4.774 -2.276 -0.188) 5.292 11.812 ( -8.454 -9.151 0.107) 12.459 11.986 ( 0.645 -1.692 -0.661) 1.927 12.251 ( 0.607 4.917 5.962) 7.752 12.840 ( 5.749 7.628 -0.738) 9.581 12.979 ( 8.116 6.919 -1.265) 10.739 13.601 ( -6.629 4.510 -0.294) 8.023 13.723 ( -4.039 -3.285 -0.236) 5.212 13.838 ( -2.710 -0.067 -3.359) 4.316 13.917 ( -1.386 -0.518 1.905) 2.412 15.331 ( 6.738 3.004 4.100) 8.440 15.641 ( -3.578 -4.200 2.169) 5.929 15.895 ( -3.327 -4.924 -5.427) 8.048 16.144 ( 0.931 -3.543 9.546) 10.225 16.323 ( 2.634 -1.615 -11.996) 12.387 16.725 ( 4.700 1.700 1.240) 5.149 17.316 ( 6.528 1.476 4.608) 8.126 17.389 ( -9.954 19.309 -7.668) 23.037 17.639 ( 15.934 -10.728 2.759) 19.406 17.939 ( 4.106 4.781 -6.028) 8.721 19.489 ( -7.085 -5.195 16.751) 18.915 19.728 ( -12.014 -9.781 -12.996) 20.221 ======================= Grid point 125 (57/195) ======================= q-point: ( 0.36 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( 2.806 1.982 -5.021) 6.083 1.883 ( -4.671 -0.206 -1.327) 4.860 2.057 ( 2.123 -2.942 1.798) 4.049 2.196 ( 5.504 -3.964 -1.762) 7.008 2.437 ( -1.046 -0.070 -3.528) 3.681 2.520 ( 2.299 -4.581 8.222) 9.688 2.948 ( -7.859 0.747 1.440) 8.024 3.002 ( -10.025 -7.425 -3.909) 13.073 3.175 ( -0.566 3.971 2.481) 4.717 3.356 ( -2.081 0.739 -4.055) 4.617 3.413 ( -1.498 1.265 -2.477) 3.159 3.649 ( -3.939 -3.548 4.586) 7.009 4.276 ( 1.318 -1.270 0.546) 1.910 4.378 ( 3.603 -1.218 -0.063) 3.804 4.614 ( 4.469 1.173 -0.294) 4.630 4.682 ( 1.924 5.503 1.247) 5.962 4.950 ( -0.867 -8.152 -0.195) 8.201 5.120 ( 0.599 -4.505 -0.357) 4.559 6.523 ( -5.359 -0.490 -0.370) 5.394 6.646 ( -5.125 -1.754 -2.410) 5.929 7.141 ( -1.205 0.229 1.494) 1.933 7.563 ( 1.268 -1.241 -1.073) 2.074 8.047 ( 2.203 -12.677 -2.755) 13.159 8.189 ( -3.506 -17.640 4.480) 18.535 8.512 ( -0.660 -9.648 0.938) 9.716 8.738 ( 0.308 -7.566 -1.013) 7.640 8.971 ( 0.771 5.219 -0.959) 5.362 9.157 ( -4.551 5.701 4.003) 8.321 9.359 ( -1.592 4.320 5.391) 7.090 9.537 ( -2.584 4.026 -9.023) 10.212 9.905 ( -2.631 -3.132 -0.940) 4.197 9.960 ( 1.039 0.475 -0.564) 1.274 10.088 ( 2.607 -4.618 3.446) 6.324 10.499 ( 9.169 -1.835 -2.625) 9.712 10.684 ( 4.683 5.330 5.434) 8.937 10.808 ( 8.075 -3.191 -0.563) 8.701 11.128 ( 3.582 6.753 -2.241) 7.966 11.176 ( -2.573 1.136 -6.395) 6.986 11.530 ( -3.802 -1.973 2.160) 4.797 11.664 ( -7.466 -10.432 0.318) 12.832 12.028 ( 2.258 -1.596 0.536) 2.816 12.297 ( -1.762 2.723 3.301) 4.628 12.918 ( 4.619 9.784 -1.104) 10.876 13.097 ( 6.650 8.197 -1.343) 10.640 13.470 ( -6.307 0.545 -1.017) 6.411 13.653 ( -3.259 -2.723 -1.210) 4.416 13.787 ( -0.642 -0.033 -0.134) 0.657 13.928 ( -1.071 -0.151 2.480) 2.706 15.402 ( 2.413 -4.434 -2.816) 5.781 15.611 ( -5.218 -11.371 3.080) 12.885 15.874 ( 3.412 -0.723 2.855) 4.508 16.202 ( -4.615 -5.349 2.590) 7.524 16.333 ( 7.950 9.268 0.745) 12.233 16.843 ( 6.612 6.874 1.173) 9.610 17.135 ( -10.113 16.389 -4.419) 19.758 17.397 ( -0.151 7.535 -0.066) 7.537 17.909 ( 9.003 -2.265 -4.603) 10.362 18.008 ( 11.633 -8.643 3.381) 14.882 19.390 ( -9.335 -10.478 -11.193) 17.950 19.519 ( -8.564 -7.902 10.987) 16.016 ======================= Grid point 126 (58/195) ======================= q-point: ( 0.45 0.22 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( 3.429 -0.286 -6.943) 7.749 1.771 ( -2.649 -3.349 -6.459) 7.743 2.064 ( 0.228 -2.549 5.387) 5.964 2.328 ( -4.588 -5.888 3.948) 8.444 2.440 ( 13.832 -0.068 -3.409) 14.246 2.702 ( 0.649 -6.327 3.194) 7.117 2.760 ( -7.550 -2.239 1.733) 8.063 2.835 ( -6.172 0.845 3.009) 6.918 3.177 ( -4.991 0.707 -7.225) 8.809 3.278 ( 4.551 1.460 4.593) 6.628 3.422 ( 1.041 4.758 -0.932) 4.959 3.627 ( -3.731 -4.840 3.168) 6.884 4.280 ( 0.019 -0.993 -2.016) 2.247 4.418 ( 1.178 -0.918 -0.602) 1.610 4.646 ( 2.533 1.858 -4.521) 5.506 4.694 ( -0.684 5.021 -1.823) 5.385 4.935 ( -0.264 -8.751 -0.755) 8.787 5.120 ( 0.508 -5.033 -1.185) 5.195 6.475 ( -1.461 0.689 1.866) 2.467 6.572 ( -0.808 -1.147 -0.763) 1.598 7.169 ( -0.259 0.217 4.689) 4.701 7.576 ( 0.683 -2.092 0.570) 2.273 8.023 ( 0.864 -13.222 -5.078) 14.190 8.240 ( -0.800 -15.729 8.559) 17.925 8.477 ( -2.357 -9.704 -1.940) 10.173 8.722 ( 0.987 -7.432 -1.408) 7.628 8.991 ( 1.688 4.387 -0.825) 4.772 9.082 ( -4.972 4.542 1.507) 6.901 9.302 ( -3.898 5.194 -7.564) 9.970 9.552 ( 3.586 2.965 8.350) 9.559 9.856 ( -0.596 -3.444 -2.469) 4.279 9.984 ( 0.422 2.846 2.058) 3.538 10.120 ( -0.718 -4.119 -0.409) 4.201 10.572 ( 5.217 1.798 -3.331) 6.446 10.769 ( 0.262 5.728 3.027) 6.485 10.961 ( -1.488 -11.600 -7.488) 13.887 11.082 ( 8.138 -0.046 3.014) 8.678 11.137 ( 1.465 6.029 -4.488) 7.657 11.472 ( -4.083 -3.076 -0.771) 5.169 11.581 ( -2.897 -5.547 0.432) 6.273 12.044 ( 0.581 0.020 -1.991) 2.074 12.281 ( -2.633 1.147 0.852) 2.996 12.958 ( 2.009 10.079 -1.789) 10.432 13.170 ( 3.982 8.973 -2.056) 10.030 13.402 ( -2.170 -1.662 2.542) 3.733 13.594 ( -1.053 -3.090 -1.674) 3.668 13.790 ( -0.182 0.552 1.182) 1.317 13.927 ( -1.622 -0.363 1.150) 2.021 15.417 ( 3.868 -7.105 -2.681) 8.522 15.566 ( -3.863 -13.076 4.316) 14.302 15.981 ( 0.180 -2.285 5.195) 5.679 16.140 ( -3.413 -3.161 1.676) 4.944 16.480 ( 3.177 14.564 4.246) 15.500 16.965 ( 2.283 10.732 6.711) 12.861 16.987 ( -1.096 12.432 -2.091) 12.654 17.335 ( -2.689 9.740 -4.701) 11.145 17.948 ( 7.068 -5.358 -9.416) 12.935 18.213 ( 2.053 -6.161 4.133) 7.698 19.214 ( 2.051 -12.950 -4.542) 13.876 19.458 ( -8.899 -9.253 4.635) 13.649 ======================= Grid point 127 (59/195) ======================= q-point: (-0.45 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 0.559 1.187 -7.990) 8.097 1.787 ( 9.382 -4.549 -4.303) 11.280 2.102 ( -4.923 -2.438 -0.007) 5.494 2.302 ( -0.694 -3.590 4.326) 5.664 2.512 ( -6.000 -2.090 3.992) 7.503 2.644 ( 0.986 -1.432 -0.049) 1.740 2.761 ( 2.611 1.435 2.450) 3.857 2.973 ( 6.678 -7.228 5.062) 11.067 3.049 ( 1.134 7.583 -4.919) 9.110 3.370 ( 1.479 0.426 -3.057) 3.422 3.466 ( 3.588 1.465 5.797) 6.973 3.586 ( -4.418 -5.590 1.013) 7.197 4.247 ( -0.665 -2.671 -1.501) 3.135 4.404 ( -0.199 0.489 -2.723) 2.774 4.593 ( -2.718 0.710 -5.525) 6.198 4.614 ( -1.467 4.460 -6.313) 7.867 4.934 ( 0.969 -7.118 -0.044) 7.184 5.104 ( -0.292 -4.925 -2.055) 5.345 6.509 ( 2.012 0.975 3.157) 3.869 6.601 ( 3.865 -0.740 0.463) 3.962 7.227 ( -1.243 -0.829 7.028) 7.185 7.606 ( 1.232 -2.254 1.847) 3.164 7.975 ( 0.218 -13.577 -3.779) 14.095 8.307 ( -3.750 -12.367 7.179) 14.783 8.422 ( 1.476 -7.930 -4.316) 9.148 8.744 ( 1.960 -7.730 -0.811) 8.016 8.971 ( -0.852 4.998 -2.095) 5.486 9.078 ( 1.088 1.058 1.455) 2.102 9.180 ( -0.409 3.797 -4.268) 5.727 9.722 ( 3.771 0.865 8.013) 8.898 9.817 ( 0.441 -4.029 -4.517) 6.069 10.014 ( -0.562 3.334 2.766) 4.368 10.079 ( -2.417 -0.804 -0.320) 2.567 10.621 ( 2.828 1.966 0.002) 3.445 10.740 ( -8.728 -4.630 -9.395) 13.634 10.774 ( -4.029 4.891 2.328) 6.751 11.069 ( -0.638 3.078 -8.896) 9.435 11.254 ( 2.546 -6.454 1.586) 7.117 11.455 ( 3.925 -0.953 0.292) 4.050 11.564 ( 1.923 -7.342 0.351) 7.598 12.024 ( 0.277 3.287 -1.261) 3.532 12.215 ( -3.472 0.974 -3.875) 5.293 12.959 ( -0.171 10.730 -0.416) 10.739 13.167 ( -1.354 11.006 -2.691) 11.411 13.443 ( 1.878 -3.180 3.301) 4.953 13.583 ( 2.351 -6.324 -2.107) 7.068 13.814 ( 0.844 0.638 2.522) 2.736 13.905 ( -1.527 0.628 0.297) 1.678 15.459 ( 0.713 -7.415 0.842) 7.496 15.591 ( 3.054 -11.308 1.383) 11.794 15.919 ( -9.749 1.253 2.666) 10.185 16.191 ( 0.495 -2.298 7.831) 8.176 16.538 ( -1.003 7.568 5.503) 9.411 16.918 ( -6.246 10.241 -1.540) 12.094 17.176 ( 6.718 14.130 11.634) 19.497 17.240 ( 2.987 9.043 -8.674) 12.882 17.913 ( 0.017 -8.534 -8.098) 11.765 18.178 ( -4.223 -0.747 -1.804) 4.653 19.266 ( -4.082 -11.105 -2.524) 12.098 19.421 ( 9.260 -12.320 3.859) 15.888 ======================= Grid point 128 (60/195) ======================= q-point: (-0.36 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( 0.467 0.398 -9.588) 9.608 1.850 ( -7.811 9.701 1.240) 12.516 2.025 ( 9.446 -2.091 -4.696) 10.754 2.348 ( -0.480 -4.185 4.745) 6.345 2.536 ( -0.416 -4.505 9.263) 10.309 2.683 ( 0.116 -1.706 5.441) 5.704 2.810 ( 2.611 -0.286 -5.225) 5.848 2.991 ( 1.039 11.617 -7.257) 13.737 3.179 ( 7.811 -6.841 3.021) 10.814 3.338 ( 0.592 1.829 -2.949) 3.521 3.490 ( -4.944 -3.868 -2.188) 6.648 3.623 ( 5.696 -5.402 6.782) 10.374 4.252 ( 1.140 -3.099 1.521) 3.635 4.342 ( -3.308 0.688 -3.600) 4.937 4.477 ( -1.183 -0.479 -3.767) 3.977 4.518 ( -0.915 2.152 -6.785) 7.177 4.963 ( 1.365 -4.720 1.014) 5.017 5.059 ( -1.274 -4.433 -3.190) 5.609 6.615 ( 5.673 0.570 3.122) 6.501 6.697 ( 6.649 -0.595 0.070) 6.675 7.289 ( -0.976 -2.970 6.745) 7.435 7.663 ( 2.104 -1.921 2.968) 4.115 7.965 ( 2.070 -12.895 -0.427) 13.067 8.287 ( -1.773 -6.556 -0.783) 6.837 8.409 ( -0.342 -6.772 -1.476) 6.939 8.737 ( -0.714 -4.843 -1.321) 5.070 8.945 ( -2.517 -2.241 1.555) 3.711 9.111 ( 2.939 -1.258 -0.332) 3.214 9.216 ( 5.821 2.488 -0.072) 6.331 9.733 ( -0.344 -7.500 -7.692) 10.749 9.861 ( 0.943 3.719 5.364) 6.595 10.045 ( 0.594 3.253 1.806) 3.768 10.049 ( -2.331 0.402 3.523) 4.244 10.439 ( -15.057 -3.105 -6.316) 16.621 10.667 ( -0.920 2.327 3.058) 3.951 10.714 ( -1.052 7.768 -2.409) 8.201 10.915 ( -2.806 -1.226 -10.619) 11.052 11.255 ( -3.050 -1.025 -0.406) 3.243 11.483 ( 3.900 -6.124 -3.740) 8.167 11.719 ( 9.161 -6.015 4.312) 11.777 12.025 ( -2.744 2.229 -1.129) 3.711 12.104 ( 0.876 4.698 -3.380) 5.854 12.937 ( -3.246 9.575 1.012) 10.161 13.081 ( -4.067 10.529 -2.415) 11.543 13.499 ( 2.703 -3.735 -1.261) 4.779 13.634 ( 4.995 -6.627 -0.402) 8.308 13.861 ( 0.355 1.012 1.573) 1.903 13.913 ( 1.993 1.047 2.391) 3.284 15.400 ( -6.694 -0.534 -2.510) 7.169 15.690 ( 3.670 -11.282 2.430) 12.110 15.825 ( -4.109 1.498 4.838) 6.522 16.280 ( -3.360 -0.540 10.706) 11.234 16.618 ( 1.104 1.422 7.620) 7.830 16.738 ( -8.151 5.392 -5.392) 11.162 17.129 ( -0.312 3.809 -10.423) 11.102 17.513 ( 9.958 17.719 14.975) 25.247 17.774 ( -5.956 -7.290 -4.303) 10.351 18.103 ( -1.175 0.537 -3.193) 3.445 19.068 ( -7.164 -7.253 -10.290) 14.485 19.739 ( 16.286 -13.487 6.563) 22.141 ======================= Grid point 129 (61/195) ======================= q-point: (-0.27 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( -5.966 6.889 -9.305) 13.025 1.661 ( -13.888 18.426 2.619) 23.222 2.189 ( 9.080 0.508 -3.367) 9.698 2.442 ( 2.064 -5.162 6.586) 8.618 2.572 ( -6.548 3.747 2.447) 7.931 2.679 ( -8.162 1.546 -4.380) 9.391 2.787 ( 2.686 -1.388 -0.510) 3.066 2.936 ( 9.888 3.407 -3.653) 11.078 3.299 ( 0.982 -4.197 -0.880) 4.400 3.377 ( 7.196 -7.080 2.071) 10.305 3.408 ( 0.663 -2.224 -3.957) 4.588 3.832 ( 7.404 -5.345 8.802) 12.684 4.214 ( -4.091 1.009 -2.784) 5.050 4.282 ( 0.535 0.079 -4.828) 4.858 4.466 ( 1.461 0.418 -1.842) 2.388 4.472 ( 0.820 -4.632 2.605) 5.377 4.980 ( -1.177 -2.228 -2.123) 3.295 5.012 ( 0.985 -5.294 -0.436) 5.402 6.766 ( 8.543 -0.393 1.512) 8.685 6.829 ( 9.004 -1.584 -0.562) 9.160 7.346 ( 0.642 -4.968 3.262) 5.978 7.738 ( 2.755 -3.377 1.775) 4.705 8.049 ( 4.929 -9.757 4.235) 11.723 8.237 ( 0.290 -1.084 -5.234) 5.353 8.379 ( -2.365 -6.652 1.556) 7.229 8.725 ( 0.401 -1.661 -0.105) 1.711 8.900 ( -4.900 -6.402 2.621) 8.478 9.157 ( -1.811 -6.691 3.192) 7.631 9.326 ( 7.472 0.882 -0.903) 7.578 9.631 ( -1.419 -3.531 -6.817) 7.808 9.888 ( -3.314 4.421 1.208) 5.655 9.984 ( -6.027 -1.624 2.447) 6.705 10.074 ( -12.401 -1.713 -5.047) 13.498 10.173 ( 2.912 2.432 1.685) 4.151 10.575 ( -5.371 11.333 -5.567) 13.721 10.738 ( 0.852 0.886 -3.484) 3.695 10.808 ( 1.037 -2.059 2.374) 3.309 11.136 ( -6.104 -1.231 -4.489) 7.676 11.541 ( 5.079 -2.184 -1.365) 5.695 11.826 ( -3.881 4.590 -1.399) 6.172 11.975 ( 7.656 -7.781 -1.880) 11.077 12.200 ( 4.714 3.693 5.606) 8.203 12.861 ( -6.677 7.539 1.504) 10.182 13.005 ( -1.959 8.982 -1.545) 9.322 13.517 ( 3.093 -3.542 -3.718) 5.995 13.721 ( 5.323 -4.556 -0.356) 7.015 13.877 ( 0.158 2.473 0.992) 2.669 14.001 ( 3.877 -0.814 2.499) 4.684 15.218 ( -9.785 7.023 -2.206) 12.245 15.699 ( -6.835 -4.640 5.093) 9.705 15.887 ( 2.921 -9.308 1.032) 9.810 16.303 ( -6.009 9.011 7.227) 13.021 16.592 ( -0.053 -5.537 -3.494) 6.548 16.738 ( 1.666 -1.192 7.197) 7.483 16.987 ( -1.967 1.025 -8.755) 9.031 17.645 ( -5.743 -5.361 -0.470) 7.870 17.844 ( 6.492 17.572 14.302) 23.568 18.051 ( -1.184 -1.734 -0.733) 2.224 18.809 ( -4.038 -1.668 -16.390) 16.963 20.084 ( 14.987 -12.997 5.363) 20.549 ======================= Grid point 130 (62/195) ======================= q-point: (-0.18 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -8.166 15.977 -4.527) 18.505 1.462 ( -12.072 23.127 1.638) 26.139 2.018 ( -22.630 16.298 -0.340) 27.890 2.383 ( -7.147 -0.247 -9.272) 11.709 2.549 ( 6.932 -0.331 1.129) 7.031 2.702 ( 6.630 0.812 7.688) 10.184 2.818 ( 1.520 -3.304 -1.382) 3.891 3.102 ( 4.846 -1.983 -2.611) 5.851 3.317 ( 6.799 -5.811 0.209) 8.946 3.412 ( 2.953 -2.165 -2.310) 4.329 3.546 ( 7.920 -9.118 2.748) 12.386 4.025 ( 4.224 -6.957 1.533) 8.282 4.152 ( -0.099 1.368 2.254) 2.638 4.215 ( -0.563 -0.131 -3.500) 3.548 4.474 ( 1.003 -1.403 -0.927) 1.958 4.531 ( -0.567 -0.725 3.841) 3.950 4.930 ( 0.098 -3.373 -2.452) 4.172 5.039 ( 0.781 -5.428 0.832) 5.547 6.939 ( 10.712 -2.408 -0.477) 10.990 6.987 ( 9.995 -4.548 -0.803) 11.011 7.389 ( 2.374 -4.917 -0.337) 5.471 7.783 ( 2.433 -4.861 -1.786) 5.722 8.150 ( 3.906 -0.512 -5.594) 6.842 8.265 ( 4.811 -5.847 8.156) 11.129 8.375 ( -1.237 -5.733 2.770) 6.486 8.715 ( -1.834 -0.997 -0.758) 2.221 8.880 ( -2.621 -7.244 5.280) 9.339 9.078 ( -11.666 -6.450 3.300) 13.732 9.441 ( 5.401 0.457 1.146) 5.540 9.516 ( -4.178 -0.892 -5.662) 7.093 9.634 ( -17.217 0.479 -4.187) 17.725 9.893 ( -4.217 -3.841 -1.126) 5.814 9.997 ( 2.761 2.830 0.582) 3.997 10.272 ( 4.006 2.687 0.523) 4.852 10.413 ( -3.676 7.245 -4.657) 9.364 10.733 ( 3.018 0.890 -1.559) 3.512 10.879 ( -1.054 2.489 3.245) 4.224 10.993 ( -3.049 -0.853 -3.600) 4.794 11.584 ( 0.733 2.076 -0.311) 2.224 11.749 ( -1.424 1.167 0.235) 1.856 12.081 ( 4.735 -6.593 -1.896) 8.335 12.350 ( 4.488 1.354 5.512) 7.236 12.779 ( -5.258 9.284 2.646) 10.992 12.964 ( -0.452 7.656 -2.395) 8.034 13.526 ( 2.384 -3.223 -2.487) 4.718 13.802 ( 5.248 -5.246 -2.204) 7.740 13.894 ( 1.419 2.918 0.781) 3.337 14.089 ( 3.488 -0.953 1.243) 3.823 15.042 ( -10.467 10.891 2.386) 15.293 15.592 ( -9.164 -1.584 0.630) 9.321 15.863 ( -4.954 -9.046 0.365) 10.320 16.342 ( 4.331 5.565 3.024) 7.672 16.609 ( 1.178 -9.619 1.109) 9.754 16.796 ( 0.374 -2.536 -3.107) 4.028 16.927 ( 2.781 1.044 0.758) 3.065 17.548 ( -7.896 -4.318 2.533) 9.349 17.890 ( -5.144 5.896 -1.786) 8.025 18.181 ( 4.454 -1.137 8.161) 9.367 18.597 ( 1.737 11.548 -11.855) 16.641 20.357 ( 11.156 -12.439 2.311) 16.868 ======================= Grid point 131 (63/195) ======================= q-point: (-0.09 0.22 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( -8.503 20.372 3.430) 22.340 1.261 ( -8.612 26.214 -5.666) 28.169 1.728 ( -16.416 28.940 15.948) 36.896 2.192 ( -3.846 0.113 -4.452) 5.884 2.677 ( 4.344 -2.537 -1.479) 5.243 2.776 ( -0.146 -3.509 -2.933) 4.576 2.916 ( 6.130 -1.486 5.568) 8.414 3.075 ( -0.254 0.144 -2.444) 2.461 3.423 ( 1.705 -2.999 -1.397) 3.722 3.475 ( 8.113 -4.769 -1.725) 9.568 3.674 ( 3.766 -10.496 -1.128) 11.208 4.020 ( 1.165 -5.130 -2.997) 6.055 4.180 ( 0.715 -1.077 0.970) 1.616 4.261 ( 0.278 -2.192 4.487) 5.001 4.481 ( 0.530 0.209 0.428) 0.713 4.521 ( -2.425 2.298 0.386) 3.363 4.938 ( 1.466 -4.000 0.785) 4.332 5.051 ( -0.087 -6.929 0.232) 6.933 7.103 ( 9.384 -5.042 -2.357) 10.911 7.132 ( 7.084 -7.808 -0.752) 10.570 7.415 ( 2.106 -3.481 -2.037) 4.550 7.793 ( 3.657 -6.176 -4.887) 8.683 8.154 ( 3.873 -0.563 -3.153) 5.026 8.369 ( -1.057 -2.938 1.716) 3.563 8.499 ( 9.130 -5.661 6.484) 12.547 8.666 ( -2.403 -4.477 -0.435) 5.100 8.835 ( -11.182 -2.651 0.824) 11.521 8.875 ( -13.702 -3.352 2.484) 14.323 9.275 ( -9.920 2.670 -1.689) 10.411 9.493 ( -0.059 -4.616 0.839) 4.692 9.556 ( 2.645 1.607 5.116) 5.980 9.810 ( -2.049 -2.983 -2.972) 4.683 10.039 ( 0.605 4.184 1.199) 4.395 10.321 ( 3.536 3.213 -1.313) 4.955 10.381 ( 0.671 -1.126 -0.232) 1.331 10.788 ( 3.854 0.994 0.500) 4.011 10.818 ( -2.523 5.341 -3.258) 6.746 10.960 ( -2.795 0.902 2.286) 3.722 11.593 ( 0.894 2.776 0.541) 2.966 11.764 ( -1.111 0.148 3.783) 3.945 12.104 ( 1.900 -6.229 -1.410) 6.663 12.455 ( 1.251 -2.541 2.710) 3.920 12.725 ( -3.166 14.567 -0.805) 14.929 12.929 ( 0.695 7.014 -3.887) 8.049 13.544 ( 0.716 -3.066 1.276) 3.397 13.837 ( 2.506 -5.329 -1.843) 6.170 13.965 ( 6.065 2.141 -1.250) 6.552 14.140 ( 1.613 -0.414 -0.350) 1.701 14.915 ( -11.111 12.850 7.409) 18.533 15.455 ( -4.439 -0.892 -0.682) 4.579 15.798 ( -4.040 -7.231 2.781) 8.738 16.448 ( 3.888 -2.434 -0.946) 4.683 16.628 ( -0.282 -9.674 1.205) 9.753 16.768 ( 5.576 -0.852 -6.483) 8.594 17.008 ( 2.642 0.305 0.741) 2.761 17.390 ( -13.422 -4.951 0.987) 14.340 17.790 ( -1.193 4.074 -3.351) 5.409 18.192 ( 2.920 -0.727 -13.053) 13.395 18.684 ( 3.231 16.538 14.730) 22.381 20.507 ( 5.647 -11.847 -1.749) 13.240 ======================= Grid point 132 (64/195) ======================= q-point: ( 0.00 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( -0.168 18.975 6.895) 20.190 1.650 ( 1.440 24.146 -5.092) 24.719 2.106 ( 4.985 -1.440 0.939) 5.273 2.335 ( -3.398 15.607 11.397) 19.622 2.522 ( -3.558 -0.430 -8.324) 9.063 2.810 ( 1.304 5.109 2.589) 5.874 3.021 ( -1.395 1.734 1.258) 2.556 3.126 ( 2.961 2.838 3.386) 5.318 3.331 ( -2.268 -9.679 -6.527) 11.892 3.373 ( -0.221 -8.512 -4.948) 9.848 3.442 ( 2.075 -5.789 -2.106) 6.501 3.923 ( 2.285 -8.687 3.502) 9.641 4.212 ( 1.214 -1.352 5.184) 5.494 4.252 ( -2.942 2.471 0.864) 3.938 4.421 ( -0.455 -4.300 -0.463) 4.348 4.543 ( -3.305 0.813 -1.115) 3.581 4.891 ( 1.988 -5.449 1.166) 5.916 4.927 ( -0.648 -4.187 2.396) 4.868 7.003 ( 0.764 -7.981 -1.964) 8.254 7.054 ( 2.069 -6.921 -3.831) 8.177 7.370 ( 0.490 -1.143 -2.021) 2.373 7.608 ( 0.698 -8.647 -4.301) 9.683 8.202 ( 7.045 -2.751 -1.515) 7.714 8.348 ( -8.380 -8.512 -3.642) 12.488 8.412 ( -1.032 4.695 2.503) 5.420 8.618 ( -6.767 -1.205 -1.503) 7.035 8.662 ( -3.648 -0.600 -0.246) 3.706 8.735 ( 5.404 0.957 0.688) 5.531 9.256 ( 2.289 -0.718 6.120) 6.573 9.439 ( 2.238 -8.185 6.773) 10.857 9.620 ( -2.838 3.181 -0.871) 4.351 9.766 ( 2.766 -2.409 1.786) 4.079 10.130 ( -1.187 2.059 0.480) 2.425 10.301 ( 0.104 -3.640 -2.859) 4.630 10.450 ( 3.931 5.842 1.774) 7.262 10.755 ( -0.346 -4.731 2.607) 5.413 10.941 ( -0.666 7.557 0.227) 7.590 11.039 ( -1.056 3.823 2.864) 4.892 11.682 ( 2.085 2.841 2.810) 4.508 11.793 ( -1.021 0.634 2.632) 2.894 12.062 ( 2.763 -2.583 2.109) 4.330 12.321 ( -3.596 -6.702 -2.149) 7.904 12.922 ( -3.213 12.576 -8.993) 15.791 13.017 ( -0.708 6.208 -5.758) 8.497 13.573 ( 3.530 -1.202 7.645) 8.506 13.756 ( 2.818 -6.475 2.979) 7.664 14.050 ( -0.406 1.875 -1.000) 2.163 14.131 ( -0.574 -0.402 -1.275) 1.455 15.151 ( -3.114 16.450 2.787) 16.973 15.451 ( 3.240 -0.074 2.269) 3.956 15.702 ( -3.615 -2.724 9.369) 10.405 16.321 ( -1.986 -5.878 -6.352) 8.879 16.444 ( 0.565 -7.865 0.746) 7.921 16.801 ( 10.230 -4.999 -8.951) 14.483 16.941 ( -5.071 -0.558 -7.204) 8.827 17.051 ( -7.707 -6.315 -3.835) 10.676 17.898 ( 3.442 6.077 2.073) 7.285 18.156 ( 2.434 -0.048 -0.714) 2.537 19.208 ( -0.211 17.772 9.504) 20.155 20.251 ( -0.659 -14.889 -4.455) 15.555 ======================= Grid point 133 (65/195) ======================= q-point: ( 0.09 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( 6.596 15.635 6.909) 18.322 1.671 ( 4.517 21.975 -0.149) 22.435 2.253 ( 6.762 0.277 -1.932) 7.038 2.307 ( 1.258 2.813 -7.092) 7.733 2.466 ( -2.487 1.517 7.148) 7.719 2.830 ( -3.049 4.142 1.998) 5.518 2.939 ( -8.358 -1.656 -1.847) 8.718 3.122 ( -2.376 -7.004 -6.137) 9.610 3.280 ( 2.344 1.280 8.257) 8.678 3.359 ( 0.049 -4.541 -0.632) 4.585 3.425 ( -1.360 -5.409 -1.452) 5.763 3.928 ( -4.342 -2.753 -2.771) 5.840 4.205 ( -0.736 3.601 1.801) 4.094 4.304 ( 1.954 -0.983 3.978) 4.540 4.438 ( -5.397 -2.293 -3.130) 6.647 4.457 ( 2.278 -4.652 3.530) 6.268 4.923 ( -0.136 -4.540 1.008) 4.652 4.956 ( -0.001 -3.808 3.103) 4.913 6.952 ( -3.330 -7.178 -2.724) 8.369 6.975 ( -4.853 -5.110 -4.594) 8.413 7.352 ( -0.372 -1.055 -0.952) 1.469 7.579 ( 1.859 -8.109 -5.301) 9.865 8.043 ( -12.494 -5.110 -7.891) 15.636 8.205 ( -6.889 -9.145 1.193) 11.511 8.454 ( -3.803 6.543 3.327) 8.267 8.606 ( 9.379 -0.422 -0.492) 9.401 8.682 ( 3.452 -1.944 1.219) 4.145 8.825 ( 5.331 -2.893 -0.338) 6.074 9.464 ( 11.579 -1.575 5.098) 12.750 9.562 ( 2.467 -2.352 3.533) 4.909 9.596 ( -0.237 1.154 5.317) 5.446 9.818 ( 1.002 -2.550 1.684) 3.216 10.079 ( -3.608 0.111 -1.179) 3.797 10.236 ( -1.837 -3.603 -5.629) 6.931 10.601 ( 6.361 6.112 5.551) 10.423 10.764 ( -0.819 -1.693 0.905) 2.087 10.919 ( -2.453 6.667 2.035) 7.390 11.085 ( 1.864 0.743 3.805) 4.302 11.732 ( -4.621 3.165 1.271) 5.743 11.823 ( 4.791 3.538 5.086) 7.832 12.129 ( -5.876 -5.344 3.178) 8.554 12.219 ( 0.885 -4.260 -3.295) 5.457 12.781 ( 0.440 8.882 -7.181) 11.430 12.946 ( 1.765 2.099 -6.723) 7.261 13.713 ( 1.254 2.846 7.639) 8.248 13.831 ( -0.051 -3.233 4.114) 5.233 13.971 ( -5.670 2.349 -1.799) 6.396 14.076 ( -3.098 -0.604 -2.848) 4.251 15.194 ( 3.698 14.501 2.542) 15.180 15.566 ( 3.647 -2.729 4.622) 6.489 15.783 ( -0.797 -1.405 11.139) 11.255 16.182 ( -2.062 -2.020 -11.429) 11.788 16.483 ( 0.924 -8.777 2.626) 9.208 16.668 ( -2.536 -0.362 -15.624) 15.832 16.900 ( 2.831 -3.760 -2.684) 5.418 16.996 ( 8.957 -11.771 -4.584) 15.485 17.983 ( 2.400 8.855 1.751) 9.340 18.159 ( -0.580 6.652 -2.080) 6.993 19.300 ( -4.641 9.684 13.491) 17.243 20.116 ( -6.879 -13.655 -7.288) 16.938 ======================= Grid point 134 (66/195) ======================= q-point: ( 0.18 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( 7.546 11.456 1.539) 13.804 1.771 ( 3.156 14.905 3.518) 15.636 2.184 ( 2.586 0.244 -8.815) 9.190 2.351 ( 0.610 2.303 -2.920) 3.769 2.468 ( -5.414 -0.811 -0.979) 5.562 2.724 ( -12.296 -3.229 -0.240) 12.715 2.780 ( 0.360 -5.238 1.587) 5.485 3.103 ( 0.600 -4.663 -0.855) 4.778 3.325 ( -2.582 -4.107 -1.020) 4.957 3.398 ( -0.850 -5.119 1.123) 5.309 3.452 ( 1.771 5.209 12.237) 13.417 3.748 ( -7.950 2.594 -6.402) 10.532 4.254 ( 0.658 2.530 1.532) 3.030 4.311 ( -2.742 -2.180 -1.809) 3.943 4.382 ( 2.309 -2.456 3.538) 4.887 4.561 ( 3.790 -1.511 4.091) 5.778 4.909 ( -1.836 -3.915 -0.082) 4.325 4.994 ( 0.216 -4.160 2.790) 5.013 6.808 ( -7.319 -3.165 -5.067) 9.447 6.841 ( -5.087 -5.374 -3.093) 8.020 7.318 ( -4.290 1.108 0.484) 4.457 7.528 ( 0.803 -5.188 -6.182) 8.110 7.824 ( -4.016 -9.230 -4.166) 10.894 8.076 ( -6.456 -14.050 -1.500) 15.534 8.406 ( -4.857 3.297 2.713) 6.467 8.679 ( -1.451 -2.178 0.850) 2.752 8.844 ( 9.218 1.677 4.946) 10.594 8.965 ( 9.665 -3.153 1.351) 10.255 9.555 ( -3.619 3.747 2.512) 5.783 9.692 ( 4.685 -2.516 2.199) 5.754 9.749 ( 9.063 -0.712 2.588) 9.452 9.862 ( 3.521 -2.201 1.327) 4.359 10.010 ( -1.456 -1.197 -0.612) 1.982 10.115 ( -2.554 -2.941 -7.313) 8.286 10.696 ( -0.797 2.659 2.193) 3.538 10.785 ( 1.654 1.076 0.840) 2.145 10.976 ( 3.817 6.579 7.068) 10.383 11.168 ( 2.399 -0.694 3.132) 4.005 11.630 ( -5.995 0.134 -1.084) 6.093 11.925 ( -11.537 -7.722 -4.529) 14.603 11.974 ( 3.741 6.718 3.522) 8.457 12.260 ( 0.737 1.234 3.323) 3.621 12.823 ( 8.060 4.990 -0.105) 9.480 12.942 ( 6.099 0.835 -4.027) 7.356 13.762 ( -4.292 2.268 2.343) 5.390 13.783 ( -9.324 -1.306 2.864) 9.841 13.901 ( -0.481 2.404 -0.513) 2.504 13.974 ( -3.273 -0.324 -3.359) 4.701 15.301 ( 4.434 8.572 2.217) 9.902 15.623 ( -3.197 -3.904 3.381) 6.074 15.933 ( -0.666 -1.498 13.521) 13.620 15.997 ( 0.341 0.537 -13.845) 13.859 16.415 ( 1.130 -1.841 -13.362) 13.536 16.632 ( 5.229 0.734 3.174) 6.161 16.998 ( 10.750 -7.989 1.728) 13.504 17.155 ( 12.985 -12.393 -2.956) 18.192 17.960 ( -3.505 14.044 -5.969) 15.657 18.113 ( -1.534 8.160 -0.936) 8.356 19.364 ( -7.531 1.377 15.012) 16.852 19.857 ( -11.605 -12.113 -8.973) 19.024 ======================= Grid point 135 (67/195) ======================= q-point: ( 0.27 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 3.961 5.528 -3.867) 7.823 1.861 ( 4.028 5.731 1.756) 7.222 2.110 ( -2.273 2.669 -4.636) 5.813 2.233 ( -6.948 -2.907 -5.579) 9.373 2.401 ( 0.078 2.625 3.281) 4.202 2.536 ( -8.847 -1.008 0.143) 8.906 2.868 ( 1.493 -6.010 4.592) 7.709 3.034 ( -5.650 -6.916 -2.837) 9.370 3.252 ( -3.939 -3.207 -2.131) 5.508 3.406 ( -0.688 -5.429 1.426) 5.655 3.529 ( -4.556 4.743 -1.827) 6.826 3.605 ( -2.557 1.899 3.971) 5.090 4.227 ( -0.198 0.551 1.832) 1.923 4.350 ( 3.758 3.731 -1.017) 5.392 4.485 ( 4.207 -3.110 4.742) 7.061 4.668 ( 3.826 -0.597 2.396) 4.554 4.868 ( -1.987 -3.022 -0.746) 3.693 5.023 ( 0.135 -4.300 1.495) 4.554 6.629 ( -6.439 -1.851 -4.226) 7.922 6.716 ( -5.188 -3.932 -2.868) 7.113 7.222 ( -5.236 3.140 -0.422) 6.120 7.504 ( 2.353 -4.054 -2.909) 5.517 7.780 ( -0.353 -10.824 1.658) 10.956 7.957 ( -4.122 -14.828 -3.431) 15.769 8.373 ( -2.087 -1.608 1.946) 3.275 8.643 ( -3.238 -5.158 0.710) 6.131 9.027 ( 5.312 3.647 2.432) 6.887 9.149 ( 6.559 1.638 6.241) 9.201 9.477 ( -7.925 3.273 1.667) 8.735 9.691 ( -0.314 -1.635 -5.525) 5.771 9.871 ( -2.712 -1.239 2.222) 3.719 9.924 ( 7.608 -1.029 -0.000) 7.677 9.978 ( -2.391 -2.110 -3.959) 5.084 10.158 ( 13.633 -5.864 0.221) 14.843 10.701 ( -0.571 4.068 2.256) 4.687 10.820 ( 1.998 2.960 -0.149) 3.574 11.142 ( 5.507 4.548 4.701) 8.551 11.225 ( 0.770 -0.660 1.193) 1.566 11.524 ( -4.788 -3.343 -0.377) 5.851 11.671 ( -10.677 -5.944 -4.214) 12.926 12.034 ( 2.458 6.060 -0.776) 6.586 12.317 ( -0.935 1.386 5.149) 5.414 12.962 ( 8.057 5.054 -0.335) 9.517 13.083 ( 9.671 3.751 1.675) 10.507 13.624 ( -8.334 -3.489 -2.487) 9.371 13.652 ( -8.410 -1.759 0.506) 8.607 13.864 ( -2.281 2.698 -2.110) 4.115 13.931 ( -1.049 1.107 0.949) 1.796 15.364 ( 0.682 0.826 0.107) 1.077 15.553 ( -7.540 -5.098 1.645) 9.250 15.839 ( -0.124 -0.006 -5.981) 5.982 16.097 ( -0.224 -3.652 6.020) 7.045 16.375 ( 8.926 8.945 -3.726) 13.175 16.797 ( 9.520 5.213 2.097) 11.055 17.261 ( 12.694 -6.286 3.041) 14.488 17.373 ( 13.721 -14.753 3.304) 20.416 17.757 ( -7.404 16.780 -10.052) 20.915 18.062 ( -1.997 6.480 -3.652) 7.702 19.386 ( -9.417 -4.980 13.257) 17.006 19.526 ( -13.832 -10.344 -9.282) 19.608 ======================= Grid point 136 (68/195) ======================= q-point: ( 0.36 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( 0.032 1.499 -10.429) 10.536 1.924 ( -2.175 2.284 0.463) 3.188 2.059 ( -2.177 1.870 1.505) 3.241 2.110 ( 1.459 -5.294 -1.541) 5.703 2.416 ( -3.880 0.222 2.903) 4.851 2.498 ( 3.134 1.381 2.777) 4.409 2.868 ( -9.333 -6.448 1.526) 11.446 2.891 ( -5.501 -4.859 1.016) 7.410 3.162 ( -2.873 -3.834 -1.421) 4.997 3.364 ( -2.754 -1.426 -2.970) 4.294 3.473 ( 1.224 3.062 -0.697) 3.370 3.598 ( -2.878 -0.942 2.183) 3.733 4.289 ( 1.739 3.055 3.023) 4.636 4.383 ( 2.759 2.275 -2.079) 4.137 4.611 ( 5.039 -1.805 1.323) 5.514 4.734 ( 1.635 -4.190 0.204) 4.502 4.834 ( -0.658 0.308 -0.843) 1.113 5.031 ( -0.077 -4.421 -0.290) 4.431 6.509 ( -3.138 -0.720 -1.678) 3.631 6.605 ( -4.116 -2.565 -1.871) 5.198 7.169 ( -1.355 2.913 1.200) 3.429 7.515 ( 0.481 -4.136 -0.215) 4.170 7.821 ( 1.372 -9.758 -0.067) 9.854 7.876 ( -2.091 -13.681 2.669) 14.094 8.362 ( -1.585 -4.865 0.659) 5.159 8.593 ( -2.532 -7.742 -0.280) 8.151 9.077 ( 1.653 5.979 -1.615) 6.410 9.283 ( -4.314 7.163 3.517) 9.071 9.401 ( 0.690 -0.302 5.589) 5.640 9.575 ( -2.505 0.159 -9.481) 9.808 9.845 ( -2.927 -2.853 0.445) 4.112 9.915 ( -0.060 -4.933 0.759) 4.992 10.056 ( 5.629 1.501 0.039) 5.826 10.400 ( 12.855 -8.517 0.238) 15.423 10.731 ( 1.184 3.121 1.178) 3.540 10.849 ( 1.420 4.826 0.334) 5.042 11.202 ( -1.953 0.860 -3.178) 3.827 11.242 ( 3.604 4.424 -1.550) 5.914 11.473 ( -2.986 -5.858 3.066) 7.255 11.490 ( -5.682 -4.835 -2.252) 7.794 12.070 ( 2.733 5.249 -0.702) 5.959 12.329 ( -2.890 0.270 2.930) 4.124 13.085 ( 4.964 7.723 0.106) 9.181 13.225 ( 6.187 5.330 -1.282) 8.266 13.437 ( -6.707 -3.381 -3.488) 8.281 13.589 ( -2.459 -4.823 2.650) 6.028 13.801 ( -1.800 1.786 -1.045) 2.742 13.917 ( -1.953 -1.015 0.677) 2.303 15.339 ( -0.602 -2.064 -2.488) 3.288 15.436 ( -7.620 -6.345 2.283) 10.175 15.853 ( 3.442 -0.483 1.382) 3.741 16.085 ( -2.743 -6.443 0.232) 7.006 16.600 ( 10.859 17.090 7.693) 21.660 16.990 ( 10.274 8.034 1.232) 13.101 17.407 ( -3.288 4.032 0.094) 5.203 17.480 ( 1.070 7.482 -9.142) 11.862 17.758 ( 14.255 -11.877 9.062) 20.650 17.958 ( -1.396 1.996 -8.669) 9.005 19.191 ( -12.119 -8.790 -8.243) 17.090 19.350 ( -10.008 -9.241 8.851) 16.244 ======================= Grid point 137 (69/195) ======================= q-point: ( 0.45 0.33 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 4.469 -1.070 -8.670) 9.812 1.793 ( -3.446 1.233 -9.844) 10.502 2.059 ( -0.403 1.803 5.891) 6.174 2.199 ( -2.009 -6.593 6.574) 9.525 2.455 ( 8.701 1.882 -0.121) 8.903 2.582 ( -1.170 -5.405 3.274) 6.427 2.710 ( -8.570 -2.199 3.207) 9.411 2.818 ( -4.721 -3.186 3.489) 6.679 3.125 ( -0.508 -3.710 -1.177) 3.925 3.319 ( 0.871 0.701 -0.885) 1.426 3.494 ( 1.082 0.641 -0.592) 1.390 3.574 ( -2.090 0.630 1.507) 2.653 4.297 ( -0.817 3.090 -2.571) 4.102 4.417 ( 1.739 1.494 0.258) 2.307 4.654 ( 1.907 -1.529 -4.950) 5.521 4.732 ( -0.338 -5.617 -1.655) 5.866 4.819 ( 0.211 1.541 -1.476) 2.144 5.020 ( 0.063 -4.963 -1.301) 5.131 6.483 ( 0.064 0.208 1.289) 1.307 6.547 ( -0.824 -1.447 -0.003) 1.666 7.189 ( -0.151 2.058 3.344) 3.929 7.510 ( -0.655 -5.239 0.410) 5.295 7.799 ( 0.023 -8.665 -1.923) 8.875 7.959 ( -0.105 -12.550 9.428) 15.697 8.327 ( -1.575 -5.009 -1.230) 5.393 8.563 ( -0.196 -8.623 -0.454) 8.637 9.091 ( 2.711 6.213 -1.978) 7.061 9.185 ( -5.300 5.680 -0.441) 7.781 9.377 ( -3.926 2.415 -9.566) 10.619 9.560 ( 4.001 -2.514 4.761) 6.707 9.796 ( -1.085 -2.198 -1.297) 2.773 9.952 ( -0.141 -5.254 4.208) 6.733 10.125 ( 2.158 3.924 0.852) 4.559 10.563 ( 6.396 -7.683 -1.647) 10.132 10.737 ( -0.554 -1.860 -2.575) 3.224 10.876 ( -1.535 4.424 3.043) 5.585 11.138 ( 0.915 2.140 -2.937) 3.748 11.245 ( 2.090 4.952 -5.537) 7.717 11.403 ( -1.287 -5.528 -2.592) 6.239 11.469 ( -2.217 -4.004 2.544) 5.236 12.100 ( 1.903 5.040 -1.105) 5.499 12.300 ( -3.120 0.489 1.220) 3.385 13.119 ( 1.113 6.581 -1.121) 6.768 13.279 ( 3.524 1.233 -2.350) 4.412 13.372 ( 0.526 0.213 -0.321) 0.652 13.547 ( -3.987 -2.064 -1.132) 4.630 13.800 ( 0.048 0.501 1.718) 1.791 13.895 ( -0.735 -2.865 1.158) 3.176 15.321 ( 1.405 -2.920 -1.166) 3.444 15.374 ( -3.664 -6.419 4.296) 8.549 15.935 ( 0.210 -1.981 4.818) 5.214 16.054 ( -0.826 -5.129 1.795) 5.497 16.811 ( 0.729 18.449 5.284) 19.205 17.185 ( 5.122 11.384 7.358) 14.491 17.223 ( -1.273 12.027 -5.765) 13.398 17.475 ( 0.461 3.726 -5.438) 6.608 17.835 ( 1.346 -6.263 -11.106) 12.821 18.077 ( 6.644 -8.135 10.274) 14.693 18.973 ( -1.471 -10.104 -5.537) 11.616 19.255 ( -8.802 -11.386 3.050) 14.711 ======================= Grid point 138 (70/195) ======================= q-point: (-0.45 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 2.963 1.085 -11.672) 12.091 1.731 ( 12.548 -1.754 -5.970) 14.006 2.118 ( -2.016 2.859 4.304) 5.546 2.236 ( -0.298 -2.857 7.387) 7.925 2.471 ( -10.349 -2.286 3.825) 11.267 2.622 ( 1.449 0.192 2.503) 2.898 2.715 ( 4.854 -5.639 3.274) 8.129 2.864 ( 3.133 -3.545 4.766) 6.716 3.130 ( 2.848 0.189 -0.217) 2.862 3.335 ( 1.406 -3.300 -2.106) 4.159 3.479 ( -1.054 -0.102 -1.883) 2.160 3.579 ( -0.648 3.758 3.810) 5.391 4.232 ( -2.025 1.606 -2.910) 3.891 4.423 ( 0.268 1.924 -2.227) 2.955 4.563 ( -3.817 -3.898 -6.857) 8.762 4.674 ( -0.529 0.318 -6.991) 7.018 4.826 ( 1.480 -2.404 0.523) 2.871 5.001 ( -0.108 -5.457 -2.008) 5.816 6.527 ( 2.026 0.784 3.037) 3.734 6.583 ( 3.619 -1.059 1.376) 4.014 7.223 ( -1.572 0.727 4.807) 5.109 7.522 ( 1.689 -7.196 0.325) 7.399 7.783 ( -1.576 -4.740 1.692) 5.274 8.055 ( -1.801 -12.439 9.624) 15.830 8.302 ( 0.966 -4.047 -2.165) 4.691 8.568 ( 0.783 -9.727 -0.365) 9.766 9.092 ( 0.486 6.838 -7.109) 9.876 9.113 ( -1.440 2.761 -1.534) 3.471 9.240 ( 0.741 2.298 -4.393) 5.013 9.625 ( 2.596 -8.104 -4.118) 9.454 9.819 ( 1.825 2.071 4.775) 5.516 9.998 ( -0.338 -2.839 4.535) 5.361 10.153 ( -1.893 5.295 2.913) 6.333 10.564 ( -5.419 -10.180 -2.213) 11.743 10.671 ( -0.614 2.587 -2.451) 3.616 10.845 ( -2.804 2.102 -1.106) 3.675 11.108 ( -0.246 0.778 -8.016) 8.057 11.247 ( 3.119 3.946 -0.385) 5.045 11.368 ( 0.408 -6.505 -3.373) 7.340 11.485 ( 3.438 -1.838 1.597) 4.213 12.117 ( 0.860 5.752 0.359) 5.827 12.247 ( -2.904 1.918 -1.896) 3.963 13.124 ( -0.345 6.388 0.001) 6.397 13.335 ( -0.784 5.726 -1.860) 6.071 13.366 ( 3.724 -3.912 1.233) 5.540 13.446 ( -1.506 -7.210 -5.862) 9.413 13.835 ( 1.243 1.618 3.300) 3.880 13.918 ( 0.232 0.275 1.893) 1.926 15.353 ( 1.421 -3.568 1.575) 4.151 15.412 ( 2.446 -6.878 3.459) 8.078 15.936 ( -4.787 0.785 3.851) 6.194 16.126 ( 1.423 -4.306 7.190) 8.501 16.745 ( -8.929 13.682 2.369) 16.509 17.105 ( -7.338 8.801 -1.601) 11.571 17.338 ( -2.124 3.854 -8.851) 9.885 17.471 ( 8.217 8.360 6.155) 13.240 17.763 ( 1.998 -3.024 -3.681) 5.165 18.180 ( -2.752 0.708 3.670) 4.642 19.025 ( 5.468 -12.767 -2.946) 14.198 19.167 ( 3.009 -13.302 0.045) 13.638 ======================= Grid point 139 (71/195) ======================= q-point: (-0.36 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 6.381 4.724 -10.809) 13.412 1.951 ( 17.407 -0.877 -2.802) 17.653 2.119 ( -2.392 10.875 1.789) 11.277 2.274 ( -5.257 -2.408 6.268) 8.528 2.438 ( 0.021 -5.246 8.983) 10.403 2.639 ( -2.626 -2.758 4.965) 6.258 2.802 ( 1.761 -0.171 -2.103) 2.748 3.004 ( 6.555 -6.964 3.507) 10.187 3.183 ( 2.685 2.147 -2.792) 4.429 3.314 ( 1.577 -7.251 -3.201) 8.082 3.412 ( -3.834 4.516 -3.317) 6.790 3.643 ( 2.055 3.472 5.518) 6.836 4.202 ( 0.815 -1.394 1.216) 2.022 4.374 ( -3.019 2.636 -4.457) 5.994 4.412 ( -2.571 -4.884 -5.084) 7.504 4.563 ( -1.266 0.760 -8.633) 8.758 4.869 ( 1.693 -4.007 1.595) 4.634 4.966 ( -0.638 -5.008 -2.782) 5.765 6.624 ( 4.989 0.439 2.903) 5.789 6.681 ( 5.565 -1.069 1.148) 5.782 7.251 ( -1.115 -0.654 3.966) 4.172 7.568 ( 2.688 -8.948 0.675) 9.368 7.805 ( -0.630 -1.794 6.425) 6.701 8.138 ( -0.038 -8.959 7.726) 11.831 8.283 ( -0.822 -4.506 -2.597) 5.266 8.576 ( 1.554 -9.762 -0.975) 9.932 8.976 ( -3.159 2.842 -6.281) 7.583 9.061 ( -0.852 -2.773 -3.789) 4.772 9.291 ( 6.637 4.793 -1.749) 8.372 9.606 ( 3.088 -5.655 -5.725) 8.619 9.919 ( 1.599 2.659 4.962) 5.852 10.056 ( -0.294 0.154 5.432) 5.442 10.115 ( -5.206 3.293 1.764) 6.408 10.356 ( -13.496 -5.271 -2.577) 14.716 10.674 ( 0.264 -0.400 1.832) 1.893 10.781 ( -0.123 -0.104 -4.594) 4.597 10.969 ( -2.513 5.126 -9.946) 11.467 11.222 ( -4.822 -3.054 -1.825) 5.992 11.405 ( 8.249 -0.311 -2.423) 8.603 11.630 ( 8.655 -3.976 3.534) 10.159 12.106 ( -5.057 5.494 -1.224) 7.567 12.189 ( 1.729 3.864 -1.146) 4.386 13.078 ( -5.198 4.694 0.169) 7.006 13.208 ( -7.927 1.518 -1.184) 8.157 13.415 ( 6.489 -3.401 -5.698) 9.281 13.517 ( 8.378 -4.341 0.561) 9.453 13.900 ( 1.024 2.540 2.856) 3.957 13.939 ( 0.495 1.366 1.495) 2.085 15.388 ( 0.715 -0.647 0.623) 1.148 15.515 ( 4.523 -6.839 2.429) 8.551 15.890 ( -6.243 4.862 4.310) 9.011 16.231 ( -1.054 -4.262 9.855) 10.788 16.673 ( -4.725 5.618 7.012) 10.152 16.885 ( -12.424 8.347 -4.909) 15.752 17.161 ( -3.568 -0.652 -11.716) 12.265 17.530 ( -5.351 -11.273 2.474) 12.722 17.918 ( 8.567 16.692 9.228) 20.908 18.143 ( -2.409 3.622 -0.940) 4.450 18.931 ( 0.106 -5.907 -11.584) 13.003 19.440 ( 17.467 -16.845 4.909) 24.757 ======================= Grid point 140 (72/195) ======================= q-point: (-0.27 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( 3.268 12.473 -7.718) 15.027 2.021 ( -9.365 17.298 2.211) 19.794 2.205 ( 13.339 0.716 -2.498) 13.590 2.347 ( 2.341 -4.024 7.286) 8.646 2.551 ( -2.374 -4.050 2.157) 5.166 2.654 ( 1.136 -3.466 6.031) 7.048 2.774 ( 0.454 0.375 -1.918) 2.006 3.058 ( 0.584 0.588 -5.095) 5.162 3.221 ( 7.124 -5.646 0.083) 9.091 3.277 ( -5.335 5.788 -3.544) 8.632 3.329 ( 2.186 -5.462 -1.561) 6.087 3.785 ( 5.468 -0.768 5.893) 8.076 4.238 ( -2.594 0.391 -2.329) 3.508 4.269 ( 0.485 -0.481 -2.673) 2.759 4.379 ( 1.449 -3.933 2.590) 4.927 4.454 ( -0.817 -2.308 -5.705) 6.208 4.907 ( 0.317 -4.786 -0.946) 4.889 4.922 ( -0.165 -3.527 -0.967) 3.661 6.753 ( 7.249 -0.794 0.656) 7.322 6.792 ( 6.369 -2.106 0.019) 6.708 7.281 ( 1.151 -1.266 1.437) 2.234 7.621 ( 2.068 -9.110 1.052) 9.400 7.924 ( 3.260 -2.174 9.631) 10.397 8.207 ( -4.172 -6.797 -1.249) 8.073 8.238 ( 3.672 -1.669 2.740) 4.876 8.618 ( 4.163 -8.246 0.147) 9.238 8.842 ( -5.567 -0.268 -3.686) 6.682 9.006 ( -2.114 -7.755 -1.362) 8.153 9.389 ( 6.936 4.880 -1.752) 8.660 9.593 ( 1.596 -1.068 -4.631) 5.014 9.959 ( -11.234 0.013 1.095) 11.287 9.968 ( -3.950 2.862 2.380) 5.428 10.040 ( -10.835 -1.425 -2.501) 11.211 10.197 ( 2.681 -0.451 2.145) 3.463 10.699 ( 0.502 -2.025 -0.055) 2.087 10.722 ( -2.363 2.526 -5.550) 6.539 10.856 ( 0.846 5.585 -0.903) 5.720 11.099 ( -4.376 -2.401 -4.531) 6.741 11.535 ( 7.670 1.731 -0.302) 7.869 11.825 ( 9.081 -6.504 1.235) 11.237 11.956 ( -6.340 7.434 -3.655) 10.432 12.247 ( 2.034 0.764 3.148) 3.825 12.976 ( -5.934 3.858 1.402) 7.215 13.106 ( -3.940 1.155 1.290) 4.304 13.466 ( 6.915 -0.343 -6.890) 9.767 13.646 ( 6.115 -3.104 -0.554) 6.880 13.924 ( -0.139 2.047 0.887) 2.236 13.985 ( 2.614 -0.757 1.584) 3.149 15.379 ( -0.807 8.262 -2.501) 8.670 15.598 ( 0.309 -4.942 4.019) 6.378 15.810 ( -8.325 1.149 2.956) 8.908 16.329 ( -0.713 -7.009 9.086) 11.497 16.624 ( -10.409 9.464 -2.213) 14.242 16.734 ( 0.445 1.356 6.052) 6.218 16.970 ( -3.522 -2.548 -8.284) 9.355 17.452 ( -8.103 -13.178 5.396) 16.384 18.059 ( -0.749 2.505 -4.610) 5.300 18.138 ( 0.549 9.707 7.326) 12.174 18.844 ( 7.804 7.055 -12.377) 16.244 19.792 ( 16.121 -16.863 4.492) 23.758 ======================= Grid point 141 (73/195) ======================= q-point: (-0.18 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -3.106 18.275 -3.354) 18.838 1.881 ( -7.590 18.800 -1.195) 20.310 2.269 ( -5.445 6.195 -2.404) 8.591 2.366 ( -7.338 0.959 0.678) 7.432 2.509 ( 3.842 -2.394 3.294) 5.599 2.774 ( 2.443 -0.115 -3.219) 4.042 2.796 ( 5.068 5.351 4.488) 8.629 3.108 ( 5.877 2.111 -1.948) 6.542 3.207 ( 3.154 -3.786 0.723) 4.980 3.343 ( 2.536 -6.698 0.262) 7.166 3.354 ( 5.544 -7.143 -0.314) 9.047 3.887 ( 1.650 -7.735 -1.392) 8.030 4.192 ( -1.294 0.949 -2.170) 2.698 4.216 ( 0.214 2.079 0.289) 2.110 4.411 ( 0.142 -4.928 -0.798) 4.994 4.501 ( 3.000 -2.725 6.576) 7.724 4.860 ( -0.100 -3.131 -3.758) 4.893 4.936 ( -0.373 -4.838 0.952) 4.945 6.883 ( 8.465 -3.237 -1.549) 9.194 6.895 ( 6.529 -4.282 -1.408) 7.934 7.326 ( 3.163 -1.206 -0.350) 3.403 7.655 ( 0.909 -8.509 0.065) 8.558 8.123 ( 4.167 -6.719 7.168) 10.672 8.127 ( 2.294 -2.489 -3.104) 4.593 8.330 ( 3.271 1.603 2.529) 4.434 8.695 ( -2.073 -1.152 -1.367) 2.738 8.738 ( 0.481 -6.439 4.236) 7.722 8.936 ( -6.117 -8.011 0.524) 10.093 9.486 ( 4.727 3.519 0.370) 5.905 9.518 ( -4.718 1.405 -2.878) 5.702 9.649 ( -19.769 0.675 -3.763) 20.135 9.812 ( -5.149 -4.481 -1.163) 6.924 10.051 ( 3.024 2.893 1.412) 4.416 10.270 ( 2.864 -2.085 0.428) 3.568 10.557 ( -4.438 6.525 -7.586) 10.946 10.730 ( 0.518 -0.675 1.983) 2.158 10.940 ( 2.585 2.632 5.321) 6.475 10.985 ( -2.034 0.173 -4.624) 5.054 11.631 ( 3.576 2.864 -0.784) 4.648 11.792 ( -3.230 1.842 -3.294) 4.967 11.989 ( 4.688 -1.557 0.242) 4.945 12.315 ( 0.902 -4.428 4.010) 6.042 12.961 ( -0.236 8.246 5.308) 9.809 13.083 ( -1.013 4.400 0.961) 4.616 13.472 ( 3.776 -1.512 -7.268) 8.329 13.703 ( 2.176 -4.931 -2.251) 5.841 13.940 ( 2.154 1.955 0.441) 2.942 14.062 ( 3.978 -1.835 1.065) 4.508 15.307 ( -3.184 15.195 -2.927) 15.799 15.589 ( -10.308 1.891 5.911) 12.032 15.700 ( -4.095 -6.945 0.666) 8.089 16.385 ( -0.971 -13.341 2.873) 13.681 16.499 ( -4.031 9.541 1.006) 10.406 16.763 ( 0.887 -0.877 -4.322) 4.499 16.926 ( 2.687 -0.604 2.663) 3.832 17.385 ( -10.011 -11.928 8.635) 17.806 17.955 ( -3.256 2.561 -5.472) 6.863 18.153 ( 0.165 -2.421 -3.885) 4.581 18.924 ( 10.244 20.512 -2.527) 23.066 20.076 ( 11.893 -16.460 2.194) 20.425 ======================= Grid point 142 (74/195) ======================= q-point: (-0.09 0.33 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -6.918 19.622 2.287) 20.931 1.736 ( -3.240 21.874 -6.370) 23.012 2.114 ( -4.271 0.403 -3.286) 5.404 2.287 ( -7.228 15.839 9.751) 19.955 2.622 ( 1.618 0.013 0.213) 1.632 2.755 ( 1.711 2.476 -1.909) 3.564 2.948 ( 5.522 3.617 3.459) 7.453 3.096 ( 0.287 2.269 -2.221) 3.188 3.347 ( 2.447 -4.748 0.287) 5.349 3.372 ( 6.994 -5.176 -3.469) 9.367 3.447 ( 3.090 -12.629 -1.004) 13.040 3.864 ( 0.823 -10.647 -1.272) 10.755 4.157 ( -0.322 -1.148 1.353) 1.803 4.259 ( -0.529 0.799 3.093) 3.238 4.427 ( 0.637 -3.290 0.845) 3.456 4.576 ( -1.001 1.174 2.442) 2.889 4.845 ( 2.227 -4.598 -1.065) 5.219 4.928 ( -1.338 -5.230 0.819) 5.460 6.975 ( 4.611 -6.956 -1.589) 8.495 7.001 ( 7.932 -5.743 -3.190) 10.299 7.368 ( 2.427 -1.073 -1.399) 3.000 7.648 ( -0.351 -8.481 -2.087) 8.741 8.113 ( 5.802 -2.464 -4.957) 8.019 8.305 ( 4.939 -7.818 2.787) 9.658 8.433 ( 3.942 3.853 3.653) 6.612 8.625 ( -1.396 0.004 0.443) 1.464 8.767 ( -9.916 -4.100 4.231) 11.535 8.829 ( -5.362 -2.614 -0.262) 5.971 9.305 ( -12.572 0.516 -1.374) 12.657 9.396 ( -4.339 -4.454 1.347) 6.362 9.606 ( 4.425 2.685 2.811) 5.890 9.745 ( -1.310 -3.310 -2.075) 4.120 10.113 ( 1.608 3.412 1.336) 4.002 10.305 ( 1.790 -3.167 -1.187) 3.827 10.439 ( -1.064 5.546 -3.317) 6.549 10.743 ( -1.395 -4.244 1.784) 4.811 10.939 ( 0.749 5.823 -1.252) 6.002 11.021 ( -0.177 3.888 3.818) 5.452 11.648 ( 0.762 2.790 -0.369) 2.915 11.763 ( 0.406 -0.714 1.123) 1.391 12.028 ( 1.335 -0.740 -0.691) 1.675 12.358 ( -0.637 -6.684 1.928) 6.986 13.023 ( -0.063 15.116 -0.018) 15.116 13.068 ( 0.113 7.296 -2.329) 7.660 13.467 ( 2.242 -5.132 0.075) 5.600 13.700 ( 1.736 -8.157 -1.197) 8.426 14.010 ( 4.476 2.279 0.143) 5.024 14.125 ( 2.210 -1.123 0.029) 2.479 15.218 ( -5.891 17.363 1.077) 18.367 15.452 ( -5.755 0.564 0.260) 5.788 15.680 ( -4.493 -4.169 6.632) 9.030 16.387 ( -2.355 -13.873 1.812) 14.188 16.455 ( -0.005 1.806 -3.213) 3.686 16.744 ( 6.220 -2.140 -7.463) 9.948 17.006 ( 1.464 0.141 0.825) 1.686 17.264 ( -12.766 -7.577 2.735) 15.095 17.865 ( 0.097 3.839 -3.109) 4.941 18.126 ( 2.757 -4.790 -3.469) 6.525 19.080 ( 5.494 22.392 4.637) 23.517 20.238 ( 5.972 -15.813 -1.049) 16.936 ======================= Grid point 143 (75/195) ======================= q-point: ( 0.00 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 0.488 15.161 3.274) 15.518 1.936 ( 0.236 -2.944 -2.534) 3.891 2.106 ( 4.797 10.326 1.826) 11.531 2.333 ( 0.390 -9.720 2.563) 10.059 2.701 ( -5.398 14.567 -11.417) 19.279 2.961 ( -1.943 -2.377 -3.026) 4.311 3.010 ( -1.276 0.052 -1.965) 2.344 3.100 ( -1.777 -4.689 -2.079) 5.428 3.244 ( 1.826 2.169 -0.129) 2.838 3.294 ( -0.625 -2.693 -0.006) 2.764 3.396 ( 4.147 8.584 3.430) 10.131 3.690 ( 2.966 -15.477 8.211) 17.769 4.204 ( 1.355 0.834 5.371) 5.602 4.244 ( 0.350 -2.822 3.826) 4.767 4.416 ( -3.502 3.958 -1.944) 5.631 4.509 ( -4.305 -4.280 -1.808) 6.334 4.832 ( 1.356 -0.173 1.798) 2.259 4.862 ( 0.435 -2.687 2.062) 3.415 6.900 ( 1.277 -1.995 -2.785) 3.656 6.932 ( 1.931 -4.792 -3.497) 6.238 7.381 ( 0.688 2.429 -2.808) 3.776 7.464 ( 0.546 -6.001 -3.485) 6.961 8.171 ( 1.729 0.047 -0.491) 1.798 8.216 ( -2.866 -4.660 -1.305) 5.625 8.501 ( -1.455 3.979 -0.287) 4.246 8.567 ( -3.582 -3.126 -1.064) 4.872 8.702 ( -3.940 3.380 -0.700) 5.238 8.748 ( 1.292 -0.627 -0.283) 1.463 9.243 ( 2.483 0.234 5.797) 6.311 9.296 ( 2.912 -5.590 5.970) 8.682 9.679 ( -0.438 2.738 0.280) 2.787 9.725 ( 1.560 -2.080 1.571) 3.038 10.172 ( -1.684 2.563 -1.993) 3.658 10.231 ( -0.714 -3.439 -3.002) 4.620 10.562 ( 3.473 5.490 3.350) 7.309 10.662 ( 1.542 -4.881 3.556) 6.233 11.052 ( -1.491 3.727 0.922) 4.119 11.084 ( -2.274 0.488 1.967) 3.046 11.734 ( 2.955 2.534 3.487) 5.226 11.778 ( 2.323 -1.917 3.682) 4.757 12.079 ( -0.559 3.983 -0.481) 4.051 12.188 ( -2.537 -6.695 -1.997) 7.433 13.099 ( -4.377 5.311 -11.287) 13.220 13.120 ( -4.896 3.248 -9.644) 11.293 13.561 ( 6.408 1.036 11.035) 12.802 13.633 ( 4.970 -5.805 7.774) 10.900 14.086 ( -0.815 1.820 -0.476) 2.051 14.116 ( -0.737 -1.191 -0.686) 1.560 15.395 ( -0.727 6.672 -0.488) 6.730 15.457 ( 2.161 -0.556 -0.651) 2.324 15.757 ( -4.570 11.153 10.982) 16.306 16.062 ( -2.411 -17.120 3.782) 17.697 16.476 ( 2.915 7.330 -7.844) 11.124 16.651 ( 6.920 -9.604 -9.219) 15.004 16.941 ( -5.441 0.606 -6.609) 8.582 16.968 ( -7.306 -2.480 -5.677) 9.579 18.011 ( 3.894 5.558 4.515) 8.151 18.108 ( 3.571 -4.189 4.493) 7.105 19.576 ( -0.592 19.314 1.870) 19.413 19.936 ( -0.702 -17.629 -2.083) 17.766 ======================= Grid point 144 (76/195) ======================= q-point: ( 0.09 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.824 ( 4.616 12.534 3.255) 13.748 1.955 ( 4.298 2.885 -1.606) 5.420 2.267 ( 8.080 3.974 4.183) 9.928 2.383 ( 0.204 -4.812 1.009) 4.921 2.453 ( -4.499 10.224 -10.351) 15.229 2.734 ( -8.491 -14.923 -11.476) 20.651 2.964 ( -5.789 6.151 0.293) 8.452 3.051 ( -3.500 -2.123 0.594) 4.137 3.250 ( 0.162 -2.565 -0.788) 2.688 3.279 ( -1.188 -4.895 0.043) 5.038 3.535 ( 2.458 14.996 8.602) 17.462 3.806 ( -0.449 -10.866 5.432) 12.157 4.280 ( -2.336 3.988 0.179) 4.625 4.306 ( 2.485 1.401 4.017) 4.927 4.365 ( 1.747 -3.938 3.539) 5.575 4.380 ( -5.418 -3.711 -3.127) 7.274 4.871 ( -0.068 -0.504 2.163) 2.222 4.894 ( -0.089 -2.480 2.509) 3.529 6.858 ( -1.719 -1.916 -3.774) 4.568 6.881 ( -2.255 -3.841 -4.548) 6.366 7.360 ( 0.512 2.082 -2.028) 2.951 7.438 ( 1.370 -5.954 -3.572) 7.077 7.996 ( -13.340 0.476 -5.257) 14.347 8.058 ( -11.022 -5.649 -1.934) 12.536 8.600 ( -4.105 7.896 1.929) 9.106 8.611 ( 8.625 1.064 0.745) 8.723 8.638 ( 6.263 -2.057 1.622) 6.789 8.745 ( 0.269 -6.101 0.435) 6.122 9.443 ( 11.164 0.483 4.377) 12.001 9.486 ( 10.165 -3.435 4.705) 11.716 9.682 ( -1.337 4.860 3.028) 5.880 9.763 ( -0.018 -3.392 2.865) 4.440 10.096 ( -3.102 1.981 -3.124) 4.828 10.157 ( -2.168 -4.067 -4.915) 6.738 10.689 ( 3.717 3.096 4.159) 6.379 10.730 ( 0.963 -1.608 2.754) 3.331 11.029 ( -1.733 4.187 2.332) 5.096 11.081 ( -0.255 -1.339 3.103) 3.390 11.800 ( -3.862 3.813 0.549) 5.455 11.859 ( 2.401 -1.053 3.446) 4.330 12.074 ( -3.122 0.687 1.733) 3.636 12.134 ( 2.787 -4.330 0.734) 5.202 12.913 ( -1.364 4.645 -8.640) 9.904 12.962 ( -0.687 -0.629 -8.201) 8.254 13.754 ( 1.718 1.570 8.949) 9.247 13.783 ( 0.803 -1.732 7.324) 7.569 14.016 ( -5.021 2.251 -1.683) 5.754 14.055 ( -4.230 -1.620 -2.102) 4.994 15.421 ( 3.327 7.674 -1.216) 8.452 15.511 ( 2.839 -3.063 1.180) 4.340 15.840 ( -1.525 8.364 11.914) 14.637 16.061 ( -1.434 -11.578 0.422) 11.674 16.455 ( 5.402 6.637 -7.852) 11.614 16.620 ( 4.849 -6.821 -16.016) 18.071 16.816 ( 0.142 -3.593 -3.200) 4.814 16.831 ( 1.468 -3.357 -3.017) 4.747 18.129 ( 2.416 6.089 4.503) 7.949 18.206 ( 1.404 -1.364 3.308) 3.844 19.541 ( -6.601 14.489 3.357) 16.272 19.834 ( -7.173 -15.216 -3.335) 17.149 ======================= Grid point 145 (77/195) ======================= q-point: ( 0.18 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( 3.493 9.152 -0.209) 9.798 2.007 ( 2.821 3.958 -2.461) 5.448 2.209 ( -4.003 4.690 -8.509) 10.508 2.343 ( -5.190 -5.416 -6.489) 9.919 2.452 ( 2.220 3.349 0.750) 4.087 2.584 ( -0.974 -8.918 5.932) 10.755 2.829 ( -6.395 7.643 -2.268) 10.220 2.988 ( -3.837 -7.361 -0.965) 8.356 3.236 ( -1.010 -2.477 -0.542) 2.729 3.267 ( -1.212 -5.284 1.795) 5.711 3.644 ( -1.498 10.131 6.785) 12.285 3.770 ( -6.147 -2.090 -1.109) 6.587 4.257 ( -2.807 -0.333 0.571) 2.884 4.279 ( 0.629 -2.296 3.100) 3.909 4.398 ( 3.570 4.200 1.803) 5.799 4.493 ( 4.940 -4.925 3.387) 7.754 4.877 ( -1.342 0.670 1.574) 2.174 4.920 ( -0.388 -3.305 2.657) 4.258 6.755 ( -4.445 -1.613 -5.515) 7.265 6.763 ( -4.020 -2.411 -4.456) 6.468 7.351 ( -1.092 2.488 0.570) 2.776 7.424 ( 0.946 -5.046 -2.411) 5.672 7.741 ( -7.308 1.088 -5.391) 9.147 7.847 ( -7.983 -9.168 -3.908) 12.769 8.501 ( -7.373 6.068 1.772) 9.712 8.613 ( -5.610 -4.824 1.199) 7.496 8.864 ( 10.815 1.057 5.459) 12.161 8.903 ( 10.989 -2.965 4.699) 12.314 9.627 ( 1.492 3.314 0.704) 3.702 9.677 ( 3.059 -0.951 1.231) 3.432 9.742 ( 9.120 1.749 2.162) 9.534 9.809 ( 4.228 -3.475 2.452) 5.997 10.004 ( -2.735 0.850 -3.135) 4.246 10.047 ( -2.593 -3.404 -6.147) 7.490 10.740 ( -0.257 2.315 2.461) 3.388 10.780 ( 1.158 -1.442 2.650) 3.232 11.086 ( 2.504 4.315 5.351) 7.316 11.144 ( 1.859 -1.898 3.939) 4.751 11.670 ( -7.306 3.972 -3.574) 9.051 11.776 ( -8.439 -6.792 -4.484) 11.724 12.123 ( 2.560 7.361 3.964) 8.744 12.235 ( 2.419 -3.751 4.311) 6.205 12.897 ( 6.396 2.846 -1.457) 7.151 12.937 ( 6.006 -1.253 -2.513) 6.630 13.767 ( -9.279 0.855 1.452) 9.431 13.788 ( -7.855 -0.571 3.268) 8.527 13.943 ( -0.807 1.673 -0.501) 1.924 13.965 ( -1.732 -0.674 -1.418) 2.338 15.436 ( -0.238 5.683 -1.364) 5.850 15.536 ( -2.071 -4.857 0.317) 5.290 15.944 ( -1.664 2.907 4.861) 5.903 16.008 ( -0.125 -1.972 -3.381) 3.916 16.463 ( 7.302 7.934 -6.854) 12.777 16.632 ( 10.148 -4.692 0.540) 11.194 16.856 ( 9.342 -2.469 -2.062) 9.881 16.943 ( 10.568 -8.794 -1.007) 13.785 18.163 ( -1.595 6.796 -1.515) 7.143 18.216 ( -1.863 1.558 -0.535) 2.487 19.443 ( -10.669 6.975 5.767) 13.991 19.625 ( -12.091 -11.324 -3.241) 16.880 ======================= Grid point 146 (78/195) ======================= q-point: ( 0.27 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( 0.883 6.773 -4.026) 7.929 1.985 ( 0.254 5.300 -4.128) 6.723 2.086 ( -2.726 -3.828 -5.064) 6.909 2.140 ( -5.549 -6.096 -5.794) 10.076 2.502 ( -3.109 6.659 6.608) 9.883 2.574 ( -7.918 1.536 5.798) 9.934 2.782 ( 1.333 -0.336 -0.960) 1.677 2.893 ( -5.162 -8.199 -2.049) 9.903 3.197 ( -2.114 0.112 -1.637) 2.676 3.272 ( -0.902 -6.698 1.428) 6.907 3.613 ( -5.631 3.356 -0.689) 6.591 3.644 ( -4.710 0.422 -0.832) 4.802 4.285 ( 2.099 5.057 5.117) 7.494 4.394 ( 4.115 -5.106 6.519) 9.247 4.457 ( 3.005 5.939 -1.632) 6.854 4.585 ( 3.674 -6.462 -0.831) 7.480 4.878 ( -0.530 2.718 1.624) 3.210 4.943 ( -0.143 -3.863 2.008) 4.356 6.609 ( -4.489 0.212 -4.824) 6.593 6.643 ( -4.042 -3.156 -3.800) 6.383 7.308 ( -4.447 5.362 0.723) 7.004 7.413 ( -0.488 -5.211 -0.289) 5.242 7.651 ( 0.349 -1.794 -0.660) 1.943 7.720 ( -1.176 -8.663 -4.138) 9.672 8.406 ( -5.723 4.527 1.521) 7.454 8.523 ( -5.940 -6.810 1.018) 9.094 9.093 ( 7.684 3.332 4.686) 9.597 9.148 ( 8.550 -1.841 7.517) 11.532 9.555 ( -7.030 4.678 -0.688) 8.472 9.640 ( -3.616 -3.644 -2.618) 5.763 9.867 ( -1.819 0.595 -2.366) 3.043 9.893 ( 1.409 -1.868 -2.968) 3.779 9.974 ( 6.195 1.975 -1.175) 6.608 10.046 ( 10.560 -5.197 -0.414) 11.777 10.781 ( 1.209 4.077 2.899) 5.147 10.840 ( 2.186 -1.318 2.503) 3.575 11.195 ( 2.549 1.252 4.046) 4.944 11.212 ( 0.691 -0.656 3.457) 3.586 11.507 ( -5.865 1.667 -3.847) 7.210 11.571 ( -7.598 -4.447 -5.018) 10.133 12.176 ( 1.204 7.533 0.247) 7.632 12.293 ( -0.274 -3.953 2.490) 4.680 13.048 ( 9.425 4.078 2.594) 10.592 13.108 ( 10.403 -1.359 4.239) 11.315 13.577 ( -10.489 -0.107 -2.603) 10.807 13.609 ( -10.650 -2.610 -2.538) 11.255 13.916 ( -2.174 2.208 -1.139) 3.301 13.941 ( -1.602 -0.301 -0.158) 1.638 15.388 ( -3.335 2.151 -0.824) 4.053 15.454 ( -6.279 -4.589 -0.200) 7.779 15.890 ( -0.408 4.634 -3.806) 6.010 15.997 ( -1.052 -5.913 -0.986) 6.086 16.639 ( 12.842 16.415 5.371) 21.523 16.881 ( 11.893 -1.073 5.533) 13.161 17.077 ( 16.106 -8.714 2.002) 18.422 17.134 ( 13.083 -8.227 -1.655) 15.543 18.028 ( -6.434 10.388 -8.481) 14.874 18.133 ( -4.433 -0.313 -4.884) 6.603 19.319 ( -12.386 -1.253 6.940) 14.253 19.362 ( -14.454 -5.834 -2.075) 15.725 ======================= Grid point 147 (79/195) ======================= q-point: ( 0.36 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( -2.265 5.821 -10.441) 12.167 1.938 ( -2.571 -4.185 -8.954) 10.212 2.017 ( 0.363 -0.296 4.504) 4.528 2.059 ( -1.332 -2.060 1.954) 3.136 2.495 ( -4.900 6.414 6.373) 10.285 2.544 ( -3.184 2.454 3.553) 5.365 2.746 ( -5.987 -4.699 1.277) 7.718 2.781 ( -4.905 -6.431 -0.788) 8.126 3.140 ( -1.674 3.199 -1.381) 3.865 3.260 ( -0.965 -7.625 -0.376) 7.695 3.535 ( -1.710 3.330 -0.523) 3.780 3.586 ( -1.600 -1.536 -0.047) 2.218 4.390 ( 1.975 6.810 4.337) 8.312 4.465 ( 1.724 5.064 -3.139) 6.202 4.535 ( 4.208 -5.297 3.958) 7.838 4.602 ( 1.980 -6.937 -3.922) 8.211 4.891 ( 0.326 3.342 0.150) 3.361 4.955 ( -0.112 -3.442 -0.014) 3.444 6.509 ( -2.086 1.015 -2.154) 3.165 6.549 ( -2.771 -2.896 -1.775) 4.384 7.258 ( -1.722 6.271 0.681) 6.539 7.398 ( -1.390 -7.488 0.626) 7.642 7.689 ( 1.087 -3.619 -0.529) 3.816 7.696 ( 1.068 -4.494 3.323) 5.691 8.342 ( -3.367 2.659 0.720) 4.350 8.444 ( -3.902 -7.178 0.429) 8.181 9.206 ( 2.576 7.191 0.035) 7.638 9.339 ( 3.053 -5.754 3.628) 7.456 9.426 ( -4.284 7.204 -0.204) 8.384 9.540 ( -2.783 -3.992 -5.559) 7.388 9.808 ( -2.776 -0.578 0.161) 2.840 9.831 ( -1.764 -2.970 -0.269) 3.464 10.114 ( 7.644 4.366 -0.068) 8.803 10.230 ( 9.611 -7.811 0.402) 12.391 10.828 ( 1.364 5.594 0.329) 5.767 10.899 ( 1.678 -0.665 1.354) 2.257 11.215 ( -1.675 1.370 -0.338) 2.190 11.264 ( -0.247 -2.568 2.295) 3.452 11.397 ( -2.374 0.547 -2.598) 3.561 11.436 ( -1.790 -2.447 -2.861) 4.169 12.193 ( 1.120 6.551 -0.349) 6.655 12.297 ( -1.292 -3.716 1.145) 4.098 13.224 ( 4.318 6.653 1.639) 8.099 13.307 ( 7.114 1.321 1.599) 7.410 13.373 ( -7.416 -0.817 -4.409) 8.666 13.466 ( -1.735 -7.038 1.849) 7.480 13.846 ( -3.376 2.490 -1.613) 4.495 13.889 ( -3.315 -1.884 -1.192) 3.995 15.323 ( -2.981 0.436 -0.267) 3.024 15.354 ( -5.815 -2.699 1.727) 6.640 15.876 ( 1.151 3.052 0.171) 3.266 15.964 ( -1.251 -5.736 -0.224) 5.875 16.949 ( 11.004 17.551 9.097) 22.625 17.128 ( 10.739 3.774 3.841) 12.013 17.329 ( 12.275 -4.940 -1.239) 13.290 17.434 ( 16.402 -12.733 6.808) 21.852 17.780 ( -7.565 11.467 -10.573) 17.335 17.948 ( -6.745 -4.566 -9.711) 12.674 19.099 ( -13.215 0.012 -1.492) 13.299 19.181 ( -11.836 -7.478 5.069) 14.890 ======================= Grid point 148 (80/195) ======================= q-point: ( 0.45 0.44 -0.86) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.686 ( 2.904 3.704 -10.509) 11.515 1.770 ( -0.328 -3.729 -12.257) 12.816 2.098 ( -0.310 1.174 7.459) 7.557 2.116 ( -0.586 -1.572 7.238) 7.430 2.505 ( -1.733 2.229 4.341) 5.178 2.531 ( -1.208 0.271 2.374) 2.678 2.659 ( -6.264 -1.441 3.353) 7.250 2.726 ( -1.427 -5.978 2.226) 6.537 3.119 ( 0.080 4.086 0.045) 4.087 3.245 ( -0.145 -7.135 -0.429) 7.149 3.525 ( -0.201 3.192 0.707) 3.275 3.579 ( -0.154 -1.529 1.112) 1.897 4.395 ( -1.203 6.517 -3.571) 7.528 4.477 ( 1.102 2.686 -0.809) 3.014 4.568 ( 0.177 -4.767 -4.299) 6.421 4.618 ( 2.858 -5.214 -0.475) 5.965 4.878 ( -0.193 3.096 -2.508) 3.989 4.938 ( -0.219 -3.421 -2.077) 4.008 6.491 ( 0.601 0.805 0.999) 1.417 6.516 ( -0.293 -1.673 0.894) 1.920 7.257 ( -0.303 5.074 1.267) 5.239 7.380 ( -1.011 -7.283 -0.131) 7.354 7.711 ( 0.259 -0.526 3.276) 3.328 7.772 ( -0.249 -6.604 7.174) 9.755 8.302 ( -1.505 2.411 -0.251) 2.853 8.403 ( -1.268 -7.364 -0.005) 7.473 9.230 ( 2.412 7.614 -1.486) 8.124 9.283 ( -3.461 3.436 -2.295) 5.390 9.392 ( -3.875 -0.410 -9.211) 10.001 9.454 ( 2.887 -7.185 -3.403) 8.458 9.792 ( -0.342 1.752 3.346) 3.793 9.854 ( 0.022 -4.359 5.101) 6.710 10.219 ( 3.000 5.764 2.111) 6.832 10.362 ( 3.694 -9.460 1.727) 10.301 10.821 ( -0.123 6.336 -3.477) 7.229 10.911 ( -0.829 -1.712 -1.332) 2.322 11.172 ( -0.788 2.455 -1.952) 3.234 11.250 ( -1.531 -5.110 -0.321) 5.344 11.359 ( 1.278 3.083 -3.160) 4.596 11.417 ( 0.688 -2.538 -0.731) 2.730 12.207 ( 0.910 5.315 -0.147) 5.394 12.285 ( -1.354 -2.382 0.906) 2.886 13.211 ( 0.207 3.135 -2.842) 4.236 13.259 ( -0.352 -1.989 -2.636) 3.321 13.414 ( 2.484 3.673 -0.675) 4.485 13.494 ( -2.498 -3.768 0.225) 4.527 13.811 ( 0.042 0.773 1.777) 1.938 13.839 ( -0.268 -2.289 1.506) 2.753 15.293 ( -1.111 -0.291 1.283) 1.722 15.304 ( -2.882 -1.572 2.775) 4.298 15.919 ( 0.390 0.597 3.905) 3.970 15.963 ( 0.064 -3.814 2.744) 4.699 17.143 ( 1.076 14.448 3.775) 14.972 17.320 ( 1.907 -1.659 5.909) 6.427 17.451 ( -4.199 10.377 -10.571) 15.397 17.526 ( 6.765 4.479 -3.177) 8.714 17.718 ( -0.306 -3.392 -7.141) 7.912 17.872 ( 12.106 -13.115 11.088) 21.011 18.895 ( -6.255 2.663 -3.292) 7.553 19.037 ( -8.350 -10.456 0.489) 13.390 ======================= Grid point 149 (81/195) ======================= q-point: (-0.45 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 7.791 1.953 -12.233) 14.635 1.705 ( 11.892 -1.239 -9.666) 15.374 2.160 ( -2.480 1.447 7.390) 7.928 2.196 ( -0.206 -1.922 9.112) 9.315 2.466 ( -6.531 3.063 3.872) 8.187 2.570 ( -3.359 -6.425 4.042) 8.301 2.689 ( 6.078 4.199 4.066) 8.433 2.788 ( 3.222 -5.021 4.190) 7.290 3.136 ( 1.469 2.500 0.213) 2.908 3.231 ( -0.326 -6.299 -2.221) 6.687 3.538 ( 0.166 4.456 1.767) 4.796 3.604 ( 0.116 -1.535 3.388) 3.721 4.306 ( -2.769 5.590 -5.032) 8.015 4.425 ( -2.407 -5.396 -5.904) 8.352 4.521 ( -0.324 3.875 -3.858) 5.478 4.621 ( 0.817 -4.838 -4.822) 6.880 4.841 ( -0.090 2.555 -2.324) 3.455 4.906 ( -0.179 -4.158 -2.568) 4.890 6.541 ( 2.338 0.835 2.988) 3.885 6.561 ( 2.828 -1.176 2.628) 4.036 7.264 ( -1.011 3.682 1.909) 4.269 7.369 ( 0.116 -7.167 -0.046) 7.168 7.769 ( -0.679 2.131 6.825) 7.182 7.859 ( -0.649 -7.409 9.324) 11.927 8.283 ( -0.040 2.413 -1.142) 2.670 8.389 ( -0.009 -8.053 -0.840) 8.097 9.175 ( -3.421 3.173 -5.789) 7.435 9.202 ( -3.859 1.972 -10.842) 11.676 9.294 ( 5.733 5.573 -1.446) 8.125 9.453 ( 4.623 -9.294 -5.339) 11.673 9.868 ( 1.701 2.958 6.381) 7.236 9.933 ( 1.069 -3.612 6.517) 7.528 10.253 ( -3.294 5.429 3.439) 7.222 10.380 ( -4.559 -8.052 2.010) 9.468 10.753 ( -0.827 5.185 -5.534) 7.628 10.839 ( -1.958 -2.856 -5.635) 6.614 11.138 ( -0.497 2.770 -3.420) 4.429 11.218 ( -2.172 -5.265 -0.951) 5.774 11.368 ( 4.437 4.460 -2.542) 6.785 11.442 ( 3.867 -2.942 -0.449) 4.880 12.221 ( 0.209 4.348 0.679) 4.406 12.268 ( -1.571 -0.347 -0.005) 1.609 13.205 ( 1.071 2.863 -2.879) 4.199 13.282 ( 3.990 -5.232 -3.421) 7.416 13.372 ( -2.736 0.639 -2.796) 3.963 13.390 ( -3.565 0.158 -0.936) 3.689 13.873 ( 2.380 2.106 3.978) 5.091 13.908 ( 2.088 -1.320 3.477) 4.265 15.313 ( 1.101 -0.732 2.226) 2.589 15.326 ( 1.461 -2.251 3.075) 4.082 15.966 ( -1.204 2.600 5.747) 6.422 16.037 ( 0.949 -4.489 6.880) 8.270 17.039 ( -11.653 15.720 -2.048) 19.675 17.240 ( -9.880 2.828 -1.033) 10.328 17.342 ( -4.288 -3.895 -13.737) 14.909 17.389 ( -1.494 -8.053 -1.174) 8.274 17.936 ( 11.025 14.324 10.192) 20.751 18.152 ( 3.132 -5.887 10.264) 12.240 18.849 ( 7.002 -2.827 -5.561) 9.378 18.934 ( 1.389 -9.806 -4.319) 10.805 ======================= Grid point 150 (82/195) ======================= q-point: (-0.36 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( 12.647 8.156 -9.455) 17.772 1.878 ( 18.270 -6.693 -7.385) 20.812 2.229 ( 0.070 3.150 8.339) 8.914 2.311 ( 1.436 -3.227 7.880) 8.635 2.400 ( -6.272 7.770 5.335) 11.321 2.556 ( -3.516 -6.410 4.291) 8.478 2.822 ( 2.552 2.488 1.486) 3.862 2.892 ( 3.505 -4.536 2.547) 6.273 3.165 ( 1.616 -1.548 -1.898) 2.934 3.184 ( 0.628 -4.185 -3.218) 5.316 3.567 ( -0.164 7.889 1.717) 8.076 3.666 ( 1.275 -1.887 4.770) 5.286 4.214 ( -1.360 2.771 -2.420) 3.922 4.301 ( -3.032 -5.705 -5.061) 8.207 4.449 ( -1.387 4.605 -6.106) 7.772 4.534 ( -1.482 -3.542 -8.463) 9.293 4.834 ( 0.656 0.443 -0.065) 0.794 4.877 ( -0.009 -3.786 -1.891) 4.232 6.635 ( 4.331 0.806 2.793) 5.217 6.656 ( 4.402 -1.328 2.368) 5.171 7.276 ( 0.016 3.424 1.732) 3.837 7.387 ( 1.484 -8.110 0.794) 8.282 7.845 ( -1.938 4.581 10.160) 11.312 7.967 ( -1.278 -7.890 11.290) 13.833 8.268 ( 1.526 3.063 -3.286) 4.745 8.390 ( 3.031 -8.817 -2.702) 9.707 9.014 ( -4.064 1.068 -8.778) 9.732 9.028 ( -4.186 -0.764 -7.245) 8.402 9.393 ( 7.712 5.583 -2.308) 9.796 9.501 ( 6.695 -5.488 -4.020) 9.545 9.976 ( 1.659 3.299 6.092) 7.124 10.037 ( 1.407 -2.421 6.883) 7.431 10.174 ( -9.523 3.277 1.858) 10.241 10.253 ( -11.578 -4.937 0.534) 12.598 10.692 ( 0.295 2.449 -3.248) 4.079 10.749 ( 0.210 -2.775 -5.946) 6.565 11.061 ( -1.905 4.268 -5.637) 7.323 11.143 ( -3.117 -4.394 -3.533) 6.443 11.460 ( 7.658 4.574 -0.224) 8.922 11.550 ( 7.528 -4.457 1.469) 8.871 12.206 ( -3.633 4.033 -0.579) 5.458 12.239 ( -0.475 0.751 -0.317) 0.943 13.122 ( -5.409 0.907 -2.608) 6.073 13.162 ( -6.088 -3.628 -4.097) 8.186 13.414 ( 6.939 2.282 -1.074) 7.383 13.461 ( 8.042 -2.259 0.132) 8.354 13.943 ( 0.696 1.599 2.366) 2.940 13.956 ( 0.218 0.208 1.577) 1.605 15.384 ( 3.751 0.569 2.681) 4.646 15.419 ( 4.709 -3.210 2.987) 6.434 16.000 ( -3.855 6.301 5.601) 9.270 16.125 ( -1.557 -6.317 7.740) 10.111 16.838 ( -8.552 10.381 0.878) 13.479 16.991 ( -11.349 -1.530 -4.376) 12.259 17.144 ( -7.593 3.045 -6.418) 10.398 17.302 ( -8.185 -11.090 1.144) 13.831 18.167 ( 2.247 7.850 5.110) 9.632 18.219 ( -2.356 2.351 3.995) 5.200 18.901 ( 11.672 4.673 -8.111) 14.962 19.116 ( 17.725 -15.623 0.685) 23.637 ======================= Grid point 151 (83/195) ======================= q-point: (-0.27 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 8.834 13.860 -5.639) 17.377 2.078 ( 9.943 -9.850 -4.984) 14.857 2.345 ( 2.149 5.341 0.691) 5.799 2.359 ( 0.183 10.645 10.077) 14.659 2.454 ( 0.154 -4.737 2.465) 5.342 2.562 ( -0.250 -6.845 7.962) 10.502 2.817 ( 0.349 4.478 -2.230) 5.015 2.943 ( 2.135 -7.918 -0.782) 8.238 3.155 ( 2.765 -0.197 -1.754) 3.280 3.210 ( 2.068 -5.252 -0.533) 5.669 3.531 ( -3.764 13.931 -1.965) 14.563 3.734 ( 0.794 -6.150 1.612) 6.407 4.226 ( 1.462 0.255 1.343) 2.002 4.261 ( 2.225 -2.185 1.641) 3.524 4.344 ( -1.787 1.176 -5.173) 5.598 4.394 ( -2.716 -3.299 -7.850) 8.937 4.847 ( 0.367 -1.079 -0.218) 1.160 4.862 ( 0.225 -2.306 -0.826) 2.460 6.743 ( 5.647 -0.071 0.427) 5.663 6.755 ( 4.957 -1.415 0.421) 5.173 7.306 ( 1.822 3.900 0.660) 4.355 7.432 ( 2.289 -8.946 0.890) 9.277 7.944 ( -1.350 3.509 11.367) 11.973 8.048 ( -4.403 -7.176 9.722) 12.861 8.294 ( 7.536 5.843 -3.845) 10.282 8.445 ( 7.553 -9.069 -2.950) 12.166 8.851 ( -5.557 1.020 -4.702) 7.351 8.892 ( -4.086 -3.725 -3.571) 6.582 9.488 ( 6.725 4.805 -2.862) 8.747 9.562 ( 5.249 -2.641 -3.921) 7.064 9.965 ( -14.804 1.121 0.484) 14.854 9.992 ( -16.221 -1.176 -0.274) 16.266 10.060 ( 1.065 3.920 2.699) 4.877 10.147 ( 1.756 -4.342 3.257) 5.705 10.688 ( 1.678 1.105 -1.123) 2.302 10.722 ( 1.167 -1.648 -1.720) 2.652 10.965 ( -1.315 4.947 -4.096) 6.556 11.044 ( -2.525 -3.356 -4.252) 5.976 11.601 ( 7.883 4.752 0.182) 9.206 11.706 ( 7.922 -5.858 0.532) 9.868 12.107 ( -4.976 7.413 -1.876) 9.123 12.219 ( -2.145 -3.765 0.419) 4.353 13.024 ( -2.859 2.062 0.955) 3.652 13.075 ( -2.225 -3.023 1.632) 4.093 13.511 ( 6.686 3.959 -4.460) 8.960 13.586 ( 6.517 -3.427 -1.991) 7.628 13.954 ( -0.210 1.115 0.257) 1.164 13.971 ( 0.791 -0.751 0.496) 1.198 15.488 ( 4.701 2.981 0.954) 5.648 15.530 ( 3.493 -2.230 2.870) 5.041 15.923 ( -10.625 9.816 2.640) 14.704 16.139 ( -4.968 -11.384 4.058) 13.067 16.791 ( -0.977 4.264 0.785) 4.444 16.839 ( -6.104 7.156 7.525) 12.045 16.920 ( -8.843 2.307 -6.329) 11.116 17.168 ( -10.824 -15.444 6.141) 19.834 18.131 ( -1.783 4.328 -5.842) 7.486 18.200 ( -2.941 -1.789 -2.533) 4.273 19.092 ( 15.994 17.004 -2.402) 23.467 19.445 ( 16.998 -18.610 2.547) 25.333 ======================= Grid point 152 (84/195) ======================= q-point: (-0.18 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.850 ( -1.991 16.009 -2.148) 16.275 2.079 ( -2.583 -3.730 -1.938) 4.934 2.267 ( -6.748 3.743 -6.313) 9.970 2.378 ( -3.635 -4.709 -1.511) 6.137 2.585 ( 9.861 10.674 8.701) 16.937 2.770 ( 9.161 -5.706 4.968) 11.881 2.857 ( 5.748 5.983 0.922) 8.348 3.018 ( 5.031 -8.893 4.089) 11.005 3.195 ( 3.086 -1.517 -1.889) 3.924 3.225 ( 1.693 -3.466 -1.976) 4.334 3.430 ( -3.789 14.027 -2.684) 14.776 3.702 ( -2.725 -12.056 -3.476) 12.839 4.206 ( -2.136 1.876 -4.092) 4.982 4.261 ( -2.191 -1.425 -2.734) 3.783 4.335 ( 3.517 1.026 4.035) 5.450 4.420 ( 4.348 -5.213 6.033) 9.082 4.831 ( -0.374 0.198 -1.757) 1.807 4.861 ( -0.336 -2.768 -0.099) 2.790 6.830 ( 5.062 -1.397 -1.566) 5.480 6.837 ( 5.980 -1.901 -2.130) 6.627 7.350 ( 2.862 3.883 -0.229) 4.829 7.476 ( 1.773 -8.787 0.215) 8.967 8.047 ( 0.658 -0.839 4.591) 4.713 8.072 ( 0.594 -2.744 3.897) 4.803 8.423 ( 9.277 7.319 -0.225) 11.819 8.582 ( 9.130 -8.221 0.899) 12.319 8.721 ( -6.217 2.119 -0.027) 6.568 8.795 ( -5.799 -5.780 0.727) 8.220 9.548 ( -3.735 2.331 -2.290) 4.963 9.559 ( 1.029 1.725 -1.781) 2.684 9.662 ( -17.149 1.371 -2.551) 17.392 9.723 ( -7.843 -4.423 -1.488) 9.126 10.118 ( 2.396 4.135 1.820) 5.113 10.204 ( 2.062 -4.394 0.882) 4.933 10.656 ( -2.924 3.845 -4.726) 6.758 10.709 ( -1.933 -1.712 0.110) 2.585 10.972 ( 3.277 1.227 1.285) 3.727 10.989 ( 0.716 -0.277 -0.161) 0.784 11.697 ( 3.628 3.865 -1.886) 5.627 11.771 ( 0.988 -3.320 -3.413) 4.863 12.052 ( -0.126 6.801 1.266) 6.919 12.197 ( -1.301 -7.349 2.173) 7.773 13.077 ( 3.856 3.932 6.203) 8.295 13.122 ( 2.417 -0.460 5.629) 6.143 13.498 ( 0.897 4.175 -9.217) 10.158 13.601 ( 0.101 -5.647 -5.521) 7.898 13.978 ( 3.145 2.104 0.554) 3.824 14.021 ( 3.913 -2.270 0.846) 4.602 15.516 ( 0.742 4.943 -4.117) 6.476 15.591 ( -1.540 -4.026 1.223) 4.481 15.757 ( -11.583 15.665 6.370) 20.497 16.089 ( -4.560 -16.955 3.290) 17.863 16.685 ( -7.027 7.850 -4.738) 11.552 16.754 ( -0.950 -0.621 -6.985) 7.076 16.942 ( 1.034 4.080 10.398) 11.217 17.127 ( -7.391 -13.372 12.948) 20.027 18.016 ( -1.550 3.649 -7.673) 8.637 18.090 ( -1.250 -3.816 -7.743) 8.722 19.335 ( 12.338 21.182 0.706) 24.523 19.728 ( 12.467 -19.294 1.806) 23.042 ======================= Grid point 153 (85/195) ======================= q-point: (-0.09 0.44 0.14) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -5.753 15.843 0.427) 16.861 2.002 ( -3.762 -8.923 -1.617) 9.818 2.094 ( -2.423 14.342 -4.682) 15.281 2.324 ( -1.771 -8.647 0.638) 8.849 2.817 ( 4.704 12.690 0.359) 13.539 2.888 ( 4.660 9.577 1.390) 10.741 2.989 ( 4.241 -0.322 2.348) 4.859 3.135 ( 1.632 -5.871 -0.916) 6.163 3.226 ( 2.099 -3.828 -0.856) 4.449 3.254 ( 5.823 -3.958 -0.276) 7.047 3.357 ( -1.139 7.075 -1.839) 7.398 3.614 ( -2.212 -14.969 -0.003) 15.131 4.158 ( -0.870 1.653 1.233) 2.238 4.221 ( -1.238 -4.180 1.267) 4.539 4.434 ( 1.321 4.039 2.806) 5.092 4.533 ( 0.908 -4.989 3.460) 6.139 4.808 ( 0.295 0.779 -0.961) 1.272 4.849 ( -0.608 -3.097 0.218) 3.164 6.884 ( 3.859 -1.889 -2.311) 4.879 6.905 ( 5.284 -3.659 -3.165) 7.164 7.386 ( 2.027 3.112 -1.502) 4.006 7.489 ( 0.469 -7.300 -1.541) 7.475 8.097 ( 5.516 1.218 -1.890) 5.957 8.164 ( 5.228 -5.616 0.603) 7.696 8.561 ( 1.321 7.780 1.166) 7.977 8.647 ( 0.373 1.698 2.121) 2.743 8.691 ( -8.431 -3.435 2.894) 9.553 8.742 ( 3.869 -6.021 1.674) 7.350 9.309 ( -14.037 0.521 -0.854) 14.073 9.335 ( -11.361 -2.068 -0.041) 11.548 9.651 ( 3.708 1.976 0.806) 4.279 9.690 ( 1.339 -2.329 -0.942) 2.847 10.177 ( 2.015 3.303 0.671) 3.927 10.241 ( 1.840 -3.326 -0.754) 3.875 10.549 ( -2.699 5.569 -2.202) 6.568 10.651 ( -2.990 -5.044 -0.012) 5.864 11.029 ( 2.194 3.452 1.613) 4.397 11.064 ( 1.385 0.121 3.565) 3.826 11.697 ( 0.216 2.227 -1.033) 2.465 11.735 ( -0.025 -1.813 -0.908) 2.028 12.081 ( 0.829 5.567 0.539) 5.654 12.215 ( -0.189 -7.686 1.180) 7.778 13.208 ( 1.893 7.149 0.429) 7.408 13.289 ( 4.411 10.515 6.332) 13.042 13.355 ( -1.334 -4.427 -7.117) 8.487 13.523 ( 0.277 -10.234 -1.998) 10.431 14.054 ( 3.840 2.294 0.500) 4.501 14.096 ( 3.087 -1.896 0.387) 3.644 15.465 ( -0.078 3.162 -3.500) 4.717 15.479 ( -7.200 2.186 -1.232) 7.625 15.728 ( -6.177 13.168 10.383) 17.871 16.066 ( -3.546 -18.277 4.208) 19.088 16.544 ( -1.496 6.397 -6.398) 9.170 16.669 ( 2.398 -5.646 -8.310) 10.329 17.033 ( -1.508 2.906 2.838) 4.333 17.123 ( -7.371 -6.374 4.204) 10.613 17.943 ( 1.420 4.252 -2.511) 5.139 18.031 ( 2.216 -4.845 -2.072) 5.717 19.509 ( 6.168 21.472 1.417) 22.385 19.901 ( 6.214 -18.924 -0.079) 19.918 ======================= Grid point 198 (86/195) ======================= q-point: ( 0.00 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -10.624 0.000 24.431) 26.641 1.105 ( -0.853 0.000 28.269) 28.281 1.644 ( 0.245 0.000 36.981) 36.982 2.062 ( 8.648 0.000 -10.040) 13.251 2.562 ( -2.684 0.000 -18.622) 18.815 2.802 ( 7.398 0.000 4.992) 8.925 2.995 ( -5.479 0.000 4.236) 6.926 3.264 ( -1.101 0.000 -7.692) 7.771 3.267 ( 2.566 0.000 -0.624) 2.641 3.664 ( 2.129 0.000 1.132) 2.412 3.735 ( -2.184 0.000 -9.296) 9.549 4.056 ( -1.017 0.000 -8.908) 8.966 4.127 ( -0.736 0.000 3.678) 3.751 4.353 ( 1.580 0.000 1.653) 2.286 4.507 ( -1.263 0.000 2.430) 2.739 4.531 ( 0.512 0.000 1.130) 1.241 5.097 ( -1.349 0.000 3.687) 3.926 5.204 ( 0.088 0.000 -0.732) 0.738 7.207 ( -1.861 0.000 -2.341) 2.990 7.348 ( 1.034 0.000 -3.447) 3.599 7.452 ( -0.941 0.000 0.779) 1.221 7.774 ( 9.150 0.000 -10.933) 14.257 8.311 ( -1.190 0.000 6.322) 6.433 8.340 ( -4.347 0.000 -4.811) 6.484 8.349 ( 0.193 0.000 -7.177) 7.180 8.632 ( 0.125 0.000 -3.210) 3.213 8.910 ( -0.186 0.000 1.834) 1.843 8.924 ( -7.190 0.000 5.229) 8.891 9.392 ( 4.415 0.000 10.356) 11.258 9.624 ( -0.167 0.000 8.998) 8.999 9.780 ( 7.386 0.000 -1.132) 7.472 9.971 ( 1.080 0.000 -1.382) 1.754 10.018 ( -1.438 0.000 5.805) 5.980 10.249 ( -6.790 0.000 -3.638) 7.704 10.341 ( -1.887 0.000 3.258) 3.766 10.471 ( 2.866 0.000 -2.281) 3.663 10.929 ( 7.386 0.000 5.351) 9.121 11.009 ( 0.298 0.000 0.771) 0.826 11.633 ( -0.905 0.000 3.550) 3.664 11.934 ( -3.898 0.000 7.981) 8.883 12.076 ( -4.634 0.000 -7.328) 8.671 12.406 ( 0.020 0.000 -7.446) 7.446 12.468 ( 2.123 0.000 6.601) 6.934 12.687 ( 4.087 0.000 -1.632) 4.401 13.644 ( -4.660 0.000 1.905) 5.034 13.759 ( 0.883 0.000 -2.407) 2.564 13.988 ( 7.775 0.000 -4.098) 8.789 14.063 ( -1.044 0.000 -4.176) 4.304 14.868 ( -13.974 0.000 17.553) 22.436 15.672 ( 3.574 0.000 11.209) 11.765 15.877 ( 5.600 0.000 -11.312) 12.622 16.536 ( 0.730 0.000 -9.316) 9.345 16.801 ( 1.276 0.000 1.364) 1.868 16.893 ( -0.315 0.000 -1.701) 1.730 16.992 ( -0.919 0.000 3.559) 3.675 17.205 ( -13.679 0.000 -5.593) 14.778 17.347 ( 8.869 0.000 -11.142) 14.241 17.554 ( 2.653 0.000 -7.945) 8.377 19.344 ( 0.760 0.000 26.371) 26.382 20.536 ( -0.871 0.000 -13.877) 13.905 ======================= Grid point 199 (87/195) ======================= q-point: ( 0.09 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( -1.159 0.000 21.821) 21.851 1.469 ( 5.748 0.000 24.851) 25.507 2.088 ( 9.487 0.000 -12.898) 16.011 2.099 ( 8.846 0.000 18.023) 20.077 2.327 ( -1.013 0.000 -12.893) 12.933 2.866 ( -2.812 0.000 -5.665) 6.325 3.035 ( 2.631 0.000 8.576) 8.971 3.164 ( -3.279 0.000 1.198) 3.491 3.207 ( -4.865 0.000 -5.366) 7.243 3.589 ( -0.364 0.000 -9.603) 9.610 3.701 ( -2.745 0.000 5.753) 6.375 3.938 ( -1.401 0.000 -8.953) 9.062 4.154 ( -0.656 0.000 3.772) 3.829 4.375 ( 2.041 0.000 -3.907) 4.408 4.507 ( -1.935 0.000 2.624) 3.260 4.539 ( -1.394 0.000 2.076) 2.501 5.114 ( -1.257 0.000 3.212) 3.449 5.198 ( -0.207 0.000 -0.001) 0.207 7.094 ( -9.718 0.000 0.248) 9.721 7.254 ( -7.557 0.000 -2.471) 7.951 7.383 ( -5.974 0.000 -0.928) 6.046 7.686 ( -1.926 0.000 -10.471) 10.646 8.264 ( 3.181 0.000 -1.572) 3.548 8.422 ( 11.536 0.000 -2.648) 11.836 8.433 ( 2.794 0.000 6.533) 7.106 8.609 ( 3.133 0.000 -3.911) 5.011 8.914 ( 0.180 0.000 3.132) 3.137 8.971 ( 1.888 0.000 3.844) 4.283 9.488 ( -6.144 0.000 4.902) 7.860 9.785 ( 9.965 0.000 6.827) 12.079 9.834 ( -2.008 0.000 -10.400) 10.593 9.903 ( 1.919 0.000 -2.512) 3.161 10.077 ( 2.272 0.000 6.000) 6.416 10.163 ( 0.078 0.000 -1.056) 1.059 10.312 ( -5.202 0.000 5.110) 7.292 10.522 ( 0.529 0.000 0.634) 0.826 10.997 ( -1.248 0.000 -1.549) 1.989 11.097 ( 5.694 0.000 2.999) 6.436 11.740 ( 5.643 0.000 9.456) 11.012 11.877 ( -6.407 0.000 -8.436) 10.593 11.988 ( -1.196 0.000 7.892) 7.982 12.363 ( 4.050 0.000 -6.631) 7.770 12.550 ( -0.609 0.000 4.488) 4.529 12.687 ( -0.398 0.000 -3.925) 3.945 13.580 ( -4.622 0.000 1.304) 4.802 13.754 ( 0.460 0.000 -0.229) 0.514 13.979 ( -2.515 0.000 -4.913) 5.519 14.036 ( 2.879 0.000 -3.467) 4.506 14.933 ( -3.485 0.000 18.956) 19.273 15.820 ( 3.656 0.000 -11.339) 11.914 15.872 ( 2.594 0.000 11.989) 12.266 16.397 ( 1.228 0.000 -17.964) 18.006 16.785 ( -5.499 0.000 -1.874) 5.810 16.825 ( -1.424 0.000 1.242) 1.890 17.025 ( -0.119 0.000 4.783) 4.784 17.044 ( -6.631 0.000 2.733) 7.172 17.410 ( 11.693 0.000 -8.284) 14.330 17.544 ( 6.928 0.000 -6.361) 9.406 19.637 ( -1.755 0.000 24.453) 24.516 20.297 ( -5.293 0.000 -17.229) 18.024 ======================= Grid point 200 (88/195) ======================= q-point: ( 0.18 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 3.204 0.000 16.269) 16.581 1.819 ( 8.229 0.000 8.609) 11.909 2.097 ( 5.364 0.000 -19.827) 20.539 2.129 ( 8.167 0.000 0.417) 8.178 2.376 ( -2.696 0.000 5.798) 6.394 2.744 ( -0.509 0.000 -8.994) 9.009 2.977 ( -6.817 0.000 -2.408) 7.230 3.072 ( -4.601 0.000 -0.721) 4.657 3.322 ( 2.635 0.000 14.684) 14.918 3.470 ( -2.405 0.000 -7.629) 7.999 3.741 ( -1.987 0.000 9.286) 9.497 3.776 ( -4.922 0.000 -9.976) 11.124 4.219 ( 2.757 0.000 5.035) 5.740 4.326 ( 0.465 0.000 -7.475) 7.489 4.507 ( -1.256 0.000 1.894) 2.273 4.544 ( -0.545 0.000 1.502) 1.598 5.132 ( -0.573 0.000 2.510) 2.574 5.196 ( 0.068 0.000 -0.201) 0.212 6.897 ( -13.452 0.000 1.389) 13.524 7.055 ( -11.917 0.000 -1.593) 12.023 7.272 ( -5.097 0.000 -0.692) 5.144 7.551 ( -0.554 0.000 -7.524) 7.545 8.319 ( 2.120 0.000 0.591) 2.201 8.496 ( 3.518 0.000 -4.749) 5.910 8.610 ( 8.080 0.000 8.510) 11.735 8.757 ( 11.780 0.000 3.966) 12.429 8.978 ( 4.385 0.000 -0.676) 4.437 9.014 ( -2.128 0.000 2.491) 3.276 9.372 ( -9.788 0.000 2.900) 10.208 9.590 ( -7.175 0.000 -13.292) 15.105 9.909 ( 1.767 0.000 -2.509) 3.069 10.062 ( 7.736 0.000 0.422) 7.748 10.150 ( 4.840 0.000 2.443) 5.422 10.234 ( 4.414 0.000 7.871) 9.024 10.381 ( 4.711 0.000 7.010) 8.446 10.439 ( -5.794 0.000 -4.801) 7.524 10.956 ( 0.576 0.000 -4.498) 4.535 11.165 ( 2.329 0.000 -4.300) 4.890 11.704 ( -4.909 0.000 -2.869) 5.686 11.978 ( 5.457 0.000 7.523) 9.293 12.094 ( 3.142 0.000 10.657) 11.111 12.358 ( 1.696 0.000 -5.614) 5.865 12.553 ( -2.564 0.000 1.666) 3.058 12.611 ( 0.699 0.000 -5.947) 5.988 13.522 ( -4.064 0.000 1.377) 4.291 13.770 ( 0.185 0.000 1.816) 1.826 13.868 ( -3.478 0.000 -4.668) 5.821 14.019 ( -0.969 0.000 -1.462) 1.754 15.162 ( 4.601 0.000 16.895) 17.511 15.752 ( 2.074 0.000 -8.254) 8.510 16.018 ( -1.107 0.000 10.850) 10.907 16.199 ( 3.786 0.000 -20.244) 20.595 16.717 ( -4.240 0.000 3.065) 5.232 16.760 ( -7.515 0.000 1.173) 7.606 16.962 ( -6.716 0.000 2.689) 7.235 17.080 ( 0.787 0.000 1.371) 1.581 17.540 ( 13.574 0.000 -7.285) 15.406 17.688 ( 14.175 0.000 0.899) 14.203 19.846 ( -5.126 0.000 20.818) 21.440 19.969 ( -7.597 0.000 -18.782) 20.260 ======================= Grid point 201 (89/195) ======================= q-point: ( 0.27 0.00 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 0.983 0.000 8.032) 8.092 1.926 ( 9.235 0.000 -8.368) 12.462 2.001 ( 7.933 0.000 -15.235) 17.177 2.310 ( -3.786 0.000 -1.854) 4.216 2.407 ( 6.576 0.000 14.346) 15.782 2.639 ( 1.180 0.000 -8.191) 8.276 2.851 ( -5.741 0.000 3.027) 6.490 3.008 ( -4.464 0.000 2.459) 5.096 3.320 ( -5.437 0.000 -6.370) 8.375 3.473 ( -2.241 0.000 4.571) 5.091 3.537 ( -9.374 0.000 -5.644) 10.942 3.840 ( -1.493 0.000 10.716) 10.820 4.252 ( 1.747 0.000 -6.588) 6.815 4.356 ( 5.457 0.000 3.798) 6.649 4.506 ( 0.034 0.000 0.337) 0.338 4.543 ( 0.649 0.000 -2.203) 2.297 5.150 ( -0.163 0.000 1.200) 1.211 5.194 ( 0.795 0.000 -1.311) 1.533 6.693 ( -11.666 0.000 1.666) 11.784 6.836 ( -10.924 0.000 -1.267) 10.997 7.208 ( -3.270 0.000 2.579) 4.165 7.501 ( 2.442 0.000 -3.809) 4.525 8.338 ( 0.356 0.000 -0.704) 0.789 8.513 ( 5.365 0.000 -4.780) 7.185 8.874 ( 4.847 0.000 12.685) 13.580 8.963 ( -1.208 0.000 -2.425) 2.710 8.967 ( -0.073 0.000 2.988) 2.989 9.043 ( 7.943 0.000 2.777) 8.415 9.257 ( -9.309 0.000 5.116) 10.622 9.315 ( -7.692 0.000 -10.655) 13.142 9.922 ( 2.968 0.000 -2.646) 3.977 10.006 ( -3.160 0.000 -2.135) 3.814 10.208 ( -4.386 0.000 -6.952) 8.220 10.415 ( 9.522 0.000 2.888) 9.951 10.465 ( 4.951 0.000 8.017) 9.423 10.608 ( 15.521 0.000 4.840) 16.258 10.894 ( 0.854 0.000 -8.310) 8.354 11.096 ( 1.330 0.000 -10.100) 10.187 11.643 ( -3.113 0.000 2.559) 4.029 12.084 ( 0.582 0.000 5.669) 5.699 12.220 ( -7.940 0.000 -7.638) 11.017 12.253 ( 0.815 0.000 2.162) 2.311 12.558 ( 0.879 0.000 4.570) 4.654 12.646 ( 9.307 0.000 -4.111) 10.175 13.472 ( -3.900 0.000 2.253) 4.504 13.765 ( -3.042 0.000 -2.551) 3.970 13.788 ( -0.265 0.000 0.263) 0.373 13.983 ( -2.566 0.000 1.180) 2.824 15.453 ( 8.369 0.000 12.568) 15.100 15.692 ( 1.573 0.000 -7.210) 7.380 16.106 ( 7.908 0.000 -11.609) 14.047 16.109 ( -3.128 0.000 11.910) 12.314 16.610 ( -11.875 0.000 2.138) 12.066 16.674 ( -4.148 0.000 0.774) 4.220 16.891 ( -6.323 0.000 5.350) 8.283 17.071 ( 0.190 0.000 -3.673) 3.678 17.692 ( 13.721 0.000 -7.387) 15.583 18.009 ( 15.935 0.000 6.224) 17.107 19.625 ( -6.365 0.000 -17.801) 18.904 19.942 ( -8.774 0.000 15.815) 18.086 ======================= Grid point 202 (90/195) ======================= q-point: ( 0.36 0.00 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -1.909 0.000 -0.670) 2.023 2.018 ( 10.425 0.000 -5.374) 11.728 2.025 ( 11.468 0.000 -9.033) 14.598 2.270 ( -0.397 0.000 2.416) 2.448 2.406 ( -3.498 0.000 -9.357) 9.989 2.661 ( -2.712 0.000 6.168) 6.738 2.964 ( 5.122 0.000 6.881) 8.578 2.994 ( -1.619 0.000 1.915) 2.507 3.149 ( -6.543 0.000 -2.625) 7.050 3.216 ( -9.691 0.000 -3.630) 10.349 3.488 ( -5.968 0.000 3.095) 6.723 3.907 ( -4.268 0.000 8.499) 9.511 4.251 ( 4.389 0.000 -2.994) 5.313 4.393 ( -0.076 0.000 -5.156) 5.157 4.507 ( 0.981 0.000 -6.405) 6.479 4.562 ( 3.076 0.000 2.574) 4.011 5.145 ( -0.716 0.000 -0.965) 1.202 5.192 ( 1.477 0.000 -2.544) 2.942 6.552 ( -7.232 0.000 2.553) 7.669 6.672 ( -6.682 0.000 -0.243) 6.687 7.224 ( -1.119 0.000 6.511) 6.606 7.539 ( 4.623 0.000 -0.850) 4.701 8.324 ( 0.533 0.000 -2.748) 2.799 8.561 ( 6.135 0.000 -4.872) 7.834 8.818 ( -7.543 0.000 -1.360) 7.665 8.877 ( -3.820 0.000 -6.693) 7.706 9.051 ( -9.413 0.000 -3.505) 10.045 9.126 ( -1.220 0.000 7.499) 7.598 9.192 ( -0.987 0.000 7.863) 7.925 9.304 ( 6.928 0.000 10.863) 12.884 9.911 ( 0.297 0.000 -4.216) 4.226 9.946 ( -1.659 0.000 -1.258) 2.082 10.143 ( 4.413 0.000 -3.806) 5.828 10.499 ( 2.769 0.000 -3.206) 4.236 10.613 ( 1.043 0.000 3.838) 3.977 10.825 ( 4.752 0.000 -7.055) 8.506 10.915 ( 1.674 0.000 2.402) 2.928 11.095 ( 19.567 0.000 -5.289) 20.269 11.628 ( -2.764 0.000 3.321) 4.321 11.950 ( -10.339 0.000 -10.359) 14.636 12.151 ( -2.843 0.000 5.641) 6.317 12.190 ( -0.981 0.000 -5.189) 5.281 12.629 ( -0.943 0.000 2.840) 2.992 12.766 ( 8.379 0.000 -3.783) 9.194 13.460 ( -2.041 0.000 5.313) 5.691 13.715 ( -1.051 0.000 0.329) 1.101 13.754 ( -1.049 0.000 -3.150) 3.320 13.969 ( -2.376 0.000 3.220) 4.002 15.652 ( 3.786 0.000 -6.280) 7.333 15.726 ( 9.818 0.000 6.913) 12.008 16.179 ( 7.515 0.000 -1.184) 7.607 16.186 ( -5.341 0.000 10.683) 11.943 16.426 ( -14.103 0.000 7.568) 16.005 16.593 ( -2.881 0.000 -2.790) 4.010 16.884 ( -4.224 0.000 9.093) 10.026 17.018 ( 0.710 0.000 -6.194) 6.235 17.820 ( 11.930 0.000 -8.976) 14.929 18.287 ( 7.421 0.000 2.591) 7.860 19.395 ( 1.948 0.000 -11.379) 11.545 19.912 ( -12.368 0.000 10.025) 15.921 ======================= Grid point 203 (91/195) ======================= q-point: ( 0.45 0.00 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( -0.950 0.000 -1.611) 1.870 2.035 ( -6.197 0.000 -4.085) 7.422 2.167 ( 14.035 0.000 -5.115) 14.938 2.334 ( 14.106 0.000 -11.062) 17.927 2.358 ( 3.624 0.000 6.097) 7.093 2.697 ( -3.231 0.000 8.432) 9.030 2.708 ( -16.610 0.000 -11.550) 20.231 2.865 ( -8.967 0.000 -3.938) 9.793 3.156 ( 2.521 0.000 5.092) 5.682 3.363 ( -1.804 0.000 3.249) 3.716 3.461 ( 7.315 0.000 10.361) 12.683 3.885 ( -7.701 0.000 4.935) 9.146 4.301 ( 0.165 0.000 -8.575) 8.577 4.305 ( 2.659 0.000 -0.589) 2.723 4.441 ( 3.140 0.000 -8.559) 9.117 4.585 ( -3.137 0.000 0.113) 3.139 5.106 ( -1.220 0.000 -2.326) 2.627 5.181 ( 1.162 0.000 -3.397) 3.590 6.508 ( -2.174 0.000 3.456) 4.083 6.606 ( -1.554 0.000 0.715) 1.711 7.313 ( 0.180 0.000 9.461) 9.463 7.615 ( 3.741 0.000 0.600) 3.789 8.295 ( 1.390 0.000 -4.891) 5.084 8.558 ( 1.587 0.000 -10.476) 10.596 8.671 ( -6.583 0.000 -2.048) 6.895 8.734 ( -1.978 0.000 -5.688) 6.022 8.942 ( -0.467 0.000 2.403) 2.448 9.078 ( -5.999 0.000 3.637) 7.015 9.339 ( -0.671 0.000 10.437) 10.458 9.548 ( 3.725 0.000 13.329) 13.840 9.888 ( 3.282 0.000 -3.247) 4.617 9.918 ( 0.124 0.000 -0.819) 0.829 10.188 ( 2.292 0.000 -1.748) 2.882 10.484 ( 1.220 0.000 -4.694) 4.850 10.566 ( -0.999 0.000 -5.656) 5.743 10.811 ( -4.568 0.000 -8.815) 9.928 10.938 ( 8.227 0.000 2.731) 8.669 11.421 ( 6.075 0.000 3.729) 7.128 11.625 ( -3.584 0.000 1.303) 3.814 11.709 ( 5.523 0.000 -6.909) 8.845 12.030 ( -5.381 0.000 -4.956) 7.316 12.216 ( -0.240 0.000 0.694) 0.734 12.554 ( -7.024 0.000 -2.148) 7.345 12.814 ( 3.476 0.000 -5.428) 6.446 13.525 ( 0.048 0.000 7.305) 7.305 13.712 ( 0.024 0.000 -1.631) 1.631 13.743 ( 2.250 0.000 2.752) 3.555 13.955 ( -2.504 0.000 0.965) 2.683 15.690 ( 6.359 0.000 -2.033) 6.676 15.936 ( 6.008 0.000 0.399) 6.021 16.073 ( -10.639 0.000 2.278) 10.880 16.244 ( -0.698 0.000 -0.387) 0.798 16.410 ( -9.481 0.000 19.726) 21.886 16.573 ( 4.596 0.000 -1.227) 4.757 16.959 ( 1.734 0.000 -6.983) 7.196 16.965 ( -1.107 0.000 12.676) 12.724 17.890 ( 10.359 0.000 -11.128) 15.203 18.267 ( -5.147 0.000 -7.242) 8.885 19.474 ( 13.838 0.000 -0.234) 13.840 19.754 ( -15.642 0.000 4.353) 16.237 ======================= Grid point 204 (92/195) ======================= q-point: (-0.45 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.575 ( -0.175 0.000 4.632) 4.635 1.851 ( -4.640 0.000 -7.502) 8.821 2.260 ( -17.811 0.000 -10.164) 20.507 2.353 ( 9.114 0.000 -2.853) 9.550 2.449 ( 6.006 0.000 -3.244) 6.827 2.513 ( 14.844 0.000 -6.260) 16.110 2.743 ( -3.507 0.000 5.503) 6.525 2.762 ( -1.251 0.000 6.191) 6.316 3.262 ( 3.764 0.000 2.999) 4.812 3.291 ( -4.112 0.000 1.034) 4.240 3.760 ( -10.045 0.000 0.861) 10.082 3.774 ( 10.456 0.000 9.316) 14.004 4.233 ( 2.537 0.000 -6.187) 6.687 4.262 ( -0.630 0.000 -7.096) 7.124 4.466 ( -8.134 0.000 -2.304) 8.454 4.492 ( 6.862 0.000 0.554) 6.884 5.060 ( -1.440 0.000 -1.415) 2.019 5.148 ( -0.215 0.000 -3.626) 3.633 6.551 ( 2.163 0.000 3.320) 3.963 6.621 ( 2.504 0.000 0.104) 2.507 7.436 ( 0.277 0.000 10.063) 10.067 7.676 ( 2.549 0.000 1.064) 2.762 8.260 ( 1.956 0.000 -5.804) 6.124 8.397 ( -1.172 0.000 -13.194) 13.246 8.560 ( -5.221 0.000 0.517) 5.247 8.698 ( 1.202 0.000 -1.596) 1.999 9.033 ( -2.166 0.000 0.926) 2.356 9.066 ( 8.524 0.000 4.246) 9.523 9.401 ( -5.269 0.000 10.342) 11.607 9.709 ( 0.862 0.000 7.497) 7.547 9.941 ( 2.604 0.000 0.401) 2.634 9.947 ( 3.713 0.000 -0.473) 3.743 10.148 ( -3.037 0.000 -1.262) 3.289 10.413 ( -3.948 0.000 -4.514) 5.997 10.539 ( 3.557 0.000 -2.114) 4.138 10.578 ( -7.639 0.000 -12.705) 14.825 11.113 ( 5.163 0.000 6.195) 8.064 11.253 ( -10.954 0.000 -6.094) 12.535 11.675 ( 2.228 0.000 6.466) 6.839 11.876 ( -5.304 0.000 -6.491) 8.383 11.988 ( 19.079 0.000 3.190) 19.344 12.078 ( -8.716 0.000 -10.524) 13.665 12.460 ( -3.180 0.000 3.584) 4.791 12.772 ( 0.037 0.000 -6.038) 6.038 13.599 ( -0.597 0.000 5.371) 5.405 13.718 ( 1.314 0.000 0.218) 1.332 13.848 ( 4.651 0.000 3.841) 6.032 13.904 ( -2.591 0.000 -2.028) 3.290 15.738 ( -16.177 0.000 -1.772) 16.273 15.805 ( 5.430 0.000 2.285) 5.891 16.179 ( 7.632 0.000 4.168) 8.696 16.197 ( -0.008 0.000 -2.716) 2.716 16.433 ( -11.125 0.000 12.177) 16.494 16.673 ( 5.273 0.000 1.078) 5.382 16.931 ( 2.206 0.000 -3.035) 3.752 17.132 ( 2.171 0.000 12.849) 13.031 17.937 ( 9.866 0.000 -9.590) 13.759 18.032 ( -7.986 0.000 -10.344) 13.068 19.485 ( -18.348 0.000 -0.065) 18.348 19.779 ( 17.312 0.000 3.885) 17.743 ======================= Grid point 205 (93/195) ======================= q-point: (-0.36 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -14.361 0.000 7.485) 16.194 1.628 ( -16.738 0.000 -5.326) 17.565 1.997 ( 4.349 0.000 -8.298) 9.368 2.352 ( 4.492 0.000 -9.714) 10.702 2.597 ( 2.896 0.000 4.373) 5.246 2.613 ( 4.473 0.000 -9.155) 10.189 2.796 ( -0.639 0.000 5.524) 5.560 2.814 ( 6.051 0.000 5.015) 7.860 3.284 ( 0.196 0.000 2.855) 2.861 3.368 ( 5.977 0.000 2.094) 6.333 3.606 ( -7.067 0.000 -0.708) 7.102 4.012 ( 7.712 0.000 4.400) 8.879 4.190 ( 1.894 0.000 -4.951) 5.301 4.242 ( 3.247 0.000 -2.162) 3.901 4.301 ( -6.100 0.000 -2.401) 6.556 4.617 ( 3.704 0.000 2.543) 4.493 5.026 ( -1.636 0.000 0.433) 1.692 5.100 ( -0.374 0.000 -2.469) 2.497 6.651 ( 5.643 0.000 2.165) 6.044 6.692 ( 6.597 0.000 -1.127) 6.692 7.535 ( -0.395 0.000 5.899) 5.912 7.730 ( 3.647 0.000 -1.797) 4.066 8.234 ( 0.502 0.000 -2.117) 2.176 8.265 ( 1.490 0.000 -8.329) 8.461 8.507 ( -3.308 0.000 3.528) 4.836 8.716 ( 1.765 0.000 0.115) 1.769 9.024 ( 0.624 0.000 -0.671) 0.916 9.278 ( 9.690 0.000 3.192) 10.202 9.446 ( -3.276 0.000 11.448) 11.907 9.784 ( 0.877 0.000 3.569) 3.675 9.872 ( -4.188 0.000 -9.544) 10.422 9.979 ( 0.602 0.000 -3.049) 3.108 10.160 ( -2.029 0.000 8.013) 8.266 10.258 ( -12.104 0.000 -11.138) 16.449 10.272 ( -5.811 0.000 -1.039) 5.903 10.614 ( 5.035 0.000 0.550) 5.065 11.035 ( -5.884 0.000 -6.296) 8.617 11.201 ( -6.756 0.000 6.119) 9.115 11.662 ( -4.308 0.000 -10.076) 10.958 11.824 ( 5.318 0.000 7.149) 8.911 11.862 ( -2.707 0.000 -5.856) 6.451 12.330 ( 14.741 0.000 3.732) 15.206 12.464 ( -3.238 0.000 4.291) 5.376 12.693 ( -1.276 0.000 -4.915) 5.078 13.632 ( -1.118 0.000 3.045) 3.244 13.749 ( 1.992 0.000 -0.249) 2.008 13.831 ( -1.363 0.000 -3.870) 4.103 13.968 ( 4.305 0.000 2.946) 5.216 15.450 ( -16.178 0.000 1.178) 16.221 15.872 ( -0.174 0.000 0.761) 0.780 16.227 ( -15.866 0.000 6.556) 17.167 16.258 ( 8.450 0.000 1.290) 8.548 16.418 ( 8.794 0.000 -1.353) 8.898 16.750 ( 2.423 0.000 0.277) 2.439 16.950 ( -0.210 0.000 2.203) 2.213 17.302 ( 4.499 0.000 4.788) 6.570 17.805 ( -4.743 0.000 -8.286) 9.548 18.029 ( 9.236 0.000 -1.993) 9.449 19.132 ( -20.716 0.000 -2.408) 20.855 20.120 ( 16.786 0.000 3.202) 17.089 ======================= Grid point 206 (94/195) ======================= q-point: (-0.27 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( -22.930 0.000 1.410) 22.974 1.289 ( -23.198 0.000 7.724) 24.450 2.104 ( 15.185 0.000 -9.155) 17.731 2.124 ( -22.865 0.000 -1.535) 22.917 2.492 ( -3.464 0.000 -7.056) 7.861 2.741 ( 9.747 0.000 4.460) 10.719 2.873 ( 0.512 0.000 5.990) 6.012 3.058 ( 12.189 0.000 2.321) 12.408 3.326 ( 2.941 0.000 -1.429) 3.270 3.429 ( -2.194 0.000 -3.760) 4.354 3.589 ( 8.240 0.000 2.367) 8.573 4.126 ( 2.990 0.000 1.299) 3.261 4.183 ( -2.346 0.000 -2.002) 3.084 4.250 ( 6.339 0.000 1.129) 6.439 4.323 ( 4.061 0.000 1.665) 4.389 4.621 ( -4.172 0.000 -1.916) 4.591 5.019 ( -1.066 0.000 2.314) 2.547 5.110 ( 2.724 0.000 0.628) 2.795 6.798 ( 9.431 0.000 1.217) 9.510 6.832 ( 11.920 0.000 -1.660) 12.035 7.544 ( -1.249 0.000 -1.597) 2.027 7.733 ( 4.328 0.000 -9.303) 10.261 8.216 ( -3.660 0.000 3.053) 4.766 8.276 ( 5.295 0.000 -0.399) 5.310 8.553 ( 1.276 0.000 7.712) 7.817 8.761 ( 1.663 0.000 2.367) 2.893 9.025 ( -0.991 0.000 0.947) 1.370 9.436 ( 2.645 0.000 3.799) 4.629 9.545 ( -2.458 0.000 10.231) 10.522 9.652 ( -5.257 0.000 -11.455) 12.604 9.769 ( -12.768 0.000 -14.244) 19.129 9.828 ( 0.247 0.000 1.611) 1.630 9.988 ( -4.171 0.000 -2.441) 4.833 10.191 ( -5.451 0.000 6.963) 8.843 10.299 ( 1.730 0.000 7.328) 7.530 10.660 ( -0.947 0.000 -1.525) 1.795 10.885 ( -3.392 0.000 -6.630) 7.447 11.045 ( -6.314 0.000 -2.527) 6.801 11.607 ( -1.098 0.000 2.105) 2.374 11.825 ( 2.517 0.000 0.042) 2.517 12.006 ( 6.331 0.000 5.888) 8.646 12.426 ( -5.852 0.000 2.396) 6.324 12.525 ( 6.981 0.000 -4.804) 8.474 12.650 ( -0.111 0.000 1.635) 1.639 13.644 ( -0.698 0.000 2.319) 2.422 13.772 ( 3.205 0.000 -3.712) 4.905 13.783 ( 0.794 0.000 -2.669) 2.785 14.058 ( 3.169 0.000 1.405) 3.467 15.228 ( -14.508 0.000 6.354) 15.838 15.860 ( 0.871 0.000 -2.202) 2.368 15.942 ( -18.915 0.000 0.082) 18.915 16.464 ( 9.534 0.000 5.220) 10.870 16.581 ( 9.160 0.000 0.497) 9.173 16.759 ( 0.293 0.000 -2.705) 2.721 16.960 ( -1.960 0.000 2.627) 3.278 17.383 ( 5.968 0.000 -6.052) 8.500 17.686 ( -0.382 0.000 -4.670) 4.685 18.189 ( 6.457 0.000 1.982) 6.754 18.752 ( -20.850 0.000 2.525) 21.002 20.410 ( 14.211 0.000 0.169) 14.212 ======================= Grid point 207 (95/195) ======================= q-point: (-0.18 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -20.808 0.000 13.341) 24.718 1.008 ( -22.415 0.000 14.416) 26.651 1.678 ( -33.884 0.000 13.989) 36.658 2.143 ( 2.265 0.000 -10.698) 10.935 2.479 ( 8.949 0.000 -2.259) 9.230 2.943 ( -0.865 0.000 6.524) 6.582 2.971 ( 10.057 0.000 4.100) 10.860 3.083 ( -3.480 0.000 -11.368) 11.889 3.348 ( 4.181 0.000 -4.987) 6.508 3.453 ( 8.094 0.000 0.356) 8.102 3.776 ( 8.594 0.000 0.585) 8.614 4.152 ( 0.207 0.000 -1.757) 1.770 4.196 ( 1.973 0.000 3.313) 3.856 4.352 ( 3.981 0.000 -3.022) 4.998 4.415 ( 3.097 0.000 2.622) 4.058 4.480 ( -6.349 0.000 -1.138) 6.450 5.041 ( -0.589 0.000 3.491) 3.541 5.172 ( 2.777 0.000 0.531) 2.827 7.000 ( 12.192 0.000 0.588) 12.207 7.055 ( 15.682 0.000 -1.909) 15.798 7.482 ( -0.754 0.000 -4.708) 4.768 7.693 ( 6.741 0.000 -12.112) 13.861 8.189 ( -4.321 0.000 5.257) 6.805 8.384 ( 6.058 0.000 -0.098) 6.058 8.681 ( -0.695 0.000 8.305) 8.334 8.807 ( -1.523 0.000 3.217) 3.559 9.013 ( -2.946 0.000 3.462) 4.546 9.293 ( -13.383 0.000 -5.683) 14.540 9.353 ( -14.351 0.000 -11.445) 18.356 9.545 ( -7.348 0.000 7.379) 10.413 9.626 ( 5.861 0.000 2.502) 6.373 9.815 ( -3.322 0.000 0.584) 3.373 10.071 ( 9.343 0.000 3.630) 10.024 10.132 ( -8.070 0.000 2.879) 8.568 10.421 ( 0.709 0.000 7.240) 7.275 10.589 ( 0.579 0.000 -7.311) 7.334 10.760 ( -1.870 0.000 -5.828) 6.120 11.000 ( 1.477 0.000 -1.589) 2.169 11.593 ( -3.613 0.000 2.976) 4.681 11.913 ( 0.073 0.000 7.498) 7.499 12.150 ( 3.948 0.000 2.360) 4.600 12.341 ( -4.699 0.000 0.973) 4.799 12.541 ( 5.271 0.000 -5.502) 7.620 12.649 ( -2.842 0.000 -1.054) 3.031 13.668 ( -0.572 0.000 3.184) 3.235 13.780 ( 2.382 0.000 -3.618) 4.331 13.800 ( 5.804 0.000 -3.056) 6.559 14.107 ( 1.915 0.000 -0.580) 2.001 15.094 ( -14.866 0.000 12.526) 19.439 15.649 ( -13.493 0.000 0.205) 13.494 15.865 ( 4.236 0.000 -4.520) 6.195 16.671 ( 4.177 0.000 7.189) 8.315 16.709 ( 2.576 0.000 -7.216) 7.662 16.725 ( 6.187 0.000 0.520) 6.209 16.947 ( -1.818 0.000 0.577) 1.908 17.382 ( 6.136 0.000 -11.071) 12.657 17.674 ( 2.852 0.000 -1.811) 3.378 18.059 ( -13.117 0.000 -14.156) 19.299 18.704 ( -2.728 0.000 23.538) 23.695 20.596 ( 9.915 0.000 -4.280) 10.799 ======================= Grid point 208 (96/195) ======================= q-point: (-0.09 0.00 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( -11.510 0.000 25.483) 27.962 0.912 ( -15.133 0.000 23.220) 27.716 1.413 ( -24.942 0.000 32.905) 41.290 2.061 ( 2.582 0.000 -7.495) 7.927 2.632 ( 9.880 0.000 -1.017) 9.932 2.832 ( -4.472 0.000 -16.499) 17.095 2.995 ( -2.242 0.000 6.431) 6.811 3.163 ( 7.312 0.000 2.674) 7.785 3.342 ( 2.454 0.000 -6.746) 7.179 3.577 ( 6.037 0.000 0.697) 6.077 3.844 ( 2.076 0.000 -6.165) 6.505 4.102 ( -1.627 0.000 1.188) 2.014 4.198 ( -2.192 0.000 -8.804) 9.073 4.301 ( -0.313 0.000 3.400) 3.414 4.482 ( 1.036 0.000 2.567) 2.768 4.490 ( 1.781 0.000 2.270) 2.885 5.072 ( -0.905 0.000 3.855) 3.959 5.204 ( 1.189 0.000 -0.774) 1.419 7.186 ( 8.051 0.000 -1.484) 8.187 7.278 ( 11.557 0.000 -2.676) 11.863 7.438 ( 1.143 0.000 -2.250) 2.524 7.699 ( 11.283 0.000 -11.935) 16.424 8.215 ( -0.735 0.000 7.011) 7.049 8.443 ( 2.437 0.000 -4.505) 5.122 8.594 ( -13.380 0.000 -1.945) 13.521 8.729 ( -7.097 0.000 -2.812) 7.634 8.960 ( -4.925 0.000 -2.196) 5.393 9.037 ( -12.112 0.000 2.380) 12.344 9.206 ( 2.319 0.000 7.003) 7.377 9.545 ( -4.158 0.000 10.026) 10.854 9.717 ( 2.893 0.000 -4.810) 5.613 9.829 ( 2.751 0.000 11.718) 12.037 10.021 ( -4.161 0.000 2.828) 5.030 10.266 ( 5.964 0.000 4.000) 7.181 10.413 ( -6.195 0.000 -1.606) 6.400 10.508 ( 2.011 0.000 -9.012) 9.233 10.759 ( 4.996 0.000 2.678) 5.668 11.004 ( -0.087 0.000 -0.738) 0.743 11.605 ( -0.234 0.000 4.421) 4.427 11.944 ( -6.922 0.000 8.114) 10.665 12.179 ( -0.231 0.000 -2.896) 2.905 12.353 ( 2.108 0.000 4.692) 5.144 12.532 ( -3.801 0.000 -6.872) 7.853 12.607 ( 6.088 0.000 -1.226) 6.210 13.680 ( -2.652 0.000 3.051) 4.043 13.774 ( 1.704 0.000 -3.563) 3.950 13.889 ( 8.299 0.000 -3.816) 9.134 14.109 ( 0.497 0.000 -2.662) 2.708 14.970 ( -18.505 0.000 15.092) 23.879 15.543 ( -1.982 0.000 5.708) 6.043 15.886 ( 6.216 0.000 -7.922) 10.069 16.622 ( -0.274 0.000 -6.745) 6.750 16.770 ( 0.968 0.000 0.125) 0.977 16.833 ( 4.466 0.000 3.552) 5.706 16.955 ( 0.528 0.000 3.091) 3.136 17.352 ( 6.113 0.000 -11.239) 12.794 17.609 ( -16.838 0.000 -14.610) 22.293 17.630 ( -0.285 0.000 -8.580) 8.585 19.009 ( 1.622 0.000 26.490) 26.539 20.641 ( 4.549 0.000 -9.323) 10.374 ======================= Grid point 209 (97/195) ======================= q-point: ( 0.00 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( -7.343 4.299 23.626) 25.112 1.121 ( -0.244 6.042 23.708) 24.467 1.880 ( -1.549 18.861 30.057) 35.518 2.076 ( 7.899 1.650 -8.817) 11.952 2.457 ( -2.224 -7.093 -15.765) 17.430 2.832 ( 5.933 0.752 5.451) 8.092 3.035 ( -5.023 2.190 4.150) 6.874 3.246 ( 2.260 -2.038 -0.727) 3.129 3.279 ( 0.254 2.336 -8.308) 8.633 3.615 ( 1.976 -6.932 -7.063) 10.092 3.652 ( -1.536 -5.768 -1.620) 6.186 4.046 ( -1.893 -1.785 -8.209) 8.611 4.139 ( -1.505 1.474 3.075) 3.727 4.329 ( 1.865 -1.621 1.918) 3.128 4.519 ( -0.727 0.498 2.202) 2.371 4.539 ( -0.229 0.542 0.502) 0.774 5.081 ( -1.139 -1.705 3.477) 4.037 5.163 ( 0.317 -4.058 -0.282) 4.080 7.181 ( -0.780 -3.069 -2.975) 4.345 7.289 ( 0.707 -5.845 -3.130) 6.668 7.440 ( -0.764 -1.343 0.752) 1.719 7.740 ( 7.355 -3.345 -10.014) 12.867 8.257 ( 4.965 -3.767 -1.652) 6.447 8.367 ( -10.017 0.138 -7.571) 12.557 8.373 ( -1.575 2.342 2.424) 3.720 8.632 ( 1.538 0.248 -2.857) 3.254 8.844 ( -5.936 -6.074 4.460) 9.593 8.914 ( -0.543 -2.728 1.844) 3.337 9.389 ( 5.290 -0.013 9.762) 11.103 9.596 ( -2.825 -1.363 5.245) 6.111 9.790 ( 4.366 -1.245 0.114) 4.542 9.913 ( 1.632 -4.564 -0.648) 4.890 10.075 ( -0.249 4.902 5.646) 7.482 10.293 ( -1.699 2.665 -1.522) 3.508 10.348 ( -2.917 -0.092 1.342) 3.213 10.531 ( 1.030 7.208 -1.223) 7.383 10.946 ( 6.924 1.601 4.543) 8.435 10.989 ( -0.903 -1.689 1.403) 2.374 11.640 ( 0.053 1.530 4.285) 4.551 11.877 ( -4.257 -3.089 5.026) 7.275 12.203 ( -4.316 7.210 -6.265) 10.481 12.377 ( 4.458 -0.174 -2.051) 4.911 12.471 ( -3.468 -1.067 2.106) 4.195 12.720 ( 4.412 3.047 -3.697) 6.513 13.651 ( -2.745 0.824 2.961) 4.121 13.805 ( -0.214 4.035 -2.187) 4.594 13.969 ( 6.795 -1.618 -3.581) 7.850 14.068 ( -0.925 0.411 -4.261) 4.379 14.921 ( -12.734 5.335 16.794) 21.741 15.649 ( 4.728 -2.339 10.491) 11.743 15.849 ( 3.193 -2.194 -8.541) 9.378 16.490 ( -1.122 -5.146 -4.464) 6.904 16.706 ( 0.112 -7.706 -8.737) 11.651 16.840 ( 2.677 -5.163 1.179) 5.934 16.908 ( -1.249 -3.344 -1.547) 3.890 17.222 ( -4.304 -4.427 -4.788) 7.813 17.502 ( -0.965 15.002 -7.236) 16.683 17.651 ( 4.365 9.599 -6.114) 12.189 19.340 ( 0.859 -0.270 25.389) 25.405 20.483 ( -0.906 -5.276 -13.281) 14.319 ======================= Grid point 210 (98/195) ======================= q-point: ( 0.09 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( 0.381 6.125 20.195) 21.107 1.464 ( 6.444 1.423 22.050) 23.016 2.103 ( 9.172 1.509 -12.598) 15.656 2.123 ( 4.330 -2.581 -7.426) 8.975 2.348 ( -0.462 7.752 10.928) 13.406 2.959 ( -5.823 5.138 0.754) 7.802 3.026 ( 3.442 -2.096 10.691) 11.426 3.133 ( -2.311 -0.561 -8.500) 8.826 3.213 ( -3.408 1.507 -4.428) 5.787 3.505 ( 0.988 -7.758 -9.059) 11.967 3.679 ( -2.354 -2.494 6.225) 7.107 3.904 ( -2.909 -3.481 -7.943) 9.147 4.165 ( -0.536 1.156 3.857) 4.062 4.364 ( 2.091 -0.801 -2.987) 3.733 4.518 ( -1.971 -1.192 1.865) 2.963 4.530 ( -1.065 1.022 1.327) 1.985 5.095 ( -1.355 -2.044 2.610) 3.581 5.167 ( -0.029 -3.118 0.461) 3.152 7.070 ( -8.875 -2.648 -0.783) 9.295 7.194 ( -7.546 -5.491 -2.520) 9.666 7.389 ( -5.021 0.201 -0.302) 5.034 7.657 ( -1.697 -2.886 -9.612) 10.178 8.199 ( 0.832 -6.318 -2.985) 7.037 8.414 ( 1.452 0.006 2.706) 3.071 8.454 ( 13.138 1.189 1.766) 13.310 8.627 ( 2.567 1.649 -2.998) 4.277 8.804 ( -2.941 -9.232 3.265) 10.224 8.976 ( 3.001 -1.005 2.348) 3.941 9.521 ( -3.329 2.460 3.973) 5.738 9.701 ( 8.356 -5.986 6.840) 12.347 9.829 ( -0.983 -0.566 -7.898) 7.979 9.864 ( 2.911 -2.871 -1.598) 4.390 10.093 ( -2.077 1.419 3.755) 4.520 10.227 ( -2.919 0.209 -3.117) 4.275 10.391 ( 1.321 9.707 7.470) 12.320 10.563 ( 0.697 4.609 0.729) 4.718 10.963 ( -1.791 -2.943 -1.041) 3.599 11.106 ( 5.668 0.694 2.607) 6.277 11.751 ( 4.628 0.836 9.038) 10.189 11.828 ( -5.048 -2.190 -2.034) 5.867 12.088 ( -2.803 7.095 0.376) 7.638 12.343 ( -0.342 -3.026 -6.199) 6.907 12.528 ( 2.080 0.002 4.731) 5.168 12.730 ( 2.349 3.058 -4.537) 5.954 13.627 ( -3.617 4.545 2.255) 6.231 13.781 ( -0.342 2.632 -0.751) 2.759 13.976 ( -2.271 -0.482 -4.450) 5.019 14.013 ( 1.507 -1.849 -3.011) 3.841 14.991 ( -2.850 5.675 17.737) 18.840 15.783 ( 0.478 -1.939 -4.822) 5.219 15.872 ( 6.063 -1.662 6.299) 8.899 16.372 ( 0.258 -2.112 -17.980) 18.105 16.530 ( -8.821 -14.307 3.477) 17.164 16.849 ( -2.538 -7.197 -1.147) 7.717 16.970 ( 6.489 1.770 0.527) 6.746 17.211 ( 5.252 1.748 -1.345) 5.696 17.422 ( 0.361 8.465 -3.535) 9.180 17.662 ( 4.796 10.152 -5.687) 12.586 19.620 ( -1.940 -1.587 23.510) 23.643 20.250 ( -5.500 -4.696 -16.531) 18.043 ======================= Grid point 211 (99/195) ======================= q-point: ( 0.18 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 3.997 5.636 14.346) 15.923 1.790 ( 7.499 -2.475 9.352) 12.240 2.011 ( 5.017 -5.228 -17.660) 19.089 2.138 ( 8.354 0.759 -2.718) 8.818 2.415 ( -6.605 3.220 3.474) 8.128 2.858 ( -6.636 5.335 -0.748) 8.547 2.976 ( -1.768 3.585 -9.177) 10.010 3.097 ( -1.968 0.784 1.917) 2.857 3.271 ( 2.543 -2.932 11.009) 11.673 3.411 ( -1.981 -5.428 -6.275) 8.531 3.691 ( -4.061 -4.024 -0.402) 5.732 3.784 ( -2.920 -0.785 1.420) 3.340 4.227 ( 2.495 0.619 4.348) 5.051 4.316 ( -0.164 -1.030 -6.660) 6.741 4.517 ( -0.338 -0.892 1.312) 1.623 4.543 ( 0.007 1.940 1.996) 2.784 5.099 ( -1.068 -3.428 1.660) 3.956 5.171 ( 0.099 -2.517 0.050) 2.519 6.880 ( -12.491 -1.906 0.794) 12.660 7.002 ( -10.541 -4.706 -2.396) 11.790 7.280 ( -6.433 0.714 -0.035) 6.473 7.543 ( 0.328 -1.046 -6.486) 6.578 8.219 ( 1.740 -9.070 -0.758) 9.266 8.479 ( 3.356 -3.172 0.935) 4.712 8.630 ( 5.660 2.644 1.688) 6.471 8.720 ( 1.660 -9.394 5.694) 11.110 8.851 ( 8.586 -2.542 1.437) 9.069 9.029 ( 0.504 -0.664 0.353) 0.905 9.460 ( -5.919 6.118 1.932) 8.729 9.611 ( -6.170 1.772 -10.307) 12.143 9.896 ( 2.786 -1.399 -2.123) 3.772 9.994 ( 10.236 -4.623 2.751) 11.564 10.129 ( -0.268 -2.038 0.752) 2.189 10.184 ( 2.688 -4.085 5.577) 7.417 10.499 ( -0.538 8.430 1.834) 8.644 10.532 ( 1.113 8.523 -0.109) 8.596 10.931 ( 1.663 -1.494 -3.826) 4.431 11.179 ( 2.440 1.105 -3.053) 4.062 11.692 ( -5.108 -0.448 -2.589) 5.745 11.980 ( 6.949 -4.930 9.478) 12.745 12.099 ( -1.524 5.221 5.346) 7.626 12.246 ( -3.768 -8.343 -3.839) 9.926 12.614 ( 4.017 6.333 0.563) 7.521 12.712 ( 2.991 6.285 -4.499) 8.287 13.579 ( -4.433 5.625 1.464) 7.310 13.778 ( -0.520 0.576 0.978) 1.248 13.866 ( -3.431 -0.174 -4.710) 5.830 13.995 ( -1.115 -2.168 -0.241) 2.449 15.205 ( 3.974 4.088 15.029) 16.074 15.724 ( 0.821 -1.889 -5.507) 5.880 16.008 ( -0.583 -2.531 7.653) 8.082 16.160 ( 2.632 -2.991 -17.907) 18.345 16.490 ( -5.837 -11.311 8.071) 15.071 16.768 ( -2.857 -7.089 -3.023) 8.220 17.045 ( 1.736 10.307 -3.415) 10.996 17.252 ( -2.613 10.735 4.669) 11.994 17.529 ( 13.566 -2.507 -0.931) 13.827 17.702 ( 8.566 3.903 -4.057) 10.251 19.814 ( -5.471 -3.131 20.000) 20.970 19.925 ( -8.037 -4.398 -18.085) 20.273 ======================= Grid point 212 (100/195) ======================= q-point: ( 0.27 0.11 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( 1.706 2.859 4.395) 5.513 1.907 ( 3.030 -1.865 -8.306) 9.036 1.946 ( 12.232 -2.738 -9.326) 15.623 2.251 ( -3.521 -4.214 -0.828) 5.554 2.407 ( 4.806 -0.255 11.733) 12.682 2.728 ( -5.705 1.032 -0.727) 5.843 2.848 ( -1.925 6.709 -6.502) 9.539 3.095 ( -2.255 6.093 4.003) 7.631 3.257 ( -5.804 -5.758 -5.753) 9.997 3.428 ( -0.669 -4.285 8.162) 9.242 3.503 ( -8.245 -2.798 -9.057) 12.563 3.824 ( -3.367 -2.020 8.213) 9.104 4.253 ( 1.670 -0.134 -4.786) 5.070 4.343 ( 4.841 -1.274 2.809) 5.740 4.531 ( 1.378 0.748 -0.606) 1.680 4.560 ( 0.855 3.495 -0.431) 3.624 5.099 ( -0.614 -5.048 0.717) 5.135 5.170 ( 0.664 -2.434 -1.179) 2.785 6.685 ( -11.050 -0.960 1.521) 11.196 6.799 ( -9.463 -3.295 -2.001) 10.218 7.204 ( -3.788 -0.221 2.823) 4.730 7.514 ( 2.373 0.953 -2.827) 3.812 8.221 ( 0.748 -9.791 -2.238) 10.071 8.528 ( 2.004 -3.034 -0.070) 3.637 8.728 ( -2.350 -13.307 3.944) 14.077 8.804 ( 8.168 -7.822 2.016) 11.488 8.957 ( -5.500 -0.508 0.486) 5.544 9.097 ( 7.000 4.244 6.284) 10.320 9.373 ( -7.749 6.962 3.159) 10.886 9.401 ( -3.854 6.379 -9.008) 11.692 9.918 ( 2.771 -0.565 -2.139) 3.546 9.985 ( -3.047 -1.318 -2.704) 4.282 10.172 ( -0.808 -3.677 -0.372) 3.783 10.402 ( 10.755 -3.771 1.939) 11.560 10.507 ( 3.079 6.317 5.341) 8.826 10.641 ( 11.094 1.741 -0.713) 11.253 10.920 ( 3.314 3.640 -5.922) 7.701 11.115 ( -0.734 2.031 -8.945) 9.202 11.626 ( -2.744 -0.936 2.171) 3.622 12.040 ( -9.159 -10.115 -1.751) 13.758 12.130 ( 0.847 -8.825 3.905) 9.688 12.224 ( 2.043 6.094 2.265) 6.815 12.654 ( 2.456 8.116 -1.168) 8.559 12.782 ( 8.111 9.735 -1.464) 12.756 13.514 ( -4.905 3.925 1.677) 6.502 13.736 ( -2.884 -2.328 -3.227) 4.915 13.801 ( -0.955 0.592 0.173) 1.137 13.979 ( -1.994 -0.329 2.271) 3.039 15.410 ( 4.316 -3.374 4.103) 6.845 15.733 ( 4.820 2.596 2.330) 5.950 16.017 ( -5.219 -6.418 4.423) 9.381 16.100 ( 6.350 -2.131 -6.643) 9.433 16.483 ( -7.205 -6.656 8.412) 12.922 16.704 ( 0.053 -0.898 -3.165) 3.290 16.972 ( -5.322 10.885 -0.028) 12.116 17.243 ( -2.685 11.282 -0.067) 11.597 17.685 ( 11.170 0.674 -7.479) 13.459 17.955 ( 15.987 -5.486 6.374) 18.064 19.578 ( -7.183 -4.755 -17.367) 19.386 19.895 ( -9.148 -4.608 15.157) 18.294 ======================= Grid point 213 (101/195) ======================= q-point: ( 0.36 0.11 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( -0.499 0.602 -3.157) 3.252 1.869 ( 2.520 -7.148 -6.015) 9.676 2.095 ( 14.961 2.503 -6.695) 16.581 2.191 ( -1.288 -4.363 1.655) 4.841 2.505 ( -4.904 1.573 1.467) 5.355 2.708 ( 0.573 6.185 -0.816) 6.265 2.831 ( 2.233 -4.978 6.986) 8.864 3.060 ( -9.918 -5.927 -2.631) 11.850 3.134 ( -1.538 7.131 -1.466) 7.441 3.254 ( -4.442 1.147 -1.509) 4.829 3.451 ( -4.548 -3.364 2.854) 6.336 3.841 ( -4.105 -5.788 6.392) 9.550 4.256 ( 3.070 -0.040 -2.633) 4.044 4.395 ( 0.948 -0.051 -3.466) 3.594 4.522 ( 1.672 1.502 -5.729) 6.155 4.594 ( 2.165 3.354 1.178) 4.162 5.087 ( -0.773 -5.785 -1.016) 5.924 5.167 ( 1.224 -2.528 -2.159) 3.542 6.554 ( -6.785 0.053 2.639) 7.280 6.650 ( -5.724 -2.044 -0.653) 6.113 7.219 ( -0.930 -0.374 6.360) 6.438 7.550 ( 3.554 0.933 -0.242) 3.682 8.200 ( 0.991 -10.322 -3.811) 11.048 8.557 ( 1.027 -4.827 0.557) 4.967 8.707 ( -1.979 -12.353 -1.853) 12.647 8.807 ( -4.360 -2.325 -4.066) 6.399 8.961 ( 0.766 -5.699 2.442) 6.247 9.127 ( -6.644 3.216 3.065) 7.993 9.264 ( -5.677 4.826 0.111) 7.452 9.436 ( 5.961 7.680 9.387) 13.514 9.900 ( -0.963 -1.315 -3.999) 4.318 9.934 ( 0.193 0.089 -1.001) 1.023 10.172 ( 2.315 1.186 -0.951) 2.769 10.467 ( 2.512 -2.694 -3.931) 5.387 10.647 ( 3.692 3.833 3.777) 6.526 10.876 ( 3.846 4.510 -7.802) 9.798 10.975 ( 14.573 -0.059 6.185) 15.832 10.996 ( 4.500 -3.083 -10.930) 12.216 11.620 ( -2.309 -0.921 3.222) 4.070 11.816 ( -11.008 -9.263 -5.616) 15.444 12.117 ( -2.991 -5.932 -2.608) 7.137 12.267 ( -0.219 5.699 2.618) 6.276 12.691 ( 2.571 8.046 -1.513) 8.581 12.896 ( 5.987 9.664 -1.564) 11.476 13.475 ( -2.873 1.066 4.140) 5.151 13.664 ( -1.446 -3.521 -2.034) 4.315 13.785 ( -0.806 1.614 -0.160) 1.811 13.975 ( -2.395 0.424 2.836) 3.736 15.466 ( 4.992 -9.752 -4.091) 11.695 15.916 ( 5.674 8.721 5.536) 11.785 15.994 ( -4.819 -14.388 8.763) 17.522 16.166 ( 7.268 -0.395 -2.118) 7.581 16.412 ( -12.297 -0.498 8.457) 14.932 16.705 ( 2.913 7.874 -1.102) 8.467 16.923 ( -3.494 5.161 5.882) 8.570 17.157 ( -3.899 11.551 -4.065) 12.851 17.781 ( 11.397 -2.944 -9.491) 15.121 18.252 ( 8.164 -3.713 3.870) 9.768 19.330 ( 0.711 -6.519 -11.704) 13.416 19.854 ( -12.532 -5.736 9.547) 16.766 ======================= Grid point 214 (102/195) ======================= q-point: ( 0.45 0.11 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -0.832 1.263 -2.720) 3.112 1.832 ( 0.907 -12.575 -5.658) 13.819 2.230 ( 3.063 -2.433 2.360) 4.568 2.304 ( 13.029 1.509 -3.454) 13.563 2.414 ( -0.860 2.723 -5.706) 6.381 2.723 ( -2.119 4.244 5.687) 7.405 2.759 ( -9.140 1.828 -1.321) 9.414 2.895 ( -8.597 4.558 -9.651) 13.705 3.076 ( 3.674 -6.868 7.717) 10.965 3.370 ( -3.897 0.126 -0.236) 3.906 3.435 ( 7.825 -2.057 9.361) 12.373 3.820 ( -6.403 -6.086 4.247) 9.802 4.282 ( 1.987 -2.027 -0.825) 2.956 4.329 ( 0.365 2.282 -7.419) 7.771 4.474 ( 2.580 2.806 -7.934) 8.802 4.599 ( -3.011 1.467 -0.771) 3.437 5.054 ( -0.705 -5.196 -1.750) 5.528 5.157 ( 0.885 -2.495 -2.966) 3.976 6.515 ( -2.092 0.677 3.423) 4.069 6.594 ( -0.921 -1.130 0.671) 1.605 7.307 ( 0.135 -0.571 8.991) 9.010 7.612 ( 2.841 -0.307 0.893) 2.994 8.168 ( 1.204 -10.419 -4.579) 11.444 8.544 ( -1.298 -5.991 -7.824) 9.940 8.598 ( -5.089 -5.965 -0.297) 7.846 8.734 ( 0.819 0.656 -3.936) 4.074 8.933 ( -0.341 -0.814 1.153) 1.452 9.087 ( -4.095 0.517 1.865) 4.529 9.245 ( -2.577 -4.495 7.955) 9.494 9.656 ( 3.689 6.236 11.745) 13.800 9.849 ( 1.407 -3.322 -4.894) 6.080 9.939 ( 0.964 2.835 0.791) 3.097 10.177 ( -1.445 -1.934 -1.145) 2.672 10.483 ( 4.784 1.391 -3.391) 6.027 10.646 ( -0.703 5.567 -6.642) 8.695 10.834 ( -3.993 2.489 -5.700) 7.391 10.943 ( 6.605 0.405 -2.514) 7.078 11.366 ( 15.720 -6.954 6.194) 18.271 11.516 ( -10.377 -8.667 -6.710) 15.094 11.660 ( -0.138 -1.118 2.567) 2.803 12.006 ( -3.414 -2.158 -5.090) 6.498 12.251 ( -3.666 0.990 -1.969) 4.277 12.688 ( 0.062 12.390 -1.581) 12.491 12.930 ( 1.721 9.900 -3.897) 10.778 13.516 ( -0.196 -1.279 6.107) 6.242 13.645 ( 1.198 -4.586 -0.745) 4.798 13.789 ( 0.691 2.467 1.815) 3.139 13.951 ( -2.956 -0.371 0.668) 3.054 15.539 ( 8.147 -10.384 -1.995) 13.349 15.871 ( -8.705 -10.308 -0.751) 13.513 16.107 ( -1.406 2.823 6.024) 6.800 16.298 ( 5.247 -0.652 5.485) 7.619 16.334 ( -4.865 4.511 8.825) 11.041 16.751 ( -0.382 11.858 3.202) 12.288 16.983 ( 1.366 4.226 2.449) 5.071 17.052 ( -1.890 7.352 0.987) 7.655 17.847 ( 10.155 -3.844 -10.711) 15.252 18.255 ( -4.869 -1.178 -6.270) 8.026 19.389 ( 13.184 -8.602 -0.347) 15.746 19.693 ( -15.069 -6.079 3.953) 16.723 ======================= Grid point 215 (103/195) ======================= q-point: (-0.45 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -0.520 -2.097 1.077) 2.414 1.791 ( 2.845 -4.808 -5.577) 7.894 2.127 ( -13.123 -6.199 -5.574) 15.547 2.385 ( 5.629 1.199 0.730) 5.802 2.524 ( 13.411 1.137 -4.769) 14.279 2.634 ( -1.232 11.807 -9.232) 15.039 2.725 ( -3.487 -0.800 7.453) 8.267 2.796 ( -0.335 3.398 3.967) 5.234 3.217 ( 4.078 -4.495 4.125) 7.338 3.298 ( -2.641 0.775 0.030) 2.753 3.670 ( 1.601 -5.972 5.738) 8.435 3.722 ( -2.126 -6.428 1.192) 6.875 4.265 ( 0.708 1.010 -4.368) 4.539 4.294 ( 1.712 3.461 -3.450) 5.178 4.446 ( -1.907 -0.927 -3.288) 3.912 4.497 ( -0.547 0.065 -2.550) 2.609 5.032 ( -0.443 -2.973 -0.433) 3.037 5.124 ( -0.416 -2.512 -3.463) 4.298 6.556 ( 2.114 0.566 3.198) 3.875 6.619 ( 2.830 -0.305 0.201) 2.853 7.416 ( -0.444 -1.861 9.309) 9.504 7.665 ( 2.333 -1.062 0.877) 2.709 8.145 ( 1.921 -9.623 -3.272) 10.343 8.371 ( -2.009 -3.615 -11.657) 12.369 8.543 ( -4.124 -2.315 1.693) 5.023 8.715 ( 1.399 1.264 -2.931) 3.485 9.026 ( 4.245 -1.012 1.415) 4.587 9.055 ( 2.236 -1.226 1.533) 2.975 9.300 ( -4.171 -7.174 10.965) 13.751 9.768 ( -0.044 2.013 -0.088) 2.015 9.867 ( 2.933 -4.010 1.767) 5.273 9.981 ( 1.173 2.292 0.983) 2.756 10.121 ( -3.024 -1.234 2.167) 3.920 10.495 ( -0.569 5.220 -7.026) 8.772 10.577 ( 2.330 3.372 -1.882) 4.510 10.627 ( -8.083 5.969 -9.654) 13.934 11.036 ( -1.069 -6.077 2.744) 6.753 11.274 ( -3.689 -0.247 -5.309) 6.470 11.602 ( 0.374 -6.344 4.568) 7.827 11.765 ( 7.942 -11.853 -0.508) 14.277 11.947 ( 3.598 2.769 1.292) 4.720 12.077 ( -7.541 0.547 -8.946) 11.714 12.694 ( 0.561 16.554 1.748) 16.655 12.877 ( -1.173 9.825 -5.058) 11.112 13.575 ( -0.569 -2.735 4.131) 4.987 13.678 ( 2.653 -4.267 -0.007) 5.024 13.855 ( 3.046 0.524 3.086) 4.368 13.896 ( -2.401 -0.151 -1.037) 2.620 15.621 ( -9.170 -8.090 -1.520) 12.322 15.735 ( 7.967 -8.402 -1.147) 11.635 16.067 ( -10.052 -1.361 8.092) 12.976 16.425 ( -3.530 2.552 9.896) 10.812 16.442 ( 6.965 8.070 2.329) 10.911 16.721 ( -3.903 6.155 -0.518) 7.307 16.959 ( 2.555 2.818 -4.725) 6.066 17.210 ( 4.762 8.075 12.328) 15.487 17.882 ( 6.420 -5.024 -8.539) 11.806 18.044 ( -4.890 0.931 -10.167) 11.320 19.418 ( -17.428 -6.758 -0.260) 18.694 19.702 ( 17.101 -7.819 3.680) 19.161 ======================= Grid point 216 (104/195) ======================= q-point: (-0.36 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -9.853 -5.527 -1.812) 11.441 1.700 ( -16.315 8.118 2.970) 18.463 1.960 ( 8.733 -2.704 -7.400) 11.762 2.450 ( 5.476 4.551 -5.004) 8.703 2.609 ( 0.241 5.131 -3.134) 6.017 2.631 ( 2.445 1.308 -3.878) 4.767 2.772 ( 1.957 -2.416 5.631) 6.432 2.812 ( 0.523 -0.264 3.529) 3.577 3.294 ( 1.686 0.336 1.750) 2.453 3.341 ( 5.696 -2.226 2.271) 6.524 3.539 ( -6.706 -6.050 -2.417) 9.350 3.906 ( 7.987 -8.514 6.023) 13.136 4.207 ( 0.053 2.477 -5.693) 6.209 4.279 ( -4.982 -0.105 -2.476) 5.564 4.338 ( 2.782 4.569 -1.640) 5.595 4.571 ( 3.361 -4.435 2.907) 6.279 5.021 ( -1.227 -0.797 0.125) 1.468 5.074 ( -0.280 -2.734 -2.185) 3.511 6.653 ( 5.592 0.191 1.805) 5.879 6.692 ( 6.506 0.015 -1.040) 6.588 7.489 ( -1.394 -4.378 4.901) 6.718 7.716 ( 3.687 -1.225 -1.411) 4.134 8.175 ( 2.993 -7.007 0.484) 7.634 8.231 ( -0.453 -1.653 -6.921) 7.130 8.502 ( -3.156 -1.290 2.568) 4.268 8.716 ( 1.444 -0.013 -0.911) 1.707 9.026 ( 0.602 -0.102 -1.301) 1.437 9.230 ( 9.257 -5.032 2.331) 10.791 9.376 ( -2.734 -5.998 12.224) 13.888 9.717 ( -0.687 -7.084 -7.505) 10.343 9.855 ( -3.806 2.095 -0.450) 4.368 10.029 ( 3.534 2.365 0.807) 4.329 10.147 ( -3.198 -0.415 7.301) 7.981 10.285 ( -12.056 2.015 -10.094) 15.852 10.402 ( -5.922 11.143 -3.231) 13.026 10.644 ( 4.157 2.716 0.050) 4.966 10.930 ( -5.907 -7.135 -2.779) 9.671 11.244 ( -5.739 1.319 0.988) 5.971 11.555 ( 0.495 -7.621 -4.599) 8.915 11.833 ( -3.237 1.338 -0.591) 3.552 11.917 ( 5.460 0.415 -3.009) 6.248 12.145 ( 7.940 -6.064 6.971) 12.182 12.730 ( 0.634 15.895 1.790) 16.008 12.788 ( -2.401 8.901 -4.073) 10.079 13.590 ( -1.057 -4.333 1.125) 4.600 13.723 ( 3.035 -3.117 -0.865) 4.435 13.842 ( -1.120 1.427 -1.252) 2.204 13.964 ( 4.139 -0.378 2.775) 4.997 15.379 ( -12.663 -4.718 -1.817) 13.635 15.927 ( 2.856 0.957 4.952) 5.796 16.006 ( -0.444 -11.856 4.707) 12.764 16.319 ( -15.120 7.589 1.500) 16.984 16.596 ( 8.892 5.803 -0.026) 10.618 16.712 ( 1.642 -0.941 1.712) 2.552 16.941 ( -1.477 -0.187 -1.028) 1.809 17.423 ( 7.111 11.651 3.796) 14.167 17.795 ( -3.901 -0.943 -5.296) 6.645 18.008 ( 8.249 -1.864 -2.679) 8.871 19.074 ( -19.708 -5.888 -3.171) 20.811 20.045 ( 17.005 -7.657 3.217) 18.925 ======================= Grid point 217 (105/195) ======================= q-point: (-0.27 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -17.561 -0.315 0.187) 17.565 1.423 ( -20.718 11.974 5.877) 24.641 2.091 ( 9.078 0.790 -5.920) 10.866 2.282 ( -16.557 12.854 -2.782) 21.145 2.493 ( -2.789 -0.167 -7.154) 7.681 2.703 ( 7.692 -3.198 5.961) 10.243 2.864 ( 0.767 -1.319 4.608) 4.854 3.002 ( 11.579 -4.311 1.316) 12.426 3.336 ( 3.183 0.151 -4.023) 5.132 3.382 ( -1.901 -4.009 -1.813) 4.793 3.540 ( 8.621 -4.593 2.523) 10.089 4.097 ( 5.070 -7.742 1.338) 9.351 4.161 ( 1.078 2.182 0.054) 2.434 4.187 ( -0.888 -1.388 -0.485) 1.718 4.404 ( 3.837 3.868 0.290) 5.456 4.605 ( -2.586 -1.581 0.337) 3.050 4.993 ( -1.135 -2.632 0.785) 2.972 5.090 ( 2.114 -2.065 0.809) 3.064 6.792 ( 9.218 -0.839 0.329) 9.262 6.827 ( 11.206 -0.610 -1.663) 11.345 7.482 ( -0.969 -5.567 -1.721) 5.907 7.738 ( 3.638 0.131 -6.613) 7.549 8.141 ( 0.349 -5.094 -3.033) 5.939 8.310 ( 2.991 0.379 7.016) 7.636 8.514 ( -0.005 -3.816 5.043) 6.324 8.742 ( 1.204 -1.376 1.203) 2.189 9.027 ( -0.369 -1.301 1.042) 1.708 9.382 ( 3.534 -4.851 1.075) 6.098 9.449 ( -2.718 -8.221 5.653) 10.341 9.590 ( -2.926 -4.708 -4.671) 7.249 9.784 ( -6.683 4.725 -3.343) 8.841 9.922 ( -8.322 3.337 -6.798) 11.252 10.077 ( -1.328 4.008 1.469) 4.470 10.151 ( -6.768 0.525 3.979) 7.868 10.346 ( -0.763 3.719 4.238) 5.690 10.651 ( -0.657 0.208 -3.816) 3.878 10.865 ( 0.009 -0.087 -1.655) 1.657 11.059 ( -7.214 0.241 -4.325) 8.415 11.589 ( 0.538 -1.604 2.568) 3.075 11.776 ( 0.584 -2.220 0.527) 2.355 12.063 ( 7.807 0.319 2.206) 8.119 12.298 ( 1.485 -3.554 4.698) 6.076 12.698 ( -0.750 9.313 -4.796) 10.502 12.760 ( -1.089 10.206 1.963) 10.450 13.585 ( 0.204 -5.106 0.476) 5.132 13.758 ( 3.876 -1.587 -3.295) 5.329 13.826 ( 0.357 3.297 -0.537) 3.359 14.055 ( 3.371 -0.505 1.453) 3.705 15.180 ( -11.072 -2.994 3.257) 11.923 15.850 ( -12.330 -0.526 3.791) 12.910 16.053 ( -10.763 7.004 -3.342) 13.269 16.213 ( 10.840 -11.852 3.764) 16.497 16.711 ( 3.928 -2.848 -2.229) 5.339 16.779 ( 4.314 7.082 2.181) 8.575 16.888 ( -3.325 -4.834 0.266) 5.873 17.509 ( 5.197 9.753 -5.820) 12.490 17.714 ( 0.939 4.345 -5.168) 6.817 18.171 ( 6.239 -1.770 3.688) 7.461 18.705 ( -18.963 -4.495 1.466) 19.544 20.339 ( 14.419 -7.179 0.263) 16.110 ======================= Grid point 218 (106/195) ======================= q-point: (-0.18 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -16.979 5.499 9.081) 20.024 1.160 ( -19.383 13.091 9.797) 25.358 1.842 ( -29.171 14.944 14.798) 35.962 2.165 ( 0.420 2.390 -9.590) 9.892 2.493 ( 9.698 0.851 -2.846) 10.143 2.891 ( -1.799 -5.697 -0.966) 6.052 2.925 ( 8.777 -3.876 5.845) 11.235 3.058 ( -0.538 -0.662 -4.558) 4.638 3.364 ( 4.690 0.287 -4.638) 6.602 3.406 ( 7.070 -3.190 -0.158) 7.758 3.722 ( 8.095 -5.248 0.680) 9.671 4.067 ( -0.157 -4.670 -3.668) 5.941 4.195 ( 1.453 -1.249 1.645) 2.525 4.306 ( 3.990 -2.193 4.165) 6.171 4.446 ( 0.181 2.222 -1.116) 2.493 4.522 ( -3.530 2.784 -0.165) 4.499 5.012 ( -0.018 -3.071 3.235) 4.461 5.137 ( 2.035 -3.483 0.268) 4.043 6.973 ( 11.823 -2.807 -0.886) 12.184 7.032 ( 14.352 -2.395 -1.818) 14.664 7.442 ( 0.635 -4.041 -3.722) 5.530 7.695 ( 4.362 0.691 -10.513) 11.403 8.154 ( 1.211 -4.189 2.209) 4.888 8.411 ( 1.809 1.550 2.459) 3.424 8.607 ( 0.514 -7.301 6.720) 9.936 8.774 ( -0.102 -3.596 2.511) 4.387 9.019 ( -4.169 -1.736 1.524) 4.766 9.245 ( -11.314 -3.710 -3.176) 12.323 9.367 ( -13.316 0.940 -8.834) 16.008 9.555 ( 1.803 -1.584 5.685) 6.171 9.622 ( -2.435 -0.961 5.553) 6.139 9.859 ( -4.824 3.358 -1.874) 6.169 10.042 ( -6.246 -2.775 4.086) 7.963 10.135 ( 6.534 5.192 1.862) 8.551 10.414 ( 0.516 -2.419 3.325) 4.144 10.625 ( 2.780 5.482 -2.615) 6.679 10.773 ( -3.203 1.789 -5.733) 6.806 11.002 ( 0.553 0.042 -0.400) 0.684 11.588 ( -2.679 0.080 2.927) 3.969 11.854 ( 0.740 -4.018 6.801) 7.934 12.182 ( 3.759 -4.970 0.018) 6.231 12.344 ( 0.467 6.668 2.846) 7.265 12.642 ( -0.977 4.627 -2.775) 5.483 12.731 ( -1.343 8.056 -3.502) 8.886 13.618 ( 0.978 -4.401 2.692) 5.251 13.790 ( 6.210 -0.194 -5.130) 8.057 13.832 ( 0.827 3.195 -0.633) 3.361 14.108 ( 2.135 -0.197 -0.534) 2.209 15.075 ( -11.099 -0.765 10.342) 15.190 15.624 ( -13.376 -1.027 0.699) 13.433 15.927 ( -1.789 3.681 -2.401) 4.745 16.425 ( 9.067 -11.793 2.681) 15.115 16.693 ( 1.085 -1.581 -6.383) 6.665 16.810 ( -2.522 -3.455 1.091) 4.414 16.919 ( 4.702 1.751 0.932) 5.104 17.509 ( 2.271 8.197 -4.765) 9.750 17.668 ( 1.574 4.412 -6.939) 8.372 18.051 ( -10.814 -0.825 -14.971) 18.486 18.694 ( -0.911 -0.665 23.298) 23.325 20.530 ( 10.094 -6.615 -4.059) 12.733 ======================= Grid point 219 (107/195) ======================= q-point: (-0.09 0.11 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.881 ( -11.115 5.666 19.905) 23.492 1.021 ( -15.283 9.990 18.266) 25.827 1.677 ( -18.209 21.721 29.338) 40.793 2.076 ( 1.795 1.604 -6.552) 6.980 2.617 ( 6.278 -2.620 -6.183) 9.193 2.759 ( -0.840 -4.373 -9.107) 10.137 3.041 ( -1.804 2.184 3.769) 4.715 3.125 ( 7.050 -3.459 4.372) 8.988 3.356 ( 2.289 1.239 -6.597) 7.092 3.540 ( 6.778 -3.597 0.231) 7.677 3.764 ( 0.959 -7.602 -7.358) 10.623 4.065 ( 1.685 -2.580 0.885) 3.207 4.222 ( -1.511 0.543 -4.114) 4.416 4.285 ( -1.467 -0.663 0.208) 1.623 4.477 ( 1.135 1.353 4.436) 4.775 4.524 ( 0.592 1.201 0.970) 1.653 5.052 ( -0.421 -2.202 3.813) 4.423 5.159 ( 1.007 -4.440 -0.697) 4.606 7.143 ( 8.898 -4.283 -2.534) 10.195 7.232 ( 10.040 -4.680 -2.357) 11.325 7.427 ( 1.432 -1.682 -1.649) 2.756 7.686 ( 9.737 -0.645 -10.578) 14.392 8.211 ( 1.241 -3.681 2.993) 4.904 8.413 ( -1.946 -1.280 -2.575) 3.472 8.612 ( -3.326 -1.132 -0.903) 3.628 8.752 ( -11.978 2.197 -3.264) 12.607 8.861 ( -3.051 -9.749 -1.497) 10.325 9.004 ( -11.524 -3.251 2.202) 12.175 9.241 ( -0.292 3.262 5.368) 6.288 9.593 ( -3.743 1.099 6.633) 7.695 9.748 ( -0.457 1.078 -2.588) 2.841 9.778 ( 5.205 -3.696 9.736) 11.642 10.029 ( -2.201 1.994 4.456) 5.355 10.285 ( 5.580 0.025 1.360) 5.744 10.398 ( -2.629 -0.621 -1.764) 3.227 10.588 ( -1.605 6.900 -5.847) 9.185 10.779 ( 5.724 2.707 3.159) 7.077 10.996 ( -1.140 -0.691 0.406) 1.393 11.600 ( -0.396 0.492 3.470) 3.527 11.896 ( -5.218 -2.865 6.731) 8.986 12.242 ( 3.505 -6.298 1.070) 7.286 12.359 ( -0.342 10.784 -2.422) 11.058 12.564 ( -5.790 0.502 -1.119) 5.918 12.688 ( 4.609 6.480 -6.040) 9.986 13.652 ( -1.474 -2.392 3.274) 4.315 13.828 ( 0.857 4.255 -2.223) 4.876 13.871 ( 8.567 -1.255 -3.763) 9.440 14.113 ( 0.602 0.177 -2.704) 2.775 14.998 ( -15.847 3.210 14.862) 21.961 15.515 ( -1.494 -2.309 4.555) 5.321 15.887 ( 1.335 -0.422 -4.712) 4.916 16.543 ( 0.492 -8.473 -0.599) 8.509 16.668 ( 8.469 -3.906 -7.201) 11.783 16.799 ( -1.083 -4.301 2.840) 5.267 16.970 ( 1.536 -0.350 -3.052) 3.435 17.428 ( -8.981 0.906 -2.787) 9.447 17.608 ( 0.893 5.224 -8.090) 9.672 17.711 ( -2.594 8.845 -14.204) 16.933 19.010 ( 2.204 0.343 25.669) 25.766 20.582 ( 4.661 -5.952 -8.874) 11.657 ======================= Grid point 220 (108/195) ======================= q-point: ( 0.00 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( -1.694 16.714 13.163) 21.342 1.323 ( -0.783 13.538 16.250) 21.165 2.083 ( 7.455 1.665 -4.627) 8.931 2.213 ( -4.771 6.530 -1.075) 8.158 2.430 ( -1.484 8.999 7.010) 11.503 2.826 ( 3.646 -0.457 4.650) 5.927 3.037 ( -3.597 -1.218 2.182) 4.380 3.203 ( 2.914 -1.579 1.529) 3.651 3.331 ( 0.721 -1.303 -7.047) 7.203 3.417 ( -0.284 -8.887 -8.561) 12.343 3.543 ( 1.450 -6.543 1.437) 6.854 3.991 ( -2.011 -3.095 -7.117) 8.017 4.184 ( -2.424 3.046 1.853) 4.311 4.309 ( 2.061 -0.512 2.425) 3.223 4.511 ( 0.034 -1.991 0.631) 2.088 4.538 ( -2.180 -0.503 0.985) 2.445 5.027 ( -0.245 -4.156 2.692) 4.958 5.063 ( 0.438 -5.504 1.159) 5.642 7.090 ( 1.634 -6.116 -4.088) 7.536 7.138 ( 0.273 -9.265 -2.860) 9.700 7.400 ( -0.515 -2.712 0.704) 2.849 7.643 ( 3.171 -6.524 -7.832) 10.675 8.197 ( 13.511 -2.127 -2.557) 13.915 8.331 ( -17.315 -2.964 -7.603) 19.141 8.431 ( -1.547 3.038 4.016) 5.268 8.642 ( 2.190 0.183 -2.323) 3.198 8.708 ( -6.296 -6.382 3.645) 9.678 8.816 ( 1.934 -6.268 0.978) 6.632 9.403 ( 3.343 0.978 9.059) 9.705 9.587 ( -3.647 0.516 2.609) 4.514 9.713 ( 2.204 -6.448 3.232) 7.542 9.838 ( 2.654 -2.775 0.221) 3.846 10.131 ( -1.400 0.314 1.218) 1.882 10.291 ( -1.261 -3.196 -4.827) 5.925 10.400 ( 4.491 6.524 6.797) 10.437 10.714 ( -1.619 9.395 -0.673) 9.557 10.937 ( -1.727 -1.516 3.890) 4.518 11.009 ( 3.843 3.420 2.189) 5.591 11.696 ( 1.617 3.854 5.020) 6.532 11.835 ( -3.881 -1.237 3.098) 5.117 12.195 ( 4.522 -4.759 -0.372) 6.575 12.404 ( -6.259 -4.837 -1.659) 8.083 12.529 ( -1.215 11.621 -4.385) 12.480 12.796 ( 2.416 4.637 -5.738) 7.763 13.681 ( 0.400 2.193 5.285) 5.736 13.859 ( 1.138 -0.136 0.248) 1.172 13.960 ( 2.900 2.025 -3.240) 4.797 14.079 ( -0.929 0.659 -3.934) 4.095 15.061 ( -9.379 8.772 13.403) 18.562 15.587 ( 6.139 -3.637 7.911) 10.654 15.829 ( -0.602 0.796 -1.932) 2.174 16.338 ( -4.488 -9.307 0.967) 10.377 16.589 ( 2.132 -4.556 -18.515) 19.186 16.713 ( 0.706 -8.343 3.962) 9.262 16.850 ( 3.219 -2.522 -6.134) 7.372 17.096 ( -4.937 -7.805 -6.423) 11.250 17.757 ( 1.547 11.090 -0.343) 11.203 17.908 ( 1.771 14.775 -5.731) 15.947 19.349 ( 0.971 1.820 21.667) 21.765 20.339 ( -1.028 -9.423 -11.510) 14.911 ======================= Grid point 221 (109/195) ======================= q-point: ( 0.09 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.380 ( 2.682 12.333 13.612) 18.563 1.565 ( 4.435 8.712 15.655) 18.457 2.048 ( 2.462 -2.242 -15.561) 15.913 2.150 ( 8.539 3.075 -9.944) 13.464 2.556 ( -5.362 9.645 13.582) 17.501 2.910 ( -2.463 -6.673 4.831) 8.599 2.999 ( -5.277 -1.751 4.021) 6.862 3.126 ( -0.885 -2.176 -4.127) 4.748 3.319 ( 1.830 6.824 -5.668) 9.058 3.357 ( 2.913 -4.513 -4.330) 6.900 3.595 ( -0.862 -6.033 6.885) 9.194 3.819 ( -4.749 -4.094 -8.634) 10.671 4.202 ( -0.693 2.650 3.730) 4.628 4.352 ( 1.305 -0.465 -1.957) 2.397 4.474 ( -3.262 -2.945 1.231) 4.564 4.548 ( 1.211 0.034 1.407) 1.857 5.033 ( -1.694 -4.347 1.330) 4.851 5.088 ( 0.428 -4.524 1.484) 4.781 6.990 ( -6.972 -5.376 -3.066) 9.322 7.059 ( -5.904 -8.153 -2.396) 10.348 7.382 ( -2.656 -0.961 1.021) 3.003 7.580 ( -0.823 -4.905 -7.631) 9.108 8.047 ( -5.112 -8.359 -4.820) 10.919 8.422 ( 4.482 -4.454 1.595) 6.517 8.439 ( -0.723 0.555 4.016) 4.118 8.637 ( 4.599 -4.248 -0.215) 6.265 8.671 ( 0.800 1.788 0.335) 1.987 8.916 ( 5.552 -4.831 1.079) 7.438 9.553 ( 0.669 0.517 2.854) 2.977 9.627 ( 5.150 -1.229 6.291) 8.222 9.778 ( 2.791 -4.756 0.863) 5.582 9.838 ( 0.984 0.055 -3.879) 4.002 10.090 ( -3.747 -1.599 1.706) 4.417 10.187 ( -3.739 -3.174 -4.367) 6.567 10.588 ( 4.645 8.787 7.261) 12.309 10.691 ( 0.060 7.031 -0.969) 7.097 10.918 ( -2.327 -0.422 1.659) 2.889 11.120 ( 4.996 0.740 1.587) 5.294 11.744 ( -3.345 -1.174 3.136) 4.733 11.847 ( 1.214 3.624 3.378) 5.101 12.195 ( -1.893 1.689 -1.128) 2.777 12.245 ( -6.508 -4.720 -3.920) 8.944 12.586 ( 6.593 5.497 3.517) 9.276 12.782 ( 4.109 2.255 -6.063) 7.663 13.734 ( -1.271 5.764 4.199) 7.243 13.846 ( -1.778 3.765 -1.795) 4.534 13.944 ( -1.810 -2.190 -0.480) 2.881 13.998 ( -2.009 0.219 -4.708) 5.123 15.132 ( -1.303 8.346 13.874) 16.243 15.779 ( -3.024 -0.149 6.846) 7.486 15.800 ( 8.612 -3.127 -4.946) 10.412 16.278 ( -9.094 -11.251 5.353) 15.425 16.333 ( 0.048 -1.957 -16.973) 17.086 16.716 ( -3.509 -6.299 -0.019) 7.210 16.936 ( 11.018 -4.789 -2.319) 12.236 17.103 ( 12.210 -8.989 -3.916) 15.659 17.708 ( -5.581 16.488 -2.240) 17.551 17.892 ( 1.889 12.739 -2.972) 13.217 19.585 ( -2.537 -1.725 20.449) 20.678 20.123 ( -6.079 -8.184 -14.402) 17.645 ======================= Grid point 222 (110/195) ======================= q-point: ( 0.18 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( 4.485 7.420 8.024) 11.813 1.756 ( 4.494 -0.077 3.502) 5.698 1.973 ( 5.463 1.894 -10.054) 11.598 2.189 ( 6.653 4.589 -3.120) 8.664 2.460 ( -11.237 0.829 -0.029) 11.268 2.816 ( -10.938 -5.723 1.907) 12.491 3.024 ( 0.145 -6.106 6.437) 8.874 3.128 ( 1.757 2.661 -2.520) 4.064 3.276 ( 1.127 1.968 -7.339) 7.682 3.356 ( -0.752 3.561 1.436) 3.913 3.600 ( -4.843 -4.604 -3.828) 7.701 3.730 ( -1.262 -4.291 6.871) 8.199 4.242 ( 1.234 1.138 2.555) 3.057 4.289 ( -1.750 -1.465 -4.397) 4.954 4.488 ( 1.467 -1.556 2.031) 2.949 4.598 ( 2.061 2.617 1.971) 3.870 5.006 ( -2.202 -5.798 0.104) 6.203 5.106 ( 0.256 -3.965 0.345) 3.988 6.813 ( -9.579 -4.959 -1.912) 10.954 6.903 ( -8.591 -5.256 -1.887) 10.247 7.299 ( -7.745 1.354 0.628) 7.887 7.504 ( 2.029 -3.056 -4.405) 5.732 8.003 ( 1.329 -12.507 -1.357) 12.650 8.380 ( -6.522 -11.244 1.822) 13.126 8.461 ( -0.197 -7.834 2.678) 8.282 8.688 ( 2.039 1.754 -0.348) 2.712 8.887 ( 12.359 3.418 5.858) 14.098 9.004 ( 4.720 -1.488 -0.826) 5.017 9.548 ( -3.494 2.825 1.504) 4.738 9.644 ( -3.478 1.442 -6.589) 7.589 9.855 ( 4.806 -2.851 -0.800) 5.645 9.926 ( 9.621 -2.601 2.130) 10.192 10.076 ( -5.121 -3.518 -1.096) 6.309 10.094 ( 2.503 -4.365 3.802) 6.306 10.653 ( -1.940 5.664 0.838) 6.045 10.681 ( 1.239 6.691 -2.761) 7.344 10.955 ( 4.588 4.763 0.980) 6.685 11.195 ( 2.942 0.384 -1.548) 3.347 11.679 ( -5.183 -2.048 -0.117) 5.574 11.903 ( 0.033 -0.402 3.097) 3.123 12.028 ( -7.720 -9.529 -3.716) 12.814 12.272 ( 1.882 6.764 6.168) 9.345 12.735 ( 5.711 4.981 -0.084) 7.578 12.823 ( 8.159 5.750 -2.320) 10.248 13.710 ( -5.657 6.678 0.987) 8.807 13.779 ( -3.067 -0.732 -1.712) 3.588 13.862 ( -3.113 -0.239 -4.196) 5.230 13.958 ( -1.265 -0.953 2.265) 2.764 15.297 ( 2.227 4.735 9.719) 11.038 15.714 ( -1.746 1.297 -2.822) 3.563 15.889 ( -0.461 -8.934 1.736) 9.112 16.130 ( 2.111 0.726 -9.998) 10.244 16.312 ( -3.724 -7.452 9.551) 12.674 16.670 ( 1.275 -2.520 -2.083) 3.509 17.117 ( 13.450 -2.664 -5.535) 14.786 17.367 ( 16.711 -8.125 4.563) 19.133 17.547 ( -9.322 14.024 -1.260) 16.887 17.873 ( 0.285 11.736 -4.038) 12.415 19.733 ( -6.362 -4.961 17.560) 19.324 19.809 ( -9.264 -7.248 -15.858) 19.744 ======================= Grid point 223 (111/195) ======================= q-point: ( 0.27 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 2.077 -0.104 -6.582) 6.902 1.903 ( 9.386 -1.822 -0.512) 9.575 1.945 ( 1.053 5.717 -2.288) 6.247 2.196 ( -5.258 -1.241 -1.567) 5.625 2.412 ( 2.934 1.476 7.070) 7.796 2.656 ( -9.721 -5.393 3.240) 11.579 3.021 ( -1.322 3.541 -3.469) 5.130 3.120 ( -4.831 -5.268 -0.526) 7.167 3.198 ( -0.976 3.304 -0.907) 3.562 3.372 ( -0.865 -0.262 3.121) 3.250 3.439 ( -4.807 -3.013 -7.612) 9.494 3.760 ( -4.886 -4.303 4.682) 8.019 4.246 ( 1.297 -0.086 -1.756) 2.185 4.316 ( 3.771 -1.113 1.762) 4.309 4.538 ( 3.024 0.251 -0.898) 3.165 4.654 ( 2.177 4.959 0.834) 5.479 4.969 ( -1.645 -7.817 -0.418) 7.999 5.106 ( 0.388 -4.032 -1.121) 4.203 6.641 ( -8.334 -3.696 -0.121) 9.118 6.738 ( -7.734 -2.685 -1.693) 8.359 7.204 ( -4.391 0.403 2.589) 5.113 7.521 ( 2.711 -0.581 -0.735) 2.868 8.006 ( 0.587 -11.601 -1.684) 11.737 8.304 ( -5.586 -17.100 4.637) 18.577 8.504 ( 1.817 -8.877 0.659) 9.085 8.722 ( 1.511 -2.661 0.067) 3.061 8.967 ( -1.480 1.714 -1.218) 2.571 9.193 ( 7.163 5.373 7.494) 11.677 9.464 ( -7.354 2.636 2.021) 8.070 9.500 ( -1.380 3.375 -9.552) 10.224 9.901 ( 3.615 -1.014 -1.974) 4.242 9.958 ( -3.578 -1.758 -2.630) 4.776 10.088 ( 1.130 -4.982 5.888) 7.795 10.292 ( 13.534 -6.428 0.810) 15.005 10.635 ( 3.735 1.758 -2.579) 4.868 10.685 ( 2.622 7.728 -0.998) 8.221 11.035 ( 4.649 7.055 -2.926) 8.942 11.161 ( -0.975 2.221 -6.550) 6.985 11.609 ( -3.475 -1.498 1.841) 4.208 11.813 ( -9.371 -11.618 -0.335) 14.931 11.993 ( 2.128 -3.462 0.843) 4.150 12.353 ( -1.106 5.215 4.832) 7.195 12.811 ( 6.072 7.798 -2.026) 10.088 12.962 ( 8.038 8.623 -0.644) 11.806 13.579 ( -7.557 0.844 -2.032) 7.871 13.697 ( -3.129 -1.081 -2.162) 3.954 13.803 ( -1.212 0.007 0.107) 1.217 13.972 ( -1.448 -0.329 3.322) 3.638 15.354 ( 0.099 -2.038 -2.886) 3.535 15.735 ( -1.175 -2.737 7.865) 8.410 15.859 ( -2.157 -8.131 2.476) 8.769 16.129 ( 7.249 4.351 -6.114) 10.434 16.384 ( -3.723 -2.266 13.450) 14.138 16.724 ( 6.780 2.911 -1.317) 7.495 17.196 ( 3.616 8.426 -10.422) 13.881 17.391 ( -4.481 5.898 2.270) 7.747 17.753 ( 11.479 -1.125 5.676) 12.855 17.828 ( 6.160 -0.284 -2.915) 6.821 19.456 ( -9.456 -7.182 -15.687) 19.674 19.774 ( -9.985 -7.702 13.263) 18.301 ======================= Grid point 224 (112/195) ======================= q-point: ( 0.36 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( 3.184 -4.199 -9.045) 10.468 1.829 ( -7.123 1.668 -3.593) 8.150 2.119 ( -0.007 -0.927 5.123) 5.206 2.150 ( 13.265 1.230 -3.783) 13.849 2.464 ( -6.765 -3.421 4.695) 8.917 2.667 ( 4.215 -5.120 6.561) 9.329 2.940 ( -7.125 5.953 -2.488) 9.612 2.957 ( -7.414 -3.099 0.615) 8.059 3.220 ( -6.322 -1.571 -8.717) 10.882 3.250 ( 2.255 1.296 4.820) 5.477 3.410 ( -0.028 1.002 0.671) 1.206 3.718 ( -4.022 -6.295 3.066) 8.075 4.250 ( 1.609 -0.075 -2.641) 3.093 4.384 ( 1.993 -0.849 -0.552) 2.236 4.555 ( 2.935 1.466 -4.970) 5.955 4.681 ( 0.972 4.962 -1.150) 5.185 4.939 ( -0.949 -8.921 -1.196) 9.051 5.098 ( 0.720 -4.447 -1.677) 4.807 6.542 ( -4.556 -1.642 2.264) 5.345 6.613 ( -4.751 -1.282 -0.717) 4.973 7.212 ( -0.570 -0.328 5.415) 5.455 7.563 ( 1.573 0.019 1.159) 1.954 7.983 ( 0.179 -11.161 -2.764) 11.500 8.311 ( -1.574 -16.283 6.480) 17.596 8.512 ( -1.490 -9.531 -0.659) 9.669 8.708 ( -1.285 -6.262 -2.026) 6.705 8.949 ( 1.790 2.742 -1.680) 3.680 9.211 ( -8.172 4.763 1.243) 9.541 9.341 ( -5.435 3.199 -5.168) 8.154 9.530 ( 5.732 1.824 6.977) 9.212 9.862 ( -2.577 -2.288 -3.167) 4.680 9.964 ( 3.703 2.552 0.732) 4.556 10.138 ( -0.926 -4.841 2.109) 5.361 10.447 ( 6.448 1.010 -2.356) 6.939 10.702 ( 7.846 -2.919 -7.727) 11.393 10.838 ( 10.424 -0.095 7.222) 12.682 10.993 ( 0.641 6.011 -9.564) 11.315 11.091 ( 0.508 4.661 -3.235) 5.696 11.563 ( -5.823 -5.631 -0.250) 8.104 11.667 ( -6.165 -5.893 0.773) 8.563 12.016 ( 0.749 -2.331 -1.877) 3.085 12.349 ( -3.644 2.763 2.023) 5.001 12.885 ( 4.708 10.605 -1.890) 11.756 13.068 ( 5.899 7.529 -1.543) 9.688 13.460 ( -3.490 -3.376 -0.339) 4.867 13.623 ( -3.273 -0.187 -1.132) 3.468 13.805 ( -0.270 0.544 1.745) 1.848 13.973 ( -2.235 -0.997 1.969) 3.141 15.323 ( 3.143 -4.715 -4.672) 7.345 15.714 ( -8.276 -12.804 6.540) 16.589 15.980 ( 5.215 -1.347 7.855) 9.524 16.178 ( 1.874 -1.275 -0.401) 2.302 16.497 ( -0.736 11.488 11.209) 16.067 16.848 ( 8.515 7.049 -1.093) 11.109 17.078 ( -3.773 9.962 -1.879) 10.817 17.363 ( -3.018 7.250 -2.013) 8.107 17.747 ( 5.239 0.450 -9.134) 10.539 18.144 ( 10.761 -7.333 7.552) 15.053 19.164 ( -3.156 -9.658 -12.249) 15.914 19.702 ( -12.867 -9.715 8.083) 18.035 ======================= Grid point 225 (113/195) ======================= q-point: ( 0.45 0.22 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( 6.168 -3.711 -6.743) 9.863 1.644 ( -5.599 -4.372 -5.856) 9.207 2.168 ( -0.783 -1.798 4.923) 5.299 2.363 ( 4.720 2.756 0.350) 5.477 2.405 ( 4.006 -1.618 -1.086) 4.455 2.732 ( -6.590 -3.653 2.025) 7.802 2.819 ( -2.194 1.935 3.156) 4.303 2.951 ( -0.122 -3.942 5.929) 7.121 3.023 ( -2.817 6.365 -6.247) 9.353 3.336 ( 0.837 -3.016 -0.028) 3.130 3.439 ( 3.317 2.786 3.284) 5.436 3.685 ( -4.827 -6.737 2.800) 8.748 4.243 ( 0.438 -1.527 -1.149) 1.961 4.364 ( 0.861 1.089 -5.181) 5.364 4.527 ( 2.155 2.099 -7.322) 7.916 4.639 ( -3.212 2.318 -3.919) 5.572 4.920 ( 0.515 -7.926 -0.320) 7.949 5.087 ( 0.416 -4.609 -2.218) 5.132 6.528 ( -1.388 0.437 3.423) 3.719 6.570 ( -0.030 -1.000 0.620) 1.177 7.291 ( 0.274 -1.029 7.508) 7.583 7.596 ( 0.782 -1.849 1.179) 2.328 7.957 ( -0.155 -10.252 -1.596) 10.377 8.368 ( 1.255 -9.588 -0.523) 9.684 8.438 ( -5.713 -10.855 2.604) 12.540 8.687 ( 2.381 -5.724 -2.545) 6.701 8.948 ( 1.158 2.564 -3.197) 4.258 9.108 ( -4.145 2.049 0.554) 4.657 9.217 ( -4.630 0.692 0.524) 4.711 9.691 ( 4.222 -4.097 2.255) 6.301 9.800 ( -0.591 0.047 -0.585) 0.833 10.038 ( 1.140 6.269 3.504) 7.272 10.120 ( -2.373 -3.112 1.051) 4.052 10.529 ( 6.301 2.828 -1.729) 7.119 10.688 ( 2.088 -2.825 -9.746) 10.360 10.902 ( -2.745 3.820 1.401) 4.908 10.987 ( 2.228 5.422 -9.378) 11.059 11.177 ( 8.244 -9.189 4.095) 13.006 11.417 ( -3.224 -3.433 -3.812) 6.059 11.610 ( -4.683 -4.594 2.079) 6.882 11.994 ( 1.121 2.029 -2.766) 3.609 12.273 ( -5.354 1.665 -2.241) 6.038 12.932 ( 2.693 11.503 -0.287) 11.817 13.124 ( 3.211 8.817 -2.725) 9.771 13.453 ( 0.642 -5.350 2.104) 5.785 13.561 ( -2.030 -3.647 -1.357) 4.389 13.825 ( -0.018 1.347 2.363) 2.720 13.945 ( -2.559 -0.283 0.687) 2.665 15.374 ( 6.861 -5.995 -1.274) 9.200 15.643 ( -6.449 -11.451 2.376) 13.356 16.108 ( -5.268 -1.819 8.048) 9.789 16.221 ( 2.364 -4.053 7.502) 8.849 16.577 ( -0.371 15.277 3.928) 15.779 16.951 ( 3.587 8.743 0.021) 9.450 17.123 ( 4.560 9.823 3.280) 11.316 17.230 ( -5.861 9.913 -0.869) 11.549 17.756 ( 7.709 -5.535 -9.785) 13.632 18.234 ( -3.665 -0.582 -2.786) 4.641 19.157 ( 11.620 -14.727 -1.102) 18.791 19.528 ( -14.156 -10.729 2.569) 17.947 ======================= Grid point 226 (114/195) ======================= q-point: (-0.45 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.491 ( -1.906 -4.137 -5.720) 7.312 1.693 ( 13.544 -5.262 -5.222) 15.440 2.102 ( -10.404 3.470 1.488) 11.068 2.387 ( 1.133 -0.753 4.190) 4.406 2.557 ( 7.380 2.171 -1.420) 7.822 2.649 ( -2.099 -3.375 0.630) 4.024 2.816 ( -2.906 1.620 2.605) 4.225 2.925 ( 2.046 9.019 -3.726) 9.971 3.112 ( 3.617 -4.787 6.234) 8.652 3.314 ( 0.123 0.234 -2.235) 2.251 3.555 ( 0.975 -8.150 1.569) 8.357 3.605 ( -3.066 -0.750 2.250) 3.876 4.249 ( 0.319 -2.191 1.496) 2.672 4.341 ( 1.463 0.901 -2.280) 2.855 4.463 ( 1.097 1.620 -7.884) 8.123 4.492 ( -4.978 -0.274 -6.246) 7.991 4.948 ( 1.361 -5.340 1.544) 5.723 5.054 ( -0.661 -4.517 -3.131) 5.536 6.570 ( 1.966 0.769 2.850) 3.546 6.611 ( 3.405 -0.348 0.549) 3.466 7.371 ( -1.929 -2.665 7.493) 8.184 7.628 ( 2.702 -3.370 -0.329) 4.332 7.954 ( 0.052 -8.421 2.227) 8.710 8.280 ( -1.145 -5.057 -7.940) 9.483 8.447 ( -2.590 -7.487 4.910) 9.320 8.702 ( 2.580 -4.238 -3.684) 6.180 8.967 ( 2.456 -2.717 2.307) 4.329 9.056 ( -0.080 0.509 -2.766) 2.813 9.207 ( -1.827 -1.955 5.886) 6.466 9.669 ( 1.082 -8.625 -8.487) 12.149 9.879 ( 1.977 2.442 6.170) 6.924 10.043 ( -1.433 3.230 -0.517) 3.571 10.131 ( -1.777 2.637 6.176) 6.947 10.546 ( -2.076 0.323 -9.132) 9.371 10.637 ( 2.779 1.912 0.888) 3.488 10.796 ( -6.681 9.649 -4.710) 12.646 10.912 ( -4.385 -6.330 -2.608) 8.130 11.222 ( 4.707 -3.310 -3.973) 6.993 11.469 ( -2.724 -7.337 0.462) 7.840 11.586 ( 7.331 -6.071 1.794) 9.686 12.027 ( 3.557 5.165 1.870) 6.544 12.116 ( -6.566 3.401 -6.078) 9.572 12.971 ( 0.339 11.562 1.679) 11.688 13.103 ( -1.096 11.933 -3.905) 12.604 13.484 ( -0.921 -6.632 0.648) 6.727 13.550 ( 3.842 -8.701 -1.038) 9.568 13.867 ( 0.922 1.131 2.849) 3.201 13.915 ( -1.038 1.767 0.518) 2.114 15.478 ( -1.961 -6.202 0.493) 6.523 15.568 ( 4.561 -7.709 -2.109) 9.202 16.058 ( -11.022 -0.085 10.766) 15.408 16.378 ( 1.300 -3.543 10.463) 11.123 16.622 ( 2.317 7.552 1.794) 8.101 16.899 ( -12.879 10.912 0.091) 16.881 17.032 ( 2.882 4.164 -9.567) 10.825 17.440 ( 10.617 15.289 11.929) 22.109 17.758 ( 3.352 -7.608 -6.543) 10.580 18.073 ( -3.418 2.496 -8.932) 9.884 19.235 ( -14.447 -11.834 -1.036) 18.703 19.486 ( 16.259 -14.169 2.962) 21.769 ======================= Grid point 227 (115/195) ======================= q-point: (-0.36 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( -2.443 -2.505 -5.813) 6.785 1.902 ( 12.867 2.128 -1.664) 13.148 1.925 ( -9.743 8.748 0.501) 13.103 2.447 ( 1.774 -2.126 3.191) 4.225 2.629 ( 4.455 -1.964 -2.341) 5.402 2.720 ( 5.576 0.112 1.331) 5.734 2.780 ( -2.095 -2.307 2.533) 4.016 2.854 ( -7.353 12.951 -4.809) 15.650 3.238 ( 5.446 -5.453 3.422) 8.432 3.323 ( 2.437 -0.705 0.213) 2.546 3.412 ( -6.591 -6.133 -5.016) 10.306 3.763 ( 7.438 -4.684 7.040) 11.262 4.249 ( -1.446 1.097 -3.999) 4.392 4.274 ( -4.366 0.052 -2.395) 4.980 4.407 ( 2.790 2.023 -2.967) 4.548 4.467 ( 2.711 -5.753 2.940) 7.006 4.986 ( -0.602 -2.876 -0.754) 3.034 4.997 ( 0.067 -5.046 -1.117) 5.169 6.655 ( 5.173 -0.103 0.744) 5.227 6.691 ( 6.078 -0.039 -0.659) 6.114 7.390 ( -2.903 -5.215 3.211) 6.778 7.682 ( 4.068 -2.827 -0.927) 5.040 8.022 ( 1.905 -7.236 5.172) 9.096 8.189 ( 0.883 -2.446 -5.688) 6.255 8.441 ( -3.056 -4.816 3.195) 6.537 8.697 ( 1.956 -3.247 -2.544) 4.566 8.973 ( -2.334 -5.774 -1.115) 6.327 9.138 ( 7.412 -3.508 3.807) 9.041 9.259 ( -0.714 -4.447 5.326) 6.975 9.587 ( 0.834 -5.599 -7.361) 9.286 9.919 ( -1.607 3.750 0.423) 4.101 10.065 ( 2.557 1.851 1.441) 3.470 10.152 ( -4.529 0.834 6.305) 7.808 10.316 ( -13.005 0.756 -6.456) 14.539 10.619 ( -4.484 8.646 -7.425) 12.247 10.698 ( 0.757 3.474 -0.694) 3.623 10.819 ( -1.595 -4.058 1.948) 4.775 11.230 ( -6.297 -1.962 -2.448) 7.036 11.420 ( 6.373 -5.794 -1.766) 8.792 11.795 ( 10.169 -6.507 3.009) 12.442 11.922 ( -6.558 4.662 -5.741) 9.884 12.157 ( 5.174 3.815 5.585) 8.515 12.964 ( -3.844 9.087 1.562) 9.990 13.019 ( -2.200 12.182 -3.964) 12.999 13.465 ( 0.370 -8.262 -1.724) 8.449 13.630 ( 5.171 -5.892 -0.153) 7.841 13.885 ( -0.386 2.692 0.704) 2.809 13.958 ( 3.008 -0.006 2.169) 3.708 15.330 ( -7.297 -0.011 -4.239) 8.439 15.731 ( 8.275 -11.194 2.963) 14.232 15.997 ( -11.253 1.802 10.833) 15.723 16.486 ( -5.005 2.882 9.596) 11.200 16.575 ( -4.123 2.713 -9.017) 10.280 16.769 ( -0.023 3.010 5.319) 6.111 16.956 ( -2.235 1.343 -5.895) 6.446 17.651 ( 3.756 4.066 -6.713) 8.701 17.823 ( 5.442 10.175 11.722) 16.449 17.978 ( 4.588 -0.456 -6.434) 7.916 18.918 ( -16.209 -9.694 -5.531) 19.680 19.833 ( 17.660 -13.945 3.329) 22.747 ======================= Grid point 228 (116/195) ======================= q-point: (-0.27 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -5.999 6.392 -2.364) 9.079 1.711 ( -15.087 16.543 2.257) 22.503 2.120 ( 12.539 2.089 -4.278) 13.413 2.480 ( -0.779 -1.065 -6.016) 6.159 2.547 ( -16.880 8.842 1.707) 19.132 2.661 ( 2.976 2.308 3.045) 4.843 2.820 ( -0.142 -2.159 2.844) 3.573 2.926 ( 12.069 -2.864 1.572) 12.503 3.266 ( -1.635 -5.096 -5.165) 7.437 3.350 ( 2.870 -1.079 0.114) 3.069 3.420 ( 7.875 -7.640 2.268) 11.204 3.946 ( 5.758 -6.926 0.487) 9.020 4.173 ( -1.271 0.707 0.424) 1.515 4.207 ( -0.613 1.216 -1.153) 1.784 4.441 ( 2.273 -0.141 -0.269) 2.293 4.563 ( 0.893 -2.707 5.150) 5.886 4.921 ( -1.165 -4.512 -2.601) 5.337 5.031 ( 0.951 -3.964 1.314) 4.283 6.765 ( 8.283 -1.857 -1.615) 8.641 6.807 ( 9.096 -1.517 -1.734) 9.383 7.368 ( -0.712 -5.441 -0.794) 5.545 7.723 ( 2.567 -2.134 -2.969) 4.468 8.055 ( 2.427 -3.073 -4.421) 5.906 8.251 ( 3.862 -6.182 7.556) 10.498 8.430 ( -2.558 -4.362 3.169) 5.968 8.716 ( 1.455 -1.626 -0.588) 2.260 8.928 ( -0.793 -8.567 -0.242) 8.607 9.251 ( -5.714 -10.905 5.305) 13.406 9.331 ( 8.051 0.118 1.380) 8.169 9.536 ( -0.696 -1.277 -2.157) 2.601 9.878 ( -6.417 4.504 -2.365) 8.189 9.960 ( -10.615 0.944 -5.646) 12.060 10.054 ( -7.639 -2.045 5.681) 9.737 10.220 ( 2.522 2.006 2.160) 3.879 10.446 ( -4.939 6.069 -6.784) 10.356 10.688 ( 0.772 3.608 0.019) 3.689 10.895 ( 2.295 2.215 4.111) 5.203 11.041 ( -6.903 -1.567 -5.092) 8.720 11.550 ( 5.115 -2.124 2.276) 5.988 11.782 ( -3.244 2.511 -2.190) 4.651 11.973 ( 7.145 -6.203 0.975) 9.512 12.314 ( 4.596 1.995 6.092) 7.888 12.883 ( -5.177 9.601 -0.410) 10.915 12.954 ( -1.421 8.853 -2.530) 9.317 13.467 ( 2.219 -6.758 -1.282) 7.227 13.709 ( 4.484 -3.281 -0.818) 5.616 13.886 ( 0.142 2.625 -0.302) 2.647 14.037 ( 3.464 -1.354 1.281) 3.934 15.178 ( -5.841 3.440 -1.507) 6.944 15.827 ( -9.346 -3.822 7.685) 12.689 15.923 ( -3.330 -7.331 1.907) 8.274 16.330 ( -3.976 12.453 -3.659) 13.574 16.604 ( 1.433 -6.716 3.713) 7.806 16.815 ( -4.879 -2.671 -1.566) 5.778 16.870 ( 3.643 2.117 -0.356) 4.228 17.608 ( -0.051 0.716 -3.260) 3.338 17.887 ( 4.163 8.364 -8.822) 12.849 18.150 ( 3.421 1.441 6.827) 7.771 18.616 ( -9.576 -2.508 -0.440) 9.909 20.141 ( 15.012 -12.996 0.690) 19.867 ======================= Grid point 229 (117/195) ======================= q-point: (-0.18 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( -6.401 14.723 3.667) 16.467 1.468 ( -15.180 17.616 1.475) 23.301 2.114 ( -8.556 7.556 0.994) 11.458 2.286 ( -14.680 13.146 6.552) 20.767 2.509 ( 10.346 0.521 -4.269) 11.205 2.766 ( -1.090 -5.775 -4.610) 7.469 2.862 ( 6.086 -1.340 6.420) 8.947 3.050 ( 1.739 -0.468 -0.592) 1.896 3.299 ( 9.225 -5.627 -2.079) 11.004 3.378 ( 2.006 -1.166 -1.543) 2.786 3.577 ( 6.668 -9.529 -0.175) 11.632 3.959 ( 2.507 -6.471 -4.764) 8.417 4.175 ( 0.809 -0.269 1.199) 1.471 4.281 ( 1.597 -0.723 5.516) 5.787 4.471 ( 1.132 -0.609 0.615) 1.425 4.576 ( -3.033 2.991 0.886) 4.351 4.919 ( 1.532 -6.241 1.611) 6.625 5.051 ( 0.230 -5.043 0.360) 5.061 6.899 ( 10.648 -4.545 -3.515) 12.100 6.962 ( 10.854 -4.791 -1.752) 11.993 7.362 ( 1.959 -3.695 -1.830) 4.565 7.695 ( 1.832 -1.179 -6.881) 7.217 8.069 ( 3.837 -4.097 -2.856) 6.298 8.405 ( 1.030 -3.664 4.543) 5.927 8.436 ( 2.084 -8.427 4.310) 9.692 8.696 ( -2.150 -2.915 -1.083) 3.780 8.947 ( -0.666 -5.234 1.678) 5.537 9.137 ( -12.050 -7.283 1.979) 14.218 9.414 ( -5.842 3.637 -4.125) 8.024 9.526 ( 4.296 -0.927 5.324) 6.904 9.601 ( -11.283 -0.807 2.525) 11.591 9.869 ( -6.505 -2.393 -0.947) 6.996 10.039 ( 0.352 1.853 3.821) 4.261 10.258 ( 1.887 5.818 -1.294) 6.252 10.357 ( 0.841 -1.965 -1.931) 2.880 10.738 ( 2.797 5.293 2.713) 6.572 10.848 ( -3.929 5.128 -4.253) 7.735 10.999 ( -0.006 0.070 2.017) 2.018 11.603 ( -0.685 1.251 1.915) 2.387 11.790 ( 1.773 -2.433 3.943) 4.961 12.053 ( 2.829 -6.069 -1.201) 6.803 12.442 ( 2.952 0.728 4.019) 5.039 12.785 ( -4.426 11.132 -2.918) 12.330 12.899 ( -1.315 8.526 -3.270) 9.226 13.521 ( 3.445 -5.569 1.984) 6.843 13.761 ( 3.677 -3.009 -1.982) 5.148 13.891 ( 1.892 2.707 -1.081) 3.475 14.098 ( 2.734 -0.916 -0.316) 2.901 15.108 ( -4.618 4.722 4.716) 8.115 15.632 ( -15.324 1.864 2.919) 15.710 15.903 ( -4.493 -6.210 3.414) 8.391 16.336 ( 6.753 2.561 -3.172) 7.888 16.642 ( 0.801 -4.998 -0.812) 5.127 16.691 ( -3.754 -5.827 -3.255) 7.658 16.953 ( 4.029 1.124 -0.405) 4.202 17.564 ( -3.854 -0.660 -0.799) 3.991 17.816 ( -4.202 5.198 -4.966) 8.327 18.042 ( -0.776 0.119 -14.963) 14.984 18.738 ( 4.497 7.263 18.743) 20.598 20.349 ( 10.535 -11.916 -3.231) 16.230 ======================= Grid point 230 (118/195) ======================= q-point: (-0.09 0.22 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( -4.919 18.776 8.742) 21.287 1.278 ( -11.730 16.068 9.081) 21.869 2.033 ( -2.635 6.540 3.745) 7.984 2.201 ( -9.466 17.713 14.351) 24.684 2.539 ( -0.381 -3.778 -11.568) 12.176 2.719 ( 5.674 -0.314 -1.909) 5.995 3.055 ( 4.391 -0.848 0.470) 4.497 3.057 ( 1.114 -2.032 6.936) 7.313 3.373 ( 1.945 -0.135 -3.175) 3.725 3.437 ( 7.143 -7.290 -2.757) 10.572 3.580 ( -0.405 -10.460 -7.264) 12.741 3.995 ( 3.818 -4.679 -0.006) 6.039 4.227 ( 1.408 0.427 2.486) 2.889 4.282 ( -3.225 0.202 -1.775) 3.687 4.498 ( 0.572 -1.884 0.668) 2.079 4.545 ( -1.799 2.901 2.658) 4.326 4.980 ( 1.476 -5.373 3.134) 6.393 5.053 ( -0.090 -5.834 0.191) 5.838 7.033 ( 9.640 -6.643 -4.449) 12.524 7.105 ( 7.192 -8.096 -1.989) 11.010 7.385 ( 1.862 -2.389 -0.569) 3.082 7.663 ( 4.796 -2.296 -7.911) 9.532 8.094 ( 4.057 -6.742 -3.734) 8.709 8.410 ( -1.175 0.537 2.407) 2.732 8.581 ( 6.144 -5.030 2.104) 8.214 8.647 ( -3.047 -7.280 -1.720) 8.077 8.791 ( -15.648 1.477 -3.664) 16.139 8.921 ( -11.311 -4.990 1.485) 12.452 9.308 ( -2.845 2.970 4.919) 6.412 9.577 ( -0.473 -2.994 6.424) 7.103 9.685 ( -2.008 -3.329 6.928) 7.944 9.757 ( 1.964 -1.521 -2.034) 3.211 10.093 ( 0.414 3.340 4.112) 5.314 10.298 ( 3.297 2.084 -0.836) 3.989 10.354 ( 0.463 -3.228 -2.104) 3.881 10.757 ( -1.772 9.302 -1.773) 9.634 10.846 ( 3.668 2.555 4.510) 6.350 10.994 ( -2.189 1.765 1.390) 3.137 11.627 ( 0.668 1.969 2.912) 3.579 11.853 ( -2.184 -1.685 4.884) 5.609 12.095 ( 4.585 -7.070 0.105) 8.427 12.486 ( -1.495 -2.797 0.385) 3.195 12.656 ( -4.483 12.792 -5.733) 14.718 12.836 ( 0.222 8.571 -5.112) 9.982 13.607 ( 1.356 -2.391 4.849) 5.574 13.812 ( 4.047 -4.047 -0.598) 5.754 13.926 ( 4.398 4.506 -2.739) 6.867 14.116 ( 0.953 0.070 -2.239) 2.434 15.097 ( -9.341 6.961 11.368) 16.277 15.480 ( -3.789 -0.805 3.270) 5.070 15.862 ( -3.799 -1.707 2.368) 4.791 16.390 ( 1.578 -5.981 -3.057) 6.900 16.617 ( 7.726 -2.234 -10.202) 12.991 16.670 ( -0.911 -8.918 3.100) 9.485 16.950 ( 0.002 -1.149 -7.147) 7.239 17.360 ( -15.525 -5.922 -4.007) 17.093 17.724 ( 2.041 5.894 -2.786) 6.832 17.947 ( 4.190 11.836 -9.677) 15.853 19.054 ( 3.773 5.277 21.331) 22.296 20.419 ( 4.871 -10.711 -7.566) 13.989 ======================= Grid point 231 (119/195) ======================= q-point: ( 0.00 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( -1.281 16.032 9.422) 18.640 1.635 ( 1.910 18.668 4.580) 19.316 2.097 ( 7.656 0.221 -2.657) 8.107 2.287 ( -5.914 5.562 -12.182) 14.640 2.554 ( -0.793 -3.079 7.238) 7.905 2.898 ( -0.305 8.185 6.622) 10.532 3.013 ( -2.608 -3.007 -2.162) 4.529 3.103 ( -2.537 -10.338 -10.021) 14.620 3.277 ( 5.578 7.969 7.575) 12.329 3.347 ( 0.297 -4.753 -0.046) 4.762 3.403 ( 1.769 -7.479 -0.839) 7.731 3.945 ( -0.075 -2.329 -2.802) 3.644 4.252 ( -2.700 3.832 0.730) 4.744 4.304 ( 1.180 0.036 3.555) 3.746 4.434 ( 1.693 -5.316 1.534) 5.787 4.521 ( -5.244 -1.633 -1.357) 5.657 4.932 ( 0.981 -4.419 2.871) 5.360 4.974 ( 0.107 -3.899 2.290) 4.522 6.947 ( 2.303 -8.318 -3.921) 9.480 6.966 ( 1.309 -7.616 -4.484) 8.935 7.347 ( -0.108 -2.310 -0.304) 2.332 7.506 ( 0.957 -7.110 -5.744) 9.190 8.169 ( 12.809 -0.981 -1.657) 12.953 8.261 ( -15.190 -4.069 -4.873) 16.463 8.474 ( 0.563 0.996 3.696) 3.869 8.599 ( -7.536 -2.257 -0.693) 7.897 8.665 ( -1.853 -0.588 0.490) 2.005 8.734 ( 4.143 -0.677 -0.754) 4.265 9.399 ( 1.638 -1.519 8.212) 8.511 9.552 ( 0.783 -8.009 3.264) 8.684 9.634 ( -0.255 2.846 3.436) 4.469 9.798 ( 2.904 -1.698 1.452) 3.664 10.120 ( -1.949 -0.635 -1.560) 2.576 10.218 ( -0.678 -3.797 -5.325) 6.575 10.538 ( 5.804 6.994 7.346) 11.686 10.793 ( -1.741 -1.302 1.127) 2.449 10.982 ( -2.210 5.717 3.393) 7.006 11.077 ( 0.669 3.142 0.933) 3.345 11.766 ( 4.596 2.867 5.523) 7.736 11.830 ( -3.564 0.627 1.046) 3.767 12.110 ( 6.871 -3.241 2.102) 7.882 12.286 ( -7.141 -6.699 -0.714) 9.818 12.745 ( -2.542 9.767 -8.468) 13.175 12.888 ( -1.580 4.338 -7.393) 8.716 13.724 ( 3.637 1.897 7.751) 8.770 13.824 ( 3.458 -2.366 4.013) 5.802 14.019 ( -0.480 3.058 -2.279) 3.844 14.091 ( -1.113 0.483 -3.071) 3.302 15.244 ( -4.813 9.637 7.117) 12.911 15.525 ( 4.541 -2.560 5.265) 7.409 15.887 ( -2.446 4.761 6.448) 8.380 16.184 ( -5.275 -5.549 -3.031) 8.234 16.482 ( 0.678 -8.393 -8.016) 11.626 16.540 ( 4.564 -7.542 -5.734) 10.516 16.812 ( 1.638 -1.477 -8.058) 8.354 16.942 ( -6.716 -7.492 -7.256) 12.405 17.954 ( 3.725 9.300 3.679) 10.672 18.134 ( 1.746 7.503 -1.617) 7.871 19.434 ( 0.444 7.298 13.513) 15.364 20.128 ( -1.157 -12.137 -8.503) 14.865 ======================= Grid point 232 (120/195) ======================= q-point: ( 0.09 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( 1.910 14.034 5.846) 15.323 1.778 ( 2.120 12.631 8.416) 15.325 2.067 ( 0.932 4.207 -12.314) 13.046 2.220 ( 8.918 4.153 -4.928) 11.003 2.596 ( -5.797 -6.192 4.629) 9.663 2.823 ( -5.385 -6.242 -3.110) 8.811 2.900 ( -6.682 -3.035 1.037) 7.412 3.077 ( 1.699 -1.582 0.013) 2.321 3.329 ( -0.232 -4.133 -2.442) 4.806 3.394 ( 1.768 -1.535 -0.851) 2.491 3.506 ( 2.649 3.628 13.351) 14.086 3.810 ( -5.162 3.273 -9.150) 11.004 4.263 ( -0.449 3.352 3.442) 4.825 4.342 ( -0.658 -0.695 -0.633) 1.148 4.407 ( -3.562 -3.851 0.800) 5.307 4.517 ( 3.789 -3.470 2.154) 5.571 4.948 ( -2.005 -3.557 1.305) 4.287 5.005 ( 0.550 -3.876 1.913) 4.357 6.874 ( -4.755 -6.317 -4.966) 9.337 6.897 ( -3.148 -7.848 -2.902) 8.940 7.353 ( 0.580 -1.852 1.027) 2.196 7.474 ( 1.321 -5.879 -5.216) 7.969 7.922 ( -12.945 -3.535 -4.549) 14.169 8.234 ( -8.232 -11.146 1.740) 13.965 8.510 ( -4.598 5.306 2.490) 7.449 8.613 ( 11.904 0.476 0.914) 11.949 8.707 ( 5.668 0.606 1.302) 5.847 8.820 ( 6.606 -4.225 -0.127) 7.843 9.534 ( 5.273 -2.260 2.140) 6.123 9.625 ( 4.534 -1.537 3.411) 5.878 9.697 ( 0.731 -0.933 4.167) 4.332 9.837 ( 0.937 -0.423 -0.765) 1.282 10.054 ( -3.393 -1.593 -0.767) 3.826 10.120 ( -2.932 -3.562 -5.135) 6.903 10.714 ( 2.374 4.176 5.410) 7.235 10.768 ( 0.067 1.549 -0.438) 1.611 10.981 ( -0.501 5.651 3.484) 6.658 11.132 ( 3.543 0.363 1.083) 3.722 11.735 ( -6.578 0.569 -0.160) 6.605 11.915 ( 4.438 1.548 2.377) 5.267 12.106 ( -10.552 -3.706 -2.599) 11.481 12.246 ( 3.761 -0.245 3.696) 5.279 12.705 ( 4.947 5.963 -0.111) 7.749 12.819 ( 3.651 1.458 -6.149) 7.298 13.829 ( -0.846 3.837 4.318) 5.838 13.901 ( 0.620 0.654 2.527) 2.683 13.932 ( -5.940 2.121 -1.491) 6.481 14.004 ( -3.304 0.194 -4.518) 5.601 15.295 ( -0.148 8.156 7.819) 11.300 15.669 ( 3.205 -6.372 4.855) 8.628 15.884 ( -0.089 6.766 -5.972) 9.025 16.111 ( -6.768 -5.566 11.163) 14.191 16.291 ( 0.642 -2.170 -17.169) 17.318 16.611 ( 0.465 -4.700 4.226) 6.338 16.805 ( 9.493 -8.032 -6.039) 13.823 16.919 ( 10.346 -9.155 -4.121) 14.417 17.996 ( -2.861 12.724 -0.402) 13.048 18.118 ( 0.021 9.643 -1.935) 9.835 19.570 ( -3.815 0.606 14.389) 14.899 19.946 ( -6.720 -9.734 -10.525) 15.833 ======================= Grid point 233 (121/195) ======================= q-point: ( 0.18 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.736 ( 1.705 8.149 0.361) 8.333 1.818 ( 1.311 6.541 -0.904) 6.732 2.041 ( 4.528 3.265 -5.248) 7.662 2.309 ( 3.006 6.827 -0.583) 7.482 2.424 ( -8.372 -4.621 -1.293) 9.650 2.728 ( -9.503 -1.046 1.109) 9.625 2.890 ( 0.106 -7.758 8.378) 11.419 3.068 ( -1.060 -4.505 -2.366) 5.198 3.281 ( -1.408 -4.487 -3.607) 5.927 3.408 ( 0.775 -2.978 -0.341) 3.096 3.598 ( -5.745 5.724 -7.094) 10.775 3.685 ( -1.082 1.521 8.613) 8.813 4.256 ( -2.277 0.376 -0.028) 2.308 4.299 ( 0.899 3.017 -0.480) 3.185 4.453 ( 2.670 -2.281 3.276) 4.802 4.611 ( 4.317 -2.192 1.793) 5.163 4.907 ( -2.944 -3.178 -0.511) 4.362 5.027 ( 0.256 -3.915 0.506) 3.956 6.713 ( -6.890 -4.660 -4.177) 9.308 6.792 ( -5.477 -6.156 -1.708) 8.415 7.336 ( -6.763 2.310 0.656) 7.176 7.434 ( 3.034 -3.702 -2.471) 5.387 7.778 ( -0.821 -9.320 -0.736) 9.385 8.082 ( -9.854 -15.409 1.899) 18.389 8.443 ( -4.676 2.441 1.256) 5.422 8.691 ( -1.164 -1.481 0.367) 1.919 8.932 ( 8.610 0.713 3.475) 9.313 8.995 ( 14.334 0.674 2.247) 14.525 9.587 ( -1.397 1.624 0.140) 2.146 9.660 ( -2.831 0.336 -3.900) 4.831 9.792 ( 6.631 -3.233 -0.197) 7.380 9.877 ( 7.577 -2.848 -0.665) 8.122 10.006 ( -2.653 -2.831 0.223) 3.886 10.029 ( -2.227 -2.755 0.780) 3.627 10.712 ( -0.023 2.452 -2.877) 3.780 10.799 ( 0.141 4.068 1.888) 4.487 11.071 ( 5.055 5.808 2.386) 8.061 11.199 ( 2.824 0.282 -0.080) 2.839 11.620 ( -6.320 -2.729 0.414) 6.896 11.834 ( -10.980 -8.495 -4.454) 14.580 11.998 ( 1.025 7.280 -0.308) 7.358 12.352 ( 1.440 0.735 5.346) 5.585 12.816 ( 7.654 4.258 -1.315) 8.857 12.928 ( 10.034 4.166 2.966) 11.262 13.742 ( -7.483 -1.538 -3.210) 8.286 13.793 ( -8.731 0.135 -3.365) 9.358 13.888 ( -1.713 3.470 -0.798) 3.951 13.963 ( -1.068 0.931 2.773) 3.113 15.372 ( -0.560 3.186 3.680) 4.899 15.701 ( -4.028 -9.068 2.038) 10.129 15.779 ( -1.111 4.485 -5.022) 6.824 16.163 ( -0.303 -5.463 -4.196) 6.896 16.237 ( 4.042 7.678 10.985) 13.998 16.667 ( 6.060 1.961 -1.039) 6.453 17.004 ( 15.461 -8.170 -3.712) 17.877 17.135 ( 15.894 -13.977 3.986) 21.538 17.850 ( -8.861 15.067 -5.251) 18.251 18.084 ( -2.228 8.829 -2.303) 9.392 19.633 ( -7.775 -5.019 12.994) 15.953 19.665 ( -10.647 -6.968 -11.083) 16.874 ======================= Grid point 234 (122/195) ======================= q-point: ( 0.27 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -1.339 4.541 -8.408) 9.649 1.897 ( 6.222 1.623 1.117) 6.527 2.035 ( 0.471 1.351 -2.691) 3.048 2.182 ( -7.903 -1.366 -0.247) 8.024 2.482 ( 2.590 5.706 5.449) 8.304 2.575 ( -9.811 -0.798 3.391) 10.411 2.969 ( -1.961 -5.768 4.298) 7.456 3.004 ( -4.555 -5.941 1.246) 7.589 3.199 ( -2.853 -4.857 -3.366) 6.562 3.392 ( -2.680 -3.373 -3.547) 5.580 3.451 ( -0.180 7.280 -3.359) 8.019 3.680 ( -5.214 -3.202 1.816) 6.382 4.277 ( 1.394 3.804 1.209) 4.228 4.318 ( 2.923 1.759 -0.180) 3.416 4.530 ( 4.015 -1.423 -0.907) 4.355 4.700 ( 3.054 -2.829 1.906) 4.579 4.846 ( -2.081 -2.032 -1.931) 3.491 5.025 ( 0.068 -4.078 -1.315) 4.286 6.568 ( -5.318 -3.031 -1.639) 6.337 6.678 ( -5.677 -3.953 -0.920) 6.978 7.230 ( -4.637 2.615 1.104) 5.436 7.487 ( 2.753 -2.710 1.170) 4.036 7.798 ( 1.190 -9.336 0.282) 9.415 7.976 ( -5.953 -15.440 5.183) 17.341 8.395 ( -2.168 -1.955 0.498) 2.962 8.649 ( -3.618 -5.077 0.014) 6.235 9.025 ( 2.960 4.216 -2.180) 5.593 9.279 ( 9.866 2.330 6.413) 11.995 9.489 ( -8.061 0.537 -0.837) 8.122 9.538 ( -1.662 1.181 -8.254) 8.502 9.876 ( 3.902 -1.778 -1.774) 4.640 9.921 ( -1.684 -2.088 -1.638) 3.143 9.991 ( 0.188 -3.723 5.415) 6.574 10.168 ( 13.696 -6.395 1.004) 15.149 10.681 ( 2.431 4.120 -5.643) 7.398 10.834 ( 1.283 5.611 2.641) 6.333 11.157 ( 4.176 5.071 -2.168) 6.918 11.193 ( -0.392 1.589 -5.126) 5.381 11.548 ( -4.023 -4.405 2.141) 6.338 11.618 ( -9.367 -8.338 -0.670) 12.558 12.023 ( 2.188 5.769 -0.454) 6.187 12.394 ( -1.883 -1.188 2.721) 3.516 12.964 ( 8.801 8.273 0.928) 12.114 13.111 ( 6.917 6.587 0.676) 9.575 13.537 ( -8.747 -3.706 -6.175) 11.330 13.651 ( -3.711 -4.754 -0.143) 6.032 13.837 ( -2.967 3.349 -0.375) 4.490 13.965 ( -2.349 -0.590 2.008) 3.146 15.337 ( -1.928 0.412 -3.629) 4.130 15.617 ( -9.309 -8.006 4.666) 13.134 15.799 ( 4.121 1.615 3.120) 5.416 16.124 ( -1.122 -5.054 -0.453) 5.196 16.501 ( 8.646 13.728 13.647) 21.201 16.802 ( 10.950 5.047 -1.621) 12.166 17.193 ( 14.950 -5.703 -8.631) 18.180 17.520 ( 14.129 -13.792 10.170) 22.210 17.613 ( -7.754 12.422 -4.513) 15.323 17.975 ( -5.120 6.763 -5.267) 9.985 19.334 ( -12.164 -4.442 -11.049) 17.023 19.607 ( -11.143 -9.205 10.038) 17.597 ======================= Grid point 235 (123/195) ======================= q-point: ( 0.36 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -0.235 1.134 -9.938) 10.005 1.848 ( -8.706 -0.801 -5.266) 10.206 2.120 ( -2.294 0.769 4.449) 5.064 2.152 ( 11.528 -1.932 3.921) 12.329 2.443 ( -6.836 2.898 2.274) 7.765 2.606 ( 1.548 -0.808 5.684) 5.946 2.894 ( -8.459 -2.399 2.521) 9.147 2.947 ( -6.718 -5.706 2.614) 9.193 3.131 ( -1.516 -4.918 -2.309) 5.641 3.303 ( -0.582 1.619 -2.425) 2.973 3.470 ( 2.038 3.602 0.074) 4.139 3.621 ( -2.608 -3.060 0.897) 4.119 4.276 ( 0.928 3.109 -3.345) 4.661 4.383 ( 2.069 1.410 0.583) 2.571 4.560 ( 3.731 -1.452 -5.397) 6.720 4.729 ( -0.490 -5.058 -1.685) 5.354 4.803 ( 0.007 0.285 -1.978) 1.999 5.006 ( 0.184 -4.703 -1.855) 5.059 6.505 ( -1.886 -1.446 1.458) 2.789 6.590 ( -3.859 -1.703 0.348) 4.233 7.216 ( -0.438 1.221 3.402) 3.641 7.529 ( -0.286 -4.129 1.434) 4.380 7.796 ( -0.540 -7.258 0.551) 7.299 8.025 ( 0.174 -12.563 9.681) 15.861 8.359 ( -2.511 -4.882 -1.059) 5.591 8.581 ( -2.857 -7.000 -1.029) 7.630 9.029 ( 2.421 5.432 -3.728) 7.019 9.297 ( -7.976 4.029 -1.068) 9.000 9.388 ( -4.000 1.329 -8.321) 9.327 9.505 ( 5.108 -4.448 2.458) 7.206 9.826 ( -3.004 -0.916 -0.309) 3.156 9.983 ( 1.687 -3.159 4.824) 6.008 10.064 ( 4.446 0.849 1.149) 4.670 10.410 ( 11.374 -6.958 0.684) 13.351 10.658 ( 3.485 3.441 -7.591) 9.034 10.913 ( 2.171 3.204 5.127) 6.424 11.094 ( 0.196 3.932 -7.574) 8.536 11.169 ( 1.590 4.180 -5.017) 6.721 11.442 ( -5.951 -5.841 -2.835) 8.807 11.553 ( -4.246 -5.996 4.424) 8.576 12.053 ( 2.351 5.366 -1.272) 5.995 12.369 ( -3.342 -0.933 1.129) 3.649 13.077 ( 3.124 8.615 -0.844) 9.203 13.188 ( 4.728 5.628 -2.362) 7.721 13.371 ( -2.584 -4.934 -3.282) 6.464 13.614 ( -3.384 -2.206 0.119) 4.041 13.814 ( -0.203 0.685 2.288) 2.397 13.933 ( -2.686 -2.863 0.929) 4.034 15.284 ( 0.931 0.460 -2.718) 2.909 15.520 ( -8.463 -7.286 5.530) 12.462 15.942 ( 4.277 -1.606 7.580) 8.851 16.104 ( -2.786 -5.188 2.834) 6.535 16.804 ( 6.486 17.868 11.841) 22.395 16.992 ( 13.354 8.535 -1.739) 15.943 17.256 ( 4.425 5.574 -12.469) 14.357 17.421 ( -3.569 2.468 1.906) 4.739 17.782 ( -4.431 0.379 -8.457) 9.555 17.968 ( 14.017 -10.735 11.088) 20.849 19.014 ( -9.202 -4.015 -10.351) 14.420 19.488 ( -13.339 -12.140 5.587) 18.882 ======================= Grid point 236 (124/195) ======================= q-point: ( 0.45 0.33 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( 6.829 -2.641 -8.860) 11.494 1.610 ( -7.352 -1.870 -8.556) 11.435 2.177 ( -0.207 2.386 6.697) 7.113 2.319 ( -2.706 -3.829 5.398) 7.150 2.472 ( 10.528 5.605 2.040) 12.100 2.646 ( -4.550 -4.275 3.168) 7.001 2.787 ( -6.118 -2.876 4.057) 7.884 2.893 ( -2.586 -4.112 3.381) 5.919 3.091 ( 0.750 0.463 -1.561) 1.792 3.299 ( 1.043 -1.504 -1.862) 2.610 3.494 ( -0.397 2.165 0.999) 2.417 3.618 ( -0.758 0.614 3.373) 3.511 4.241 ( -0.896 1.702 -2.432) 3.101 4.382 ( 1.184 1.358 -4.458) 4.808 4.532 ( 1.459 -2.105 -7.234) 7.673 4.645 ( -2.568 -3.133 -7.419) 8.453 4.807 ( 1.275 -1.754 0.777) 2.304 4.988 ( 0.008 -5.326 -1.910) 5.658 6.527 ( 0.696 -0.224 3.051) 3.138 6.563 ( -0.431 -0.111 1.655) 1.714 7.274 ( 0.512 -0.423 5.105) 5.148 7.514 ( -1.325 -6.655 -0.238) 6.790 7.820 ( -0.171 -3.167 4.012) 5.114 8.156 ( -0.569 -12.596 10.870) 16.648 8.283 ( -1.769 -3.143 -3.539) 5.053 8.550 ( 0.558 -7.877 -1.122) 7.976 9.016 ( 2.085 4.600 -6.193) 7.992 9.161 ( -5.310 3.071 -2.262) 6.538 9.241 ( -3.638 1.242 -3.039) 4.900 9.542 ( 2.542 -9.928 -6.481) 12.125 9.833 ( 0.612 2.589 5.077) 5.732 10.040 ( -0.781 -3.693 4.608) 5.956 10.174 ( 2.819 5.938 4.355) 7.885 10.546 ( 4.398 -5.968 -0.587) 7.437 10.616 ( 2.868 2.290 -7.931) 8.739 10.937 ( -4.947 -2.339 -0.006) 5.472 11.060 ( 1.079 1.321 -5.375) 5.639 11.148 ( 4.224 7.171 -2.163) 8.599 11.341 ( 0.363 -4.683 -3.535) 5.879 11.505 ( -5.035 -5.417 1.089) 7.475 12.081 ( 2.677 6.241 -0.668) 6.824 12.306 ( -4.263 1.233 -0.948) 4.538 13.103 ( 2.109 5.160 -0.153) 5.577 13.240 ( 5.145 2.963 -1.587) 6.146 13.344 ( 0.989 -4.104 -2.584) 4.950 13.509 ( -6.704 -1.692 -2.630) 7.398 13.847 ( 0.033 1.057 3.116) 3.291 13.931 ( 0.063 -1.359 2.290) 2.664 15.310 ( 3.629 -0.915 0.238) 3.750 15.462 ( -4.822 -6.997 3.762) 9.293 16.065 ( -4.239 -2.178 8.358) 9.622 16.141 ( 2.942 -4.165 7.949) 9.444 16.880 ( -5.479 15.337 -0.352) 16.290 17.103 ( 5.746 6.994 -6.104) 10.917 17.328 ( 2.186 8.411 -3.869) 9.513 17.405 ( 2.891 9.836 10.367) 14.580 17.639 ( 2.690 -6.026 -9.067) 11.215 18.233 ( 1.158 -0.867 4.982) 5.188 18.869 ( 6.387 -12.613 -4.441) 14.819 19.289 ( -13.413 -13.710 0.330) 19.183 ======================= Grid point 237 (125/195) ======================= q-point: (-0.45 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( 0.858 -0.772 -8.970) 9.044 1.598 ( 16.405 -4.395 -7.126) 18.418 2.208 ( -4.201 5.869 5.294) 8.951 2.369 ( 0.825 -0.913 6.172) 6.293 2.555 ( -7.701 -2.261 3.731) 8.851 2.647 ( 6.029 3.594 0.276) 7.025 2.786 ( -1.697 -3.978 3.554) 5.598 2.938 ( 3.598 -4.378 2.299) 6.115 3.124 ( 2.739 1.742 -0.195) 3.252 3.268 ( 0.422 -5.603 -4.543) 7.226 3.480 ( -3.852 3.211 2.785) 5.736 3.658 ( 0.463 4.239 3.445) 5.482 4.211 ( -0.569 -1.031 1.190) 1.674 4.351 ( 1.304 0.561 -4.066) 4.306 4.429 ( -3.566 -4.009 -7.070) 8.876 4.507 ( -0.433 0.031 -9.912) 9.921 4.853 ( 1.665 -3.575 2.209) 4.520 4.957 ( -0.516 -5.206 -2.607) 5.845 6.583 ( 1.995 0.617 2.514) 3.268 6.611 ( 3.317 0.235 1.420) 3.616 7.322 ( -2.591 -2.079 5.000) 6.003 7.513 ( 2.838 -7.837 -1.160) 8.415 7.875 ( -1.130 0.238 7.350) 7.440 8.174 ( -1.501 -6.730 -0.853) 6.947 8.301 ( -0.018 -5.385 5.143) 7.446 8.551 ( 0.889 -9.819 -1.777) 10.018 8.961 ( 0.088 1.261 -4.314) 4.495 9.056 ( -2.280 -0.174 -4.321) 4.889 9.214 ( 1.069 1.975 0.644) 2.336 9.500 ( 3.541 -8.392 -7.627) 11.881 9.929 ( 1.841 2.887 5.884) 6.808 10.077 ( 0.056 0.318 2.831) 2.849 10.217 ( -3.457 5.361 3.944) 7.500 10.509 ( -4.883 -3.982 -3.646) 7.280 10.641 ( 4.201 -0.643 0.185) 4.254 10.794 ( -5.354 -5.425 -5.781) 9.567 10.965 ( -4.615 7.244 -4.324) 9.616 11.220 ( 8.487 3.160 -3.412) 9.678 11.326 ( -5.565 -6.898 -0.318) 8.868 11.499 ( 7.545 -3.874 0.001) 8.482 12.139 ( 2.946 6.035 2.083) 7.031 12.197 ( -5.421 4.469 -3.308) 7.765 13.137 ( -0.697 4.856 1.297) 5.075 13.282 ( 2.103 3.914 -3.966) 5.956 13.343 ( -7.097 -5.449 -3.686) 9.677 13.383 ( 7.170 -6.308 0.314) 9.555 13.903 ( 1.287 2.329 3.541) 4.429 13.950 ( -0.479 1.520 1.101) 1.937 15.389 ( 1.234 -3.073 1.877) 3.806 15.445 ( 2.397 -5.012 -0.009) 5.556 16.069 ( -7.113 1.496 10.289) 12.597 16.300 ( 1.420 -4.535 9.944) 11.022 16.766 ( -3.559 7.977 -1.624) 8.885 17.090 ( -2.531 1.734 -14.658) 14.975 17.103 ( -10.148 9.066 3.335) 14.011 17.592 ( -0.272 -8.870 -0.435) 8.885 17.778 ( 15.052 18.524 9.204) 25.582 18.158 ( -4.140 6.491 -6.009) 9.766 18.977 ( -8.120 -14.260 -2.286) 16.568 19.174 ( 13.692 -17.524 0.944) 22.259 ======================= Grid point 238 (126/195) ======================= q-point: (-0.36 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( 6.771 4.745 -7.287) 11.021 1.852 ( 20.076 -3.832 -5.770) 21.237 2.181 ( -5.769 12.423 3.856) 14.230 2.412 ( -2.677 -0.514 6.245) 6.814 2.564 ( 2.557 -4.076 2.413) 5.383 2.712 ( -0.578 -2.566 2.305) 3.497 2.751 ( -1.313 1.363 -1.022) 2.151 3.011 ( 1.679 -1.102 -4.180) 4.637 3.133 ( 2.474 -3.549 0.415) 4.346 3.269 ( 3.250 -5.622 -1.941) 6.778 3.396 ( -8.648 7.980 1.322) 11.841 3.742 ( 4.236 1.430 4.300) 6.203 4.254 ( 0.151 -1.205 1.410) 1.861 4.267 ( -3.398 -0.260 -4.769) 5.862 4.363 ( 1.942 -4.661 1.194) 5.189 4.412 ( 0.813 -1.400 -5.766) 5.989 4.898 ( 0.073 -4.516 -0.489) 4.543 4.917 ( 0.181 -3.934 -0.704) 4.001 6.653 ( 4.315 0.128 -0.019) 4.317 6.690 ( 4.925 -0.212 -0.338) 4.941 7.309 ( -2.723 -2.598 1.900) 4.216 7.573 ( 3.940 -8.404 0.023) 9.282 7.959 ( 0.390 1.264 7.925) 8.034 8.153 ( 1.581 -0.931 -3.981) 4.383 8.329 ( -3.432 -6.357 5.724) 9.217 8.546 ( 2.795 -11.463 -2.634) 12.089 8.900 ( -3.817 -1.247 -2.557) 4.761 9.022 ( 0.406 -6.922 1.811) 7.166 9.268 ( 5.081 3.557 -0.573) 6.229 9.498 ( 4.822 -4.019 -5.437) 8.305 9.991 ( -0.450 3.731 1.842) 4.185 10.108 ( 0.183 2.258 -0.595) 2.342 10.174 ( -6.491 1.237 5.406) 8.538 10.307 ( -13.343 -1.622 -2.574) 13.685 10.650 ( 0.108 -1.272 -8.423) 8.520 10.745 ( 1.557 -3.880 5.232) 6.697 10.847 ( -2.734 8.194 -2.473) 8.985 11.179 ( -7.715 -3.871 -2.494) 8.985 11.369 ( 10.852 1.371 -1.173) 11.001 11.672 ( 9.857 -5.960 0.906) 11.554 12.045 ( -6.717 7.367 -3.278) 10.495 12.229 ( 2.951 3.109 3.771) 5.710 13.077 ( -5.272 1.846 -0.408) 5.601 13.187 ( -5.601 2.291 -1.367) 6.204 13.323 ( 5.340 -2.450 -3.403) 6.790 13.527 ( 7.628 -4.040 0.911) 8.680 13.935 ( -0.486 2.200 0.449) 2.297 13.965 ( 1.037 0.603 1.197) 1.695 15.363 ( -0.968 2.641 -3.252) 4.300 15.558 ( 6.092 -6.669 2.766) 9.447 16.043 ( -10.923 3.448 10.327) 15.422 16.398 ( -0.709 -6.479 5.575) 8.576 16.718 ( -2.836 5.276 -3.016) 6.706 16.856 ( -6.795 6.398 1.818) 9.509 16.980 ( -7.117 2.248 -4.263) 8.595 17.566 ( -1.987 -8.531 0.801) 8.796 18.009 ( 0.574 4.149 -6.839) 8.019 18.143 ( 8.253 16.154 7.869) 19.773 18.736 ( -6.558 -7.136 -8.504) 12.894 19.519 ( 18.615 -18.096 3.414) 26.184 ======================= Grid point 239 (127/195) ======================= q-point: (-0.27 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( 5.138 13.074 -3.830) 14.560 1.990 ( -3.894 9.005 -3.481) 10.410 2.181 ( 8.976 5.249 -2.785) 10.765 2.458 ( -0.005 -0.893 -1.789) 1.999 2.531 ( -4.116 -3.598 3.925) 6.729 2.713 ( -0.229 0.074 -2.410) 2.422 2.823 ( 3.021 -2.706 8.879) 9.761 2.975 ( 3.232 6.734 -2.458) 7.863 3.212 ( -1.376 -1.558 -4.069) 4.569 3.251 ( 3.945 -6.395 1.720) 7.708 3.330 ( -0.555 0.523 1.923) 2.069 3.837 ( 2.936 -4.748 -1.877) 5.890 4.202 ( -1.409 1.200 -1.776) 2.565 4.218 ( -0.194 1.334 1.209) 1.811 4.398 ( 0.890 -4.248 -0.404) 4.359 4.494 ( 3.918 -4.681 7.944) 10.018 4.845 ( -1.108 -2.677 -3.639) 4.652 4.944 ( 0.329 -4.704 1.271) 4.884 6.730 ( 6.690 -1.457 -2.960) 7.459 6.770 ( 6.227 -2.184 -2.185) 6.951 7.294 ( 0.072 -1.671 -0.008) 1.673 7.626 ( 2.209 -8.229 -0.613) 8.543 8.043 ( 3.481 1.892 -3.791) 5.483 8.135 ( -0.085 -4.000 3.793) 5.513 8.344 ( -1.391 -4.398 3.751) 5.945 8.622 ( 7.383 -9.480 0.230) 12.018 8.802 ( -4.410 -1.878 -0.325) 4.805 9.044 ( -4.258 -9.720 5.538) 11.970 9.376 ( 7.450 3.496 0.391) 8.239 9.521 ( 2.738 -0.722 -2.699) 3.912 9.946 ( -10.773 2.037 -2.672) 11.285 9.966 ( -14.111 -0.201 -3.169) 14.464 10.042 ( -3.919 1.280 4.309) 5.964 10.223 ( 2.192 -1.340 -0.228) 2.579 10.551 ( -1.448 4.777 -7.087) 8.668 10.766 ( -2.390 2.831 3.710) 5.243 10.904 ( 4.597 -0.648 3.981) 6.116 11.028 ( -5.462 -0.026 -2.438) 5.982 11.532 ( 7.948 0.908 0.050) 8.000 11.789 ( 2.562 -4.011 -3.573) 5.952 11.947 ( -0.645 5.339 1.545) 5.596 12.320 ( 1.949 -1.726 4.218) 4.956 13.013 ( -2.353 3.279 2.347) 4.669 13.107 ( -2.317 5.881 -1.371) 6.468 13.360 ( 3.866 -2.385 -3.741) 5.885 13.642 ( 4.334 -3.649 0.336) 5.676 13.924 ( -0.183 1.346 -0.982) 1.676 14.005 ( 2.995 -1.837 0.500) 3.550 15.299 ( -0.752 8.099 -4.560) 9.325 15.690 ( 3.960 -7.047 4.297) 9.154 15.913 ( -15.706 3.213 6.453) 17.281 16.404 ( -0.220 -7.976 -1.626) 8.144 16.613 ( -6.761 9.283 2.246) 11.702 16.785 ( -7.994 -0.374 -4.188) 9.032 16.897 ( 2.726 2.491 4.083) 5.505 17.556 ( -3.448 -6.858 4.532) 8.914 17.931 ( 1.785 0.051 -8.105) 8.299 18.170 ( -7.507 -3.079 -5.458) 9.779 18.734 ( 10.767 15.303 2.493) 18.877 19.848 ( 15.823 -17.062 1.387) 23.311 ======================= Grid point 240 (128/195) ======================= q-point: (-0.18 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 0.255 18.189 1.370) 18.243 1.799 ( -9.361 15.684 -4.873) 18.903 2.157 ( -3.648 -1.077 -6.839) 7.825 2.473 ( 2.381 -3.819 -2.484) 5.140 2.559 ( -1.183 10.257 11.521) 15.470 2.711 ( 1.072 0.915 -3.423) 3.702 2.937 ( 0.018 7.694 9.032) 11.865 3.040 ( 4.750 0.710 -3.789) 6.118 3.190 ( 6.539 -4.570 -2.871) 8.478 3.338 ( 0.929 -3.615 -0.797) 3.816 3.370 ( 4.624 -10.088 0.588) 11.113 3.823 ( 2.013 -7.746 -3.514) 8.740 4.173 ( -0.244 -0.191 1.391) 1.425 4.288 ( 0.626 1.218 4.860) 5.049 4.421 ( 0.888 -3.548 1.145) 3.832 4.614 ( -0.122 -0.500 4.640) 4.668 4.806 ( 1.277 -3.785 -1.088) 4.140 4.950 ( -0.668 -5.184 0.552) 5.256 6.815 ( 8.792 -3.721 -5.105) 10.826 6.858 ( 7.058 -5.368 -2.349) 9.173 7.314 ( 2.448 -0.868 -0.660) 2.680 7.627 ( 0.480 -6.482 -3.074) 7.191 8.003 ( 2.354 -2.167 -7.117) 7.803 8.237 ( 4.475 -8.560 2.291) 9.927 8.386 ( 3.031 0.498 2.897) 4.222 8.680 ( -2.300 0.203 0.048) 2.309 8.827 ( 3.617 -6.645 3.978) 8.548 8.989 ( -9.663 -7.439 5.147) 13.237 9.481 ( -4.747 2.841 -1.818) 5.823 9.528 ( 5.699 1.036 3.668) 6.856 9.597 ( -16.985 0.474 -0.663) 17.005 9.796 ( -7.395 -4.626 -0.311) 8.728 10.083 ( 2.716 2.442 1.797) 4.070 10.250 ( 2.865 -3.327 -2.602) 5.103 10.445 ( -2.676 7.635 -3.422) 8.784 10.790 ( -1.644 -1.036 3.901) 4.358 10.927 ( -0.385 3.675 -0.815) 3.784 11.037 ( 1.572 3.139 4.361) 5.598 11.624 ( 2.697 0.969 0.018) 2.866 11.758 ( 0.439 -1.417 -0.360) 1.526 11.994 ( 2.083 0.739 0.138) 2.215 12.383 ( 0.029 -5.936 2.971) 6.638 13.033 ( -1.329 12.799 0.138) 12.868 13.049 ( -0.290 7.466 -2.973) 8.042 13.406 ( 4.820 -6.096 1.043) 7.841 13.672 ( 0.517 -6.245 -0.902) 6.331 13.938 ( 3.423 2.253 -0.610) 4.143 14.072 ( 3.748 -1.769 0.002) 4.144 15.251 ( -0.006 9.272 -1.729) 9.432 15.668 ( -13.653 -0.972 0.731) 13.707 15.804 ( -3.117 0.332 9.907) 10.391 16.397 ( 2.514 -2.774 -3.304) 4.993 16.500 ( -8.230 -3.241 1.395) 8.955 16.632 ( -1.352 -1.901 -7.678) 8.025 16.986 ( 1.866 3.193 1.269) 3.910 17.496 ( -10.551 -6.942 2.005) 12.788 17.846 ( -2.538 0.470 -5.646) 6.208 18.023 ( 4.511 -2.689 -6.962) 8.720 18.996 ( 9.630 17.978 8.682) 22.165 20.079 ( 11.090 -15.749 -1.865) 19.352 ======================= Grid point 241 (129/195) ======================= q-point: (-0.09 0.33 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -4.412 17.198 7.493) 19.271 1.633 ( -3.259 20.239 -2.430) 20.643 2.053 ( 0.053 -1.840 -2.957) 3.483 2.490 ( -0.130 -1.209 3.396) 3.607 2.527 ( -8.193 8.245 -4.701) 12.538 2.772 ( 5.467 8.320 4.854) 11.076 3.045 ( -0.842 -0.151 1.366) 1.612 3.085 ( 5.263 6.303 5.552) 9.912 3.255 ( 4.490 -10.340 -8.418) 14.069 3.331 ( 1.172 -4.797 -2.111) 5.370 3.394 ( 1.082 -7.981 -2.173) 8.342 3.884 ( 4.712 -7.174 2.356) 8.900 4.223 ( 1.518 -0.624 4.412) 4.707 4.312 ( -2.433 2.129 1.410) 3.527 4.425 ( -0.568 -3.877 -0.843) 4.008 4.602 ( -3.477 1.645 0.649) 3.901 4.864 ( 2.782 -5.399 2.591) 6.603 4.950 ( -0.351 -4.769 1.614) 5.047 6.906 ( 8.297 -6.062 -5.321) 11.572 6.942 ( 5.579 -7.934 -2.686) 10.064 7.345 ( 1.442 -1.361 -0.655) 2.089 7.576 ( -0.649 -6.643 -5.119) 8.412 8.009 ( 8.429 -1.393 -5.605) 10.218 8.323 ( 4.934 -10.367 -0.485) 11.491 8.502 ( 2.693 2.900 3.083) 5.017 8.638 ( -2.089 1.766 0.663) 2.814 8.805 ( -13.569 -0.776 -0.919) 13.622 8.822 ( -8.620 -4.590 0.261) 9.769 9.340 ( -5.806 0.368 5.105) 7.740 9.484 ( -2.889 -5.530 6.917) 9.315 9.657 ( -0.509 -0.105 1.831) 1.903 9.718 ( 2.143 -1.990 -0.213) 2.932 10.136 ( 1.140 1.467 0.413) 1.903 10.258 ( 2.086 -3.805 -3.737) 5.726 10.416 ( 1.102 6.924 2.018) 7.296 10.792 ( -1.575 -4.189 2.745) 5.250 10.956 ( 0.312 7.802 3.284) 8.471 11.075 ( -0.959 4.930 1.718) 5.308 11.662 ( 2.018 1.542 1.944) 3.198 11.812 ( 2.006 -2.982 3.564) 5.061 12.018 ( 2.291 0.006 -0.649) 2.381 12.378 ( -3.176 -7.308 0.458) 7.981 12.911 ( -3.279 12.171 -9.027) 15.504 13.009 ( -2.754 8.902 -4.457) 10.330 13.552 ( 5.268 -3.284 7.336) 9.610 13.711 ( 3.980 -6.168 2.267) 7.683 14.002 ( 4.090 3.338 -1.093) 5.391 14.113 ( 1.651 -0.449 -1.426) 2.228 15.256 ( -1.990 8.977 3.746) 9.929 15.482 ( -7.298 0.533 2.555) 7.751 15.853 ( -4.690 1.677 9.815) 11.007 16.324 ( -3.367 -1.133 -7.113) 7.951 16.460 ( -0.987 -12.076 4.208) 12.826 16.564 ( 6.537 -3.619 -11.665) 13.853 16.943 ( -2.173 0.785 -7.769) 8.105 17.227 ( -15.107 -7.476 -5.877) 17.851 17.840 ( 4.610 6.096 0.884) 7.694 18.084 ( 5.126 2.104 -0.741) 5.591 19.241 ( 5.057 13.768 11.344) 18.542 20.177 ( 5.124 -14.131 -5.416) 15.978 ======================= Grid point 242 (130/195) ======================= q-point: ( 0.00 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( 0.765 10.267 5.492) 11.669 1.907 ( 0.313 3.774 0.003) 3.787 2.148 ( 7.976 8.885 2.108) 12.125 2.385 ( 1.883 -12.078 2.953) 12.575 2.472 ( -7.265 13.263 -12.057) 19.340 2.767 ( -5.831 -15.965 -11.775) 20.677 3.037 ( -0.745 5.585 1.864) 5.935 3.084 ( -0.394 1.909 -1.341) 2.366 3.230 ( 1.095 -4.799 -0.542) 4.952 3.262 ( 1.670 -6.469 -2.511) 7.137 3.551 ( 3.476 16.846 10.986) 20.410 3.833 ( 2.382 -10.623 6.086) 12.473 4.299 ( 0.946 0.856 3.615) 3.834 4.323 ( -0.035 -0.629 3.599) 3.654 4.371 ( -2.347 2.559 -1.881) 3.950 4.461 ( -5.832 -4.539 -3.179) 8.045 4.886 ( 0.921 -0.230 3.556) 3.681 4.911 ( 0.351 -2.473 2.871) 3.806 6.828 ( 1.819 -2.992 -4.491) 5.695 6.844 ( 2.328 -4.306 -5.197) 7.139 7.330 ( 0.396 0.968 -2.162) 2.402 7.387 ( 0.601 -4.795 -4.046) 6.303 8.161 ( 3.968 0.343 -0.506) 4.015 8.191 ( -5.573 -2.789 -1.197) 6.346 8.493 ( -1.606 1.656 -0.290) 2.325 8.542 ( -4.277 -3.227 -1.458) 5.553 8.702 ( -2.702 3.346 0.559) 4.337 8.741 ( 1.610 -0.281 -0.421) 1.687 9.368 ( 1.599 -0.596 6.532) 6.751 9.411 ( 2.236 -5.305 5.208) 7.763 9.704 ( 1.137 3.599 2.603) 4.585 9.762 ( 2.471 -2.296 2.384) 4.130 10.121 ( -2.025 0.840 -3.246) 3.917 10.155 ( -1.278 -2.617 -4.695) 5.525 10.657 ( 3.952 5.155 6.271) 9.029 10.740 ( 0.795 -3.533 4.313) 5.632 11.077 ( -2.251 3.505 1.224) 4.341 11.112 ( -1.996 0.039 0.568) 2.075 11.809 ( 5.680 1.958 3.371) 6.889 11.838 ( 1.195 -0.547 1.752) 2.189 12.092 ( 1.774 1.652 2.274) 3.324 12.165 ( -4.754 -5.443 0.645) 7.255 12.891 ( -3.980 5.173 -9.928) 11.881 12.939 ( -4.242 0.343 -9.344) 10.268 13.753 ( 5.644 1.325 9.165) 10.844 13.783 ( 5.080 -1.832 7.641) 9.357 14.068 ( -1.421 1.916 -1.617) 2.882 14.092 ( -1.398 -0.534 -2.049) 2.537 15.406 ( -0.861 6.322 2.304) 6.784 15.483 ( 1.883 -2.293 2.858) 4.120 15.991 ( -5.338 6.223 12.743) 15.153 16.116 ( -5.480 -4.369 -0.619) 7.036 16.334 ( 3.258 -2.138 -4.261) 5.774 16.411 ( 6.410 -6.719 -13.834) 16.661 16.797 ( -2.385 0.143 -8.637) 8.961 16.831 ( -6.185 -3.678 -8.326) 11.005 18.110 ( 4.100 6.545 5.350) 9.395 18.191 ( 3.250 -1.250 3.587) 5.000 19.627 ( -0.509 12.148 3.526) 12.660 19.879 ( -1.066 -13.341 -3.827) 13.920 ======================= Grid point 243 (131/195) ======================= q-point: ( 0.09 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.880 ( 0.841 9.146 2.536) 9.528 1.958 ( 2.746 2.635 1.421) 4.063 2.216 ( -5.341 10.628 -10.546) 15.897 2.335 ( 8.988 9.309 2.750) 13.229 2.418 ( -4.599 -10.400 -2.590) 11.662 2.586 ( 1.093 -14.405 -1.313) 14.506 2.960 ( -7.520 5.347 -0.326) 9.233 3.051 ( -3.435 -2.542 -0.559) 4.309 3.229 ( 0.583 -2.844 -1.534) 3.284 3.274 ( 1.254 -6.215 -0.315) 6.348 3.714 ( 0.440 11.783 9.209) 14.961 3.855 ( -3.938 -1.465 -1.071) 4.336 4.300 ( -0.736 0.037 3.144) 3.229 4.323 ( -4.193 -1.835 -1.497) 4.816 4.364 ( 1.011 1.590 1.147) 2.206 4.430 ( 4.223 -4.561 1.788) 6.468 4.916 ( -1.386 0.173 2.151) 2.564 4.943 ( -0.148 -2.446 2.301) 3.361 6.773 ( -2.062 -2.923 -4.686) 5.895 6.783 ( -1.942 -3.663 -4.886) 6.408 7.331 ( 2.001 0.156 -0.824) 2.169 7.372 ( 2.189 -4.047 -3.037) 5.513 7.924 ( -15.868 3.447 -2.184) 16.385 8.041 ( -13.718 -8.332 0.102) 16.051 8.627 ( -1.243 4.910 0.678) 5.110 8.636 ( 5.540 2.674 1.930) 6.447 8.682 ( 12.754 -1.779 2.652) 13.148 8.749 ( 2.625 -4.306 0.081) 5.044 9.504 ( 7.785 0.279 1.909) 8.021 9.552 ( 8.308 -4.045 2.197) 9.498 9.748 ( -1.186 3.884 3.028) 5.065 9.812 ( -0.062 -2.388 1.229) 2.686 10.038 ( -3.099 0.080 -2.375) 3.905 10.061 ( -2.895 -2.262 -4.082) 5.492 10.764 ( -0.267 1.702 2.900) 3.373 10.784 ( 0.743 -0.106 2.955) 3.049 11.077 ( 1.244 3.805 2.250) 4.592 11.126 ( 2.360 -1.257 1.447) 3.041 11.772 ( -6.584 3.391 -2.316) 7.760 11.860 ( -3.378 -5.213 -2.738) 6.788 12.132 ( -0.689 4.326 3.759) 5.772 12.211 ( 4.224 -3.245 5.028) 7.325 12.796 ( 3.137 3.234 -2.971) 5.397 12.831 ( 2.866 -0.424 -4.850) 5.649 13.883 ( -1.640 1.891 4.001) 4.720 13.903 ( -0.640 -0.213 4.660) 4.709 13.977 ( -4.714 1.783 -1.844) 5.367 14.000 ( -4.329 -0.678 -3.333) 5.505 15.438 ( 0.020 6.559 2.783) 7.125 15.553 ( 1.158 -5.667 2.428) 6.273 15.992 ( -3.400 3.799 -6.023) 7.891 16.055 ( -4.014 -2.238 7.819) 9.069 16.305 ( 5.539 5.857 -6.672) 10.464 16.483 ( 8.737 -9.702 3.982) 13.650 16.705 ( 3.704 -0.248 -7.427) 8.303 16.770 ( 6.656 -6.011 -4.468) 10.020 18.186 ( -0.828 6.484 1.139) 6.635 18.233 ( -0.388 1.813 -0.210) 1.866 19.623 ( -5.625 5.124 5.124) 9.174 19.762 ( -6.766 -8.817 -4.113) 11.850 ======================= Grid point 244 (132/195) ======================= q-point: ( 0.18 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( -0.165 8.030 -1.164) 8.115 1.962 ( -0.803 5.250 -2.474) 5.859 2.069 ( -0.712 1.760 -6.048) 6.339 2.225 ( -8.222 -10.671 -3.937) 14.034 2.515 ( 5.738 10.217 4.815) 12.669 2.711 ( 4.655 -9.240 6.098) 12.010 2.808 ( -9.918 6.802 1.067) 12.074 2.965 ( -4.734 -7.427 -1.058) 8.871 3.207 ( -0.672 -0.030 -2.309) 2.405 3.286 ( 0.093 -6.888 0.025) 6.889 3.714 ( -6.824 4.238 -4.203) 9.066 3.738 ( -5.548 1.700 1.949) 6.121 4.297 ( 0.392 3.980 4.061) 5.699 4.370 ( 2.372 0.924 2.873) 3.839 4.403 ( 2.557 0.279 0.654) 2.654 4.511 ( 4.036 -6.856 -0.385) 7.965 4.902 ( -1.505 2.013 0.408) 2.546 4.957 ( -0.296 -3.343 0.770) 3.444 6.654 ( -4.632 -0.969 -4.261) 6.368 6.686 ( -3.766 -4.089 -3.103) 6.366 7.366 ( -0.532 0.462 -0.292) 0.763 7.379 ( 3.049 -1.635 -0.888) 3.572 7.697 ( -7.593 1.713 0.555) 7.804 7.825 ( -10.949 -10.605 1.548) 15.321 8.524 ( -6.834 5.454 0.716) 8.773 8.629 ( -5.332 -4.762 0.491) 7.166 8.950 ( 12.285 1.659 3.073) 12.772 8.989 ( 14.932 -1.695 3.975) 15.545 9.622 ( 1.564 2.305 -1.245) 3.051 9.662 ( -2.023 -0.861 -2.202) 3.112 9.756 ( 6.424 0.458 -1.545) 6.623 9.809 ( 5.788 -3.929 -3.473) 7.810 9.977 ( -3.256 -0.299 1.046) 3.433 9.989 ( -2.865 -1.412 1.078) 3.371 10.770 ( 0.761 3.370 -0.570) 3.502 10.822 ( 1.127 -1.377 1.424) 2.280 11.159 ( 3.825 3.304 2.125) 5.483 11.199 ( 3.016 -0.780 2.000) 3.702 11.608 ( -8.275 1.877 -2.393) 8.816 11.689 ( -9.386 -6.155 -4.063) 11.937 12.160 ( 0.801 8.495 -0.141) 8.534 12.301 ( 1.327 -5.546 1.814) 5.984 12.904 ( 9.003 4.348 2.504) 10.307 12.960 ( 10.164 -0.914 4.647) 11.213 13.733 ( -10.352 0.932 -4.766) 11.435 13.767 ( -10.332 -2.039 -5.157) 11.726 13.950 ( -1.869 2.330 1.001) 3.150 13.974 ( -1.479 -0.183 1.988) 2.485 15.439 ( -2.629 4.144 0.514) 4.934 15.544 ( -3.297 -6.847 -0.278) 7.604 15.890 ( -2.524 6.680 -1.294) 7.257 16.028 ( -2.465 -7.305 0.208) 7.712 16.477 ( 11.420 15.172 8.180) 20.676 16.733 ( 9.232 2.041 3.958) 10.250 16.795 ( 16.517 -11.291 -0.987) 20.031 16.891 ( 11.837 -9.542 -3.003) 15.498 18.091 ( -6.410 9.119 -5.530) 12.443 18.179 ( -3.944 0.368 -3.496) 5.283 19.557 ( -9.811 -2.237 4.745) 11.125 19.564 ( -10.792 -3.023 -2.027) 11.389 ======================= Grid point 245 (133/195) ======================= q-point: ( 0.27 0.44 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.812 ( -4.865 8.509 -6.209) 11.603 1.946 ( -0.981 -0.531 -2.028) 2.315 2.002 ( 0.171 -0.595 -1.502) 1.625 2.096 ( -3.001 -6.498 0.058) 7.158 2.624 ( -0.810 8.686 6.163) 10.681 2.667 ( -8.980 8.301 3.090) 12.614 2.818 ( -0.675 -8.342 4.947) 9.722 2.875 ( -5.027 -9.044 0.087) 10.347 3.158 ( -1.624 2.714 -2.166) 3.833 3.273 ( -0.904 -7.603 -1.062) 7.730 3.574 ( -3.614 4.630 -2.479) 6.375 3.635 ( -4.859 -2.147 -0.935) 5.394 4.384 ( 3.222 4.849 0.631) 5.856 4.395 ( 1.549 7.704 -0.163) 7.860 4.476 ( 4.072 -4.131 -1.325) 5.949 4.561 ( 1.329 -8.919 1.538) 9.147 4.883 ( -0.048 3.406 -1.456) 3.705 4.951 ( -0.057 -3.622 -1.377) 3.875 6.543 ( -3.682 0.646 -1.657) 4.089 6.593 ( -3.690 -4.154 -1.186) 5.681 7.310 ( -3.462 5.384 -0.412) 6.414 7.417 ( 0.216 -4.865 0.630) 4.910 7.678 ( 0.486 -1.932 2.965) 3.573 7.742 ( -3.133 -8.198 6.245) 10.771 8.423 ( -5.500 4.247 0.316) 6.956 8.533 ( -5.873 -6.472 0.121) 8.740 9.127 ( 6.383 6.183 -1.377) 8.993 9.246 ( 9.815 -5.195 1.604) 11.220 9.518 ( -7.002 2.390 -2.742) 7.890 9.550 ( -3.496 -0.372 -5.062) 6.163 9.847 ( 1.774 -0.430 -0.535) 1.902 9.870 ( 0.011 -2.512 0.834) 2.646 9.981 ( 4.320 2.082 1.935) 5.171 10.053 ( 9.521 -5.150 1.110) 10.881 10.781 ( 2.709 5.524 -3.098) 6.889 10.865 ( 2.692 -2.271 -0.071) 3.522 11.224 ( 1.271 2.811 -0.028) 3.085 11.242 ( 1.507 1.774 -2.407) 3.348 11.473 ( -5.304 -2.246 1.192) 5.882 11.495 ( -8.209 -4.240 -1.973) 9.448 12.169 ( 1.230 8.330 -0.852) 8.463 12.316 ( -0.212 -6.323 0.104) 6.327 13.120 ( 9.384 7.120 4.693) 12.680 13.193 ( 8.575 0.699 3.885) 9.440 13.482 ( -9.899 -0.604 -7.127) 12.212 13.539 ( -7.150 -5.620 -3.857) 9.878 13.901 ( -3.840 2.891 -0.391) 4.822 13.945 ( -3.477 -1.598 0.364) 3.844 15.376 ( -3.344 3.637 -0.941) 5.029 15.474 ( -5.418 -6.435 2.049) 8.658 15.876 ( -0.584 5.729 3.255) 6.615 16.002 ( -2.363 -6.829 2.455) 7.632 16.825 ( 13.246 18.458 12.438) 25.901 16.917 ( 14.181 6.829 -3.001) 16.023 17.056 ( 15.062 -7.616 -6.077) 17.939 17.192 ( 16.986 -18.451 11.249) 27.487 17.864 ( -9.591 11.320 -8.535) 17.116 18.013 ( -7.466 -3.257 -7.554) 11.109 19.317 ( -13.317 2.983 -2.763) 13.924 19.433 ( -12.486 -8.245 4.973) 15.768 ======================= Grid point 246 (134/195) ======================= q-point: ( 0.36 0.44 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -4.941 6.858 -8.939) 12.303 1.773 ( -8.383 -6.878 -7.601) 13.243 2.115 ( 5.878 -0.427 5.904) 8.343 2.125 ( 1.717 -0.588 5.176) 5.485 2.571 ( -5.693 8.879 2.729) 10.895 2.640 ( -4.401 3.677 4.931) 7.563 2.793 ( -4.320 -8.051 1.622) 9.280 2.806 ( -6.761 -7.183 3.749) 10.553 3.121 ( -0.435 4.510 -0.628) 4.574 3.245 ( -0.435 -6.552 -1.052) 6.650 3.539 ( -0.364 3.477 1.185) 3.692 3.590 ( -0.344 -1.532 0.852) 1.787 4.366 ( 1.368 5.870 -5.410) 8.099 4.449 ( 0.880 3.872 -0.378) 3.989 4.495 ( 3.635 -3.786 -5.691) 7.742 4.587 ( 0.154 -7.246 -0.158) 7.249 4.860 ( 0.148 3.286 -2.877) 4.370 4.925 ( -0.097 -3.670 -2.559) 4.475 6.501 ( -1.056 1.088 1.431) 2.084 6.542 ( -1.976 -2.808 1.134) 3.616 7.275 ( -0.952 5.059 1.165) 5.278 7.404 ( -1.573 -7.678 0.165) 7.839 7.737 ( 0.470 1.228 5.786) 5.934 7.828 ( 0.502 -7.717 9.259) 12.064 8.344 ( -3.548 2.947 -0.559) 4.646 8.444 ( -3.760 -6.693 -0.442) 7.690 9.160 ( 3.242 8.108 -4.870) 9.998 9.322 ( 1.225 -6.649 -4.593) 8.174 9.379 ( -3.884 1.764 -5.918) 7.295 9.421 ( -4.363 -2.079 -4.486) 6.594 9.839 ( -1.867 2.204 3.992) 4.927 9.901 ( -0.971 -3.965 5.507) 6.855 10.132 ( 8.594 5.030 2.080) 10.173 10.254 ( 10.121 -7.622 1.822) 12.800 10.776 ( 1.699 7.082 -4.949) 8.805 10.897 ( 1.566 -4.533 -1.964) 5.182 11.171 ( -0.923 4.416 -4.783) 6.575 11.231 ( 1.422 0.062 -4.420) 4.644 11.373 ( -4.774 0.319 -0.177) 4.788 11.443 ( -3.371 -5.252 3.395) 7.104 12.184 ( 1.539 7.291 -0.673) 7.482 12.309 ( -0.651 -5.124 0.180) 5.168 13.195 ( -1.192 4.200 -4.298) 6.127 13.270 ( -4.328 -3.149 -5.831) 7.915 13.344 ( 5.895 7.994 2.220) 10.178 13.513 ( 1.175 -7.897 2.191) 8.279 13.839 ( -2.248 1.830 1.067) 3.089 13.880 ( -3.375 -2.410 0.386) 4.165 15.327 ( -1.954 3.626 0.690) 4.176 15.410 ( -5.799 -4.740 3.580) 8.302 15.940 ( 1.154 1.696 6.478) 6.795 16.005 ( -2.005 -4.653 4.788) 6.972 17.072 ( 9.508 8.944 -0.764) 13.076 17.203 ( 10.164 -1.130 -2.612) 10.555 17.274 ( 19.565 13.702 4.380) 24.284 17.541 ( -5.630 1.886 1.685) 6.172 17.668 ( 8.389 -7.324 1.971) 11.309 17.776 ( -5.418 -8.413 -7.103) 12.271 19.049 ( -13.123 7.181 -3.822) 15.440 19.247 ( -13.733 -12.177 1.895) 18.452 ======================= Grid point 247 (135/195) ======================= q-point: ( 0.45 0.44 -0.71) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( 2.582 2.414 -9.849) 10.464 1.552 ( -3.489 -3.834 -10.124) 11.374 2.229 ( 0.773 2.123 7.258) 7.601 2.261 ( 0.468 -1.957 7.054) 7.336 2.588 ( 3.124 5.420 4.935) 7.968 2.607 ( -5.100 0.726 4.820) 7.055 2.721 ( -6.198 -2.987 2.398) 7.286 2.781 ( 0.303 -6.852 2.861) 7.431 3.119 ( 0.449 3.831 -0.429) 3.881 3.223 ( -0.562 -5.780 -2.278) 6.238 3.563 ( -0.486 4.555 3.799) 5.951 3.628 ( 0.691 -1.332 4.355) 4.606 4.308 ( -1.227 4.989 -4.743) 6.992 4.407 ( -0.578 -2.508 -6.087) 6.609 4.472 ( 1.541 0.732 -6.259) 6.487 4.555 ( 0.932 -5.114 -6.629) 8.424 4.829 ( -0.077 2.616 -1.687) 3.113 4.894 ( -0.295 -4.157 -2.070) 4.653 6.532 ( 1.138 0.801 3.127) 3.423 6.552 ( 0.342 -1.027 2.738) 2.944 7.292 ( -0.005 2.663 2.293) 3.514 7.379 ( -1.317 -6.229 0.151) 6.369 7.822 ( 0.210 3.058 7.651) 8.242 7.939 ( -0.857 -9.007 9.593) 13.186 8.292 ( -1.401 3.553 -0.647) 3.874 8.400 ( -1.242 -7.118 -0.326) 7.233 9.135 ( 1.819 7.554 -9.859) 12.552 9.212 ( -5.230 1.569 -6.298) 8.336 9.254 ( -2.146 0.136 -2.625) 3.393 9.340 ( 2.783 -9.992 -6.298) 12.134 9.892 ( 0.610 3.481 6.297) 7.221 9.965 ( 0.360 -3.915 6.242) 7.377 10.283 ( 3.479 5.667 4.462) 8.008 10.404 ( 3.815 -7.011 2.275) 8.299 10.713 ( -0.193 6.302 -7.197) 9.568 10.839 ( -2.634 -6.336 -6.494) 9.447 11.133 ( 0.731 4.870 -2.052) 5.335 11.229 ( 2.238 -4.260 -1.426) 5.019 11.298 ( -1.411 5.405 -2.877) 6.283 11.405 ( -2.447 -5.186 -0.572) 5.763 12.208 ( 1.587 6.263 0.308) 6.468 12.298 ( -1.211 -2.518 0.292) 2.809 13.143 ( 1.939 1.247 -3.863) 4.498 13.199 ( 2.032 -4.376 -3.567) 6.000 13.388 ( -1.181 5.523 -1.686) 5.894 13.474 ( -5.209 -2.855 -1.941) 6.249 13.869 ( 1.274 1.219 3.927) 4.304 13.898 ( 2.078 -1.779 4.002) 4.848 15.321 ( -0.381 1.640 1.687) 2.383 15.367 ( -3.433 -3.242 3.019) 5.605 16.040 ( -1.373 0.002 8.630) 8.739 16.069 ( 1.610 -2.897 8.661) 9.274 17.137 ( -1.260 10.082 -8.292) 13.114 17.208 ( 4.884 2.778 -12.691) 13.879 17.389 ( -5.252 0.939 -0.946) 5.418 17.464 ( -9.051 -6.209 1.505) 11.079 17.741 ( 17.730 17.626 8.009) 26.252 18.086 ( 14.067 -15.237 11.227) 23.582 18.800 ( -7.179 6.272 -6.543) 11.562 19.016 ( -12.115 -13.826 -2.718) 18.583 ======================= Grid point 248 (136/195) ======================= q-point: (-0.45 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( 7.328 2.520 -9.758) 12.461 1.521 ( 14.050 -3.638 -8.844) 16.995 2.292 ( -1.616 3.053 6.239) 7.132 2.344 ( 1.011 -2.138 6.345) 6.771 2.562 ( -6.345 3.554 5.578) 9.165 2.658 ( -4.191 -4.967 4.206) 7.741 2.762 ( 5.717 4.261 3.643) 8.007 2.855 ( 2.963 -4.516 2.416) 5.917 3.120 ( 1.673 -0.116 -1.903) 2.536 3.161 ( -1.301 -4.249 -4.832) 6.565 3.608 ( -1.220 7.224 5.750) 9.313 3.698 ( 0.003 -1.230 5.801) 5.930 4.226 ( -2.062 2.750 -2.838) 4.458 4.309 ( -2.178 -5.222 -5.526) 7.909 4.404 ( 0.452 2.757 -7.707) 8.198 4.472 ( 0.783 -3.322 -9.676) 10.260 4.825 ( 0.444 0.594 0.387) 0.837 4.868 ( -0.252 -3.645 -1.483) 3.944 6.597 ( 2.237 0.817 2.573) 3.506 6.610 ( 2.635 -0.404 2.279) 3.507 7.309 ( -1.582 1.214 2.487) 3.188 7.375 ( 0.659 -5.598 0.537) 5.662 7.926 ( 0.601 4.263 8.854) 9.845 8.032 ( 0.891 -6.785 7.244) 9.966 8.271 ( -1.986 1.949 0.806) 2.897 8.370 ( -1.856 -7.930 -1.120) 8.221 9.000 ( -1.839 2.633 -8.584) 9.165 9.045 ( -3.986 -1.459 -7.882) 8.953 9.266 ( 4.483 3.441 -1.356) 5.812 9.357 ( 5.998 -6.132 -4.496) 9.685 9.992 ( 1.651 3.502 6.331) 7.421 10.055 ( 1.440 -2.566 5.713) 6.427 10.320 ( -5.052 5.156 3.182) 7.888 10.417 ( -5.620 -5.014 1.753) 7.733 10.646 ( 1.945 1.580 -4.888) 5.492 10.702 ( -1.252 -3.974 -8.241) 9.234 11.085 ( -4.351 5.561 -1.847) 7.298 11.193 ( -3.738 -5.711 -1.695) 7.033 11.322 ( 6.116 5.275 -1.833) 8.282 11.419 ( 7.065 -4.529 -1.650) 8.553 12.241 ( 0.700 3.805 1.387) 4.110 12.263 ( -2.909 1.615 -0.591) 3.379 13.145 ( 0.975 -1.292 -3.068) 3.469 13.180 ( -0.468 -5.319 -5.821) 7.899 13.361 ( 0.826 1.976 0.596) 2.223 13.377 ( -0.581 1.115 -0.357) 1.307 13.946 ( 1.408 1.818 3.315) 4.034 13.965 ( 0.542 -0.081 2.223) 2.290 15.356 ( 1.523 -0.377 2.046) 2.578 15.374 ( 1.774 -2.278 1.617) 3.310 16.120 ( -2.912 3.681 10.311) 11.329 16.206 ( -0.033 -4.946 10.272) 11.401 16.930 ( -5.381 8.485 -9.040) 13.516 17.062 ( -3.611 -4.411 -14.487) 15.568 17.267 ( -8.447 7.774 4.007) 12.159 17.421 ( -3.799 -8.464 2.707) 9.665 18.129 ( 11.183 16.236 9.905) 22.063 18.285 ( -2.544 2.977 2.494) 4.642 18.738 ( 2.340 -6.863 -5.508) 9.106 18.846 ( 7.800 -14.749 -4.086) 17.178 ======================= Grid point 249 (137/195) ======================= q-point: (-0.36 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( 14.884 9.245 -7.231) 18.955 1.738 ( 20.020 -8.101 -6.609) 22.585 2.342 ( 0.067 4.895 3.249) 5.876 2.427 ( 0.507 -2.715 3.745) 4.653 2.537 ( -4.862 5.365 7.319) 10.296 2.652 ( -3.009 -4.301 5.506) 7.607 2.797 ( -0.632 3.583 -3.555) 5.086 2.900 ( 1.685 -6.823 -1.778) 7.250 3.106 ( 1.563 0.644 -1.829) 2.491 3.162 ( 3.229 -4.762 -0.284) 5.760 3.613 ( -5.110 11.107 2.565) 12.493 3.751 ( -0.424 -2.404 3.137) 3.975 4.217 ( 0.900 -0.950 2.185) 2.547 4.244 ( 0.484 -2.916 -0.276) 2.969 4.322 ( -0.325 1.135 -5.537) 5.662 4.366 ( -0.658 -2.850 -7.646) 8.186 4.841 ( 0.227 -1.124 0.038) 1.148 4.853 ( 0.323 -2.217 -0.381) 2.273 6.662 ( 3.514 0.787 -0.097) 3.602 6.680 ( 3.659 -0.858 -0.158) 3.761 7.306 ( -0.897 2.506 1.207) 2.922 7.406 ( 1.570 -7.588 0.898) 7.800 8.046 ( 0.423 6.762 9.460) 11.637 8.155 ( 5.164 -0.857 3.347) 6.213 8.219 ( -6.384 -2.624 2.998) 7.525 8.321 ( 1.867 -10.210 -4.725) 11.404 8.895 ( -3.166 0.432 -3.525) 4.757 8.924 ( -2.097 -2.984 -2.151) 4.234 9.346 ( 6.984 4.107 -2.414) 8.454 9.423 ( 7.072 -3.885 -4.015) 9.012 10.065 ( 0.226 3.887 2.422) 4.586 10.123 ( 0.941 -1.369 0.593) 1.764 10.206 ( -11.036 2.443 2.837) 11.654 10.261 ( -12.828 -2.892 0.527) 13.161 10.637 ( 2.162 0.424 -4.416) 4.935 10.672 ( 3.582 -3.079 0.546) 4.755 10.983 ( -3.756 5.979 -2.139) 7.377 11.088 ( -5.107 -5.075 -1.789) 7.418 11.447 ( 9.449 5.568 -0.948) 11.008 11.560 ( 9.194 -5.840 -0.235) 10.895 12.182 ( -4.860 6.112 -1.298) 7.916 12.255 ( -1.099 -1.013 1.439) 2.075 13.069 ( -2.966 -0.461 -2.491) 3.901 13.111 ( -1.610 -4.731 -1.325) 5.170 13.397 ( 4.110 5.089 -0.634) 6.572 13.470 ( 6.235 -2.703 1.046) 6.876 13.965 ( -0.988 1.008 -0.199) 1.425 13.974 ( -0.631 0.106 0.173) 0.663 15.413 ( 3.725 2.441 -0.137) 4.455 15.465 ( 5.350 -3.330 1.963) 6.601 16.136 ( -8.732 6.033 7.931) 13.249 16.266 ( -4.754 -7.034 5.873) 10.323 16.799 ( -1.516 4.150 -3.866) 5.871 16.875 ( -1.611 -3.081 -6.816) 7.652 17.139 ( -12.503 11.819 5.558) 18.080 17.369 ( -6.907 -11.436 5.351) 14.392 18.127 ( -4.132 7.696 -7.766) 11.688 18.268 ( -6.434 -4.400 -1.865) 8.015 18.795 ( 15.713 14.493 -1.593) 21.436 19.149 ( 19.273 -19.680 2.807) 27.688 ======================= Grid point 250 (138/195) ======================= q-point: (-0.27 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( 11.876 14.593 -4.218) 19.282 1.978 ( 12.951 -8.484 -4.719) 16.186 2.303 ( -3.771 5.505 -5.599) 8.710 2.405 ( -2.917 -5.082 -5.671) 8.155 2.564 ( -0.100 7.739 9.364) 12.148 2.717 ( 1.318 -6.228 5.302) 8.285 2.783 ( 4.315 6.078 1.411) 7.587 2.949 ( 5.381 -8.503 1.593) 10.187 3.136 ( 2.239 0.580 -0.534) 2.374 3.192 ( 1.027 -3.939 -1.185) 4.240 3.512 ( -6.799 13.636 -0.374) 15.242 3.727 ( -2.618 -7.807 -2.667) 8.656 4.215 ( -1.644 1.669 -2.399) 3.354 4.271 ( -0.588 0.019 -1.182) 1.320 4.307 ( 2.869 -1.042 3.546) 4.679 4.390 ( 4.435 -5.583 6.728) 9.804 4.827 ( -0.409 0.682 -1.361) 1.576 4.865 ( 0.087 -3.156 0.427) 3.186 6.715 ( 5.009 -0.006 -3.223) 5.956 6.731 ( 4.494 -1.594 -2.796) 5.527 7.315 ( 1.034 3.907 0.174) 4.045 7.444 ( 1.925 -9.053 0.192) 9.257 8.097 ( -2.625 2.286 -5.598) 6.592 8.116 ( -3.323 0.844 4.479) 5.640 8.292 ( 5.736 0.925 3.274) 6.669 8.415 ( 10.178 -10.160 1.773) 14.490 8.816 ( -4.384 2.416 1.453) 5.212 8.893 ( -3.822 -5.744 3.936) 7.943 9.445 ( 7.169 3.285 -1.479) 8.023 9.496 ( 5.904 -1.979 -2.692) 6.784 9.959 ( -14.576 0.140 -1.210) 14.627 9.963 ( -17.244 -0.192 -2.296) 17.397 10.099 ( -0.133 3.935 1.281) 4.140 10.174 ( 0.851 -3.493 -0.731) 3.669 10.643 ( 1.088 4.942 -2.204) 5.520 10.738 ( 0.176 -4.479 2.211) 4.998 10.942 ( 0.614 3.746 1.354) 4.030 11.006 ( -2.422 -2.464 0.875) 3.564 11.589 ( 7.603 4.559 -1.363) 8.969 11.689 ( 6.125 -5.472 -1.933) 8.438 12.094 ( -3.677 8.450 0.402) 9.224 12.242 ( -2.070 -6.258 1.747) 6.819 13.056 ( 2.041 2.333 2.462) 3.959 13.115 ( 1.715 -3.199 2.817) 4.595 13.426 ( 1.341 7.055 -4.412) 8.428 13.556 ( 2.422 -5.642 -1.226) 6.260 13.945 ( 0.436 1.093 -1.123) 1.626 13.971 ( 1.912 -1.566 -0.447) 2.511 15.453 ( 2.675 7.163 -3.434) 8.382 15.573 ( 4.058 -5.567 0.852) 6.942 16.024 ( -12.217 8.269 6.519) 16.129 16.214 ( -5.561 -10.545 3.487) 12.421 16.725 ( -3.310 2.892 -4.321) 6.164 16.770 ( -5.535 -1.804 -6.584) 8.789 17.061 ( -5.884 13.695 11.350) 18.735 17.344 ( -7.025 -14.042 10.794) 19.054 17.970 ( -0.764 3.903 -10.603) 11.325 18.068 ( -4.771 -5.894 -10.772) 13.174 19.100 ( 16.036 20.470 2.815) 26.156 19.491 ( 16.445 -19.586 2.155) 25.665 ======================= Grid point 251 (139/195) ======================= q-point: (-0.18 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.826 ( 0.629 15.013 -0.357) 15.030 2.018 ( -0.031 -0.001 -3.682) 3.683 2.124 ( -5.900 4.846 -7.797) 10.913 2.323 ( 1.915 -10.537 -4.318) 11.547 2.729 ( 5.806 7.628 5.280) 10.944 2.807 ( 4.730 5.580 1.399) 7.447 2.923 ( 5.763 -2.149 2.290) 6.563 3.075 ( 5.058 -9.345 -0.007) 10.626 3.158 ( 2.942 1.297 -0.787) 3.311 3.195 ( 0.982 -2.095 0.139) 2.318 3.404 ( -4.694 10.997 -0.080) 11.957 3.644 ( -1.918 -11.201 -1.573) 11.472 4.185 ( -0.825 1.991 1.808) 2.812 4.255 ( -1.113 -4.560 2.135) 5.157 4.425 ( 2.764 4.453 4.282) 6.768 4.536 ( 2.659 -6.120 5.642) 8.738 4.802 ( -0.427 2.181 -0.930) 2.410 4.861 ( -0.625 -3.833 0.210) 3.889 6.765 ( 6.575 -1.216 -5.027) 8.366 6.777 ( 5.478 -2.580 -3.735) 7.115 7.341 ( 1.958 3.916 -0.665) 4.428 7.466 ( 0.938 -8.572 -1.228) 8.710 8.010 ( 1.462 2.802 -5.985) 6.768 8.098 ( 1.555 -5.973 -2.529) 6.670 8.457 ( 8.127 6.488 3.062) 10.841 8.609 ( 8.013 -7.944 1.285) 11.357 8.779 ( -4.821 2.482 5.816) 7.952 8.862 ( -7.198 -5.586 5.970) 10.892 9.524 ( -4.262 1.763 -0.624) 4.654 9.544 ( 0.783 -0.038 0.491) 0.925 9.627 ( -13.669 2.871 -0.844) 13.992 9.703 ( -8.862 -4.697 -0.523) 10.043 10.133 ( 2.983 2.730 -0.406) 4.064 10.188 ( 2.811 -2.995 -2.442) 4.779 10.589 ( -3.415 7.129 -1.506) 8.047 10.715 ( -3.780 -5.672 0.923) 6.878 11.006 ( 2.466 3.969 3.770) 6.004 11.061 ( 2.351 -1.128 5.242) 5.855 11.658 ( 3.351 2.713 -2.239) 4.858 11.716 ( 1.437 -2.858 -2.350) 3.969 12.079 ( -0.244 7.197 1.380) 7.332 12.238 ( -1.182 -8.519 1.916) 8.812 13.165 ( 4.043 5.630 2.373) 7.327 13.249 ( 6.409 1.729 8.082) 10.458 13.327 ( -2.968 4.743 -8.691) 10.336 13.517 ( -1.652 -9.685 -2.773) 10.209 13.984 ( 4.277 2.499 0.114) 4.955 14.031 ( 4.365 -2.348 0.270) 4.964 15.431 ( 0.554 8.625 -3.826) 9.452 15.576 ( -3.345 -6.502 -1.797) 7.529 15.942 ( -8.229 11.310 10.678) 17.597 16.190 ( -4.350 -13.348 6.400) 15.429 16.548 ( -6.813 3.225 -8.036) 11.018 16.597 ( -2.987 -1.946 -8.565) 9.278 17.102 ( -3.688 8.892 4.040) 10.440 17.308 ( -10.230 -11.374 4.184) 15.860 17.881 ( 2.468 3.047 -5.265) 6.565 17.953 ( 4.029 -4.063 -4.595) 7.339 19.373 ( 11.313 19.966 2.929) 23.135 19.747 ( 11.495 -18.453 0.028) 21.740 ======================= Grid point 252 (140/195) ======================= q-point: (-0.09 0.44 0.29) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -3.746 11.818 2.568) 12.661 1.955 ( -4.027 -2.832 -2.551) 5.545 2.035 ( 4.087 14.756 -1.240) 15.362 2.336 ( 1.733 -12.900 0.195) 13.017 2.707 ( -4.169 11.494 -8.826) 15.080 2.930 ( 2.578 -3.362 -1.122) 4.383 2.978 ( 3.273 0.386 -3.332) 4.687 3.091 ( 1.202 -3.164 -1.486) 3.697 3.212 ( 2.337 -3.403 -1.764) 4.489 3.248 ( 3.451 -3.554 0.079) 4.954 3.390 ( 0.306 14.989 6.915) 16.510 3.690 ( 3.378 -13.354 6.552) 15.254 4.226 ( 0.646 1.272 4.867) 5.071 4.278 ( -0.651 -3.894 4.057) 5.661 4.454 ( -1.902 5.545 -1.188) 5.981 4.568 ( -3.044 -5.071 -0.190) 5.918 4.820 ( 1.678 1.044 2.476) 3.168 4.870 ( 0.397 -3.488 2.163) 4.124 6.817 ( 5.626 -2.488 -4.834) 7.824 6.827 ( 5.513 -3.499 -4.323) 7.831 7.350 ( 0.656 2.313 -1.880) 3.052 7.438 ( -0.722 -6.542 -3.411) 7.413 8.035 ( 8.652 3.659 -4.145) 10.267 8.143 ( 6.859 -7.520 -2.236) 10.421 8.595 ( 0.855 5.651 1.909) 6.025 8.675 ( 0.195 0.153 0.780) 0.818 8.731 ( -10.127 -2.026 1.409) 10.424 8.775 ( -5.553 -3.212 0.878) 6.475 9.344 ( -8.972 0.895 4.570) 10.109 9.391 ( -8.764 -3.833 5.503) 11.035 9.666 ( 2.375 0.843 0.499) 2.569 9.687 ( 3.418 -1.320 0.726) 3.736 10.163 ( 1.286 1.528 -2.126) 2.917 10.199 ( 1.822 -2.312 -3.481) 4.558 10.556 ( -0.211 7.147 3.226) 7.845 10.686 ( -1.460 -6.269 3.561) 7.356 11.079 ( 0.023 4.729 3.197) 5.708 11.129 ( -0.813 0.003 2.787) 2.903 11.695 ( 3.482 2.163 0.701) 4.159 11.748 ( 3.635 -3.228 1.674) 5.141 12.084 ( -0.472 6.020 0.152) 6.040 12.225 ( -2.334 -8.043 0.333) 8.381 13.101 ( -4.977 6.989 -9.928) 13.122 13.145 ( -5.627 3.369 -8.909) 11.062 13.507 ( 8.673 0.129 10.519) 13.634 13.583 ( 6.412 -6.518 6.674) 11.320 14.057 ( 3.416 2.446 -0.277) 4.210 14.095 ( 2.566 -1.427 -0.571) 2.992 15.410 ( 0.430 5.981 -0.971) 6.074 15.479 ( -4.670 -1.441 0.482) 4.911 15.955 ( -7.228 9.109 12.585) 17.134 16.184 ( -6.928 -13.306 7.695) 16.860 16.378 ( 0.287 3.844 -10.101) 10.811 16.475 ( 3.261 -5.367 -11.936) 13.488 16.987 ( -6.038 3.775 -7.557) 10.384 17.087 ( -11.299 -6.507 -7.043) 14.819 17.957 ( 5.914 5.868 3.887) 9.193 18.057 ( 5.894 -3.980 4.180) 8.250 19.550 ( 5.429 17.190 2.764) 18.238 19.879 ( 5.354 -16.455 -2.255) 17.450 ======================= Grid point 297 (141/195) ======================= q-point: ( 0.00 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -9.125 0.000 21.586) 23.435 1.604 ( -1.359 0.000 21.070) 21.114 1.813 ( 10.378 0.000 -12.427) 16.191 2.063 ( -1.366 0.000 -11.552) 11.633 2.365 ( -2.321 0.000 16.689) 16.850 2.740 ( 5.957 0.000 -14.919) 16.065 3.085 ( -0.132 0.000 7.196) 7.198 3.209 ( 0.464 0.000 -5.258) 5.278 3.270 ( -4.363 0.000 8.304) 9.380 3.488 ( 1.381 0.000 -13.044) 13.117 3.762 ( 0.481 0.000 5.979) 5.998 3.896 ( -0.566 0.000 -7.939) 7.960 4.212 ( -1.652 0.000 5.216) 5.471 4.313 ( 1.826 0.000 -4.851) 5.183 4.549 ( -1.011 0.000 1.631) 1.919 4.557 ( 0.482 0.000 0.909) 1.029 5.157 ( -1.195 0.000 2.472) 2.746 5.189 ( 0.721 0.000 -1.036) 1.263 7.205 ( -2.464 0.000 2.081) 3.225 7.271 ( 2.333 0.000 -4.386) 4.967 7.496 ( -3.392 0.000 3.849) 5.130 7.600 ( 6.193 0.000 -7.327) 9.594 8.252 ( -5.487 0.000 -2.529) 6.042 8.252 ( 2.823 0.000 -2.698) 3.905 8.443 ( 1.135 0.000 6.279) 6.381 8.552 ( -0.246 0.000 -5.149) 5.155 8.954 ( 2.134 0.000 2.341) 3.168 8.977 ( -4.685 0.000 0.449) 4.707 9.586 ( 1.706 0.000 9.865) 10.011 9.733 ( 6.656 0.000 -4.659) 8.125 9.760 ( -1.488 0.000 5.569) 5.764 9.871 ( -2.382 0.000 -7.091) 7.480 10.093 ( -0.212 0.000 3.632) 3.639 10.170 ( -3.051 0.000 -4.331) 5.298 10.433 ( -3.901 0.000 5.252) 6.542 10.489 ( 4.015 0.000 0.209) 4.020 11.009 ( 6.495 0.000 2.713) 7.039 11.025 ( -2.628 0.000 0.625) 2.701 11.738 ( 2.504 0.000 7.780) 8.173 11.912 ( -5.362 0.000 -9.707) 11.090 12.086 ( -3.686 0.000 8.243) 9.030 12.247 ( 2.637 0.000 -8.791) 9.178 12.582 ( 0.810 0.000 5.064) 5.129 12.652 ( 1.563 0.000 -2.438) 2.896 13.681 ( -5.084 0.000 1.912) 5.432 13.717 ( 3.301 0.000 -1.991) 3.854 13.948 ( 4.496 0.000 0.003) 4.496 13.985 ( -2.020 0.000 -3.576) 4.107 15.223 ( -12.145 0.000 19.727) 23.165 15.590 ( 9.208 0.000 -18.274) 20.463 15.932 ( 2.401 0.000 16.128) 16.306 16.263 ( -0.227 0.000 -17.913) 17.915 16.824 ( 1.809 0.000 1.078) 2.106 16.847 ( -2.830 0.000 -1.709) 3.306 17.077 ( -1.041 0.000 5.423) 5.522 17.190 ( -1.760 0.000 -5.708) 5.973 17.231 ( -1.685 0.000 5.459) 5.713 17.386 ( 4.179 0.000 -9.331) 10.224 19.816 ( 1.105 0.000 23.411) 23.437 20.220 ( -1.116 0.000 -19.299) 19.331 ======================= Grid point 298 (142/195) ======================= q-point: ( 0.09 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -4.020 0.000 19.542) 19.951 1.686 ( 7.580 0.000 -12.271) 14.423 1.848 ( 4.353 0.000 -23.683) 24.079 2.031 ( 8.441 0.000 16.678) 18.692 2.525 ( -6.368 0.000 12.393) 13.933 2.581 ( 4.679 0.000 -21.105) 21.618 3.110 ( -6.615 0.000 3.819) 7.638 3.111 ( -1.733 0.000 -3.596) 3.992 3.389 ( 1.472 0.000 14.521) 14.595 3.402 ( 2.632 0.000 -9.582) 9.937 3.779 ( -2.891 0.000 -7.578) 8.111 3.835 ( -1.133 0.000 8.324) 8.401 4.247 ( -1.066 0.000 5.529) 5.630 4.271 ( 0.557 0.000 -6.026) 6.052 4.540 ( -1.464 0.000 0.511) 1.550 4.560 ( -0.504 0.000 -0.299) 0.586 5.163 ( -1.031 0.000 1.852) 2.119 5.186 ( 0.517 0.000 -1.406) 1.498 7.131 ( -10.371 0.000 3.537) 10.957 7.202 ( -5.652 0.000 -2.746) 6.284 7.402 ( -9.502 0.000 3.201) 10.027 7.525 ( -2.372 0.000 -6.378) 6.804 8.271 ( 4.534 0.000 2.350) 5.107 8.397 ( 7.569 0.000 -0.839) 7.615 8.527 ( 9.719 0.000 -3.504) 10.331 8.547 ( 4.117 0.000 5.701) 7.032 8.946 ( 0.420 0.000 0.275) 0.502 9.040 ( 2.491 0.000 2.942) 3.855 9.563 ( -9.401 0.000 3.451) 10.015 9.601 ( -5.200 0.000 -12.576) 13.609 9.846 ( 2.974 0.000 -4.243) 5.182 9.907 ( 8.276 0.000 5.735) 10.069 10.129 ( 1.080 0.000 -1.894) 2.180 10.202 ( 5.113 0.000 6.864) 8.559 10.408 ( -2.949 0.000 3.245) 4.385 10.490 ( -2.124 0.000 -4.455) 4.936 10.942 ( -3.335 0.000 -4.250) 5.403 11.091 ( 2.838 0.000 -3.593) 4.579 11.742 ( -2.942 0.000 -5.275) 6.039 11.936 ( 6.071 0.000 10.054) 11.745 12.152 ( -0.665 0.000 9.749) 9.771 12.229 ( 6.017 0.000 -7.288) 9.450 12.594 ( -2.293 0.000 -5.945) 6.372 12.605 ( -2.283 0.000 1.362) 2.659 13.620 ( -5.159 0.000 2.964) 5.950 13.757 ( 2.482 0.000 -0.084) 2.484 13.896 ( -3.373 0.000 -3.438) 4.817 14.003 ( 1.697 0.000 0.422) 1.749 15.311 ( -5.481 0.000 20.216) 20.946 15.561 ( 10.515 0.000 -15.276) 18.545 16.025 ( -0.609 0.000 -18.884) 18.894 16.135 ( -1.037 0.000 15.624) 15.658 16.789 ( -2.778 0.000 0.303) 2.794 16.851 ( -1.572 0.000 1.612) 2.251 17.083 ( -4.794 0.000 -0.511) 4.822 17.102 ( -2.320 0.000 2.438) 3.366 17.338 ( 6.012 0.000 2.106) 6.370 17.445 ( 12.931 0.000 -2.876) 13.247 19.929 ( -4.476 0.000 -21.516) 21.976 20.063 ( -2.639 0.000 20.562) 20.730 ======================= Grid point 299 (143/195) ======================= q-point: ( 0.18 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( 1.567 0.000 -4.921) 5.164 1.666 ( 10.701 0.000 -15.972) 19.225 1.751 ( 5.711 0.000 -2.570) 6.263 2.362 ( 10.371 0.000 2.907) 10.771 2.423 ( -9.803 0.000 0.601) 9.821 2.500 ( 7.004 0.000 -2.160) 7.329 2.999 ( -9.204 0.000 2.349) 9.499 3.084 ( -2.305 0.000 1.050) 2.533 3.323 ( -0.718 0.000 -7.038) 7.075 3.535 ( -2.167 0.000 2.811) 3.550 3.636 ( -4.570 0.000 0.358) 4.584 3.940 ( -0.440 0.000 11.363) 11.371 4.195 ( -0.501 0.000 -6.013) 6.034 4.315 ( 2.300 0.000 4.035) 4.645 4.512 ( -1.126 0.000 -1.216) 1.657 4.533 ( -0.964 0.000 -2.255) 2.453 5.166 ( -0.726 0.000 1.080) 1.301 5.172 ( 0.429 0.000 -2.296) 2.335 6.943 ( -14.889 0.000 3.254) 15.240 7.023 ( -11.287 0.000 -1.541) 11.392 7.315 ( -6.141 0.000 5.386) 8.168 7.447 ( 0.509 0.000 -3.458) 3.496 8.341 ( -0.034 0.000 1.514) 1.514 8.401 ( 3.163 0.000 -5.330) 6.198 8.761 ( 11.100 0.000 7.134) 13.195 8.829 ( 17.750 0.000 2.724) 17.958 8.971 ( 1.396 0.000 1.028) 1.734 9.059 ( -4.074 0.000 2.608) 4.837 9.359 ( -6.139 0.000 -10.640) 12.284 9.457 ( -8.860 0.000 5.979) 10.689 9.837 ( 3.392 0.000 -5.354) 6.338 10.017 ( 0.415 0.000 -3.933) 3.955 10.233 ( 12.920 0.000 4.592) 13.712 10.275 ( -7.097 0.000 -5.326) 8.873 10.433 ( 4.866 0.000 5.920) 7.663 10.435 ( 4.390 0.000 -1.881) 4.776 10.833 ( -1.291 0.000 -7.991) 8.095 11.038 ( -0.708 0.000 -6.323) 6.362 11.684 ( -0.879 0.000 -0.526) 1.024 12.097 ( 2.214 0.000 5.104) 5.563 12.239 ( 1.355 0.000 -7.197) 7.324 12.286 ( 0.202 0.000 8.975) 8.977 12.490 ( 2.387 0.000 -6.307) 6.744 12.574 ( -0.646 0.000 1.157) 1.325 13.573 ( -5.105 0.000 4.038) 6.509 13.782 ( 0.797 0.000 -1.263) 1.494 13.802 ( -3.275 0.000 -2.084) 3.882 14.024 ( -0.803 0.000 2.171) 2.315 15.483 ( 0.071 0.000 15.934) 15.934 15.569 ( 6.755 0.000 -11.067) 12.965 15.871 ( 7.291 0.000 -13.577) 15.411 16.270 ( -3.680 0.000 15.221) 15.660 16.742 ( -3.371 0.000 -0.302) 3.384 16.798 ( -7.241 0.000 2.734) 7.740 17.008 ( -3.849 0.000 0.762) 3.924 17.057 ( -2.125 0.000 -2.584) 3.345 17.475 ( 7.463 0.000 1.324) 7.579 17.750 ( 18.645 0.000 5.348) 19.396 19.584 ( -5.303 0.000 -21.799) 22.435 20.197 ( -7.101 0.000 16.284) 17.765 ======================= Grid point 300 (144/195) ======================= q-point: ( 0.27 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 7.255 0.000 -10.521) 12.780 1.719 ( 15.570 0.000 -12.498) 19.966 1.815 ( 0.168 0.000 1.767) 1.775 2.318 ( -3.268 0.000 2.551) 4.146 2.378 ( 3.841 0.000 -11.324) 11.957 2.739 ( 0.001 0.000 11.417) 11.417 2.931 ( 1.859 0.000 4.818) 5.165 3.042 ( -2.717 0.000 0.002) 2.717 3.220 ( -3.841 0.000 -2.598) 4.637 3.357 ( -9.645 0.000 -5.042) 10.883 3.620 ( -6.374 0.000 3.401) 7.224 4.041 ( -3.299 0.000 9.917) 10.451 4.157 ( 2.915 0.000 -2.832) 4.065 4.360 ( -0.029 0.000 -4.188) 4.188 4.472 ( -1.384 0.000 -4.791) 4.987 4.520 ( 3.480 0.000 2.089) 4.058 5.151 ( 0.909 0.000 -3.212) 3.338 5.155 ( -1.124 0.000 -0.568) 1.259 6.739 ( -12.215 0.000 2.915) 12.558 6.816 ( -10.309 0.000 -0.663) 10.330 7.317 ( -3.456 0.000 8.728) 9.388 7.461 ( 3.512 0.000 -0.312) 3.525 8.323 ( -1.892 0.000 -0.931) 2.109 8.419 ( 5.821 0.000 -5.280) 7.859 8.883 ( -2.254 0.000 -7.497) 7.829 8.900 ( -2.765 0.000 -4.149) 4.986 9.123 ( 5.694 0.000 13.671) 14.810 9.148 ( -3.082 0.000 -6.324) 7.035 9.231 ( 9.221 0.000 12.298) 15.371 9.373 ( -10.061 0.000 6.628) 12.048 9.850 ( 4.182 0.000 -5.123) 6.613 9.957 ( -1.060 0.000 -3.132) 3.306 10.076 ( -3.311 0.000 -6.272) 7.092 10.437 ( 1.955 0.000 -1.973) 2.778 10.621 ( 5.121 0.000 7.883) 9.400 10.639 ( 25.763 0.000 -0.346) 25.766 10.700 ( -0.243 0.000 -11.687) 11.689 10.952 ( -2.516 0.000 -3.308) 4.156 11.674 ( -0.498 0.000 0.555) 0.746 12.052 ( -9.105 0.000 -9.701) 13.304 12.158 ( 0.627 0.000 0.118) 0.638 12.280 ( -6.363 0.000 3.841) 7.432 12.568 ( 10.556 0.000 -4.255) 11.381 12.643 ( 2.130 0.000 3.653) 4.229 13.549 ( -3.795 0.000 5.548) 6.721 13.744 ( -2.057 0.000 0.079) 2.058 13.750 ( -0.969 0.000 -3.361) 3.498 14.030 ( -2.008 0.000 2.834) 3.473 15.527 ( 4.302 0.000 -9.379) 10.319 15.666 ( 3.699 0.000 9.274) 9.984 15.978 ( 14.290 0.000 -2.935) 14.588 16.368 ( -5.532 0.000 12.982) 14.111 16.651 ( -5.515 0.000 -2.255) 5.958 16.694 ( -9.564 0.000 6.866) 11.773 16.980 ( -1.448 0.000 2.752) 3.110 16.983 ( -2.277 0.000 -3.362) 4.060 17.609 ( 6.935 0.000 -1.064) 7.016 18.125 ( 14.760 0.000 5.487) 15.747 19.277 ( -0.853 0.000 -18.687) 18.706 20.198 ( -11.550 0.000 11.189) 16.081 ======================= Grid point 301 (145/195) ======================= q-point: ( 0.36 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -2.096 0.000 -0.577) 2.174 1.872 ( 11.874 0.000 -5.389) 13.040 1.907 ( 19.203 0.000 -7.120) 20.480 2.224 ( -9.447 0.000 -7.063) 11.796 2.361 ( 1.273 0.000 5.803) 5.941 2.758 ( -1.011 0.000 1.190) 1.562 2.917 ( -12.357 0.000 -4.702) 13.222 2.959 ( -4.960 0.000 -4.027) 6.389 3.185 ( -1.252 0.000 5.059) 5.212 3.342 ( 6.742 0.000 9.931) 12.004 3.507 ( -6.235 0.000 -0.363) 6.245 4.052 ( -6.622 0.000 6.284) 9.129 4.219 ( 6.047 0.000 -0.301) 6.055 4.249 ( -1.747 0.000 -9.080) 9.247 4.373 ( -1.996 0.000 -7.053) 7.330 4.609 ( 1.386 0.000 2.256) 2.648 5.113 ( -1.565 0.000 -2.135) 2.648 5.131 ( 1.512 0.000 -3.725) 4.020 6.608 ( -6.900 0.000 3.072) 7.553 6.674 ( -5.889 0.000 0.316) 5.897 7.393 ( -1.302 0.000 10.906) 10.983 7.544 ( 4.740 0.000 1.315) 4.919 8.266 ( -1.559 0.000 -3.387) 3.729 8.444 ( 4.165 0.000 -7.673) 8.730 8.727 ( -3.071 0.000 -8.115) 8.676 8.763 ( -5.992 0.000 -3.187) 6.786 9.008 ( -5.218 0.000 -0.768) 5.274 9.248 ( -9.609 0.000 4.847) 10.762 9.398 ( 3.490 0.000 12.903) 13.367 9.556 ( 7.436 0.000 14.563) 16.352 9.811 ( 1.364 0.000 -6.318) 6.463 9.912 ( -0.470 0.000 -2.300) 2.347 10.089 ( 7.195 0.000 -1.666) 7.385 10.421 ( 1.866 0.000 -4.705) 5.062 10.535 ( -1.802 0.000 -10.231) 10.388 10.810 ( -1.720 0.000 -9.688) 9.839 10.817 ( 7.891 0.000 4.908) 9.293 11.142 ( 22.915 0.000 6.604) 23.848 11.675 ( -1.195 0.000 0.318) 1.237 11.758 ( -11.234 0.000 -7.662) 13.598 12.072 ( -4.328 0.000 -6.335) 7.673 12.274 ( -3.373 0.000 6.262) 7.113 12.644 ( -4.262 0.000 -0.877) 4.351 12.676 ( 7.722 0.000 -5.556) 9.513 13.582 ( -0.934 0.000 6.825) 6.889 13.700 ( -0.257 0.000 -2.192) 2.207 13.738 ( 0.195 0.000 1.863) 1.873 14.012 ( -2.980 0.000 1.029) 3.152 15.543 ( 7.603 0.000 -4.689) 8.933 15.826 ( 6.135 0.000 3.646) 7.137 16.207 ( 9.627 0.000 3.048) 10.098 16.298 ( -12.300 0.000 2.032) 12.466 16.522 ( -3.140 0.000 -4.499) 5.486 16.719 ( -6.081 0.000 19.392) 20.323 16.897 ( -2.554 0.000 -4.402) 5.089 17.029 ( 1.521 0.000 5.118) 5.339 17.674 ( 5.974 0.000 -5.414) 8.062 18.271 ( -0.103 0.000 -4.721) 4.723 19.215 ( 12.937 0.000 -7.148) 14.781 20.065 ( -15.546 0.000 6.015) 16.669 ======================= Grid point 302 (146/195) ======================= q-point: ( 0.45 0.00 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 0.349 0.000 4.756) 4.769 1.936 ( -10.845 0.000 -8.818) 13.978 2.094 ( 17.530 0.000 -1.754) 17.618 2.182 ( 17.499 0.000 -1.842) 17.595 2.418 ( -2.140 0.000 0.397) 2.177 2.522 ( -17.832 0.000 -7.783) 19.456 2.823 ( -0.985 0.000 4.241) 4.354 2.837 ( -4.084 0.000 0.578) 4.125 3.251 ( 1.084 0.000 4.570) 4.697 3.359 ( -4.078 0.000 -1.637) 4.394 3.656 ( 10.276 0.000 7.995) 13.020 3.942 ( -10.301 0.000 0.292) 10.305 4.155 ( 1.499 0.000 -5.074) 5.291 4.243 ( -2.804 0.000 -6.258) 6.858 4.358 ( 8.697 0.000 1.253) 8.787 4.577 ( -5.916 0.000 -1.266) 6.050 5.072 ( -0.838 0.000 -0.762) 1.133 5.113 ( 1.219 0.000 -3.553) 3.756 6.570 ( -1.902 0.000 2.896) 3.465 6.615 ( -1.578 0.000 0.043) 1.579 7.510 ( -0.450 0.000 10.500) 10.509 7.630 ( 3.433 0.000 0.461) 3.464 8.205 ( 0.084 0.000 -3.763) 3.764 8.340 ( -1.911 0.000 -10.931) 11.097 8.649 ( -4.887 0.000 0.011) 4.887 8.652 ( 1.809 0.000 -3.613) 4.041 8.994 ( 2.398 0.000 2.674) 3.592 9.129 ( -7.812 0.000 1.434) 7.942 9.552 ( -2.737 0.000 11.513) 11.834 9.722 ( 1.461 0.000 -0.173) 1.471 9.876 ( 5.768 0.000 5.218) 7.778 9.902 ( 1.903 0.000 -0.741) 2.043 10.168 ( 1.477 0.000 1.239) 1.928 10.397 ( 1.423 0.000 -4.975) 5.174 10.444 ( 3.641 0.000 -5.793) 6.842 10.614 ( -6.822 0.000 -10.291) 12.347 11.023 ( 9.088 0.000 5.634) 10.693 11.423 ( -12.878 0.000 -7.247) 14.777 11.597 ( 18.596 0.000 4.848) 19.218 11.748 ( 4.771 0.000 5.734) 7.459 11.918 ( -4.501 0.000 -6.330) 7.767 12.191 ( -10.623 0.000 -4.272) 11.449 12.553 ( -4.270 0.000 3.006) 5.222 12.695 ( 3.414 0.000 -6.969) 7.760 13.647 ( -0.671 0.000 5.091) 5.135 13.695 ( 1.191 0.000 -0.606) 1.336 13.800 ( 3.531 0.000 3.112) 4.706 13.950 ( -3.891 0.000 -1.324) 4.110 15.676 ( 10.157 0.000 0.490) 10.169 15.912 ( -2.466 0.000 -2.365) 3.417 16.125 ( -3.984 0.000 2.590) 4.752 16.248 ( -6.087 0.000 0.314) 6.096 16.557 ( 9.419 0.000 -0.241) 9.422 16.753 ( -12.300 0.000 5.943) 13.661 16.888 ( 1.446 0.000 9.316) 9.427 17.128 ( 4.412 0.000 1.396) 4.628 17.729 ( 7.107 0.000 -2.625) 7.576 18.084 ( -7.241 0.000 -11.581) 13.658 19.481 ( 19.257 0.000 0.572) 19.265 19.816 ( -18.570 0.000 2.028) 18.680 ======================= Grid point 303 (147/195) ======================= q-point: (-0.45 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.711 ( -3.412 0.000 -7.429) 8.175 1.728 ( 2.648 0.000 10.936) 11.252 2.118 ( -18.547 0.000 -4.528) 19.092 2.251 ( -5.195 0.000 -6.779) 8.540 2.424 ( 15.942 0.000 2.226) 16.097 2.428 ( 11.112 0.000 -2.093) 11.308 2.838 ( -0.922 0.000 1.603) 1.849 2.839 ( -0.595 0.000 2.661) 2.727 3.303 ( -1.196 0.000 -0.596) 1.337 3.317 ( 2.313 0.000 2.699) 3.554 3.749 ( -10.099 0.000 -2.287) 10.354 3.897 ( 9.478 0.000 4.242) 10.384 4.146 ( -0.913 0.000 -3.627) 3.740 4.172 ( 3.381 0.000 0.289) 3.393 4.411 ( -8.670 0.000 -3.383) 9.307 4.534 ( 7.749 0.000 2.915) 8.279 5.061 ( -1.304 0.000 1.587) 2.054 5.088 ( 0.094 0.000 -2.351) 2.353 6.600 ( 1.891 0.000 1.745) 2.574 6.611 ( 1.975 0.000 -1.331) 2.382 7.593 ( -1.519 0.000 5.352) 5.564 7.659 ( 2.182 0.000 -4.102) 4.647 8.208 ( -0.677 0.000 -5.375) 5.418 8.208 ( 1.961 0.000 1.810) 2.669 8.592 ( -3.734 0.000 2.638) 4.572 8.667 ( 3.128 0.000 -1.567) 3.499 9.032 ( -3.173 0.000 -1.135) 3.370 9.125 ( 8.702 0.000 1.835) 8.894 9.600 ( -4.865 0.000 9.853) 10.989 9.732 ( 3.643 0.000 -5.609) 6.689 9.906 ( -3.378 0.000 -1.965) 3.908 9.945 ( 1.828 0.000 -0.513) 1.899 10.248 ( -0.573 0.000 9.943) 9.959 10.305 ( -3.545 0.000 -11.269) 11.814 10.388 ( -7.788 0.000 -1.177) 7.877 10.511 ( 6.980 0.000 0.406) 6.992 11.137 ( -10.506 0.000 -6.225) 12.212 11.257 ( 7.544 0.000 8.762) 11.563 11.737 ( -10.726 0.000 -8.080) 13.429 11.797 ( 3.789 0.000 6.443) 7.475 11.885 ( -8.393 0.000 -8.999) 12.305 12.081 ( 17.635 0.000 6.203) 18.694 12.563 ( -3.114 0.000 6.701) 7.389 12.651 ( 1.326 0.000 -6.442) 6.578 13.671 ( -1.288 0.000 2.301) 2.637 13.709 ( 1.609 0.000 -1.608) 2.275 13.856 ( -3.814 0.000 -2.824) 4.746 13.911 ( 4.605 0.000 2.793) 5.386 15.701 ( -13.378 0.000 -1.907) 13.513 15.858 ( 5.666 0.000 3.093) 6.455 16.161 ( 0.381 0.000 -1.481) 1.529 16.237 ( 8.894 0.000 1.849) 9.084 16.560 ( -14.453 0.000 0.865) 14.479 16.709 ( 4.961 0.000 2.962) 5.778 17.004 ( -2.240 0.000 9.999) 10.247 17.176 ( 6.941 0.000 -10.287) 12.409 17.828 ( -6.035 0.000 -10.261) 11.904 17.886 ( 8.243 0.000 6.425) 10.451 19.487 ( -20.688 0.000 -0.027) 20.688 19.826 ( 19.017 0.000 0.989) 19.043 ======================= Grid point 304 (148/195) ======================= q-point: (-0.36 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( -11.138 0.000 0.232) 11.140 1.728 ( -19.590 0.000 10.962) 22.448 1.867 ( -0.033 0.000 -4.509) 4.509 2.203 ( 8.026 0.000 -4.619) 9.260 2.471 ( 0.226 0.000 -6.141) 6.146 2.690 ( 4.254 0.000 5.568) 7.008 2.879 ( 7.896 0.000 1.666) 8.070 2.883 ( 2.678 0.000 3.988) 4.804 3.278 ( 0.677 0.000 -3.510) 3.575 3.415 ( 3.875 0.000 1.956) 4.341 3.553 ( -5.770 0.000 -4.810) 7.512 4.090 ( 6.272 0.000 5.374) 8.259 4.138 ( 3.576 0.000 -1.817) 4.011 4.232 ( -4.582 0.000 -0.712) 4.637 4.274 ( 2.508 0.000 1.959) 3.182 4.639 ( 1.268 0.000 -0.459) 1.349 5.063 ( -1.608 0.000 3.131) 3.519 5.082 ( 1.120 0.000 0.632) 1.285 6.660 ( 6.554 0.000 -2.246) 6.929 6.675 ( 5.555 0.000 0.444) 5.573 7.574 ( -3.228 0.000 -1.019) 3.385 7.606 ( 2.118 0.000 -10.444) 10.657 8.209 ( 2.807 0.000 1.590) 3.226 8.291 ( -0.491 0.000 7.205) 7.222 8.594 ( -0.594 0.000 5.797) 5.827 8.723 ( 3.907 0.000 0.982) 4.029 9.010 ( 1.902 0.000 -0.671) 2.017 9.302 ( 10.471 0.000 -0.733) 10.497 9.644 ( -2.398 0.000 -12.688) 12.913 9.652 ( -1.864 0.000 9.483) 9.665 9.833 ( -7.217 0.000 -12.288) 14.250 9.860 ( -1.300 0.000 3.150) 3.408 10.099 ( -8.350 0.000 -3.682) 9.126 10.316 ( -2.879 0.000 7.092) 7.654 10.350 ( -1.187 0.000 7.889) 7.978 10.655 ( 3.774 0.000 5.237) 6.455 10.922 ( -6.558 0.000 -5.782) 8.743 11.251 ( -19.329 0.000 -2.900) 19.546 11.581 ( 7.070 0.000 3.257) 7.784 11.769 ( 1.125 0.000 -4.021) 4.175 11.951 ( 5.102 0.000 6.478) 8.246 12.359 ( 9.428 0.000 -1.688) 9.578 12.565 ( -5.978 0.000 5.987) 8.460 12.630 ( 2.708 0.000 -0.799) 2.824 13.670 ( -0.883 0.000 1.363) 1.624 13.697 ( 1.267 0.000 -5.016) 5.173 13.777 ( -1.283 0.000 -2.112) 2.471 14.008 ( 3.755 0.000 1.296) 3.972 15.480 ( -11.815 0.000 2.221) 12.022 15.869 ( -3.168 0.000 -1.117) 3.359 16.268 ( -15.659 0.000 -2.404) 15.843 16.297 ( 12.086 0.000 1.809) 12.221 16.434 ( 7.162 0.000 4.073) 8.239 16.775 ( -1.427 0.000 2.796) 3.139 17.034 ( -3.796 0.000 4.292) 5.730 17.148 ( 10.124 0.000 -18.058) 20.702 17.667 ( -2.122 0.000 -4.842) 5.286 18.123 ( 6.453 0.000 9.431) 11.427 19.130 ( -20.732 0.000 2.049) 20.834 20.136 ( 16.939 0.000 -1.499) 17.005 ======================= Grid point 305 (149/195) ======================= q-point: (-0.27 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( -18.492 0.000 11.393) 21.719 1.481 ( -21.491 0.000 12.068) 24.647 1.933 ( 10.910 0.000 -8.314) 13.717 2.186 ( -13.281 0.000 7.703) 15.353 2.388 ( 0.331 0.000 -4.497) 4.509 2.813 ( 8.476 0.000 2.267) 8.774 2.981 ( 1.612 0.000 5.264) 5.505 3.044 ( 2.198 0.000 -4.802) 5.281 3.254 ( 2.704 0.000 -4.631) 5.363 3.345 ( 2.297 0.000 -3.311) 4.030 3.631 ( 8.803 0.000 1.515) 8.933 4.149 ( -1.991 0.000 -1.329) 2.394 4.172 ( 2.828 0.000 -1.375) 3.144 4.257 ( 5.496 0.000 3.179) 6.349 4.382 ( 3.312 0.000 4.300) 5.428 4.569 ( -5.272 0.000 -2.896) 6.015 5.081 ( -1.048 0.000 3.862) 4.001 5.133 ( 2.416 0.000 1.497) 2.842 6.792 ( 12.219 0.000 -2.578) 12.488 6.810 ( 9.817 0.000 0.211) 9.820 7.488 ( -3.176 0.000 -2.931) 4.321 7.518 ( 3.751 0.000 -11.954) 12.529 8.299 ( 4.294 0.000 1.640) 4.597 8.313 ( -5.174 0.000 5.916) 7.859 8.719 ( 3.015 0.000 9.368) 9.842 8.819 ( 3.180 0.000 3.946) 5.068 9.060 ( 1.335 0.000 3.009) 3.292 9.378 ( -5.683 0.000 -12.240) 13.495 9.478 ( 8.807 0.000 -4.355) 9.825 9.490 ( -12.266 0.000 -14.642) 19.101 9.724 ( -4.735 0.000 8.258) 9.519 9.888 ( -1.227 0.000 3.998) 4.182 9.990 ( 0.466 0.000 2.529) 2.572 10.331 ( -5.801 0.000 7.549) 9.521 10.476 ( 0.735 0.000 11.158) 11.183 10.644 ( -12.227 0.000 -0.277) 12.230 10.760 ( -3.912 0.000 -6.818) 7.861 10.969 ( -1.971 0.000 -4.056) 4.509 11.664 ( -1.871 0.000 1.903) 2.669 11.885 ( 8.442 0.000 6.833) 10.861 12.104 ( 4.166 0.000 4.472) 6.112 12.400 ( 5.126 0.000 -7.351) 8.962 12.489 ( -9.327 0.000 3.963) 10.134 12.677 ( -0.050 0.000 0.148) 0.156 13.663 ( 3.356 0.000 -6.138) 6.996 13.689 ( 0.402 0.000 2.756) 2.785 13.759 ( 1.100 0.000 -1.274) 1.683 14.066 ( 2.447 0.000 -0.709) 2.548 15.362 ( -8.752 0.000 7.912) 11.798 15.797 ( -0.677 0.000 -4.813) 4.861 15.950 ( -18.781 0.000 0.833) 18.800 16.514 ( 10.970 0.000 -2.027) 11.156 16.608 ( 7.898 0.000 2.086) 8.169 16.743 ( -3.268 0.000 1.548) 3.616 16.996 ( -3.054 0.000 0.593) 3.111 17.122 ( 10.662 0.000 -16.820) 19.914 17.624 ( 0.507 0.000 -1.878) 1.945 18.197 ( -7.594 0.000 -1.753) 7.793 18.943 ( -8.709 0.000 15.676) 17.933 20.358 ( 13.435 0.000 -5.663) 14.580 ======================= Grid point 306 (150/195) ======================= q-point: (-0.18 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( -13.913 0.000 20.802) 25.025 1.332 ( -16.143 0.000 18.503) 24.555 1.945 ( 3.855 0.000 -10.938) 11.597 2.031 ( -21.587 0.000 21.348) 30.360 2.439 ( 9.479 0.000 -1.586) 9.610 2.798 ( -5.375 0.000 -17.535) 18.341 3.022 ( 9.251 0.000 0.469) 9.263 3.057 ( 0.375 0.000 4.766) 4.781 3.266 ( 2.550 0.000 -2.022) 3.254 3.473 ( 7.348 0.000 2.814) 7.869 3.746 ( 4.763 0.000 -4.534) 6.576 4.122 ( -0.324 0.000 0.851) 0.911 4.148 ( 0.676 0.000 -9.634) 9.658 4.331 ( -0.823 0.000 2.212) 2.360 4.475 ( 2.047 0.000 3.497) 4.052 4.487 ( -0.510 0.000 0.819) 0.964 5.113 ( -0.641 0.000 3.800) 3.854 5.176 ( 1.505 0.000 -0.135) 1.511 7.005 ( 11.599 0.000 0.349) 11.604 7.006 ( 15.758 0.000 -3.176) 16.075 7.423 ( -1.087 0.000 -1.015) 1.487 7.470 ( 6.383 0.000 -10.667) 12.430 8.297 ( -3.632 0.000 5.698) 6.757 8.370 ( 3.211 0.000 -1.335) 3.477 8.806 ( -7.521 0.000 4.596) 8.815 8.842 ( -6.550 0.000 -0.627) 6.580 9.046 ( -8.245 0.000 -3.506) 8.959 9.144 ( -2.932 0.000 -7.166) 7.743 9.218 ( 0.254 0.000 1.620) 1.640 9.583 ( 8.003 0.000 -6.440) 10.273 9.705 ( -6.077 0.000 8.421) 10.385 9.916 ( -2.181 0.000 7.004) 7.335 10.159 ( 9.493 0.000 5.735) 11.091 10.217 ( -16.180 0.000 6.715) 17.518 10.438 ( -0.830 0.000 -6.169) 6.224 10.520 ( -6.965 0.000 -0.040) 6.965 10.704 ( 3.595 0.000 2.737) 4.518 10.983 ( 1.984 0.000 0.098) 1.986 11.653 ( -1.510 0.000 2.883) 3.255 12.081 ( 0.514 0.000 9.318) 9.332 12.161 ( 0.204 0.000 -1.425) 1.439 12.390 ( -4.716 0.000 4.091) 6.243 12.428 ( 6.279 0.000 -6.423) 8.982 12.611 ( -3.848 0.000 -2.539) 4.610 13.669 ( 5.228 0.000 -5.976) 7.941 13.732 ( -0.466 0.000 3.451) 3.483 13.787 ( 3.064 0.000 -0.151) 3.067 14.076 ( 1.123 0.000 -2.593) 2.825 15.338 ( -10.416 0.000 12.998) 16.656 15.695 ( -12.151 0.000 5.312) 13.261 15.732 ( 3.040 0.000 -10.048) 10.498 16.538 ( 3.032 0.000 -11.685) 12.072 16.729 ( 4.081 0.000 0.535) 4.116 16.797 ( 3.523 0.000 4.722) 5.892 16.979 ( -0.523 0.000 2.794) 2.843 17.117 ( 8.433 0.000 -11.807) 14.510 17.575 ( -1.004 0.000 -7.494) 7.561 17.872 ( -19.420 0.000 -7.388) 20.778 19.154 ( 2.213 0.000 23.617) 23.720 20.454 ( 8.721 0.000 -10.741) 13.835 ======================= Grid point 307 (151/195) ======================= q-point: (-0.09 0.00 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 195 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( -11.951 0.000 21.359) 24.475 1.375 ( -6.874 0.000 26.030) 26.922 1.860 ( 4.590 0.000 -14.138) 14.864 2.016 ( -13.389 0.000 28.115) 31.140 2.488 ( -4.549 0.000 -18.316) 18.872 2.632 ( 12.686 0.000 -0.464) 12.695 3.086 ( -2.157 0.000 1.540) 2.651 3.169 ( 7.785 0.000 -1.808) 7.992 3.271 ( -1.826 0.000 1.933) 2.660 3.598 ( 3.119 0.000 -2.619) 4.073 3.702 ( 1.031 0.000 -4.260) 4.383 4.010 ( -1.105 0.000 -10.050) 10.110 4.166 ( 0.147 0.000 4.835) 4.837 4.328 ( 0.866 0.000 -1.956) 2.139 4.524 ( 1.399 0.000 1.735) 2.228 4.531 ( 0.465 0.000 2.421) 2.465 5.142 ( -0.882 0.000 3.218) 3.337 5.188 ( 0.872 0.000 -0.989) 1.319 7.168 ( 5.622 0.000 0.358) 5.633 7.210 ( 11.341 0.000 -4.306) 12.130 7.443 ( 2.346 0.000 2.461) 3.400 7.508 ( 11.059 0.000 -8.004) 13.652 8.337 ( 0.254 0.000 5.527) 5.533 8.345 ( -2.625 0.000 -5.135) 5.767 8.530 ( -17.756 0.000 -3.403) 18.079 8.649 ( -6.178 0.000 -5.055) 7.983 8.940 ( -2.163 0.000 0.207) 2.173 9.067 ( -4.901 0.000 0.233) 4.907 9.380 ( 5.410 0.000 10.694) 11.985 9.633 ( 7.415 0.000 -4.119) 8.482 9.729 ( -3.396 0.000 8.381) 9.043 9.960 ( -1.212 0.000 1.393) 1.846 10.100 ( -4.476 0.000 2.490) 5.122 10.315 ( -2.802 0.000 -3.452) 4.446 10.388 ( -0.802 0.000 4.030) 4.108 10.416 ( 2.060 0.000 0.080) 2.062 10.846 ( 5.830 0.000 5.519) 8.028 11.015 ( 0.259 0.000 2.641) 2.654 11.672 ( -0.563 0.000 2.939) 2.992 12.091 ( -7.307 0.000 7.446) 10.432 12.091 ( -3.110 0.000 -6.358) 7.078 12.352 ( -0.970 0.000 -10.872) 10.915 12.468 ( 3.274 0.000 6.975) 7.705 12.610 ( 3.598 0.000 0.430) 3.624 13.691 ( 4.297 0.000 -4.481) 6.208 13.734 ( -3.376 0.000 2.320) 4.096 13.859 ( 5.033 0.000 0.349) 5.045 14.047 ( -0.317 0.000 -3.477) 3.491 15.264 ( -16.110 0.000 15.874) 22.617 15.660 ( 6.416 0.000 -15.908) 17.153 15.720 ( 0.482 0.000 13.035) 13.044 16.429 ( 2.121 0.000 -13.962) 14.122 16.783 ( 1.891 0.000 0.787) 2.049 16.879 ( 1.702 0.000 -0.143) 1.708 17.025 ( 0.447 0.000 4.113) 4.137 17.142 ( 6.534 0.000 -5.410) 8.483 17.462 ( 0.169 0.000 -8.880) 8.882 17.462 ( -18.157 0.000 -4.126) 18.620 19.493 ( 3.244 0.000 24.557) 24.770 20.405 ( 3.630 0.000 -15.505) 15.924 ======================= Grid point 308 (152/195) ======================= q-point: ( 0.00 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -8.490 2.925 21.350) 23.161 1.562 ( 0.694 -1.086 21.272) 21.311 1.833 ( 9.707 2.242 -14.261) 17.396 2.012 ( -3.109 -4.585 -18.792) 19.591 2.503 ( -2.558 13.109 22.585) 26.238 2.857 ( 8.215 8.394 -10.620) 15.835 3.090 ( -1.663 1.092 4.501) 4.922 3.176 ( -2.394 -4.218 -0.303) 4.859 3.237 ( -1.801 -1.447 1.322) 2.662 3.398 ( 1.340 -8.271 -11.889) 14.544 3.735 ( 1.294 -3.121 6.778) 7.573 3.883 ( -1.636 -1.993 -8.537) 8.918 4.221 ( -1.438 0.969 5.005) 5.297 4.310 ( 1.737 -0.150 -3.678) 4.070 4.545 ( 0.041 -0.339 0.907) 0.969 4.552 ( -0.735 -0.571 0.438) 1.029 5.136 ( -1.226 -2.263 2.070) 3.303 5.158 ( 0.945 -3.094 -0.476) 3.270 7.164 ( -1.613 -4.188 1.351) 4.687 7.219 ( 1.748 -5.236 -3.885) 6.750 7.482 ( -2.807 -1.504 3.636) 4.833 7.579 ( 5.047 -2.107 -6.837) 8.755 8.217 ( 7.536 -2.603 -0.738) 8.007 8.248 ( -9.636 -1.244 -4.146) 10.563 8.464 ( -0.533 1.998 5.341) 5.727 8.560 ( 1.026 0.929 -4.619) 4.822 8.908 ( -1.381 -5.254 2.462) 5.965 8.934 ( -0.992 -4.374 -0.110) 4.487 9.575 ( 3.720 -0.850 9.374) 10.121 9.672 ( -1.357 -2.906 1.338) 3.475 9.774 ( 2.451 -0.752 -1.013) 2.757 9.825 ( -1.909 -2.741 -6.489) 7.299 10.147 ( -0.046 2.911 3.518) 4.567 10.224 ( -1.479 2.246 -4.486) 5.231 10.460 ( -1.830 3.464 7.053) 8.068 10.538 ( 1.808 5.865 -0.761) 6.185 11.009 ( 5.586 0.097 1.842) 5.882 11.014 ( -2.639 -0.859 0.973) 2.941 11.751 ( 2.842 1.532 7.504) 8.169 11.891 ( -5.206 -1.509 -5.200) 7.512 12.148 ( -3.060 4.543 2.711) 6.111 12.261 ( 2.467 1.325 -7.491) 7.997 12.568 ( -0.822 -1.184 5.607) 5.790 12.656 ( 2.387 0.583 -3.691) 4.434 13.708 ( -2.756 2.715 2.996) 4.893 13.761 ( 1.334 4.048 -2.568) 4.976 13.939 ( 4.055 -0.732 0.569) 4.160 13.986 ( -1.816 0.137 -3.964) 4.362 15.256 ( -11.091 3.224 18.391) 21.717 15.593 ( 8.393 0.241 -16.309) 18.343 15.912 ( 2.091 -1.814 15.890) 16.129 16.247 ( -0.543 -1.612 -18.365) 18.443 16.679 ( -3.677 -11.142 4.526) 12.576 16.783 ( 3.198 -5.761 -5.395) 8.515 16.974 ( 1.620 -6.286 6.381) 9.103 17.107 ( -2.887 -6.487 -7.149) 10.075 17.468 ( -3.680 16.495 2.223) 17.046 17.543 ( 4.686 12.910 -5.207) 14.688 19.793 ( 1.174 -2.198 22.483) 22.621 20.182 ( -1.166 -3.904 -18.498) 18.942 ======================= Grid point 309 (153/195) ======================= q-point: ( 0.09 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( -3.040 2.742 15.922) 16.440 1.712 ( 4.424 2.220 -5.883) 7.688 1.762 ( 5.722 -5.281 -22.321) 23.640 2.000 ( 9.646 -1.630 12.358) 15.761 2.596 ( -9.126 6.302 4.065) 11.812 2.758 ( 4.167 14.224 -15.283) 21.290 3.084 ( -7.565 -1.917 1.754) 7.999 3.126 ( -0.554 0.215 1.308) 1.437 3.296 ( 2.140 -7.413 5.025) 9.208 3.361 ( 3.266 -3.784 -0.323) 5.009 3.736 ( -4.020 -3.904 -6.588) 8.649 3.840 ( 0.179 -0.830 7.614) 7.661 4.251 ( -1.079 0.396 4.168) 4.324 4.274 ( 0.197 0.345 -5.079) 5.095 4.537 ( -1.065 -1.301 0.093) 1.684 4.556 ( -0.132 0.660 0.721) 0.986 5.131 ( -1.394 -3.202 1.167) 3.682 5.163 ( 0.535 -2.419 -1.088) 2.706 7.084 ( -9.028 -4.970 1.779) 10.458 7.151 ( -7.089 -4.580 -1.340) 8.546 7.415 ( -7.728 0.963 3.164) 8.406 7.510 ( -2.080 -1.651 -5.841) 6.416 8.177 ( 2.434 -8.387 0.694) 8.760 8.425 ( 5.410 2.101 0.182) 5.806 8.538 ( 10.849 -0.093 4.557) 11.767 8.568 ( 5.207 2.564 -1.669) 6.039 8.852 ( -3.430 -8.706 1.412) 9.463 9.016 ( 3.620 -2.772 1.671) 4.856 9.543 ( -5.083 0.363 -4.412) 6.741 9.664 ( -5.066 3.321 -4.030) 7.276 9.803 ( 5.900 -4.071 -0.265) 7.173 9.856 ( 5.971 -3.258 2.956) 7.417 10.138 ( -1.355 0.877 -0.259) 1.635 10.222 ( 0.107 -1.035 3.489) 3.641 10.490 ( 0.462 7.410 1.031) 7.496 10.541 ( -0.082 5.699 -2.585) 6.258 10.922 ( -4.118 -1.080 -3.016) 5.217 11.100 ( 3.940 0.635 -3.117) 5.064 11.742 ( -3.719 0.579 -5.010) 6.266 11.934 ( 5.991 -1.708 8.909) 10.871 12.166 ( -1.664 3.957 5.690) 7.128 12.233 ( 1.831 -2.191 -3.825) 4.773 12.584 ( -0.670 2.431 0.009) 2.522 12.647 ( 1.641 1.413 -3.184) 3.851 13.673 ( -4.455 5.196 2.566) 7.310 13.774 ( 1.469 1.488 -0.511) 2.152 13.892 ( -3.384 -0.289 -3.786) 5.087 13.994 ( 1.210 -0.758 1.258) 1.903 15.339 ( -5.042 2.658 17.835) 18.723 15.567 ( 9.483 0.737 -13.372) 16.410 16.000 ( -0.866 -2.411 -16.347) 16.547 16.122 ( -0.984 -1.605 14.130) 14.255 16.631 ( -5.366 -10.080 3.619) 11.979 16.795 ( -0.616 -8.193 -1.849) 8.421 16.953 ( 1.776 -3.412 -3.204) 5.006 17.240 ( 11.462 -1.206 4.638) 12.423 17.431 ( -3.253 11.113 3.629) 12.134 17.560 ( 4.391 12.425 -4.711) 13.995 19.897 ( -4.758 -3.178 -20.677) 21.454 20.030 ( -2.772 -3.353 19.716) 20.190 ======================= Grid point 310 (154/195) ======================= q-point: ( 0.18 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 4.757 -4.557 -14.228) 15.679 1.670 ( 9.778 0.984 -11.155) 14.867 1.798 ( 3.194 5.276 4.284) 7.509 2.313 ( 2.287 -5.419 12.085) 13.440 2.446 ( -2.315 3.624 1.554) 4.572 2.648 ( 4.733 12.752 -14.405) 19.813 2.947 ( -9.833 -3.829 1.603) 10.673 3.158 ( -1.587 5.351 3.501) 6.589 3.270 ( -0.730 -5.055 -5.523) 7.523 3.485 ( -0.234 -4.852 5.546) 7.373 3.575 ( -5.454 -5.113 -3.448) 8.233 3.933 ( -2.053 -1.530 8.426) 8.807 4.207 ( -0.088 1.117 -3.953) 4.109 4.301 ( 2.000 -1.280 2.553) 3.486 4.521 ( -0.550 -0.326 -0.568) 0.855 4.551 ( -0.177 2.910 -1.169) 3.141 5.118 ( -1.134 -4.648 0.336) 4.796 5.152 ( 0.342 -2.223 -1.901) 2.945 6.915 ( -12.931 -3.716 2.451) 13.676 6.967 ( -11.409 -4.172 -0.781) 12.173 7.319 ( -6.779 0.207 3.729) 7.739 7.462 ( 1.389 1.110 -1.684) 2.448 8.210 ( -0.327 -9.733 -0.483) 9.751 8.468 ( 3.552 1.536 -1.283) 4.077 8.676 ( 7.777 -4.069 2.381) 9.095 8.807 ( -2.739 -13.829 2.800) 14.373 8.914 ( 17.399 5.018 5.074) 18.806 9.044 ( -2.574 -2.056 1.971) 3.839 9.390 ( -3.136 3.722 -8.340) 9.657 9.549 ( -8.175 5.456 3.281) 10.362 9.835 ( 4.014 -0.497 -4.376) 5.959 9.980 ( 3.007 -3.029 -3.159) 5.310 10.175 ( 4.048 -4.231 2.154) 6.239 10.254 ( 1.893 -2.678 1.301) 3.529 10.475 ( 2.907 4.243 -5.621) 7.619 10.538 ( 0.791 7.068 2.579) 7.566 10.839 ( 0.308 2.348 -5.616) 6.095 11.071 ( -0.130 2.595 -6.306) 6.821 11.666 ( -1.366 -0.739 -0.852) 1.771 12.098 ( 4.074 -7.761 0.012) 8.765 12.164 ( -4.974 -7.180 0.263) 8.738 12.239 ( -0.246 5.668 6.052) 8.295 12.604 ( 2.313 8.633 -1.366) 9.041 12.650 ( 4.974 5.541 -1.319) 7.562 13.622 ( -5.467 4.675 3.133) 7.846 13.754 ( -1.918 -2.313 -3.601) 4.690 13.818 ( -1.181 0.838 -0.505) 1.534 14.021 ( -0.718 -0.226 2.865) 2.962 15.418 ( -1.605 -3.842 1.576) 4.452 15.638 ( 8.249 3.825 1.304) 9.185 15.880 ( 6.626 1.654 -10.210) 12.284 16.222 ( -6.646 -6.001 13.472) 16.177 16.596 ( -0.945 -6.924 0.492) 7.006 16.739 ( -5.532 -7.467 3.200) 9.828 16.964 ( 3.169 2.271 -5.056) 6.385 17.328 ( -5.043 13.606 3.363) 14.895 17.522 ( 4.370 6.789 -0.396) 8.084 17.705 ( 17.053 -4.062 4.928) 18.210 19.554 ( -5.959 -3.001 -21.091) 22.121 20.151 ( -7.351 -4.617 15.570) 17.826 ======================= Grid point 311 (155/195) ======================= q-point: ( 0.27 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( 7.970 -5.747 -12.056) 15.553 1.754 ( 15.540 3.439 -10.648) 19.149 1.852 ( -3.451 4.099 3.692) 6.507 2.269 ( -4.495 -2.639 2.712) 5.875 2.559 ( 2.534 13.415 -8.479) 16.071 2.684 ( 2.537 -4.343 10.223) 11.393 2.839 ( -1.278 -4.992 1.754) 5.443 3.143 ( -1.706 4.031 -3.050) 5.335 3.186 ( -4.879 -1.271 1.341) 5.217 3.333 ( -7.210 -2.276 -5.361) 9.269 3.564 ( -5.293 -5.362 4.156) 8.605 3.947 ( -3.295 -6.884 4.762) 8.996 4.196 ( 1.255 1.564 -1.086) 2.280 4.352 ( 1.463 -0.495 -2.120) 2.622 4.484 ( -1.057 1.091 -3.974) 4.254 4.558 ( 2.629 3.689 0.846) 4.608 5.093 ( -0.938 -5.554 -1.699) 5.883 5.136 ( 0.455 -2.108 -1.851) 2.842 6.731 ( -11.302 -1.270 2.958) 11.752 6.776 ( -9.442 -3.390 -0.296) 10.036 7.297 ( -2.674 -1.531 6.437) 7.136 7.497 ( 2.551 2.899 1.442) 4.122 8.177 ( -0.908 -10.057 -2.255) 10.347 8.505 ( 3.152 2.719 -2.245) 4.729 8.734 ( -2.375 -12.958 -3.300) 13.580 8.824 ( 0.872 -7.776 -1.454) 7.959 8.991 ( -1.815 -4.778 4.610) 6.883 9.247 ( -4.091 4.494 1.209) 6.196 9.294 ( 9.322 4.434 5.957) 11.918 9.447 ( -5.957 4.573 4.194) 8.602 9.859 ( 3.677 0.118 -4.342) 5.691 9.932 ( -2.255 -1.138 -2.900) 3.846 10.133 ( -0.355 3.877 -2.506) 4.630 10.418 ( 1.028 -3.242 -1.624) 3.769 10.523 ( 17.491 -6.072 -6.355) 19.575 10.666 ( 7.613 2.454 7.228) 10.780 10.770 ( 2.395 6.418 -10.099) 12.203 10.992 ( -1.681 3.774 -2.613) 4.888 11.657 ( -0.145 -1.045 0.750) 1.295 11.954 ( -9.302 -8.173 -6.595) 14.029 12.146 ( -2.078 -7.458 -1.410) 7.870 12.306 ( -0.775 6.920 5.350) 8.781 12.621 ( 3.541 6.724 -2.069) 7.876 12.778 ( 6.967 9.321 0.765) 11.662 13.567 ( -4.803 1.030 3.483) 6.022 13.679 ( -1.897 -3.067 -2.395) 4.329 13.800 ( -0.972 2.119 0.165) 2.337 14.033 ( -1.914 0.112 2.693) 3.306 15.373 ( 1.852 -8.624 -5.832) 10.574 15.837 ( 7.653 8.948 6.495) 13.447 15.972 ( 11.365 1.525 -1.965) 11.634 16.205 ( -9.522 -13.987 7.495) 18.506 16.636 ( 4.056 1.417 1.112) 4.438 16.670 ( -9.877 -3.014 7.563) 12.800 16.949 ( 1.706 2.527 -3.000) 4.277 17.247 ( -7.235 15.336 1.347) 17.011 17.582 ( 5.380 0.088 -2.473) 5.922 18.085 ( 15.338 -4.158 6.636) 17.221 19.235 ( -2.270 -4.172 -18.626) 19.222 20.140 ( -11.809 -5.790 10.608) 16.897 ======================= Grid point 312 (156/195) ======================= q-point: ( 0.36 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 4.017 -5.513 -4.479) 8.160 1.793 ( -2.369 -2.985 -1.113) 3.970 1.958 ( 18.913 4.710 -7.060) 20.730 2.256 ( -3.343 -0.493 3.276) 4.706 2.457 ( -4.182 8.752 -2.401) 9.992 2.759 ( 1.833 0.525 2.839) 3.420 2.875 ( -4.566 -3.035 -1.586) 5.707 2.980 ( -8.582 2.098 -8.960) 12.583 3.119 ( -1.794 -5.081 7.618) 9.331 3.360 ( 5.597 0.971 6.558) 8.677 3.465 ( -6.118 -4.026 -0.863) 7.375 3.950 ( -4.443 -8.335 4.803) 10.596 4.219 ( 3.635 -0.571 -1.125) 3.847 4.281 ( -1.249 2.515 -7.688) 8.184 4.409 ( -1.203 3.067 -5.352) 6.285 4.619 ( 0.831 1.082 1.107) 1.757 5.053 ( -0.666 -5.585 -2.270) 6.065 5.120 ( 0.669 -1.668 -2.652) 3.204 6.612 ( -6.556 0.280 3.106) 7.260 6.652 ( -5.211 -2.078 0.786) 5.665 7.368 ( 0.198 -2.223 8.616) 8.900 7.570 ( 2.714 2.169 2.467) 4.261 8.135 ( -0.433 -9.592 -2.857) 10.017 8.501 ( 0.368 0.266 -7.253) 7.267 8.634 ( -1.529 -7.058 -4.081) 8.295 8.740 ( -3.955 -2.619 -2.974) 5.599 8.982 ( -3.908 -3.806 0.592) 5.487 9.208 ( -6.484 -2.027 4.230) 8.003 9.336 ( -1.596 -2.508 7.502) 8.069 9.646 ( 7.583 3.594 11.008) 13.842 9.803 ( -1.005 -0.244 -5.968) 6.057 9.920 ( 2.085 2.244 0.225) 3.072 10.158 ( 3.127 4.269 -0.668) 5.334 10.387 ( 2.340 -1.853 -4.447) 5.356 10.586 ( 0.942 1.879 -10.085) 10.302 10.775 ( 9.850 -1.785 -4.697) 11.057 10.840 ( 0.192 2.991 -2.134) 3.680 11.101 ( 16.257 -2.301 6.877) 17.801 11.638 ( -5.825 -4.718 -3.867) 8.435 11.724 ( -6.164 -1.331 -0.625) 6.337 12.041 ( -4.885 -4.048 -4.679) 7.883 12.313 ( -3.698 2.034 0.864) 4.308 12.659 ( 2.435 8.004 -0.959) 8.421 12.859 ( 3.384 10.884 -2.430) 11.654 13.560 ( -0.745 -3.308 3.749) 5.055 13.641 ( -1.108 -2.491 0.356) 2.750 13.796 ( -0.212 3.208 1.278) 3.460 14.011 ( -3.165 -0.273 0.727) 3.259 15.390 ( 6.668 -9.729 -3.181) 12.216 15.996 ( 0.132 7.380 2.633) 7.837 16.103 ( -3.394 -9.465 1.298) 10.139 16.196 ( 11.330 -1.451 5.067) 12.495 16.541 ( -9.776 0.783 2.169) 10.044 16.778 ( 2.931 3.913 9.398) 10.593 16.957 ( 0.955 3.713 -2.208) 4.424 17.140 ( -6.302 11.706 3.253) 13.687 17.641 ( 5.784 -2.102 -3.838) 7.253 18.261 ( 0.406 -1.058 -3.606) 3.780 19.142 ( 11.773 -7.365 -7.510) 15.787 19.998 ( -15.589 -6.633 5.635) 17.854 ======================= Grid point 313 (157/195) ======================= q-point: ( 0.45 0.11 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 1.075 -2.373 2.028) 3.302 1.741 ( -2.282 -12.022 -3.817) 12.818 2.186 ( 14.779 4.115 -8.001) 17.303 2.268 ( 4.035 3.786 3.043) 6.314 2.363 ( -7.021 1.495 0.785) 7.221 2.666 ( -8.484 9.424 -8.496) 15.263 2.821 ( -3.418 -1.440 1.752) 4.102 2.829 ( 0.416 1.469 3.639) 3.946 3.213 ( 0.946 -3.574 6.386) 7.379 3.343 ( -3.412 -1.568 -2.155) 4.329 3.585 ( 8.757 -5.803 5.715) 11.959 3.859 ( -8.986 -7.362 -0.793) 11.643 4.201 ( 1.971 3.929 -4.318) 6.162 4.283 ( -1.111 1.686 -0.544) 2.091 4.350 ( 5.631 0.401 -2.702) 6.259 4.567 ( -5.650 -0.954 -2.806) 6.380 5.034 ( 0.111 -3.758 0.047) 3.760 5.097 ( 0.540 -1.806 -3.181) 3.698 6.575 ( -1.889 0.489 2.723) 3.350 6.608 ( -1.213 -0.712 0.491) 1.490 7.485 ( 0.599 -2.350 9.012) 9.332 7.628 ( 1.829 -0.388 0.154) 1.876 8.109 ( 0.552 -7.358 -0.790) 7.421 8.335 ( -3.566 -2.782 -11.497) 12.355 8.616 ( -1.152 -1.755 0.809) 2.250 8.662 ( -0.057 -0.651 -3.197) 3.263 8.975 ( 1.767 -2.052 2.770) 3.874 9.108 ( -6.236 -1.685 0.139) 6.461 9.439 ( -2.036 -7.915 11.504) 14.112 9.722 ( 1.527 -4.263 -8.344) 9.493 9.845 ( 3.494 0.652 6.382) 7.305 9.980 ( 0.539 5.547 2.835) 6.253 10.175 ( -0.497 0.282 2.756) 2.815 10.405 ( 4.604 1.469 -5.624) 7.415 10.511 ( 2.507 5.244 -5.056) 7.704 10.671 ( -5.261 5.713 -9.226) 12.060 10.983 ( 9.184 -3.644 4.668) 10.928 11.364 ( -9.637 -6.811 -8.290) 14.422 11.495 ( 14.126 -6.587 7.000) 17.086 11.735 ( -1.519 -2.273 4.495) 5.261 11.914 ( -1.264 0.085 -4.069) 4.262 12.169 ( -9.023 -0.603 -6.411) 11.085 12.697 ( 1.240 12.847 2.634) 13.173 12.845 ( 0.424 12.052 -4.833) 12.992 13.611 ( 0.702 -4.489 3.298) 5.614 13.642 ( 0.386 -4.081 0.588) 4.141 13.830 ( 1.924 2.254 2.264) 3.729 13.946 ( -3.839 -0.316 -1.128) 4.014 15.528 ( 10.672 -9.872 0.966) 14.570 15.827 ( -12.156 -9.356 -3.328) 15.696 16.212 ( 5.185 7.650 3.821) 10.000 16.367 ( -4.923 8.956 2.545) 10.532 16.479 ( 5.882 -5.700 5.635) 9.942 16.837 ( -4.059 5.112 -8.869) 11.013 16.944 ( -3.551 6.971 15.125) 17.029 17.167 ( 4.842 4.293 0.489) 6.489 17.709 ( 6.255 -1.762 -0.740) 6.540 18.082 ( -7.119 -0.028 -11.532) 13.552 19.399 ( 18.993 -8.293 0.972) 20.747 19.746 ( -18.324 -7.064 1.543) 19.699 ======================= Grid point 314 (158/195) ======================= q-point: (-0.45 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -4.606 -8.621 0.990) 9.824 1.712 ( 7.722 -3.948 -1.896) 8.878 2.081 ( -16.964 1.225 1.738) 17.097 2.347 ( 7.324 2.236 -4.488) 8.876 2.443 ( 0.636 7.270 -7.210) 10.259 2.531 ( 9.952 5.919 4.145) 12.298 2.838 ( -1.233 0.471 2.749) 3.050 2.844 ( -1.032 0.810 0.704) 1.489 3.286 ( 0.430 -2.261 1.426) 2.708 3.297 ( 1.260 -1.416 0.430) 1.944 3.664 ( -9.495 -7.180 -3.319) 12.358 3.798 ( 9.086 -7.888 4.723) 12.926 4.196 ( -2.463 4.256 -2.832) 5.675 4.246 ( 4.206 5.162 0.269) 6.664 4.393 ( -8.008 -1.724 -3.923) 9.083 4.501 ( 7.009 -3.249 3.334) 8.414 5.044 ( -0.717 -1.803 1.515) 2.461 5.064 ( -0.140 -2.524 -2.300) 3.418 6.601 ( 1.776 0.086 1.361) 2.239 6.612 ( 2.108 0.086 -1.069) 2.365 7.560 ( -2.786 -3.166 4.511) 6.175 7.641 ( 3.076 -1.781 -3.538) 5.015 8.153 ( 0.553 -4.815 2.116) 5.289 8.183 ( 0.941 -2.729 -4.319) 5.195 8.585 ( -3.900 -1.130 2.791) 4.927 8.665 ( 3.028 -0.482 -2.251) 3.804 9.019 ( -2.192 -1.040 -1.602) 2.907 9.092 ( 7.458 -3.156 1.646) 8.264 9.523 ( -3.695 -7.035 11.637) 14.092 9.649 ( 1.860 -7.275 -9.370) 12.007 9.917 ( -3.806 1.444 -0.846) 4.158 9.974 ( 3.633 1.900 1.065) 4.236 10.255 ( -1.899 0.890 9.633) 9.858 10.331 ( -2.525 2.272 -10.875) 11.394 10.484 ( -6.000 8.555 -2.746) 10.804 10.566 ( 5.281 5.199 1.451) 7.551 11.066 ( -11.305 -6.141 -2.363) 13.080 11.235 ( 8.951 -2.825 3.564) 10.040 11.611 ( -10.335 -8.765 -4.230) 14.197 11.769 ( 9.292 -6.108 1.569) 11.230 11.921 ( -8.040 3.348 -6.151) 10.662 12.036 ( 10.102 0.129 6.876) 12.221 12.749 ( -0.877 14.608 2.670) 14.876 12.783 ( -0.025 11.517 -3.527) 12.045 13.624 ( -1.929 -5.010 1.097) 5.480 13.669 ( 2.423 -4.325 -1.186) 5.097 13.867 ( -2.800 1.171 -1.532) 3.399 13.912 ( 3.892 0.267 2.293) 4.525 15.570 ( -12.184 -8.680 -3.059) 15.269 15.762 ( 12.653 -9.595 3.120) 16.183 16.199 ( -10.712 5.879 5.021) 13.211 16.412 ( 10.518 8.603 -2.667) 13.847 16.580 ( -11.845 2.879 -0.784) 12.215 16.690 ( 3.678 -0.182 2.864) 4.665 17.019 ( -5.551 1.897 9.260) 10.961 17.246 ( 10.087 6.877 -9.879) 15.705 17.823 ( -4.873 -0.307 -7.066) 8.589 17.878 ( 6.896 -0.567 4.552) 8.283 19.414 ( -20.397 -7.406 -0.445) 21.704 19.749 ( 19.062 -7.826 1.190) 20.640 ======================= Grid point 315 (159/195) ======================= q-point: (-0.36 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.485 ( -10.911 -8.026 2.115) 13.709 1.815 ( -11.868 7.160 6.405) 15.269 1.839 ( 1.864 -0.715 -3.753) 4.251 2.325 ( 5.786 7.429 -5.390) 10.850 2.485 ( 1.979 3.138 -4.910) 6.154 2.719 ( -0.772 2.560 6.374) 6.912 2.846 ( 5.888 -2.228 1.590) 6.493 2.869 ( 2.511 -1.560 3.302) 4.432 3.263 ( 1.252 -1.534 -5.891) 6.215 3.388 ( 3.465 -2.543 2.654) 5.052 3.487 ( -4.562 -5.780 -2.865) 7.901 3.995 ( 7.680 -8.538 1.469) 11.578 4.157 ( -0.151 3.628 2.366) 4.334 4.232 ( -5.266 -1.052 -1.983) 5.724 4.340 ( 4.183 4.483 1.868) 6.409 4.619 ( 1.841 -1.935 1.483) 3.055 5.022 ( -1.249 -3.773 0.525) 4.009 5.075 ( 0.544 -1.204 1.847) 2.271 6.661 ( 6.196 -0.067 -1.848) 6.467 6.668 ( 5.402 -0.616 -0.623) 5.473 7.500 ( -2.837 -5.166 -3.924) 7.080 7.644 ( 1.857 1.614 -5.017) 5.588 8.112 ( 0.595 -6.436 -1.441) 6.623 8.321 ( 3.360 -0.843 9.846) 10.437 8.565 ( -2.315 -2.451 3.707) 5.011 8.707 ( 3.287 -1.527 0.361) 3.642 9.001 ( 2.212 -1.639 -1.329) 3.057 9.248 ( 9.082 -4.523 -0.335) 10.152 9.512 ( -2.590 -7.920 -7.928) 11.502 9.628 ( -1.334 -4.898 7.885) 9.378 9.825 ( -2.967 2.076 -3.599) 5.105 9.989 ( -3.152 7.300 -6.592) 10.329 10.147 ( -5.522 3.172 -0.950) 6.439 10.290 ( -3.820 -0.964 6.242) 7.381 10.421 ( -3.294 5.271 5.354) 8.203 10.669 ( -0.251 1.395 3.769) 4.026 10.874 ( -4.615 -2.512 -3.001) 6.051 11.219 ( -14.803 -2.832 -4.662) 15.776 11.537 ( 8.009 -4.189 3.767) 9.792 11.771 ( -1.140 0.936 -3.922) 4.190 11.954 ( 6.859 -2.133 4.263) 8.353 12.269 ( 6.532 -3.583 5.322) 9.155 12.686 ( -2.115 11.187 -3.613) 11.945 12.804 ( -1.061 12.054 3.194) 12.515 13.593 ( -1.275 -6.325 -0.519) 6.473 13.685 ( 2.325 -1.839 -2.977) 4.201 13.822 ( -0.570 3.240 -1.202) 3.503 14.004 ( 3.801 -0.526 1.363) 4.072 15.359 ( -9.511 -7.891 0.041) 12.359 15.998 ( 5.810 1.402 2.315) 6.409 16.088 ( -2.603 -5.008 2.841) 6.318 16.287 ( -16.080 2.238 -3.923) 16.702 16.566 ( 9.699 4.021 -2.014) 10.691 16.787 ( -0.600 1.819 5.395) 5.725 16.975 ( -5.775 -2.662 1.449) 6.522 17.287 ( 10.741 11.202 -12.829) 20.136 17.672 ( -1.507 0.872 -6.217) 6.456 18.118 ( 6.350 -0.330 10.232) 12.047 19.059 ( -20.081 -7.271 1.556) 21.414 20.063 ( 17.056 -7.343 -1.253) 18.611 ======================= Grid point 316 (160/195) ======================= q-point: (-0.27 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -15.086 -3.436 9.748) 18.287 1.565 ( -19.617 7.875 9.015) 22.980 1.960 ( 10.624 2.641 -7.018) 13.003 2.310 ( -5.813 7.625 1.600) 9.721 2.411 ( -5.600 5.509 1.449) 7.988 2.783 ( 7.548 -2.710 1.615) 8.181 2.904 ( -1.028 -6.579 -3.424) 7.488 3.038 ( 3.805 0.064 5.177) 6.425 3.231 ( 5.903 -2.936 -4.346) 7.896 3.341 ( -0.282 0.207 -3.227) 3.246 3.584 ( 8.485 -4.687 1.487) 9.806 4.030 ( 1.135 -7.978 -4.551) 9.255 4.183 ( 0.402 -0.655 0.883) 1.170 4.272 ( 3.580 1.300 6.022) 7.125 4.420 ( 2.444 2.792 1.900) 4.169 4.587 ( -3.970 1.609 -1.749) 4.627 5.037 ( -0.030 -4.663 3.408) 5.775 5.111 ( 1.258 -2.138 1.172) 2.743 6.782 ( 9.462 -2.505 -1.489) 9.901 6.788 ( 11.246 -0.815 -2.001) 11.451 7.412 ( -0.432 -4.687 -5.072) 6.919 7.585 ( 0.669 3.766 -7.737) 8.631 8.138 ( 1.674 -8.606 1.664) 8.924 8.437 ( -1.108 4.074 5.308) 6.782 8.630 ( 2.368 -8.563 6.790) 11.182 8.777 ( 2.049 -3.677 2.537) 4.914 9.043 ( 1.965 -4.144 0.095) 4.587 9.304 ( -1.821 -2.147 -7.358) 7.878 9.429 ( 4.365 -3.717 -3.191) 6.562 9.560 ( -8.763 1.996 -7.399) 11.641 9.758 ( -4.390 2.539 5.162) 7.236 9.887 ( 0.337 0.693 1.379) 1.579 10.098 ( -1.358 8.109 1.186) 8.307 10.281 ( -9.365 -3.328 9.294) 13.608 10.452 ( -4.217 -6.908 4.785) 9.402 10.616 ( -2.704 4.914 2.445) 6.118 10.800 ( -4.797 3.154 -5.484) 7.939 10.991 ( -1.675 1.652 -2.070) 3.134 11.647 ( -1.308 -1.357 2.049) 2.784 11.829 ( 6.977 -4.440 5.469) 9.915 12.107 ( 5.520 -3.791 2.386) 7.109 12.362 ( 0.829 1.261 0.750) 1.685 12.616 ( -1.644 9.255 -2.590) 9.750 12.787 ( -4.010 8.639 0.368) 9.532 13.598 ( 2.385 -5.808 0.663) 6.313 13.686 ( 2.539 0.596 -3.526) 4.385 13.813 ( 0.739 3.410 -0.936) 3.612 14.065 ( 2.581 -0.319 -0.517) 2.651 15.260 ( -5.542 -6.954 5.337) 10.371 15.900 ( -12.512 4.122 0.572) 13.186 15.986 ( -10.445 6.984 -3.178) 12.961 16.264 ( 10.856 -15.178 0.901) 18.682 16.650 ( 1.348 0.116 -2.798) 3.108 16.818 ( 3.543 3.672 -1.148) 5.231 16.895 ( -3.962 -5.318 0.398) 6.643 17.333 ( 9.557 15.152 -8.980) 20.039 17.604 ( 0.057 0.538 -4.417) 4.450 18.181 ( -8.552 -1.771 -2.882) 9.196 18.896 ( -6.495 -4.531 16.202) 18.034 20.291 ( 13.606 -6.699 -5.347) 16.081 ======================= Grid point 317 (161/195) ======================= q-point: (-0.18 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -12.927 -1.004 18.190) 22.338 1.403 ( -14.980 6.286 14.885) 22.033 1.970 ( 2.040 2.510 -8.618) 9.205 2.211 ( -16.860 15.544 18.731) 29.610 2.438 ( 7.634 -0.003 -2.340) 7.985 2.720 ( -4.073 -5.970 -13.793) 15.572 2.963 ( 9.966 -3.450 0.188) 10.547 3.124 ( -0.029 2.308 6.441) 6.842 3.271 ( 2.957 1.154 -4.617) 5.603 3.427 ( 7.387 -4.253 3.178) 9.098 3.678 ( 3.554 -6.546 -5.745) 9.407 4.022 ( 2.948 -5.538 -1.502) 6.451 4.203 ( 0.775 1.246 -2.071) 2.538 4.316 ( -2.035 -0.706 -0.233) 2.167 4.484 ( 1.578 1.412 3.681) 4.247 4.527 ( -0.779 2.880 0.514) 3.027 5.083 ( 0.094 -3.546 3.718) 5.138 5.136 ( 1.005 -3.586 -0.163) 3.728 6.949 ( 11.318 -5.165 -1.351) 12.514 6.989 ( 14.372 -2.052 -2.503) 14.732 7.383 ( 2.596 -2.867 -2.589) 4.654 7.514 ( 2.125 3.156 -7.444) 8.360 8.193 ( 2.146 -8.139 1.474) 8.546 8.443 ( -2.210 3.245 1.305) 4.137 8.691 ( -4.650 -7.597 1.543) 9.039 8.817 ( 1.167 -8.662 1.513) 8.870 8.999 ( -8.675 -1.175 -3.421) 9.399 9.142 ( -9.512 -0.561 -7.565) 12.166 9.276 ( 0.069 4.656 2.093) 5.105 9.610 ( 8.318 1.076 -1.496) 8.520 9.736 ( -5.163 0.901 5.607) 7.675 9.897 ( -5.021 -1.116 5.124) 7.261 10.149 ( -3.396 -1.768 4.997) 6.295 10.206 ( -1.154 0.770 6.161) 6.316 10.406 ( -0.607 -2.448 -1.707) 3.045 10.619 ( -4.952 7.087 -3.415) 9.296 10.721 ( 3.396 3.492 4.516) 6.643 11.002 ( 0.798 1.790 1.045) 2.221 11.639 ( -1.267 -0.641 2.160) 2.585 11.999 ( 0.755 -5.937 7.632) 9.699 12.182 ( 3.112 -7.311 -0.266) 7.950 12.348 ( -0.285 7.467 -3.507) 8.254 12.589 ( 1.556 7.152 -0.904) 7.374 12.671 ( -6.997 6.447 -2.830) 9.926 13.681 ( 2.271 -4.287 3.745) 6.129 13.696 ( 5.336 2.485 -4.562) 7.447 13.818 ( 0.826 2.231 -0.552) 2.443 14.078 ( 1.187 0.054 -2.593) 2.852 15.280 ( -4.480 -4.279 10.865) 12.507 15.664 ( -12.912 -0.272 2.755) 13.206 15.849 ( -2.443 7.566 -5.352) 9.585 16.433 ( 10.884 -13.003 -5.109) 17.710 16.578 ( -3.204 -2.372 -2.492) 4.701 16.852 ( 0.903 -7.070 -1.973) 7.395 16.880 ( 1.952 2.141 -0.250) 2.908 17.392 ( 6.133 17.082 -4.860) 18.789 17.556 ( 0.232 2.087 -4.219) 4.712 17.841 ( -18.182 -3.112 -8.690) 20.391 19.136 ( 3.277 -1.698 23.061) 23.355 20.395 ( 8.951 -5.833 -10.182) 14.759 ======================= Grid point 318 (162/195) ======================= q-point: (-0.09 0.11 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.312 ( -7.074 -2.584 24.190) 25.335 1.386 ( -10.688 4.969 19.222) 22.548 1.885 ( 3.581 2.554 -12.354) 13.114 2.206 ( -12.141 13.864 17.507) 25.419 2.394 ( -1.785 -3.702 -8.943) 9.843 2.694 ( 10.766 3.081 0.483) 11.209 3.097 ( 3.497 -0.602 0.707) 3.618 3.191 ( 2.390 2.117 1.243) 3.426 3.238 ( -1.321 -1.896 -3.085) 3.855 3.533 ( 1.082 -6.715 -6.324) 9.287 3.635 ( 2.612 -5.543 0.005) 6.127 4.008 ( -0.333 -1.281 -8.304) 8.408 4.182 ( -0.572 1.660 3.114) 3.575 4.308 ( 1.037 -1.595 -0.533) 1.975 4.530 ( 0.691 -0.257 0.764) 1.062 4.545 ( 0.267 1.777 1.698) 2.472 5.121 ( -0.474 -2.442 3.071) 3.952 5.147 ( 0.928 -3.870 -0.522) 4.014 7.106 ( 7.601 -5.967 -1.038) 9.719 7.176 ( 9.477 -3.804 -3.202) 10.702 7.434 ( 2.443 -1.152 2.247) 3.513 7.514 ( 8.910 0.725 -7.308) 11.546 8.213 ( -0.736 -9.382 -2.255) 9.677 8.407 ( -1.959 3.268 1.650) 4.152 8.570 ( -10.349 2.106 -2.527) 10.860 8.647 ( -11.850 0.039 -5.939) 13.255 8.861 ( 1.938 -8.263 0.214) 8.490 9.029 ( -5.709 -3.681 0.370) 6.803 9.384 ( 3.552 1.572 9.089) 9.884 9.676 ( 1.695 2.865 -2.067) 3.918 9.731 ( -1.240 -0.829 5.300) 5.506 9.898 ( -1.322 -5.156 1.212) 5.459 10.121 ( -1.708 1.810 2.340) 3.416 10.287 ( 1.206 -1.830 -1.713) 2.782 10.404 ( -1.154 0.157 4.699) 4.841 10.531 ( -1.354 10.244 -0.426) 10.342 10.856 ( 6.005 1.830 4.095) 7.495 11.026 ( -1.235 0.705 3.296) 3.589 11.665 ( 0.464 0.307 3.417) 3.462 11.998 ( -5.858 -4.606 2.938) 8.010 12.214 ( -0.723 1.271 -3.677) 3.957 12.297 ( 1.959 1.309 -4.706) 5.263 12.543 ( -3.669 4.843 0.931) 6.147 12.632 ( 2.991 2.580 -0.434) 3.974 13.703 ( -0.005 0.673 1.013) 1.216 13.770 ( 2.496 3.673 -1.908) 4.834 13.849 ( 4.164 -0.801 0.705) 4.299 14.049 ( -0.187 0.204 -3.768) 3.778 15.283 ( -13.229 1.907 14.976) 20.073 15.606 ( 4.048 -3.591 -2.222) 5.850 15.774 ( -0.614 3.653 0.391) 3.725 16.420 ( 2.787 -1.311 -14.485) 14.809 16.609 ( 4.361 -12.387 2.851) 13.438 16.857 ( -1.252 -3.727 -4.791) 6.198 16.875 ( 1.717 -6.811 2.569) 7.479 17.346 ( -10.009 1.883 -5.447) 11.549 17.510 ( -4.469 12.120 -0.580) 12.930 17.535 ( 2.583 7.625 -6.928) 10.621 19.477 ( 3.642 -1.445 23.661) 23.983 20.357 ( 3.733 -4.850 -14.825) 16.039 ======================= Grid point 319 (163/195) ======================= q-point: ( 0.00 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( -3.983 7.145 18.133) 19.892 1.635 ( 1.123 7.395 14.986) 16.749 1.888 ( 5.387 3.169 -13.858) 15.202 1.970 ( -2.370 1.758 -15.412) 15.692 2.746 ( -1.769 7.321 16.650) 18.274 2.939 ( 3.924 0.963 2.653) 4.833 3.071 ( -3.880 -5.223 -0.979) 6.580 3.101 ( -0.547 -4.773 -5.232) 7.103 3.240 ( 7.771 0.065 -1.465) 7.908 3.295 ( -4.733 4.585 -5.912) 8.853 3.636 ( 2.345 -6.768 8.007) 10.744 3.815 ( -3.084 -4.072 -10.261) 11.462 4.251 ( -0.929 2.195 4.264) 4.885 4.316 ( 1.511 0.899 -1.860) 2.560 4.524 ( 0.309 -2.103 0.741) 2.251 4.538 ( -1.588 -1.240 -0.633) 2.112 5.069 ( -0.674 -4.541 1.604) 4.863 5.081 ( 0.783 -4.375 0.355) 4.458 7.048 ( 0.623 -7.581 -0.114) 7.607 7.079 ( 0.232 -8.873 -2.939) 9.350 7.435 ( -1.477 -3.431 2.976) 4.776 7.514 ( 2.366 -4.638 -5.577) 7.630 8.170 ( 16.139 -1.749 0.166) 16.235 8.213 ( -17.347 -1.972 -4.427) 18.011 8.512 ( -1.456 2.674 4.205) 5.192 8.586 ( 1.721 1.485 -3.566) 4.229 8.772 ( -4.038 -7.644 2.950) 9.134 8.813 ( 2.317 -7.289 -1.264) 7.752 9.568 ( 2.051 -0.282 7.498) 7.779 9.629 ( -2.189 -1.904 0.992) 3.066 9.739 ( 1.778 -2.335 0.809) 3.044 9.797 ( 0.308 -0.290 -4.483) 4.503 10.146 ( -0.507 -2.456 1.731) 3.047 10.204 ( -1.172 -3.532 -4.050) 5.499 10.571 ( 3.482 6.888 9.018) 11.870 10.689 ( -1.908 7.787 -3.203) 8.633 11.001 ( -4.655 0.403 2.638) 5.365 11.029 ( 5.528 1.809 -0.200) 5.820 11.795 ( 1.855 2.744 5.060) 6.048 11.864 ( -2.699 -1.247 -1.153) 3.189 12.186 ( 2.867 -0.744 2.166) 3.670 12.296 ( -3.747 0.830 -7.917) 8.798 12.569 ( -0.768 2.515 6.039) 6.587 12.687 ( 1.274 2.779 -5.995) 6.730 13.777 ( -0.033 4.133 4.703) 6.261 13.849 ( -0.206 4.326 -2.374) 4.939 13.931 ( 3.245 0.328 1.302) 3.512 13.995 ( -1.668 0.846 -4.547) 4.917 15.333 ( -8.566 4.282 14.912) 17.722 15.595 ( 7.690 -0.204 -11.039) 13.455 15.880 ( 0.155 -0.778 13.013) 13.038 16.202 ( -0.154 -2.975 -19.467) 19.693 16.475 ( -5.980 -9.093 10.321) 14.998 16.681 ( 5.188 -4.324 -10.139) 12.183 16.826 ( 2.949 -9.040 6.238) 11.372 16.960 ( -3.986 -8.460 -7.575) 12.035 17.775 ( -0.756 14.570 2.101) 14.740 17.828 ( 1.909 15.446 -3.360) 15.922 19.740 ( 1.311 -2.978 19.490) 19.760 20.077 ( -1.310 -6.649 -16.066) 17.437 ======================= Grid point 320 (164/195) ======================= q-point: ( 0.09 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.636 ( -1.967 4.764 8.613) 10.037 1.696 ( 0.076 1.252 -14.577) 14.630 1.810 ( 6.097 5.927 0.519) 8.519 2.026 ( 10.862 4.762 4.263) 12.603 2.679 ( -13.086 0.744 -1.294) 13.171 2.972 ( -2.979 -1.310 -4.311) 5.401 3.055 ( 3.769 -3.124 7.376) 8.852 3.091 ( -5.570 2.952 -1.846) 6.569 3.176 ( 3.487 -1.826 -4.987) 6.353 3.349 ( 3.488 3.466 2.571) 5.549 3.635 ( -4.264 -5.856 -7.936) 10.745 3.785 ( 1.642 -4.207 9.571) 10.583 4.266 ( -1.485 1.218 1.456) 2.410 4.287 ( -1.031 1.013 -3.032) 3.359 4.499 ( -1.140 -2.413 1.015) 2.855 4.572 ( 2.232 0.404 1.148) 2.542 5.046 ( -2.304 -5.172 -0.058) 5.662 5.097 ( 0.674 -4.072 -0.625) 4.174 6.954 ( -7.936 -7.754 -0.825) 11.126 7.033 ( -5.788 -7.681 0.117) 9.619 7.425 ( -2.899 -0.417 3.535) 4.591 7.463 ( -2.641 -2.942 -4.593) 6.060 7.996 ( -3.495 -9.080 -0.531) 9.744 8.448 ( 2.112 -1.937 1.045) 3.050 8.509 ( 2.011 -3.024 3.617) 5.125 8.610 ( 7.168 1.278 -1.259) 7.389 8.706 ( 1.218 -2.453 1.972) 3.375 8.932 ( 6.184 -5.527 0.601) 8.316 9.563 ( -1.616 0.780 -3.295) 3.752 9.704 ( -4.048 0.990 -1.050) 4.298 9.736 ( 8.121 -2.434 -0.627) 8.501 9.796 ( 3.350 -2.857 0.105) 4.404 10.128 ( -2.772 -2.038 -0.298) 3.454 10.162 ( -2.589 -4.250 3.810) 6.267 10.605 ( 0.205 4.602 -7.681) 8.956 10.704 ( 1.507 8.562 3.525) 9.381 10.939 ( -2.820 3.302 0.547) 4.377 11.110 ( 4.853 0.554 -2.703) 5.582 11.759 ( -4.717 0.152 -2.088) 5.160 11.899 ( 2.455 -0.069 3.008) 3.883 12.131 ( -6.580 -6.883 -4.584) 10.568 12.284 ( 2.110 6.032 7.447) 9.813 12.656 ( 3.254 0.796 -2.242) 4.031 12.684 ( 5.839 6.183 1.070) 8.571 13.793 ( -2.116 4.790 -2.095) 5.640 13.809 ( -2.335 3.623 1.892) 4.707 13.887 ( -3.786 -0.254 -4.645) 5.998 13.986 ( 0.276 0.124 3.001) 3.016 15.397 ( -4.262 2.864 11.779) 12.849 15.590 ( 8.274 1.406 -10.762) 13.647 15.943 ( -2.467 -3.141 -6.572) 7.691 16.077 ( -0.876 -2.284 7.209) 7.613 16.471 ( -5.683 -6.230 8.696) 12.113 16.643 ( 0.083 -6.544 -5.120) 8.309 16.867 ( 7.986 -5.715 -5.066) 11.050 17.118 ( 15.729 -9.440 5.427) 19.130 17.694 ( -7.702 14.529 0.220) 16.446 17.843 ( 1.153 14.940 -1.967) 15.113 19.815 ( -5.510 -4.897 -17.982) 19.434 19.941 ( -3.125 -5.524 17.150) 18.286 ======================= Grid point 321 (165/195) ======================= q-point: ( 0.18 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 2.766 1.939 -12.689) 13.131 1.710 ( 7.853 2.914 -5.402) 9.967 1.918 ( 3.216 6.108 3.719) 7.842 2.260 ( 1.855 0.804 7.939) 8.192 2.477 ( -6.266 0.155 3.642) 7.249 2.857 ( -8.466 -4.959 0.676) 9.835 2.931 ( 1.785 13.112 -12.224) 18.015 3.158 ( -0.631 -5.002 -2.582) 5.664 3.212 ( 0.574 -1.817 6.677) 6.944 3.409 ( 0.356 -1.178 2.651) 2.923 3.463 ( -5.043 -5.889 -7.349) 10.683 3.872 ( -3.800 -4.274 5.058) 7.635 4.230 ( -0.712 1.274 -1.227) 1.907 4.281 ( 1.541 -0.414 1.414) 2.132 4.506 ( 0.578 -1.192 -0.035) 1.325 4.620 ( 2.104 3.496 0.134) 4.083 5.000 ( -2.303 -7.077 -0.757) 7.481 5.090 ( 0.295 -3.973 -1.811) 4.376 6.795 ( -9.441 -7.183 0.250) 11.866 6.894 ( -10.232 -4.377 0.907) 11.166 7.320 ( -7.035 -0.038 1.056) 7.114 7.473 ( 2.389 -0.098 1.620) 2.888 7.997 ( 0.280 -11.592 0.740) 11.619 8.414 ( -3.041 -8.440 1.730) 9.136 8.502 ( -2.509 -10.876 1.499) 11.262 8.682 ( 2.781 1.128 -0.256) 3.012 8.984 ( 3.305 -1.357 -1.139) 3.750 9.011 ( 15.005 2.450 6.948) 16.716 9.465 ( -1.652 3.464 -7.363) 8.303 9.611 ( -7.382 1.205 1.041) 7.551 9.806 ( 4.464 -2.818 -4.095) 6.680 9.919 ( 8.840 -3.223 -2.079) 9.636 10.102 ( -0.146 -3.063 2.309) 3.839 10.179 ( -0.575 -4.894 4.645) 6.772 10.517 ( 2.437 1.859 -10.932) 11.354 10.711 ( -2.163 9.358 2.759) 9.994 10.943 ( 2.972 7.238 -2.732) 8.287 11.113 ( 1.398 1.582 -5.829) 6.199 11.668 ( -2.867 0.207 -0.948) 3.026 11.962 ( -5.718 -8.976 -3.593) 11.232 11.971 ( -0.824 -5.575 3.644) 6.712 12.400 ( 0.337 6.586 6.563) 9.304 12.696 ( 5.410 3.700 -2.104) 6.883 12.824 ( 7.534 10.166 1.132) 12.704 13.693 ( -7.288 -1.792 -4.593) 8.799 13.728 ( -2.885 2.464 -0.996) 3.923 13.828 ( -1.391 1.096 0.676) 1.896 14.019 ( -1.021 0.080 3.557) 3.702 15.362 ( -3.679 -1.764 -4.632) 6.172 15.687 ( 8.792 1.623 1.960) 9.153 15.917 ( 4.604 -1.187 -1.481) 4.980 16.086 ( -8.278 -3.085 8.241) 12.081 16.526 ( 0.616 -2.080 8.101) 8.387 16.619 ( 0.944 -3.932 0.003) 4.043 16.966 ( 10.503 -2.428 -8.048) 13.452 17.488 ( 10.516 -1.996 5.030) 11.826 17.579 ( -0.267 3.059 5.749) 6.517 17.803 ( -2.471 14.081 -2.860) 14.579 19.483 ( -7.744 -3.739 -18.539) 20.436 20.027 ( -7.918 -7.946 13.475) 17.533 ======================= Grid point 322 (166/195) ======================= q-point: ( 0.27 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 3.384 -0.766 -10.421) 10.983 1.838 ( 13.332 4.603 -4.813) 14.903 1.952 ( -4.055 5.353 2.267) 7.088 2.228 ( -5.852 -1.145 4.467) 7.450 2.591 ( 0.880 -2.924 10.139) 10.589 2.704 ( -8.101 -3.401 1.281) 8.879 2.895 ( 7.208 12.380 -8.855) 16.842 3.082 ( -5.212 -4.121 -0.749) 6.686 3.257 ( -5.780 -1.151 -9.949) 11.563 3.271 ( -0.352 -0.458 5.238) 5.270 3.444 ( -2.586 -5.593 2.770) 6.756 3.810 ( -4.868 -6.946 1.810) 8.673 4.208 ( 0.424 0.487 -2.128) 2.224 4.346 ( 2.221 -0.162 0.323) 2.250 4.500 ( 0.296 0.155 -2.688) 2.708 4.646 ( 2.030 4.844 -1.161) 5.379 4.951 ( -1.730 -8.555 -1.746) 8.901 5.075 ( 0.525 -4.116 -1.651) 4.466 6.660 ( -7.390 -4.999 2.119) 9.170 6.733 ( -9.107 -1.688 1.066) 9.323 7.269 ( -2.211 -1.305 3.698) 4.502 7.544 ( 2.123 1.391 3.309) 4.171 7.984 ( -1.575 -9.403 -0.469) 9.545 8.392 ( -3.433 -15.088 3.439) 15.851 8.501 ( 1.454 -8.057 -0.877) 8.234 8.718 ( 0.507 -2.959 -0.429) 3.032 8.935 ( -2.329 -1.186 -1.796) 3.171 9.336 ( 3.708 2.764 5.806) 7.423 9.349 ( -1.517 2.657 -5.583) 6.366 9.498 ( -2.228 0.697 2.171) 3.188 9.850 ( 5.573 -0.641 -3.329) 6.523 9.917 ( -2.692 -0.684 -1.621) 3.216 10.177 ( -0.300 -1.560 3.741) 4.065 10.302 ( 10.819 -6.448 0.425) 12.602 10.454 ( 7.282 0.298 -11.864) 13.924 10.775 ( 4.009 7.620 6.414) 10.737 10.905 ( 1.071 7.009 -9.612) 11.944 11.065 ( 0.090 3.069 -3.400) 4.581 11.634 ( -2.067 -2.269 0.170) 3.074 11.790 ( -8.031 -7.836 -1.910) 11.382 12.002 ( -0.137 -4.763 -0.032) 4.765 12.425 ( -3.182 3.416 2.193) 5.157 12.784 ( 5.700 9.932 -0.186) 11.453 12.953 ( 6.579 8.475 -0.259) 10.732 13.524 ( -5.607 -4.977 -3.400) 8.232 13.676 ( -2.994 1.450 0.156) 3.330 13.825 ( -0.647 0.704 1.933) 2.157 14.026 ( -2.143 -1.048 2.072) 3.160 15.257 ( 0.099 -2.971 -5.665) 6.398 15.888 ( 5.954 -0.726 6.320) 8.713 15.926 ( -3.960 -12.376 2.696) 13.271 16.111 ( 3.793 7.798 4.432) 9.739 16.632 ( -3.754 0.698 10.333) 11.016 16.687 ( 8.792 3.130 -0.500) 9.345 17.000 ( 5.765 1.738 -9.511) 11.257 17.447 ( -5.690 5.474 3.849) 8.783 17.700 ( -4.028 11.026 -3.386) 12.217 17.963 ( 16.908 -8.504 9.568) 21.207 19.141 ( -6.254 -4.482 -17.511) 19.127 19.984 ( -12.323 -10.036 8.946) 18.238 ======================= Grid point 323 (167/195) ======================= q-point: ( 0.36 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.427 ( 4.439 -5.496 -6.746) 9.768 1.786 ( -11.576 0.687 -0.488) 11.606 2.080 ( 15.841 7.266 -3.248) 17.728 2.238 ( -1.730 -0.146 7.215) 7.421 2.532 ( -9.087 -1.562 1.981) 9.431 2.753 ( 3.505 -3.915 2.925) 6.014 2.887 ( -1.397 5.870 -2.605) 6.572 3.004 ( -4.921 -1.716 -5.830) 7.819 3.067 ( -3.349 1.739 3.081) 4.871 3.345 ( -0.077 -4.416 3.097) 5.394 3.400 ( 0.798 0.501 -1.508) 1.778 3.782 ( -3.741 -8.127 3.910) 9.764 4.207 ( 2.192 -0.251 -1.268) 2.545 4.319 ( -0.390 1.213 -6.022) 6.156 4.459 ( 0.061 1.527 -4.533) 4.784 4.651 ( -0.693 1.828 -2.452) 3.136 4.912 ( -0.058 -8.289 -0.899) 8.338 5.064 ( 0.363 -3.977 -1.809) 4.384 6.596 ( -3.732 -2.435 3.063) 5.408 6.623 ( -5.394 -0.112 1.741) 5.669 7.320 ( 1.514 -2.554 5.430) 6.189 7.604 ( -0.028 0.561 2.851) 2.905 7.958 ( -0.691 -7.919 0.321) 7.955 8.359 ( -1.819 -10.565 -2.873) 11.098 8.518 ( 0.102 -8.305 1.586) 8.456 8.665 ( -3.141 -5.002 -2.264) 6.325 8.907 ( 0.935 -1.426 -1.591) 2.333 9.218 ( -7.952 2.168 -0.266) 8.247 9.305 ( -3.477 -1.067 1.672) 4.003 9.617 ( 4.428 -5.786 -1.332) 7.407 9.823 ( -1.672 1.935 1.115) 2.790 10.000 ( 6.857 5.055 3.935) 9.384 10.176 ( -2.801 -2.778 1.694) 4.293 10.406 ( 5.120 4.419 -3.890) 7.802 10.520 ( 10.497 -6.594 -7.658) 14.571 10.830 ( 3.996 5.969 -7.351) 10.278 10.942 ( 1.694 7.299 0.306) 7.499 11.059 ( 6.811 -2.934 2.513) 7.830 11.511 ( -9.039 -7.243 -4.162) 12.308 11.708 ( -3.578 -2.020 3.122) 5.161 11.965 ( -0.923 -1.296 -3.285) 3.650 12.351 ( -5.284 1.723 -2.243) 5.994 12.873 ( 4.134 12.190 1.215) 12.930 13.038 ( 4.676 6.999 -1.689) 8.585 13.449 ( -0.402 -7.078 -0.661) 7.121 13.619 ( -4.101 -0.714 0.400) 4.182 13.845 ( -0.235 1.818 2.245) 2.899 13.996 ( -2.812 -1.382 0.461) 3.167 15.257 ( 5.023 -3.368 -1.755) 6.297 15.802 ( -9.350 -12.597 1.909) 15.803 16.130 ( 8.749 -0.879 6.813) 11.124 16.235 ( 2.587 2.316 6.127) 7.042 16.629 ( -3.459 10.748 0.149) 11.292 16.850 ( 6.373 3.581 2.956) 7.885 17.021 ( 8.423 3.032 -4.419) 9.984 17.378 ( -8.969 10.044 3.708) 13.967 17.628 ( 0.306 1.363 -1.500) 2.050 18.237 ( 3.285 -1.375 0.915) 3.676 18.953 ( 6.981 -11.033 -9.034) 15.877 19.819 ( -15.756 -11.640 4.249) 20.045 ======================= Grid point 324 (168/195) ======================= q-point: ( 0.45 0.22 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 7.752 -7.769 -4.207) 11.754 1.577 ( -10.476 -4.929 -0.949) 11.617 2.246 ( 1.801 2.212 1.935) 3.447 2.329 ( 5.108 5.174 -2.490) 7.685 2.434 ( -1.025 2.773 5.042) 5.845 2.747 ( -7.352 -2.344 -3.870) 8.633 2.847 ( 1.354 3.885 -1.695) 4.449 2.887 ( 0.329 3.490 0.884) 3.615 3.140 ( -0.402 -3.002 8.428) 8.956 3.302 ( -0.991 -2.687 -2.951) 4.112 3.498 ( 6.297 -1.741 2.296) 6.925 3.715 ( -7.319 -5.973 -0.314) 9.452 4.249 ( 1.351 -0.764 0.610) 1.668 4.282 ( 3.696 0.820 -0.253) 3.794 4.392 ( -0.262 2.331 -6.344) 6.764 4.539 ( -5.275 -2.167 -6.613) 8.733 4.938 ( 1.416 -5.688 2.163) 6.248 5.040 ( -0.230 -4.054 -2.717) 4.885 6.587 ( -1.738 0.707 2.312) 2.978 6.591 ( -0.369 -0.817 1.461) 1.714 7.428 ( 2.240 -3.389 6.428) 7.605 7.599 ( -1.319 -3.146 -1.235) 3.628 7.979 ( 0.175 -5.040 4.262) 6.603 8.245 ( -2.392 -4.849 -8.924) 10.434 8.537 ( -2.735 -7.513 4.627) 9.238 8.619 ( 2.492 -4.129 -4.301) 6.462 8.930 ( 2.270 -1.752 1.796) 3.383 9.088 ( -5.228 -0.092 -2.149) 5.653 9.313 ( -3.175 -4.673 8.076) 9.856 9.577 ( 1.638 -9.459 -9.947) 13.824 9.881 ( 2.337 2.531 5.251) 6.280 10.077 ( -2.971 3.413 -1.603) 4.801 10.195 ( 0.799 2.672 8.239) 8.698 10.436 ( 5.661 1.275 -7.739) 9.672 10.596 ( 3.929 1.980 0.468) 4.424 10.799 ( -1.304 5.714 -9.395) 11.073 10.933 ( 5.307 0.567 1.650) 5.587 11.197 ( -5.659 -8.102 -2.425) 10.176 11.394 ( 7.475 -4.692 2.132) 9.080 11.638 ( -8.219 -6.722 0.525) 10.631 11.964 ( 4.266 4.986 0.135) 6.564 12.197 ( -7.037 3.028 -5.316) 9.325 12.958 ( 2.706 12.678 2.827) 13.268 13.070 ( 1.832 9.865 -2.975) 10.465 13.473 ( 2.790 -8.946 0.306) 9.376 13.547 ( -4.097 -5.889 -0.343) 7.183 13.872 ( 0.575 1.972 2.320) 3.099 13.948 ( -2.546 0.691 -0.480) 2.681 15.381 ( 8.724 -4.905 1.956) 10.198 15.640 ( -9.322 -9.036 -2.261) 13.178 16.277 ( -3.184 -0.411 8.780) 9.349 16.377 ( 4.416 -4.188 5.824) 8.424 16.586 ( 1.435 11.876 0.242) 11.965 16.907 ( 2.811 2.792 -9.339) 10.145 17.135 ( -3.152 10.777 7.685) 13.607 17.297 ( 3.513 8.620 -1.275) 9.395 17.675 ( 2.973 -1.327 4.630) 5.660 18.102 ( -7.039 2.974 -10.716) 13.162 19.170 ( 18.268 -14.952 1.991) 23.691 19.552 ( -17.810 -12.676 -0.002) 21.861 ======================= Grid point 325 (169/195) ======================= q-point: (-0.45 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( -5.586 -7.720 -0.637) 9.550 1.605 ( 13.474 -6.155 -3.603) 15.245 2.173 ( -11.647 7.060 5.589) 14.722 2.386 ( 7.502 2.390 -4.594) 9.115 2.547 ( -2.709 2.332 -3.840) 5.246 2.624 ( 7.303 3.026 3.565) 8.672 2.851 ( -3.911 0.161 0.366) 3.931 2.900 ( 0.889 4.620 -0.054) 4.705 3.219 ( 0.177 -4.211 4.303) 6.023 3.268 ( 2.180 -2.091 -3.245) 4.434 3.536 ( -9.294 -4.305 -1.990) 10.434 3.669 ( 8.152 -3.753 3.666) 9.695 4.267 ( -2.728 2.405 -0.401) 3.659 4.325 ( 1.860 2.303 -1.222) 3.202 4.353 ( -4.401 -2.030 -4.605) 6.686 4.421 ( 5.154 -4.653 3.492) 7.772 4.988 ( 0.852 -4.003 2.368) 4.728 4.992 ( -1.072 -4.583 -3.086) 5.628 6.603 ( 1.306 0.099 0.390) 1.366 6.615 ( 2.428 0.306 -0.382) 2.477 7.482 ( -4.931 -4.751 2.883) 7.429 7.589 ( 5.148 -3.800 -2.324) 6.807 8.055 ( -0.950 -4.169 5.728) 7.148 8.124 ( 1.819 -2.655 -5.792) 6.626 8.529 ( -3.894 -4.828 4.123) 7.448 8.624 ( 3.485 -4.516 -4.085) 7.017 8.988 ( -2.436 -2.580 -3.219) 4.790 9.036 ( 5.980 -1.611 3.007) 6.885 9.366 ( -3.611 -8.136 10.056) 13.430 9.495 ( 2.881 -7.803 -9.234) 12.427 9.960 ( -3.165 2.824 -0.666) 4.294 10.013 ( 3.823 2.376 1.430) 4.723 10.284 ( -3.576 2.012 8.712) 9.630 10.379 ( -1.292 2.470 -9.612) 10.008 10.642 ( -3.677 4.703 -3.123) 6.738 10.684 ( 2.151 6.448 0.828) 6.847 10.944 ( -11.041 -5.038 1.585) 12.239 11.161 ( 11.486 -3.416 -0.803) 12.010 11.449 ( -10.088 -7.578 -2.518) 12.866 11.624 ( 11.258 -7.304 1.823) 13.543 12.009 ( -7.235 5.651 -4.505) 10.226 12.095 ( 6.463 4.729 4.926) 9.402 13.015 ( -0.453 11.236 2.776) 11.583 13.026 ( -1.811 12.733 -4.078) 13.492 13.479 ( -2.757 -9.596 -0.497) 9.996 13.543 ( 4.707 -8.177 0.045) 9.435 13.901 ( -1.373 2.259 -0.297) 2.660 13.927 ( 2.254 1.285 1.439) 2.967 15.439 ( -8.954 -4.586 -3.691) 10.716 15.583 ( 10.347 -7.963 3.012) 13.400 16.267 ( -10.113 1.061 9.797) 14.120 16.460 ( 5.994 -2.196 -4.361) 7.731 16.674 ( -4.753 5.692 3.682) 8.280 16.761 ( 1.073 5.676 -6.303) 8.550 17.090 ( -12.033 5.710 9.820) 16.548 17.413 ( 14.098 8.608 -11.449) 20.098 17.839 ( -0.712 3.351 2.802) 4.425 17.884 ( 3.056 1.886 -1.246) 3.801 19.210 ( -19.463 -13.294 -1.826) 23.640 19.533 ( 19.211 -14.245 1.892) 23.990 ======================= Grid point 326 (170/195) ======================= q-point: (-0.36 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.349 ( -4.433 -4.580 1.034) 6.457 1.816 ( 14.477 -1.146 -3.511) 14.940 2.012 ( -14.263 11.563 4.452) 18.893 2.385 ( 3.138 1.116 -7.660) 8.353 2.569 ( 7.725 1.007 -2.830) 8.289 2.784 ( -3.409 -0.046 1.483) 3.718 2.812 ( 1.291 1.093 4.861) 5.147 2.862 ( -0.836 3.357 3.627) 5.013 3.223 ( 1.285 -2.537 -8.458) 8.923 3.318 ( 3.948 -4.892 3.581) 7.235 3.390 ( -5.084 -2.330 0.877) 5.661 3.838 ( 6.785 -6.739 -0.284) 9.567 4.208 ( -2.662 -0.083 0.214) 2.672 4.226 ( -2.264 1.904 -0.068) 2.959 4.399 ( 2.886 1.249 1.652) 3.552 4.568 ( 3.260 -3.368 6.018) 7.628 4.928 ( -1.654 -5.395 -2.549) 6.192 5.029 ( 0.574 -3.545 1.979) 4.100 6.642 ( 4.386 -1.292 -1.736) 4.890 6.666 ( 5.502 0.019 -2.139) 5.903 7.397 ( -3.594 -5.077 -2.289) 6.628 7.653 ( 3.411 -1.258 -2.001) 4.150 8.006 ( -0.092 -4.036 -4.523) 6.063 8.239 ( 3.842 -5.892 8.085) 10.716 8.506 ( -3.598 -4.147 3.081) 6.296 8.655 ( 4.330 -4.759 -1.447) 6.595 8.923 ( -0.720 -5.365 -2.831) 6.109 9.194 ( 8.409 -0.474 2.060) 8.671 9.365 ( -3.145 -7.726 -0.403) 8.351 9.512 ( 1.960 -5.964 3.886) 7.383 9.882 ( -0.971 3.507 -3.392) 4.974 10.099 ( -2.385 3.696 -2.392) 5.006 10.187 ( -5.273 1.475 -1.568) 5.695 10.278 ( -6.049 -0.435 5.426) 8.137 10.506 ( -6.942 2.280 -3.441) 8.076 10.722 ( -3.066 5.276 3.703) 7.138 10.883 ( 1.509 2.039 3.989) 4.727 11.155 ( -9.890 -3.070 -5.327) 11.646 11.437 ( 9.412 -5.518 3.096) 11.341 11.776 ( 4.142 -3.314 -3.953) 6.615 11.903 ( -0.096 1.414 2.839) 3.174 12.270 ( 5.826 2.084 5.791) 8.475 12.930 ( -3.268 12.954 -4.192) 14.002 13.004 ( -3.544 7.588 1.820) 8.570 13.445 ( -0.441 -8.572 -0.358) 8.590 13.626 ( 4.761 -3.881 -0.281) 6.148 13.880 ( -0.037 2.592 -1.220) 2.865 13.990 ( 2.965 -0.770 1.082) 3.249 15.264 ( -6.543 -1.436 -2.314) 7.087 15.790 ( 9.226 -11.540 2.570) 14.996 16.164 ( -12.584 2.128 4.771) 13.625 16.387 ( -5.655 4.316 -9.587) 11.938 16.598 ( 2.229 3.787 1.751) 4.731 16.832 ( 0.773 1.874 3.987) 4.472 16.959 ( -11.437 1.019 3.037) 11.877 17.494 ( 9.402 7.669 -8.558) 14.847 17.722 ( 2.736 4.444 -9.886) 11.179 18.140 ( 6.013 3.974 10.990) 13.143 18.863 ( -17.308 -12.209 0.274) 21.182 19.862 ( 17.423 -13.224 -0.327) 21.875 ======================= Grid point 327 (171/195) ======================= q-point: (-0.27 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( -5.371 3.083 5.752) 8.452 1.758 ( -15.858 11.099 3.272) 19.631 2.024 ( 9.901 3.653 -5.120) 11.730 2.342 ( 3.973 -0.352 -7.221) 8.250 2.649 ( -10.747 10.003 6.993) 16.262 2.715 ( 8.407 -3.938 1.004) 9.338 2.804 ( -4.241 0.584 -3.131) 5.304 3.029 ( 3.840 -1.241 7.934) 8.902 3.161 ( 4.793 -3.586 -3.541) 6.955 3.347 ( -0.268 0.129 -1.938) 1.961 3.457 ( 7.037 -8.026 1.257) 10.748 3.874 ( 3.176 -7.659 -5.073) 9.720 4.176 ( -0.323 0.196 0.888) 0.965 4.292 ( 1.500 0.617 5.888) 6.107 4.454 ( 1.469 0.214 1.676) 2.239 4.627 ( -1.748 2.303 1.411) 3.217 4.910 ( 0.852 -7.797 1.617) 8.009 5.052 ( 0.080 -3.969 0.958) 4.083 6.714 ( 7.566 -3.812 -3.260) 9.078 6.767 ( 9.388 -1.672 -2.235) 9.794 7.331 ( -0.228 -3.581 -2.777) 4.537 7.636 ( 0.140 0.966 -5.663) 5.746 7.993 ( 2.711 -5.898 -1.678) 6.704 8.383 ( 3.819 -10.640 4.677) 12.234 8.479 ( -2.697 -5.042 1.667) 5.956 8.711 ( 0.958 -2.527 0.139) 2.706 8.916 ( 2.637 -6.901 -0.126) 7.388 9.295 ( -4.034 -2.494 0.720) 4.797 9.368 ( 7.293 -0.616 1.588) 7.489 9.543 ( -3.173 -2.586 -0.268) 4.102 9.816 ( -9.715 3.208 -1.572) 10.351 9.904 ( -0.228 0.957 -0.589) 1.147 10.211 ( -12.525 -3.865 10.270) 16.652 10.229 ( 1.517 1.484 -1.198) 2.437 10.352 ( -3.470 1.179 -2.765) 4.591 10.745 ( -0.156 7.011 6.064) 9.271 10.894 ( -5.378 5.941 -5.119) 9.509 11.007 ( 0.176 -0.197 2.436) 2.450 11.606 ( 3.709 -3.537 2.895) 5.886 11.764 ( 2.417 -1.521 0.369) 2.879 11.993 ( 3.673 -5.182 0.905) 6.416 12.412 ( 4.016 1.521 3.551) 5.573 12.822 ( -3.757 12.058 -4.000) 13.248 12.948 ( -4.663 7.200 0.471) 8.591 13.471 ( 3.183 -7.010 1.745) 7.894 13.691 ( 3.541 -0.513 -1.071) 3.734 13.864 ( 0.385 1.858 -1.868) 2.663 14.047 ( 2.870 -1.568 -0.220) 3.278 15.180 ( -2.614 -0.512 2.085) 3.383 15.937 ( -15.583 1.689 0.842) 15.697 15.941 ( 4.074 -12.134 1.536) 12.892 16.230 ( -0.561 8.995 -6.409) 11.059 16.642 ( -1.119 -0.183 0.567) 1.268 16.796 ( -7.557 -3.014 -1.066) 8.205 16.881 ( 1.948 1.772 1.196) 2.892 17.531 ( 3.987 4.091 -4.654) 7.368 17.717 ( 7.055 9.885 -6.065) 13.575 18.124 ( -12.320 -4.510 -6.844) 14.797 18.810 ( 1.157 -2.355 16.622) 16.827 20.108 ( 14.064 -11.913 -4.184) 18.900 ======================= Grid point 328 (172/195) ======================= q-point: (-0.18 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.305 ( -5.645 8.935 10.924) 15.200 1.561 ( -13.085 9.595 7.902) 18.048 2.025 ( -0.080 2.669 -6.076) 6.637 2.391 ( 7.595 0.403 -5.501) 9.387 2.586 ( -16.147 13.383 10.210) 23.326 2.632 ( 0.561 0.161 -1.893) 1.981 2.902 ( 11.297 -1.873 -0.653) 11.470 3.111 ( -0.118 -2.464 3.495) 4.278 3.302 ( 5.997 -2.944 4.096) 7.836 3.328 ( 2.484 -2.203 -3.789) 5.038 3.519 ( 2.090 -9.060 -5.367) 10.736 3.911 ( 5.469 -5.935 -0.692) 8.100 4.211 ( 1.867 0.341 1.771) 2.596 4.315 ( -2.285 0.474 -1.593) 2.826 4.493 ( 0.666 -1.188 1.209) 1.821 4.598 ( -2.241 4.196 1.934) 5.135 4.970 ( 2.089 -7.451 2.685) 8.191 5.059 ( -0.258 -4.459 0.875) 4.551 6.829 ( 9.987 -6.560 -3.206) 12.372 6.925 ( 11.083 -4.673 -2.021) 12.196 7.335 ( 3.297 -2.093 -0.902) 4.008 7.559 ( 0.392 1.243 -6.700) 6.826 8.025 ( 2.347 -8.766 -2.035) 9.301 8.436 ( -0.843 -4.378 -0.184) 4.462 8.505 ( 4.233 -11.965 1.668) 12.801 8.681 ( -2.756 -1.300 -0.340) 3.066 8.965 ( -0.891 -3.130 0.817) 3.355 9.126 ( -16.405 -1.339 -3.960) 16.929 9.370 ( -0.950 4.765 1.437) 5.067 9.605 ( 7.032 -1.010 2.350) 7.482 9.707 ( -5.089 -3.297 6.240) 8.701 9.876 ( -9.082 -2.024 1.852) 9.487 10.114 ( -1.588 -1.433 2.174) 3.050 10.246 ( 1.646 0.651 -1.295) 2.193 10.346 ( -0.151 -0.501 3.770) 3.806 10.770 ( -1.484 7.955 -3.599) 8.856 10.839 ( 0.990 7.151 7.054) 10.093 11.035 ( -1.061 1.667 2.303) 3.035 11.641 ( 0.009 0.538 1.855) 1.931 11.880 ( 4.113 -6.182 5.003) 8.954 12.025 ( 2.006 -6.330 -2.028) 6.943 12.481 ( 1.727 2.067 -0.921) 2.846 12.703 ( -4.886 8.625 -3.476) 10.505 12.852 ( -5.066 10.401 -1.941) 11.731 13.592 ( 4.959 -4.898 5.098) 8.636 13.732 ( 3.561 -0.084 -0.966) 3.691 13.859 ( 1.758 2.469 -2.076) 3.673 14.075 ( 1.791 -0.435 -2.150) 2.832 15.225 ( 0.750 -0.704 7.616) 7.685 15.683 ( -14.421 1.616 2.224) 14.681 15.941 ( -4.327 0.146 -0.940) 4.430 16.243 ( 10.134 -3.280 -6.539) 12.499 16.556 ( -5.591 -0.977 -2.947) 6.396 16.714 ( -1.197 -7.389 -0.671) 7.516 16.896 ( -0.577 0.306 -2.798) 2.873 17.536 ( -1.570 1.119 -1.625) 2.522 17.728 ( -9.294 1.848 -6.056) 11.246 17.812 ( 2.720 8.652 -6.765) 11.314 19.116 ( 6.141 0.674 20.189) 21.113 20.237 ( 9.385 -10.337 -8.613) 16.405 ======================= Grid point 329 (173/195) ======================= q-point: (-0.09 0.22 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -4.032 9.397 15.819) 18.837 1.518 ( -7.179 8.269 13.921) 17.712 1.945 ( 1.742 3.158 -8.812) 9.522 2.260 ( -7.127 -0.643 -14.661) 16.314 2.560 ( 0.173 8.814 12.769) 15.517 2.762 ( 4.628 7.145 9.358) 12.650 3.068 ( 6.436 -1.329 0.631) 6.602 3.134 ( 0.956 -3.947 1.082) 4.203 3.263 ( -0.641 -3.614 -10.051) 10.700 3.398 ( -1.320 -3.126 -1.251) 3.616 3.510 ( 3.764 -7.275 2.474) 8.556 3.953 ( 0.852 -3.593 -6.163) 7.184 4.226 ( -1.082 2.738 0.574) 2.999 4.287 ( 1.737 -0.319 0.888) 1.977 4.506 ( 0.443 -2.441 0.208) 2.489 4.583 ( -2.157 1.699 0.555) 2.801 5.030 ( 1.915 -6.239 1.698) 6.743 5.070 ( -0.336 -4.045 1.748) 4.419 6.965 ( 8.788 -7.940 -2.199) 12.047 7.061 ( 6.656 -7.829 -2.362) 10.544 7.399 ( 1.852 -2.410 2.019) 3.649 7.523 ( 4.693 -0.342 -6.477) 8.006 8.023 ( 3.289 -8.947 -3.134) 10.034 8.448 ( 1.448 0.271 1.249) 1.931 8.578 ( 0.228 -8.253 -2.948) 8.766 8.606 ( -9.161 1.177 -1.108) 9.302 8.738 ( -7.692 -0.367 -1.795) 7.907 8.936 ( -7.612 -5.607 0.225) 9.456 9.436 ( 1.125 2.993 7.984) 8.601 9.689 ( -1.218 -3.014 4.433) 5.497 9.705 ( -3.462 -0.369 -1.014) 3.626 9.794 ( 0.982 -4.917 2.033) 5.410 10.134 ( 1.228 -0.794 -0.413) 1.520 10.249 ( 2.103 -3.065 -4.531) 5.860 10.419 ( 0.114 3.191 9.629) 10.145 10.739 ( -0.992 9.614 -0.686) 9.689 10.926 ( 3.344 4.871 2.570) 6.443 11.037 ( -3.073 0.959 3.816) 4.992 11.694 ( 2.367 2.142 3.972) 5.096 11.920 ( -3.386 -2.931 1.635) 4.767 12.093 ( 6.717 -7.738 -0.161) 10.247 12.434 ( -1.567 4.319 -6.850) 8.248 12.589 ( -5.764 3.518 0.928) 6.816 12.753 ( -2.178 8.489 -3.838) 9.567 13.708 ( 1.174 -0.094 5.456) 5.582 13.822 ( 5.334 -1.538 1.769) 5.827 13.869 ( 2.859 5.332 -3.085) 6.791 14.057 ( 0.214 0.637 -3.849) 3.907 15.326 ( -5.877 2.111 12.267) 13.765 15.553 ( -1.128 -1.522 2.084) 2.816 15.843 ( -3.050 3.646 -1.960) 5.141 16.344 ( 10.548 -6.726 -12.889) 17.962 16.440 ( -5.278 -4.082 3.300) 7.444 16.717 ( 3.775 -8.446 -3.276) 9.814 16.796 ( -5.366 -3.309 -2.702) 6.859 17.250 ( -16.499 -8.039 -7.238) 19.729 17.699 ( 5.669 9.803 -0.296) 11.328 17.840 ( 2.229 16.332 -2.235) 16.635 19.451 ( 4.678 -0.639 20.424) 20.962 20.226 ( 3.966 -8.540 -12.804) 15.894 ======================= Grid point 330 (174/195) ======================= q-point: ( 0.00 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( -2.945 12.690 9.609) 16.187 1.796 ( 3.657 8.390 8.107) 12.227 1.989 ( 3.847 7.686 -7.009) 11.091 2.062 ( -3.515 7.298 -10.524) 13.280 2.685 ( 2.686 -9.805 7.679) 12.740 2.857 ( -4.843 -13.193 -10.380) 17.472 3.004 ( -3.116 2.032 3.263) 4.948 3.035 ( 2.383 -0.484 -0.413) 2.467 3.317 ( 4.429 0.591 0.626) 4.512 3.345 ( -1.659 -2.895 -1.721) 3.754 3.554 ( 2.830 3.745 13.593) 14.381 3.801 ( -2.901 3.878 -11.458) 12.439 4.299 ( 0.125 2.392 3.456) 4.205 4.341 ( 0.505 1.413 -0.141) 1.507 4.459 ( 1.367 -4.614 1.187) 4.956 4.489 ( -3.351 -3.978 -1.903) 5.539 4.984 ( 0.262 -3.495 2.202) 4.139 5.002 ( 0.069 -3.480 0.412) 3.505 6.887 ( 2.390 -8.485 -1.496) 8.941 6.899 ( -0.813 -8.972 -2.501) 9.349 7.359 ( -0.566 -3.854 1.672) 4.239 7.412 ( 0.838 -5.403 -3.954) 6.748 8.153 ( 14.948 -0.155 0.264) 14.951 8.184 ( -15.858 -0.953 -3.012) 16.169 8.539 ( 2.747 -1.372 2.990) 4.286 8.581 ( -5.486 -2.769 -1.440) 6.312 8.681 ( -2.320 -0.496 1.274) 2.693 8.710 ( 3.330 -1.195 -1.630) 3.895 9.528 ( -0.698 -3.743 4.565) 5.944 9.570 ( 0.761 -4.989 -0.473) 5.068 9.726 ( 0.688 1.670 5.266) 5.567 9.803 ( 1.990 0.540 -1.870) 2.784 10.091 ( -0.957 -2.458 -0.435) 2.673 10.126 ( -0.973 -3.756 -3.812) 5.439 10.692 ( 4.781 5.295 7.609) 10.430 10.788 ( -3.125 2.388 -2.263) 4.537 11.040 ( -2.716 3.059 2.389) 4.737 11.073 ( 2.123 2.324 -1.174) 3.359 11.839 ( -1.863 1.307 1.055) 2.508 11.844 ( 2.417 -0.761 0.880) 2.683 12.160 ( 7.159 -0.985 4.814) 8.683 12.263 ( -7.590 -3.241 -3.836) 9.101 12.662 ( 0.475 5.786 0.944) 5.881 12.751 ( -1.892 3.166 -6.830) 7.762 13.853 ( 2.334 3.288 5.640) 6.933 13.898 ( 1.595 0.998 2.791) 3.366 13.971 ( 0.156 3.269 -1.857) 3.763 14.018 ( -1.847 1.384 -4.439) 5.003 15.413 ( -5.245 3.942 10.281) 12.197 15.576 ( 6.035 -1.831 -3.719) 7.322 15.910 ( -1.574 4.115 4.753) 6.481 16.145 ( 1.472 -2.299 -17.259) 17.473 16.335 ( -8.024 -5.709 13.835) 16.982 16.586 ( 8.376 -8.146 -8.326) 14.347 16.663 ( -1.068 -4.828 2.593) 5.583 16.796 ( -3.062 -7.947 -7.943) 11.646 18.027 ( 2.057 11.264 3.868) 12.086 18.092 ( -0.071 10.971 -2.879) 11.343 19.694 ( 1.105 -1.291 13.635) 13.741 19.936 ( -1.344 -7.640 -11.717) 14.052 ======================= Grid point 331 (175/195) ======================= q-point: ( 0.09 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -1.925 7.767 3.202) 8.619 1.809 ( -3.513 10.052 -9.228) 14.090 1.924 ( 4.755 4.981 0.895) 6.945 2.175 ( 11.048 10.193 3.230) 15.375 2.593 ( -10.718 -9.620 -3.253) 14.765 2.848 ( -1.502 -8.154 5.425) 9.909 2.960 ( -1.590 -3.382 4.067) 5.523 3.070 ( -0.202 -1.480 -0.587) 1.605 3.262 ( -1.675 -0.877 -4.499) 4.880 3.383 ( 1.865 -2.666 -0.363) 3.273 3.600 ( -3.040 5.243 -12.294) 13.707 3.756 ( 1.359 3.191 11.481) 11.993 4.293 ( -2.308 1.280 -1.480) 3.026 4.315 ( -2.157 2.069 -0.000) 2.989 4.442 ( 0.394 -3.462 1.175) 3.677 4.549 ( 4.502 -3.306 2.149) 5.985 4.956 ( -3.037 -3.346 -0.754) 4.581 5.020 ( 0.700 -3.607 -0.488) 3.706 6.807 ( -6.267 -6.969 -1.715) 9.528 6.866 ( -3.461 -8.843 -0.040) 9.496 7.379 ( 1.576 -3.494 -0.494) 3.865 7.407 ( -0.118 -3.489 0.494) 3.526 7.879 ( -12.327 -2.055 -0.012) 12.497 8.267 ( -7.708 -11.867 1.786) 14.263 8.543 ( -5.270 4.188 0.857) 6.786 8.632 ( 11.428 1.392 0.933) 11.550 8.732 ( 9.071 2.180 1.482) 9.446 8.822 ( 8.568 -5.322 0.275) 10.090 9.546 ( 1.920 -2.427 -1.259) 3.341 9.665 ( 7.551 -4.347 0.565) 8.731 9.736 ( -3.094 1.366 -2.262) 4.069 9.762 ( -0.037 -0.469 -3.875) 3.904 10.077 ( -2.053 -2.549 0.456) 3.305 10.085 ( -2.522 -3.228 3.891) 5.650 10.684 ( -1.854 3.950 -6.786) 8.068 10.816 ( 1.387 2.670 2.891) 4.173 11.029 ( 0.736 4.966 1.484) 5.235 11.131 ( 4.274 1.555 -1.154) 4.692 11.738 ( -6.775 -1.329 0.147) 6.906 11.907 ( 0.889 -3.075 -1.724) 3.636 12.045 ( -8.597 1.597 -3.771) 9.523 12.339 ( 4.653 -0.962 5.152) 7.008 12.701 ( 3.970 4.324 -1.697) 6.111 12.796 ( 7.917 4.496 4.967) 10.371 13.825 ( -5.313 1.113 -4.794) 7.242 13.882 ( -4.583 -0.258 -5.677) 7.301 13.923 ( -2.487 5.190 2.340) 6.212 14.001 ( -0.258 1.211 3.873) 4.066 15.443 ( -3.888 2.091 4.970) 6.648 15.598 ( 6.459 -1.259 -8.087) 10.426 15.907 ( -5.969 0.492 3.550) 6.962 16.066 ( 3.063 1.002 -0.509) 3.263 16.378 ( -5.085 -3.354 13.676) 14.971 16.554 ( 4.579 -2.625 -9.583) 10.940 16.742 ( 9.323 -6.882 -2.996) 11.969 16.911 ( 13.702 -11.261 5.945) 18.706 17.962 ( -7.252 12.617 -3.128) 14.885 18.094 ( -0.082 10.137 -0.694) 10.161 19.725 ( -6.192 -3.914 -12.635) 14.605 19.827 ( -3.769 -5.982 12.572) 14.424 ======================= Grid point 332 (176/195) ======================= q-point: ( 0.18 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( -2.792 10.197 -6.478) 12.399 1.784 ( 5.213 5.046 -2.113) 7.556 2.002 ( 2.892 1.941 0.872) 3.591 2.319 ( -5.114 1.876 1.640) 5.688 2.476 ( 1.545 1.493 6.274) 6.632 2.769 ( -9.513 -2.115 2.675) 10.106 3.026 ( -2.377 -1.452 -1.147) 3.012 3.058 ( 0.327 -8.191 7.786) 11.305 3.191 ( 0.074 -1.767 -5.601) 5.873 3.389 ( 0.367 -2.861 -1.358) 3.188 3.424 ( -1.751 5.428 -9.941) 11.461 3.796 ( -6.027 -3.187 2.143) 7.147 4.270 ( -1.310 2.931 -1.226) 3.437 4.294 ( 1.546 2.415 2.786) 3.998 4.469 ( 2.167 -2.812 -1.451) 3.835 4.655 ( 4.053 -1.233 2.345) 4.842 4.880 ( -3.399 -3.820 -2.270) 5.594 5.010 ( 0.185 -3.976 -2.165) 4.531 6.672 ( -7.447 -5.009 0.142) 8.976 6.783 ( -6.321 -6.775 0.731) 9.295 7.321 ( -4.704 0.231 -1.334) 4.895 7.459 ( 1.800 -1.465 3.989) 4.615 7.798 ( -0.887 -7.686 2.777) 8.220 8.139 ( -8.608 -14.811 3.865) 17.561 8.454 ( -4.610 1.824 -0.067) 4.958 8.692 ( -0.659 -0.988 -0.164) 1.199 8.946 ( 4.848 -0.911 -1.465) 5.146 9.059 ( 18.370 0.845 3.363) 18.695 9.519 ( -0.972 2.333 -5.574) 6.120 9.620 ( -6.899 0.207 -0.844) 6.954 9.738 ( 5.725 -3.438 -4.672) 8.150 9.842 ( 11.038 -5.051 -2.039) 12.309 10.057 ( -2.073 -1.614 3.061) 4.033 10.087 ( -3.065 -3.914 4.792) 6.905 10.589 ( 1.714 5.403 -8.490) 10.208 10.839 ( 0.170 2.669 1.336) 2.989 11.077 ( 3.225 6.113 -1.769) 7.134 11.150 ( 1.211 2.922 -4.456) 5.464 11.637 ( -4.847 -3.179 0.558) 5.823 11.776 ( -9.212 -8.457 -1.395) 12.583 11.990 ( 1.163 5.629 -0.187) 5.751 12.422 ( 0.698 -3.827 1.574) 4.196 12.826 ( 8.225 9.196 3.189) 12.743 12.997 ( 7.796 7.143 3.417) 11.112 13.637 ( -8.186 -2.998 -7.470) 11.481 13.714 ( -5.263 -3.369 -3.487) 7.156 13.895 ( -3.488 4.550 1.147) 5.847 14.021 ( -2.080 -0.020 2.792) 3.481 15.357 ( -3.848 1.369 -5.077) 6.516 15.666 ( 6.006 -5.418 -0.107) 8.089 15.868 ( -6.321 1.582 6.865) 9.464 16.122 ( 0.628 1.686 4.047) 4.428 16.505 ( 2.749 1.802 11.830) 12.278 16.596 ( 10.166 0.733 -5.394) 11.532 16.890 ( 12.360 -4.672 -5.105) 14.166 17.291 ( 18.036 -13.275 10.283) 24.643 17.766 ( -10.220 11.368 -3.402) 15.660 18.030 ( -4.555 7.953 -3.152) 9.692 19.439 ( -9.639 -0.024 -12.517) 15.798 19.853 ( -8.691 -9.802 9.952) 16.452 ======================= Grid point 333 (177/195) ======================= q-point: ( 0.27 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( -4.167 7.336 -6.847) 10.866 1.913 ( 6.520 3.083 0.857) 7.263 2.024 ( -0.606 1.301 1.635) 2.176 2.216 ( -5.971 -1.506 3.979) 7.332 2.594 ( -1.958 3.690 5.698) 7.065 2.637 ( -6.110 -1.260 2.587) 6.754 2.993 ( -1.464 -2.662 0.753) 3.130 3.066 ( -5.048 -0.875 -0.679) 5.168 3.142 ( -1.571 -7.143 -1.288) 7.426 3.297 ( -0.993 1.464 -4.251) 4.604 3.411 ( 3.353 2.695 -1.828) 4.674 3.692 ( -5.207 -4.844 0.799) 7.157 4.233 ( 0.510 2.156 -3.203) 3.894 4.361 ( 1.317 2.412 1.088) 2.956 4.475 ( 2.025 -2.977 -3.701) 5.163 4.714 ( 1.335 -0.494 -1.462) 2.041 4.802 ( -1.924 -3.970 -2.179) 4.920 4.987 ( 0.383 -4.607 -2.020) 5.045 6.578 ( -5.051 -3.000 2.579) 6.416 6.683 ( -6.204 -3.668 1.320) 7.327 7.257 ( -2.225 0.583 1.581) 2.791 7.535 ( 1.295 -2.751 3.380) 4.547 7.825 ( -1.056 -6.475 3.066) 7.242 8.104 ( -2.614 -13.043 7.237) 15.144 8.390 ( -2.282 -2.446 -1.035) 3.501 8.645 ( -4.492 -5.256 -0.471) 6.929 8.955 ( 2.178 3.163 -5.138) 6.415 9.306 ( 8.198 -4.361 -5.386) 10.734 9.425 ( -6.449 3.260 -0.944) 7.287 9.494 ( -3.393 -0.481 0.216) 3.434 9.842 ( 7.591 0.016 -0.851) 7.639 9.907 ( 1.246 -0.295 0.018) 1.281 10.089 ( -2.686 -4.678 4.856) 7.258 10.186 ( 13.191 -6.027 0.093) 14.503 10.546 ( 3.312 7.476 -6.801) 10.635 10.886 ( 3.259 1.791 2.179) 4.310 11.030 ( -0.116 5.945 -8.742) 10.572 11.121 ( 0.642 3.676 -3.431) 5.069 11.548 ( -6.853 -5.353 -1.058) 8.760 11.664 ( -4.920 -5.788 3.752) 8.473 12.009 ( 1.557 4.889 -1.160) 5.261 12.419 ( -1.771 -3.662 -0.051) 4.068 12.998 ( 6.248 11.535 2.504) 13.356 13.102 ( 3.530 7.151 -1.433) 8.103 13.417 ( -6.374 -5.670 -5.873) 10.357 13.654 ( -1.117 -4.707 0.318) 4.848 13.850 ( -2.541 2.231 1.640) 3.758 13.994 ( -3.454 -2.073 1.037) 4.160 15.261 ( -0.830 3.093 -3.236) 4.553 15.700 ( -6.117 -10.129 3.355) 12.299 15.911 ( 3.950 2.526 6.772) 8.237 16.175 ( -1.638 -1.450 5.983) 6.370 16.740 ( 12.521 6.347 -0.505) 14.046 16.754 ( 10.575 7.125 5.878) 14.041 17.003 ( 8.825 -0.619 -8.634) 12.362 17.560 ( -7.033 6.869 -0.701) 9.856 17.741 ( 14.085 -12.334 12.039) 22.259 17.881 ( -5.446 3.767 -4.102) 7.790 19.113 ( -11.029 2.747 -12.164) 16.648 19.761 ( -12.966 -12.780 6.200) 19.232 ======================= Grid point 334 (178/195) ======================= q-point: ( 0.36 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( -2.260 2.043 -5.923) 6.661 1.773 ( -14.501 -2.774 -2.266) 14.937 2.194 ( 8.091 3.586 3.123) 9.385 2.265 ( 4.068 1.667 7.888) 9.030 2.501 ( -7.351 1.484 3.277) 8.184 2.681 ( 1.233 -2.112 2.567) 3.546 2.938 ( -7.553 -2.272 0.180) 7.889 2.949 ( -2.909 -3.305 -3.112) 5.392 3.095 ( -1.580 -1.059 1.020) 2.158 3.275 ( 0.338 -1.760 -1.607) 2.408 3.466 ( 4.576 5.672 -0.646) 7.316 3.667 ( -2.190 -3.194 4.469) 5.914 4.219 ( 1.342 1.533 -2.011) 2.863 4.339 ( -0.310 1.587 -5.125) 5.374 4.451 ( 1.499 -2.609 -5.328) 6.119 4.643 ( -2.996 -4.437 -7.194) 8.967 4.794 ( 1.138 -1.630 1.357) 2.407 4.974 ( 0.122 -5.003 -1.484) 5.219 6.558 ( -1.919 -1.186 3.677) 4.313 6.616 ( -3.820 -0.902 2.269) 4.534 7.280 ( 1.446 -1.041 3.006) 3.494 7.555 ( -2.303 -6.006 1.126) 6.530 7.855 ( -0.421 -2.143 5.296) 5.729 8.194 ( 2.587 -7.278 6.189) 9.898 8.331 ( -4.175 -7.458 -0.475) 8.560 8.551 ( -3.025 -6.542 -2.267) 7.556 8.933 ( 2.674 3.294 -5.690) 7.098 9.258 ( -6.887 0.482 -4.002) 7.980 9.285 ( -2.265 -0.619 -1.682) 2.888 9.467 ( -0.398 -8.295 -5.069) 9.729 9.870 ( -0.937 2.976 4.335) 5.341 10.073 ( 5.179 -0.695 4.536) 6.919 10.118 ( 3.216 0.909 4.796) 5.845 10.391 ( 11.431 -6.170 -4.838) 13.861 10.527 ( 1.992 7.098 -3.365) 8.104 10.951 ( 1.591 5.822 -6.321) 8.740 10.970 ( 2.267 -5.960 -2.631) 6.898 11.091 ( 3.267 6.744 -0.551) 7.513 11.392 ( -8.604 -4.133 -2.175) 9.789 11.625 ( -6.051 -5.716 3.063) 8.870 12.024 ( 2.770 6.359 -1.538) 7.104 12.363 ( -3.369 -0.909 -1.819) 3.935 13.065 ( 1.880 4.762 -0.167) 5.122 13.149 ( 4.312 6.791 -1.277) 8.145 13.320 ( -0.470 -5.194 -2.046) 5.602 13.598 ( -5.153 -1.814 -1.742) 5.734 13.870 ( 0.205 0.848 3.143) 3.262 13.954 ( -1.592 -2.746 1.324) 3.439 15.258 ( 2.308 3.038 0.299) 3.827 15.602 ( -8.014 -8.190 2.366) 11.700 16.103 ( 6.693 -1.294 8.369) 10.794 16.209 ( -3.398 -3.520 7.821) 9.225 16.887 ( 9.314 8.179 -9.157) 15.411 16.936 ( -0.986 8.372 -1.736) 8.606 17.092 ( 18.455 6.953 -2.071) 19.829 17.501 ( -4.155 4.279 5.708) 8.255 17.669 ( -8.529 0.870 -1.327) 8.675 18.166 ( 12.713 -8.546 9.185) 17.862 18.809 ( -6.047 -0.454 -10.841) 12.421 19.558 ( -15.972 -14.965 1.948) 21.974 ======================= Grid point 335 (179/195) ======================= q-point: ( 0.45 0.33 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.350 ( 5.793 -3.247 -4.665) 8.116 1.494 ( -12.222 -4.176 -3.294) 13.329 2.305 ( 0.172 3.537 5.874) 6.859 2.383 ( -0.800 -0.196 1.150) 1.414 2.524 ( 6.454 7.154 3.351) 10.201 2.690 ( -4.753 -2.388 0.758) 5.373 2.846 ( -1.233 -3.117 1.800) 3.805 2.906 ( 0.287 -2.188 -0.808) 2.350 3.104 ( 0.096 -1.541 2.504) 2.942 3.240 ( -0.873 -3.789 -3.958) 5.548 3.540 ( 2.039 5.555 3.443) 6.846 3.678 ( -2.015 2.150 1.700) 3.402 4.224 ( 0.386 -0.614 0.974) 1.215 4.296 ( 1.897 0.238 -2.492) 3.140 4.402 ( 0.402 -1.906 -6.010) 6.317 4.475 ( -4.106 -4.278 -9.831) 11.481 4.845 ( 1.447 -3.159 2.873) 4.509 4.949 ( -0.579 -4.963 -2.284) 5.495 6.584 ( 0.291 0.120 2.586) 2.606 6.601 ( -1.080 0.638 2.000) 2.361 7.362 ( 2.806 -3.016 3.779) 5.590 7.499 ( -3.358 -6.574 -1.222) 7.482 7.932 ( 0.656 -0.013 7.181) 7.211 8.188 ( -3.052 -1.511 -6.219) 7.090 8.349 ( 0.348 -9.766 8.649) 13.050 8.510 ( 1.330 -6.502 -3.377) 7.447 8.919 ( 1.943 0.556 -2.071) 2.894 9.093 ( -5.843 -0.201 -4.854) 7.598 9.256 ( -2.657 -1.534 3.239) 4.461 9.388 ( 1.737 -9.090 -8.064) 12.275 9.939 ( 1.674 3.473 5.672) 6.858 10.103 ( -1.535 -0.287 0.596) 1.671 10.279 ( 1.385 5.218 6.935) 8.789 10.448 ( 5.874 -0.154 -6.628) 8.857 10.581 ( 4.214 -1.698 1.809) 4.890 10.823 ( -4.720 -4.480 -8.660) 10.832 10.995 ( 5.954 4.495 -2.298) 7.806 11.148 ( -7.422 4.006 0.094) 8.435 11.301 ( 7.482 -4.886 0.115) 8.937 11.510 ( -8.597 -6.257 -0.463) 10.643 12.086 ( 4.468 7.197 1.384) 8.583 12.263 ( -4.678 3.195 -3.323) 6.568 13.118 ( 3.388 1.242 1.674) 3.977 13.224 ( 3.561 7.822 -0.294) 8.600 13.292 ( 1.328 -9.094 -2.171) 9.443 13.454 ( -7.613 -2.343 -3.004) 8.513 13.908 ( 0.727 1.831 2.995) 3.585 13.964 ( -0.254 0.618 0.885) 1.109 15.335 ( 4.549 -0.269 2.251) 5.082 15.492 ( -6.000 -6.102 -0.478) 8.571 16.246 ( -3.968 -1.797 10.288) 11.172 16.311 ( 4.868 -2.948 7.383) 9.322 16.783 ( -2.131 8.175 -5.934) 10.324 16.950 ( 4.494 1.555 -10.953) 11.941 17.319 ( 0.482 7.390 3.003) 7.991 17.446 ( 3.392 4.703 -6.095) 8.413 17.703 ( 3.502 6.692 14.661) 16.492 18.220 ( -7.513 8.868 -6.616) 13.373 18.846 ( 15.822 -17.370 2.236) 23.602 19.268 ( -17.164 -16.307 -2.329) 23.790 ======================= Grid point 336 (180/195) ======================= q-point: (-0.45 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -2.529 -2.445 -2.485) 4.307 1.494 ( 15.791 -5.218 -3.188) 16.933 2.307 ( -5.540 5.587 4.463) 9.045 2.425 ( 4.677 1.102 -1.410) 5.008 2.576 ( -5.301 2.160 -1.363) 5.884 2.665 ( 5.528 1.997 2.218) 6.282 2.836 ( -5.390 -1.516 1.820) 5.888 2.935 ( 4.258 -1.983 -2.309) 5.234 3.137 ( -1.838 -3.962 0.736) 4.429 3.195 ( 3.574 -5.198 -1.601) 6.508 3.560 ( -7.566 6.653 3.247) 10.586 3.682 ( 5.006 4.295 -0.247) 6.601 4.280 ( -1.902 -0.896 1.709) 2.709 4.295 ( -2.502 -3.307 -1.704) 4.483 4.333 ( 2.167 -3.684 0.521) 4.305 4.349 ( 2.128 -1.013 -3.990) 4.634 4.898 ( -0.119 -4.358 0.405) 4.378 4.906 ( 0.303 -4.197 -0.823) 4.288 6.609 ( 0.781 0.667 0.082) 1.030 6.625 ( 2.357 0.634 -0.255) 2.454 7.390 ( -4.940 -4.175 1.509) 6.641 7.489 ( 5.305 -6.141 -0.801) 8.155 8.021 ( -2.183 0.500 4.998) 5.476 8.095 ( 2.609 -0.443 -3.276) 4.212 8.416 ( -2.411 -5.953 5.155) 8.235 8.486 ( 1.456 -8.741 -4.850) 10.102 8.944 ( -3.579 -1.751 -2.110) 4.509 8.997 ( 4.210 -3.299 2.574) 5.936 9.254 ( -2.443 -2.648 3.676) 5.147 9.365 ( 5.331 -5.407 -6.031) 9.697 10.022 ( -1.882 3.405 0.975) 4.011 10.066 ( 2.645 2.813 -0.357) 3.878 10.328 ( -5.088 2.506 6.805) 8.859 10.421 ( -1.649 1.749 -6.508) 6.938 10.633 ( -4.619 -4.047 -3.384) 7.012 10.710 ( 4.824 -4.400 1.778) 6.767 10.954 ( -9.342 5.630 1.713) 11.041 11.158 ( 11.888 2.806 -2.022) 12.381 11.322 ( -10.073 -5.344 -0.912) 11.439 11.499 ( 10.691 -5.755 0.353) 12.147 12.132 ( -5.824 6.644 -3.234) 9.409 12.194 ( 4.287 5.126 3.585) 7.584 13.152 ( -4.224 1.140 -0.796) 4.447 13.220 ( 3.540 3.858 -1.035) 5.338 13.292 ( -6.471 -5.522 -1.901) 8.717 13.404 ( 7.835 -3.971 2.065) 9.024 13.947 ( -0.976 2.245 -0.506) 2.500 13.958 ( 0.928 1.781 1.117) 2.298 15.384 ( -4.020 -1.423 -2.436) 4.912 15.461 ( 6.512 -4.725 2.141) 8.326 16.278 ( -7.175 0.768 9.430) 11.874 16.403 ( 2.264 -2.918 -2.321) 4.362 16.757 ( -1.807 2.869 4.439) 5.586 16.837 ( 0.705 1.708 -9.800) 9.972 17.230 ( -14.336 7.873 8.599) 18.478 17.498 ( 8.091 -0.082 -6.996) 10.697 17.971 ( -4.909 8.132 -12.069) 15.358 18.021 ( 11.236 14.623 12.500) 22.278 18.917 ( -17.235 -16.357 -4.120) 24.116 19.213 ( 19.319 -18.379 3.029) 26.836 ======================= Grid point 337 (181/195) ======================= q-point: (-0.36 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( 5.023 3.618 -0.744) 6.235 1.772 ( 18.359 -3.869 -2.238) 18.896 2.227 ( -8.378 9.267 0.299) 12.497 2.415 ( 0.032 1.779 -6.504) 6.743 2.547 ( 3.362 -0.387 -1.393) 3.660 2.718 ( -1.169 -2.886 -1.282) 3.367 2.827 ( 0.867 -1.177 7.049) 7.199 2.941 ( 2.210 0.495 -1.224) 2.575 3.149 ( 3.095 -4.998 -1.526) 6.074 3.241 ( 0.812 -2.963 0.452) 3.105 3.439 ( -8.079 7.931 2.341) 11.561 3.758 ( 3.944 -1.551 -3.269) 5.352 4.213 ( -1.124 0.808 -0.775) 1.587 4.249 ( -1.933 0.533 1.665) 2.607 4.381 ( 1.203 -3.191 1.708) 3.814 4.482 ( 4.352 -5.497 8.971) 11.386 4.842 ( -1.425 -2.814 -3.298) 4.563 4.945 ( 0.658 -4.703 1.727) 5.053 6.624 ( 3.014 -0.366 -2.873) 4.180 6.663 ( 4.085 -0.397 -2.343) 4.726 7.319 ( -2.910 -2.571 -0.853) 3.976 7.570 ( 3.924 -7.284 -0.416) 8.285 7.971 ( 0.492 0.703 -5.926) 5.988 8.173 ( 0.069 0.170 5.386) 5.390 8.389 ( -1.485 -8.276 -1.969) 8.635 8.504 ( 4.653 -9.245 0.831) 10.384 8.867 ( -3.157 -0.250 0.358) 3.187 9.139 ( 1.386 -7.785 8.195) 11.388 9.271 ( 2.775 0.575 0.736) 2.928 9.421 ( 5.930 -3.657 -1.709) 7.174 9.955 ( -0.578 4.038 -4.209) 5.861 10.127 ( -0.372 -0.414 0.034) 0.558 10.224 ( -10.730 2.038 -4.131) 11.677 10.270 ( -8.579 -0.425 3.927) 9.444 10.535 ( -1.934 1.956 -3.044) 4.103 10.853 ( 2.908 2.773 4.264) 5.859 10.861 ( -3.216 -0.697 5.558) 6.459 11.131 ( -8.380 -0.367 -2.706) 8.814 11.364 ( 11.285 -0.564 0.693) 11.320 11.667 ( 8.355 -6.294 -1.362) 10.549 12.010 ( -4.873 7.696 -0.393) 9.118 12.306 ( 3.275 0.956 3.948) 5.218 13.068 ( -3.173 -0.247 -0.377) 3.205 13.153 ( -4.402 7.260 -1.608) 8.642 13.296 ( 2.171 -4.189 0.278) 4.727 13.557 ( 6.474 -2.863 2.176) 7.405 13.919 ( -0.222 1.466 -1.893) 2.405 13.974 ( 0.657 -0.968 -0.423) 1.244 15.295 ( -2.289 3.937 -3.257) 5.598 15.605 ( 7.311 -7.521 1.634) 10.615 16.187 ( -11.173 1.047 1.985) 11.396 16.363 ( 1.186 -4.147 -7.459) 8.617 16.735 ( -4.172 6.120 4.863) 8.860 16.848 ( 0.026 -0.215 3.053) 3.061 17.045 ( -15.622 9.098 5.146) 18.797 17.559 ( 4.463 -0.366 -1.263) 4.652 17.800 ( 3.134 3.538 -12.236) 13.117 18.265 ( -1.592 3.828 0.887) 4.240 18.659 ( -2.688 -3.829 2.463) 5.288 19.564 ( 17.914 -17.199 1.205) 24.863 ======================= Grid point 338 (182/195) ======================= q-point: (-0.27 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( 5.449 10.998 1.901) 12.420 1.937 ( -4.486 5.546 -1.901) 7.382 2.092 ( 2.806 3.313 -5.157) 6.741 2.331 ( 2.887 -1.439 -7.730) 8.376 2.638 ( 5.495 -1.446 2.626) 6.260 2.677 ( -0.403 0.319 -1.920) 1.988 2.947 ( 2.751 -0.971 3.857) 4.836 3.019 ( 1.601 4.198 6.429) 7.843 3.124 ( -0.418 0.124 -3.345) 3.373 3.278 ( 2.794 -7.369 0.272) 7.885 3.372 ( -2.809 2.066 2.179) 4.112 3.749 ( 2.783 -5.174 -5.170) 7.826 4.188 ( -0.737 0.851 1.086) 1.564 4.311 ( 0.879 1.806 5.702) 6.045 4.419 ( 0.475 -3.734 2.201) 4.360 4.639 ( 1.962 -3.010 6.490) 7.418 4.789 ( -0.389 -2.463 -1.517) 2.918 4.962 ( -0.317 -4.968 0.839) 5.049 6.652 ( 5.671 -2.285 -4.697) 7.710 6.722 ( 6.301 -2.938 -2.590) 7.420 7.284 ( 0.382 -0.888 -1.075) 1.446 7.595 ( 0.841 -5.749 -2.609) 6.370 7.918 ( 1.853 -1.627 -6.537) 6.986 8.198 ( 0.670 -7.183 -0.864) 7.266 8.369 ( 0.958 -4.711 0.477) 4.831 8.633 ( 6.554 -6.651 0.757) 9.369 8.849 ( -2.198 0.628 5.067) 5.559 9.177 ( -6.410 -8.005 7.431) 12.664 9.399 ( 8.408 2.182 1.751) 8.861 9.498 ( 2.890 -1.757 -0.072) 3.383 9.872 ( -13.312 2.544 -3.816) 14.080 9.921 ( -4.364 0.719 -1.547) 4.685 10.138 ( -9.283 -3.027 4.543) 10.769 10.178 ( 1.716 -3.448 -3.774) 5.392 10.479 ( -2.595 8.224 -0.255) 8.628 10.858 ( -2.387 2.644 5.779) 6.789 10.941 ( -1.434 -0.390 -0.112) 1.490 11.045 ( 0.377 4.139 4.009) 5.774 11.535 ( 7.621 -2.329 0.293) 7.975 11.727 ( 2.595 -3.548 -3.014) 5.330 11.980 ( -0.315 4.270 1.760) 4.630 12.391 ( 1.715 -3.699 2.858) 4.979 13.043 ( -0.844 5.850 -0.891) 5.977 13.076 ( -3.520 10.541 0.078) 11.113 13.340 ( 3.480 -6.089 1.724) 7.222 13.653 ( 2.124 -3.831 0.491) 4.408 13.891 ( 0.808 1.155 -2.297) 2.695 14.006 ( 3.546 -2.472 -0.293) 4.333 15.240 ( -0.500 6.149 -1.219) 6.289 15.732 ( 4.649 -9.400 0.126) 10.487 15.988 ( -10.587 3.845 -0.018) 11.264 16.312 ( 2.489 -1.532 -7.119) 7.696 16.671 ( -8.940 2.380 3.064) 9.746 16.756 ( -14.976 -1.462 3.359) 15.417 16.963 ( 1.374 8.632 0.496) 8.755 17.581 ( 0.775 1.547 -1.891) 2.563 17.827 ( 7.695 0.454 -1.023) 7.776 17.985 ( -13.824 -9.629 -12.032) 20.703 18.886 ( 10.943 10.737 11.308) 19.050 19.841 ( 14.643 -15.531 -2.249) 21.464 ======================= Grid point 339 (183/195) ======================= q-point: (-0.18 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.555 ( 2.791 15.599 4.932) 16.597 1.752 ( -9.585 9.905 0.210) 13.785 2.052 ( -1.841 -0.431 -4.163) 4.572 2.382 ( 8.091 -2.221 -4.805) 9.669 2.612 ( -3.003 2.186 -6.982) 7.909 2.766 ( 3.497 2.022 5.816) 7.082 2.987 ( 2.855 4.725 1.270) 5.665 3.101 ( 0.713 4.997 3.464) 6.121 3.160 ( 2.120 -7.724 1.061) 8.080 3.293 ( 1.235 -4.615 -0.898) 4.861 3.376 ( 0.131 -4.032 0.357) 4.050 3.798 ( 6.296 -5.844 0.504) 8.605 4.222 ( 1.490 0.749 3.140) 3.556 4.346 ( -1.182 2.981 -0.156) 3.211 4.435 ( -0.852 -4.216 1.005) 4.417 4.665 ( -2.945 1.589 1.251) 3.573 4.831 ( 3.143 -5.499 2.679) 6.877 4.967 ( -0.382 -4.745 1.695) 5.053 6.718 ( 8.267 -4.442 -4.395) 10.363 6.813 ( 7.114 -6.401 -2.226) 9.825 7.308 ( 2.718 -0.476 0.094) 2.761 7.548 ( -0.512 -3.126 -4.892) 5.828 7.879 ( 2.231 -4.911 -5.695) 7.844 8.214 ( 5.354 -12.760 -3.576) 14.292 8.436 ( 4.501 1.330 1.969) 5.090 8.687 ( -0.387 -0.272 0.426) 0.637 8.896 ( -1.065 -2.845 3.457) 4.602 9.076 ( -14.567 -4.028 2.357) 15.297 9.455 ( -2.785 3.976 0.389) 4.870 9.591 ( 6.838 -0.239 2.449) 7.267 9.643 ( -9.257 -2.581 4.730) 10.711 9.807 ( -9.909 -4.812 1.433) 11.108 10.097 ( 1.890 -0.291 -0.797) 2.072 10.179 ( 3.384 -4.165 -4.574) 7.051 10.453 ( -2.433 8.135 4.498) 9.609 10.841 ( -2.399 -1.541 1.087) 3.052 10.982 ( 0.536 7.299 6.249) 9.624 11.096 ( -0.180 4.603 2.039) 5.037 11.631 ( 3.291 -1.749 0.681) 3.789 11.765 ( 5.027 -5.406 0.528) 7.401 11.992 ( 0.140 2.961 -0.235) 2.974 12.422 ( -0.930 -6.423 1.127) 6.587 12.925 ( -5.395 12.452 -6.599) 15.090 13.042 ( -3.337 9.019 -1.275) 9.701 13.493 ( 7.365 -5.138 7.054) 11.420 13.672 ( 1.801 -5.849 1.014) 6.203 13.920 ( 4.125 3.450 -1.241) 5.519 14.060 ( 3.118 -1.132 -1.294) 3.560 15.265 ( 2.088 4.690 3.298) 6.102 15.669 ( -9.575 -4.364 -0.152) 10.524 15.938 ( 1.136 3.327 1.711) 3.910 16.264 ( 2.967 1.792 -8.859) 9.513 16.532 ( -9.065 -1.515 -1.013) 9.246 16.571 ( -8.518 -6.751 3.736) 11.493 16.924 ( -2.499 3.348 -6.741) 7.930 17.459 ( -16.054 -8.927 -5.927) 19.301 17.749 ( 4.969 4.367 -2.820) 7.191 17.979 ( 7.133 4.053 1.596) 8.357 19.202 ( 9.112 8.705 12.287) 17.600 20.005 ( 9.912 -13.430 -6.036) 17.750 ======================= Grid point 340 (184/195) ======================= q-point: (-0.09 0.33 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -0.019 17.473 6.758) 18.735 1.688 ( -2.889 8.850 7.652) 12.051 1.989 ( 0.985 1.002 -4.225) 4.453 2.323 ( -7.052 7.224 -10.275) 14.404 2.553 ( 4.777 -6.625 0.755) 8.203 2.900 ( 5.109 2.824 3.820) 6.977 3.027 ( -1.233 -5.647 -2.386) 6.253 3.096 ( -3.254 -6.938 -5.702) 9.551 3.191 ( 6.315 7.664 2.636) 10.274 3.370 ( -0.099 -2.617 5.610) 6.191 3.385 ( 1.391 -2.909 3.783) 4.971 3.897 ( 3.335 -2.403 -2.670) 4.902 4.285 ( -1.014 2.298 -0.495) 2.560 4.298 ( 1.842 2.590 1.229) 3.407 4.434 ( -0.618 -4.731 1.354) 4.959 4.595 ( -4.616 -1.042 -1.742) 5.042 4.919 ( 2.927 -4.336 2.827) 5.946 4.990 ( -0.156 -3.921 2.334) 4.565 6.820 ( 7.844 -6.579 -3.043) 10.681 6.892 ( 4.628 -8.892 -2.391) 10.306 7.349 ( 0.486 -2.422 1.076) 2.694 7.476 ( -1.116 -4.649 -4.991) 6.911 7.917 ( 10.732 -1.343 -3.783) 11.459 8.300 ( 6.627 -11.789 -1.629) 13.622 8.541 ( 3.752 3.332 1.061) 5.129 8.643 ( -6.438 2.121 -0.175) 6.781 8.767 ( -13.487 1.684 -2.256) 13.778 8.826 ( -9.339 -5.452 -0.054) 10.814 9.466 ( -1.446 -0.500 6.833) 7.002 9.615 ( -3.553 -4.954 6.211) 8.703 9.671 ( -4.256 -1.281 0.610) 4.487 9.737 ( 5.180 -1.399 1.394) 5.544 10.113 ( 1.230 -0.909 -2.411) 2.855 10.174 ( 1.941 -3.766 -4.916) 6.490 10.525 ( 1.985 6.738 8.571) 11.082 10.830 ( -1.228 -0.626 1.056) 1.737 11.028 ( -0.950 5.609 2.475) 6.204 11.096 ( -2.060 4.678 1.482) 5.322 11.714 ( 4.907 -0.311 2.785) 5.651 11.871 ( 1.762 -4.088 2.320) 5.019 12.007 ( 4.464 1.173 0.070) 4.616 12.385 ( -4.205 -6.334 0.012) 7.603 12.749 ( -4.796 9.928 -6.857) 12.984 12.907 ( -6.105 6.603 -5.970) 10.794 13.701 ( 5.599 -0.565 7.800) 9.618 13.779 ( 5.361 -2.622 4.716) 7.606 13.970 ( 3.409 4.628 -2.219) 6.161 14.070 ( 0.905 0.565 -3.113) 3.290 15.368 ( 0.520 2.710 7.713) 8.191 15.536 ( -4.935 -0.942 2.481) 5.603 15.934 ( -1.480 6.238 -2.055) 6.732 16.240 ( 5.370 -3.195 -7.971) 10.128 16.377 ( -8.071 -3.471 0.993) 8.842 16.536 ( 0.034 -10.076 1.398) 10.173 16.759 ( -4.088 -0.208 -8.660) 9.579 17.075 ( -14.764 -9.523 -9.449) 19.949 17.891 ( 7.067 9.713 3.886) 12.625 18.085 ( 3.271 8.181 0.376) 8.819 19.478 ( 5.481 3.968 13.250) 14.878 20.036 ( 4.300 -10.822 -9.405) 14.968 ======================= Grid point 341 (185/195) ======================= q-point: ( 0.00 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( 0.045 5.232 4.075) 6.632 1.932 ( 0.415 3.766 1.629) 4.124 2.177 ( 9.600 12.344 1.663) 15.726 2.268 ( -8.798 12.823 -8.491) 17.718 2.457 ( 4.135 -12.318 4.799) 13.851 2.576 ( -6.029 -15.155 -8.104) 18.213 3.055 ( -2.419 2.983 0.043) 3.840 3.059 ( 1.771 2.408 -0.770) 3.087 3.223 ( 2.647 -5.615 -0.157) 6.210 3.230 ( -1.074 -6.127 -0.844) 6.278 3.756 ( 2.474 11.589 9.768) 15.357 3.879 ( -0.297 0.498 -2.188) 2.264 4.323 ( -0.031 0.334 1.263) 1.307 4.361 ( -1.332 0.004 0.113) 1.337 4.382 ( 2.319 -2.243 0.902) 3.350 4.397 ( -4.042 -3.712 -2.535) 6.045 4.946 ( 0.312 -0.558 2.204) 2.294 4.955 ( -0.014 -1.412 1.244) 1.882 6.757 ( 1.202 -3.788 -2.178) 4.532 6.763 ( 0.653 -4.266 -2.717) 5.100 7.308 ( -0.048 -1.044 -0.147) 1.055 7.327 ( 0.379 -2.957 -2.180) 3.693 8.158 ( 4.308 0.549 0.303) 4.353 8.171 ( -5.097 -0.639 -0.926) 5.219 8.496 ( 0.175 -1.084 0.662) 1.282 8.516 ( -2.452 -2.856 -1.281) 3.976 8.716 ( -1.891 2.409 0.843) 3.176 8.731 ( 1.687 1.047 -0.695) 2.103 9.459 ( -0.287 -2.267 2.712) 3.546 9.472 ( 0.980 -3.719 1.205) 4.030 9.773 ( 1.294 2.396 3.845) 4.712 9.804 ( 2.085 -0.711 1.109) 2.466 10.062 ( -1.258 -0.484 -2.170) 2.555 10.073 ( -1.144 -1.634 -3.204) 3.774 10.772 ( 2.668 2.931 4.850) 6.263 10.804 ( -0.864 -0.415 1.608) 1.872 11.089 ( -1.114 1.697 0.235) 2.044 11.102 ( -0.694 0.421 -1.163) 1.418 11.836 ( 1.282 0.121 0.270) 1.316 11.845 ( 1.208 -0.540 -0.591) 1.449 12.164 ( 3.448 1.273 4.515) 5.822 12.203 ( -3.475 -2.667 1.220) 4.547 12.756 ( -1.156 3.444 -3.330) 4.928 12.787 ( -2.720 0.258 -5.934) 6.533 13.898 ( 3.513 1.356 5.735) 6.860 13.908 ( 3.032 0.107 5.082) 5.919 14.024 ( -1.511 1.880 -2.615) 3.558 14.038 ( -2.003 0.398 -3.404) 3.969 15.482 ( -1.514 3.060 4.939) 6.004 15.533 ( 2.315 -2.403 0.849) 3.442 16.018 ( -2.656 6.172 -2.204) 7.071 16.114 ( 0.883 -2.580 -10.981) 11.314 16.268 ( -4.594 0.966 11.603) 12.517 16.392 ( 4.292 -9.839 1.966) 10.913 16.633 ( -0.764 0.417 -6.187) 6.248 16.675 ( -1.428 -4.178 -7.559) 8.755 18.195 ( 2.041 5.622 3.357) 6.859 18.227 ( 0.794 2.642 0.119) 2.762 19.705 ( 0.190 2.693 4.637) 5.366 19.796 ( -0.873 -6.369 -4.787) 8.015 ======================= Grid point 342 (186/195) ======================= q-point: ( 0.09 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.904 ( -1.091 6.125 -1.117) 6.321 1.970 ( 0.768 -0.270 -0.406) 0.910 2.060 ( -5.238 14.593 -5.045) 16.305 2.346 ( -5.923 -13.341 -1.612) 14.685 2.406 ( 7.692 11.709 4.224) 14.632 2.649 ( 6.864 -11.997 5.937) 15.043 2.967 ( -6.827 3.426 0.963) 7.699 3.046 ( -4.138 -2.776 0.546) 5.012 3.193 ( -0.179 -1.053 -2.072) 2.331 3.268 ( 1.801 -6.897 -0.483) 7.145 3.765 ( -4.243 8.188 -7.926) 12.160 3.836 ( -3.253 1.682 2.670) 4.532 4.320 ( -0.374 2.255 1.511) 2.740 4.363 ( -0.530 2.790 -0.383) 2.866 4.378 ( 1.641 -2.987 1.823) 3.866 4.448 ( 4.019 -6.137 2.102) 7.631 4.932 ( -1.927 0.623 -0.797) 2.177 4.963 ( -0.181 -2.301 -0.528) 2.368 6.708 ( -3.836 -2.559 -1.398) 4.819 6.727 ( -2.635 -4.614 -0.739) 5.365 7.326 ( 1.952 -1.389 -0.496) 2.446 7.338 ( 2.427 -2.648 0.452) 3.621 7.915 ( -15.444 5.135 1.119) 16.313 8.058 ( -13.164 -9.356 1.579) 16.227 8.632 ( -1.116 4.148 -0.105) 4.296 8.668 ( 4.090 1.798 1.270) 4.645 8.725 ( 15.272 -1.937 1.680) 15.486 8.754 ( 6.562 -2.194 0.626) 6.948 9.513 ( 5.979 0.321 -1.123) 6.092 9.569 ( 8.363 -4.805 -0.567) 9.662 9.758 ( -4.100 0.811 -2.175) 4.712 9.764 ( -2.901 0.178 -5.193) 5.951 10.044 ( -1.666 -0.838 2.329) 2.983 10.045 ( -1.803 -0.982 2.855) 3.517 10.761 ( -1.606 3.811 -3.433) 5.375 10.819 ( 0.085 -1.828 -0.355) 1.864 11.110 ( 2.875 3.224 1.416) 4.545 11.147 ( 3.923 -0.469 1.118) 4.106 11.738 ( -7.810 1.767 -1.227) 8.101 11.807 ( -6.103 -5.102 -2.270) 8.273 12.149 ( -0.660 6.658 -1.959) 6.971 12.269 ( 3.269 -5.425 0.465) 6.351 12.793 ( 5.812 4.195 3.030) 7.782 12.839 ( 7.708 -0.238 5.396) 9.412 13.849 ( -7.317 1.352 -6.184) 9.675 13.872 ( -6.542 -0.892 -6.562) 9.309 13.996 ( -1.709 2.392 2.854) 4.097 14.018 ( -1.028 0.121 3.469) 3.620 15.486 ( -2.498 2.588 0.446) 3.624 15.546 ( 1.131 -3.408 -3.199) 4.809 15.969 ( -4.600 5.087 4.654) 8.288 16.060 ( -0.270 -3.007 1.008) 3.183 16.379 ( 5.314 4.439 6.349) 9.394 16.501 ( 12.003 -5.272 -9.491) 16.184 16.643 ( 5.062 -0.838 4.317) 6.706 16.719 ( 8.197 -7.595 4.056) 11.888 18.158 ( -5.006 6.969 -3.903) 9.427 18.212 ( -2.167 1.699 -2.094) 3.459 19.683 ( -5.973 -0.066 -4.093) 7.241 19.725 ( -4.846 -4.121 5.360) 8.319 ======================= Grid point 343 (187/195) ======================= q-point: ( 0.18 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.868 ( -2.245 7.549 -1.929) 8.109 1.933 ( -2.050 9.427 -0.284) 9.652 1.991 ( 0.959 -0.512 -1.737) 2.049 2.201 ( -8.100 -11.725 0.794) 14.273 2.618 ( 6.329 10.989 5.979) 14.020 2.791 ( -1.489 0.055 3.601) 3.897 2.884 ( -2.912 -5.747 4.693) 7.971 2.960 ( -6.053 -6.020 0.985) 8.594 3.162 ( -0.721 2.463 -2.092) 3.311 3.272 ( 0.023 -7.388 -1.339) 7.509 3.600 ( -3.129 8.894 -7.458) 12.021 3.730 ( -6.795 -4.584 -2.637) 8.610 4.326 ( 0.562 3.324 -3.439) 4.816 4.398 ( 1.510 6.428 4.070) 7.757 4.400 ( 2.448 -2.937 -2.580) 4.612 4.554 ( 2.541 -7.839 4.297) 9.294 4.878 ( -1.363 2.488 -2.871) 4.036 4.939 ( -0.248 -3.444 -2.569) 4.304 6.617 ( -5.428 -0.410 0.504) 5.467 6.662 ( -4.536 -4.893 0.671) 6.705 7.338 ( -0.166 1.907 -1.065) 2.190 7.401 ( 2.267 -4.165 1.668) 5.026 7.753 ( -6.617 3.339 5.154) 9.028 7.893 ( -9.032 -10.317 5.187) 14.660 8.528 ( -6.577 5.258 -0.315) 8.426 8.633 ( -5.231 -4.853 -0.089) 7.136 8.966 ( 11.041 2.796 -1.470) 11.483 9.032 ( 15.285 -3.215 0.090) 15.620 9.573 ( -0.336 3.312 -3.568) 4.880 9.619 ( -6.108 -0.817 -2.057) 6.496 9.696 ( 7.171 -0.482 -4.218) 8.334 9.738 ( 11.170 -4.736 -2.454) 12.378 10.037 ( -3.267 -0.531 3.698) 4.963 10.040 ( -3.522 -1.052 4.060) 5.477 10.707 ( 1.891 6.291 -5.299) 8.440 10.814 ( 2.033 -4.268 -2.403) 5.304 11.175 ( 2.919 3.809 -0.910) 4.885 11.204 ( 1.731 1.235 -1.660) 2.698 11.592 ( -7.416 -0.244 0.497) 7.436 11.643 ( -8.950 -5.126 -0.244) 10.317 12.137 ( 1.388 8.573 -1.738) 8.857 12.300 ( 1.608 -7.882 -1.344) 8.156 12.997 ( 9.228 7.357 6.831) 13.636 13.074 ( 9.309 0.064 6.518) 11.364 13.601 ( -10.243 -0.108 -8.872) 13.551 13.640 ( -8.807 -3.628 -7.259) 11.976 13.970 ( -3.879 3.001 0.965) 4.999 14.011 ( -3.268 -1.236 1.594) 3.840 15.417 ( -2.802 4.736 -2.426) 6.014 15.532 ( -0.265 -6.960 -0.170) 6.967 15.962 ( -4.688 6.428 7.263) 10.772 16.081 ( -3.207 -5.097 6.406) 8.792 16.596 ( 16.048 4.710 -1.990) 16.843 16.627 ( 15.844 1.621 -8.241) 17.933 16.841 ( 8.876 2.415 7.572) 11.915 17.022 ( 13.512 -13.532 12.921) 23.078 17.970 ( -8.821 9.026 -6.794) 14.333 18.086 ( -6.549 -2.128 -6.087) 9.191 19.500 ( -10.223 6.233 -3.389) 12.444 19.660 ( -9.589 -9.694 4.584) 14.385 ======================= Grid point 344 (188/195) ======================= q-point: ( 0.27 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.719 ( -9.695 11.306 -3.394) 15.276 1.909 ( -8.304 -6.228 -1.057) 10.434 2.040 ( 5.883 3.316 4.782) 8.275 2.138 ( -0.243 -5.668 4.532) 7.261 2.702 ( -5.793 7.481 0.893) 9.503 2.726 ( -2.954 9.087 4.166) 10.424 2.874 ( -3.800 -8.736 -0.263) 9.530 2.926 ( -3.863 -10.656 4.601) 12.233 3.126 ( -0.951 4.709 -0.925) 4.892 3.244 ( -0.591 -6.034 -1.935) 6.364 3.527 ( 1.814 6.386 -2.256) 7.011 3.619 ( -2.737 -3.504 -0.080) 4.447 4.293 ( 1.688 4.178 -5.123) 6.822 4.389 ( 2.744 -5.255 -5.601) 8.156 4.452 ( -0.186 6.530 0.759) 6.577 4.596 ( -0.976 -7.822 -0.327) 7.890 4.834 ( 0.300 3.465 -2.799) 4.465 4.905 ( 0.196 -3.885 -2.699) 4.734 6.555 ( -3.668 0.749 2.803) 4.676 6.603 ( -3.826 -3.891 2.178) 5.875 7.306 ( -1.802 4.592 0.137) 4.935 7.428 ( -0.694 -7.322 0.579) 7.378 7.783 ( -0.428 2.508 7.730) 8.137 7.896 ( -1.109 -8.574 9.254) 12.664 8.414 ( -5.401 4.247 -1.437) 7.020 8.525 ( -6.104 -6.562 -1.105) 9.030 9.047 ( 5.048 6.197 -6.615) 10.375 9.184 ( 7.428 -7.467 -7.265) 12.795 9.469 ( -7.133 1.483 -2.272) 7.631 9.487 ( -5.524 -0.456 -1.908) 5.862 9.860 ( 8.096 1.840 2.026) 8.546 9.896 ( 6.979 -1.258 1.584) 7.266 10.040 ( -0.399 -0.113 4.052) 4.074 10.083 ( 7.347 -4.173 1.756) 8.630 10.699 ( 3.164 7.829 -4.527) 9.581 10.835 ( 3.357 -5.778 -2.631) 7.181 11.135 ( -0.645 4.565 -7.263) 8.603 11.181 ( 0.215 0.711 -4.794) 4.851 11.490 ( -6.872 0.497 2.480) 7.322 11.556 ( -5.301 -5.179 4.989) 8.933 12.146 ( 1.848 8.304 -1.589) 8.654 12.304 ( 0.775 -7.596 -1.166) 7.724 13.179 ( 1.306 6.455 -0.910) 6.649 13.248 ( 6.126 4.485 3.658) 8.428 13.333 ( -7.590 1.095 -7.795) 10.934 13.504 ( 0.297 -9.968 0.544) 9.987 13.901 ( -4.207 2.735 0.441) 5.037 13.951 ( -4.420 -2.371 0.335) 5.027 15.363 ( -1.782 7.090 0.163) 7.312 15.519 ( -3.388 -8.753 2.465) 9.704 15.989 ( -1.421 5.264 7.312) 9.121 16.098 ( -3.699 -5.466 7.127) 9.713 16.808 ( 15.869 3.419 -6.981) 17.670 16.865 ( 19.498 -1.319 -8.761) 21.417 17.117 ( 9.953 14.669 11.778) 21.283 17.438 ( 16.672 -16.670 12.549) 26.707 17.727 ( -10.439 8.201 -4.506) 14.019 17.864 ( -9.296 -4.997 -7.507) 12.952 19.254 ( -13.355 11.049 -3.862) 17.758 19.501 ( -13.516 -13.671 2.219) 19.352 ======================= Grid point 345 (189/195) ======================= q-point: ( 0.36 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -9.550 8.228 -4.421) 13.358 1.666 ( -14.222 -8.040 -3.430) 16.694 2.234 ( 5.739 1.258 6.703) 8.913 2.260 ( 3.924 -1.316 8.320) 9.293 2.621 ( -3.374 8.919 2.312) 9.812 2.701 ( -3.228 4.045 1.799) 5.479 2.812 ( -2.445 -7.907 -0.591) 8.297 2.851 ( -7.006 -7.650 0.922) 10.414 3.115 ( -0.199 4.172 -0.125) 4.179 3.214 ( -0.278 -4.925 -2.477) 5.520 3.582 ( 2.695 5.049 3.104) 6.511 3.640 ( 1.141 -1.136 4.722) 4.989 4.268 ( 1.762 3.767 -4.292) 5.976 4.363 ( 1.573 -5.424 -5.678) 8.008 4.404 ( -0.784 4.864 -6.117) 7.854 4.521 ( -2.302 -6.694 -6.650) 9.713 4.819 ( 0.267 2.714 -0.802) 2.843 4.884 ( -0.023 -4.089 -1.456) 4.341 6.556 ( -1.166 0.955 3.976) 4.252 6.587 ( -1.882 -1.912 3.262) 4.224 7.300 ( 0.186 3.369 1.268) 3.605 7.409 ( -1.691 -7.551 0.373) 7.747 7.879 ( -0.187 4.492 8.535) 9.647 8.018 ( 0.366 -9.352 10.286) 13.907 8.315 ( -2.872 3.910 -2.655) 5.531 8.423 ( -2.708 -6.487 -2.083) 7.331 9.025 ( 3.096 6.276 -8.591) 11.081 9.168 ( 3.264 -7.727 -10.184) 13.194 9.313 ( -6.992 1.974 -1.457) 7.410 9.356 ( -6.533 -3.034 -1.811) 7.427 9.936 ( -0.422 3.654 5.513) 6.628 10.008 ( 0.037 -3.816 5.530) 6.718 10.190 ( 10.264 4.366 3.823) 11.791 10.281 ( 11.150 -5.158 0.514) 12.296 10.673 ( -0.278 7.858 -5.315) 9.491 10.827 ( -0.660 -7.962 -5.125) 9.491 11.063 ( 2.396 5.193 -5.608) 8.010 11.141 ( 3.579 -1.982 -4.400) 6.008 11.395 ( -8.024 4.458 1.873) 9.369 11.508 ( -6.728 -6.233 2.864) 9.608 12.170 ( 2.711 7.915 -0.663) 8.393 12.303 ( 0.406 -5.334 -0.741) 5.401 13.104 ( -1.081 1.978 -4.381) 4.927 13.168 ( -1.813 -4.134 -4.477) 6.358 13.377 ( 2.129 8.805 1.105) 9.126 13.527 ( -1.930 -5.899 -0.676) 6.244 13.883 ( 0.105 0.765 3.191) 3.283 13.907 ( -0.949 -1.841 2.367) 3.146 15.350 ( -1.427 5.837 1.728) 6.252 15.468 ( -5.459 -6.218 2.180) 8.557 16.095 ( 2.393 0.839 8.985) 9.336 16.137 ( -1.973 -3.307 8.540) 9.368 16.962 ( 11.630 2.765 -8.909) 14.909 17.002 ( 9.057 -0.945 -12.307) 15.310 17.390 ( 8.458 18.197 -2.163) 20.183 17.585 ( -1.821 1.878 -1.239) 2.894 17.645 ( -6.176 0.408 7.495) 9.720 17.886 ( 16.512 -18.004 12.979) 27.663 18.957 ( -14.416 13.369 -5.761) 20.487 19.253 ( -15.915 -16.204 -1.188) 22.744 ======================= Grid point 346 (190/195) ======================= q-point: ( 0.45 0.44 -0.57) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -0.641 2.170 -4.525) 5.060 1.411 ( -8.269 -4.279 -4.325) 10.266 2.355 ( 0.931 1.341 4.886) 5.151 2.370 ( -0.824 -0.585 4.535) 4.646 2.659 ( -0.199 5.504 2.180) 5.923 2.698 ( 1.211 4.416 2.024) 5.007 2.761 ( -3.179 -5.065 4.296) 7.363 2.821 ( 2.583 -6.014 1.452) 6.704 3.095 ( -0.612 1.466 -1.961) 2.523 3.157 ( -1.986 -4.362 -4.224) 6.389 3.668 ( 0.559 6.182 6.369) 8.893 3.727 ( 1.231 0.656 4.819) 5.016 4.238 ( -1.219 2.060 -2.358) 3.360 4.293 ( -0.614 -1.892 -4.856) 5.247 4.341 ( 1.071 -1.029 -6.184) 6.359 4.392 ( -0.472 -4.196 -9.299) 10.213 4.823 ( 0.288 0.709 0.717) 1.049 4.864 ( -0.439 -3.408 -1.228) 3.649 6.594 ( 0.444 0.780 2.967) 3.099 6.606 ( -0.180 -0.270 2.501) 2.522 7.333 ( 1.231 0.427 1.685) 2.130 7.383 ( -1.685 -4.655 0.121) 4.953 7.969 ( 0.287 3.829 7.052) 8.030 8.085 ( -3.258 -7.915 4.312) 9.584 8.295 ( 1.618 3.251 1.553) 3.950 8.388 ( -0.040 -5.815 -1.276) 5.953 8.956 ( 0.366 3.507 -6.953) 7.795 9.046 ( -2.599 -4.715 -9.478) 10.900 9.244 ( -1.316 0.185 0.540) 1.435 9.268 ( -0.658 -2.979 -1.497) 3.398 10.010 ( 1.217 3.696 5.908) 7.074 10.074 ( 0.508 -2.599 4.512) 5.232 10.373 ( 3.334 4.028 4.612) 6.972 10.428 ( 5.502 -1.853 -0.417) 5.821 10.587 ( -0.574 2.925 -4.919) 5.751 10.691 ( -4.519 -7.160 -7.892) 11.575 11.095 ( 5.412 5.305 -1.802) 7.790 11.192 ( 2.069 -4.379 -2.351) 5.384 11.277 ( -2.904 5.843 0.721) 6.565 11.394 ( -7.156 -5.899 -0.517) 9.288 12.221 ( 2.656 6.097 1.059) 6.734 12.293 ( -0.944 -0.849 -0.801) 1.501 13.086 ( 2.521 -1.049 -1.674) 3.202 13.135 ( 1.261 -6.024 -2.768) 6.749 13.365 ( -1.426 5.600 -0.570) 5.807 13.433 ( -4.995 -1.513 -2.238) 5.679 13.942 ( 1.708 1.563 3.337) 4.062 13.964 ( 1.555 -0.649 2.599) 3.097 15.353 ( -0.152 1.817 1.524) 2.376 15.402 ( -3.534 -3.397 0.615) 4.940 16.230 ( -0.748 0.377 10.542) 10.575 16.259 ( 2.673 -2.345 9.572) 10.211 16.904 ( -0.877 4.450 -11.822) 12.662 16.957 ( 3.005 -1.078 -13.266) 13.645 17.414 ( -1.779 3.111 1.448) 3.865 17.460 ( -2.114 -1.678 -1.823) 3.257 17.959 ( 14.182 17.517 13.332) 26.186 18.280 ( 10.430 -10.690 8.303) 17.088 18.666 ( -6.478 6.411 -6.572) 11.237 18.939 ( -15.765 -17.118 -5.161) 23.837 ======================= Grid point 347 (191/195) ======================= q-point: (-0.45 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 4.725 2.438 -3.332) 6.275 1.401 ( 12.476 -4.419 -3.279) 13.635 2.377 ( -1.619 2.370 2.142) 3.581 2.417 ( 2.117 -1.659 0.765) 2.797 2.651 ( -3.337 4.563 3.283) 6.538 2.699 ( 0.760 0.404 0.396) 0.948 2.816 ( -2.718 0.312 0.968) 2.902 2.864 ( 1.196 -4.049 -2.098) 4.715 3.078 ( -0.243 -1.376 -1.617) 2.137 3.102 ( 3.258 -3.603 0.499) 4.883 3.718 ( -3.672 7.308 3.567) 8.922 3.768 ( 0.640 2.485 0.286) 2.582 4.225 ( 0.292 -2.534 2.436) 3.528 4.235 ( -0.135 -3.245 -1.480) 3.570 4.295 ( -0.311 0.119 -1.860) 1.890 4.317 ( 0.762 -1.875 -4.650) 5.072 4.840 ( -0.031 -1.378 0.232) 1.397 4.845 ( 0.284 -1.833 -0.315) 1.882 6.625 ( 0.824 0.751 0.025) 1.115 6.633 ( 1.592 0.027 -0.164) 1.601 7.343 ( -2.251 -0.259 0.775) 2.395 7.383 ( 1.861 -4.160 0.169) 4.560 8.051 ( 0.461 2.111 1.088) 2.419 8.087 ( 4.391 -1.059 1.353) 4.715 8.329 ( -3.318 -2.391 2.556) 4.822 8.347 ( -3.031 -4.330 -0.407) 5.301 8.917 ( -1.539 -0.787 -1.210) 2.110 8.932 ( 0.131 -2.486 -0.672) 2.579 9.249 ( 1.998 1.191 -0.405) 2.361 9.287 ( 4.913 -2.840 -2.798) 6.328 10.083 ( -0.620 2.554 1.312) 2.937 10.104 ( 1.161 0.612 -0.263) 1.338 10.382 ( -6.538 3.131 3.668) 8.124 10.434 ( -5.548 -1.165 -0.707) 5.713 10.564 ( 1.187 -1.178 -3.571) 3.943 10.607 ( 4.579 -4.712 0.271) 6.576 11.072 ( -7.091 5.751 0.401) 9.139 11.168 ( -1.559 -3.680 -0.245) 4.004 11.299 ( 3.220 3.860 -1.102) 5.146 11.394 ( 9.216 -5.247 -0.702) 10.628 12.245 ( -3.214 4.278 -1.263) 5.498 12.270 ( 0.846 1.853 1.537) 2.551 13.093 ( -2.154 -3.217 -2.521) 4.620 13.111 ( 0.622 -5.115 -0.482) 5.175 13.363 ( -0.296 3.701 -0.188) 3.718 13.393 ( 3.904 0.281 1.828) 4.320 13.981 ( -0.939 1.086 -0.534) 1.532 13.985 ( -0.108 0.703 0.463) 0.849 15.374 ( 0.378 0.255 -0.442) 0.635 15.396 ( 3.428 -2.154 1.006) 4.171 16.306 ( -4.247 2.056 6.376) 7.932 16.351 ( -1.111 -2.536 1.525) 3.161 16.801 ( -1.055 2.028 -0.458) 2.331 16.836 ( 0.023 -1.310 -6.642) 6.770 17.363 ( -7.898 5.658 5.209) 11.024 17.453 ( 0.133 -3.715 0.381) 3.737 18.186 ( -10.145 13.265 -8.817) 18.884 18.315 ( 6.601 9.637 4.965) 12.692 18.638 ( -4.914 -7.211 -4.321) 9.738 18.843 ( 18.308 -18.976 3.894) 26.655 ======================= Grid point 348 (192/195) ======================= q-point: (-0.36 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 13.585 9.205 -1.836) 16.512 1.652 ( 18.531 -8.434 -2.053) 20.463 2.341 ( -3.616 3.659 -3.491) 6.217 2.405 ( -1.569 -2.790 -5.829) 6.650 2.632 ( -1.962 7.705 2.051) 8.211 2.726 ( 2.335 4.133 -0.630) 4.788 2.764 ( -2.081 -5.068 3.194) 6.342 2.861 ( 4.877 -7.543 -1.096) 9.049 3.107 ( 1.624 1.352 0.941) 2.313 3.169 ( 1.703 -4.157 1.406) 4.707 3.631 ( -6.395 9.340 -1.191) 11.382 3.740 ( -1.490 -1.966 -4.328) 4.981 4.229 ( -1.060 1.187 -0.335) 1.626 4.281 ( 0.550 3.044 4.489) 5.452 4.290 ( 0.685 -4.712 1.793) 5.088 4.371 ( 3.577 -5.558 7.785) 10.212 4.825 ( -0.308 0.752 -1.001) 1.289 4.865 ( 0.418 -3.281 0.854) 3.416 6.630 ( 2.138 0.791 -3.242) 3.963 6.649 ( 2.521 -1.026 -2.852) 3.942 7.316 ( -0.960 2.507 -0.224) 2.694 7.415 ( 1.670 -7.395 -0.009) 7.582 8.035 ( 1.975 5.927 -7.291) 9.602 8.196 ( 1.116 -10.084 -8.026) 12.937 8.235 ( -0.233 5.101 6.026) 7.898 8.352 ( -0.054 -6.709 5.704) 8.806 8.893 ( -2.402 2.847 3.916) 5.405 8.985 ( -1.774 -6.743 7.852) 10.501 9.311 ( 6.451 2.528 -1.038) 7.006 9.361 ( 7.027 -2.697 -2.130) 7.822 10.033 ( -0.767 3.827 -4.497) 5.954 10.097 ( -0.820 -2.573 -3.319) 4.279 10.253 ( -12.064 0.923 -1.018) 12.142 10.263 ( -10.987 -0.287 1.332) 11.071 10.602 ( 2.886 5.088 1.366) 6.007 10.726 ( 3.937 -7.284 4.737) 9.539 10.985 ( -4.078 5.899 2.272) 7.523 11.084 ( -5.600 -4.221 1.418) 7.155 11.426 ( 9.723 5.695 -1.314) 11.344 11.546 ( 8.773 -6.295 -1.262) 10.871 12.166 ( -4.196 7.775 -0.363) 8.842 12.283 ( -1.104 -3.727 1.369) 4.121 13.051 ( -0.337 0.441 0.943) 1.095 13.111 ( 0.241 -5.234 1.464) 5.441 13.389 ( 1.381 7.446 -0.337) 7.581 13.500 ( 4.375 -3.925 1.837) 6.158 13.939 ( -0.903 0.769 -2.404) 2.681 13.955 ( -1.140 -0.910 -2.156) 2.603 15.388 ( 2.329 5.178 -2.037) 6.032 15.487 ( 5.657 -5.217 0.153) 7.696 16.218 ( -7.347 2.337 -1.603) 7.875 16.280 ( -2.231 -3.980 -4.898) 6.694 16.801 ( -4.958 1.847 5.427) 7.579 16.831 ( -3.022 -1.351 4.185) 5.336 17.277 ( -9.782 12.706 7.736) 17.804 17.481 ( -0.647 -7.643 6.106) 9.804 17.910 ( -3.905 8.648 -14.300) 17.161 18.128 ( -12.034 -12.741 -11.524) 20.975 18.845 ( 16.384 17.543 5.437) 24.612 19.209 ( 18.097 -19.134 3.148) 26.524 ======================= Grid point 349 (193/195) ======================= q-point: (-0.27 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 12.220 13.630 -0.600) 18.316 1.915 ( 12.097 -7.778 -1.801) 14.494 2.164 ( -6.699 4.541 -7.832) 11.262 2.263 ( -2.334 -5.118 -8.133) 9.889 2.688 ( 3.991 5.967 3.090) 7.816 2.759 ( 2.953 6.293 0.920) 7.012 2.847 ( 3.888 -5.093 2.513) 6.883 2.973 ( 6.609 -9.682 -0.165) 11.724 3.126 ( 0.834 2.924 -0.665) 3.112 3.198 ( 0.055 -3.533 2.304) 4.218 3.506 ( -6.379 9.498 -0.075) 11.441 3.654 ( -1.329 -5.576 -3.780) 6.867 4.215 ( -1.220 2.545 2.517) 3.782 4.295 ( -1.517 -5.017 3.808) 6.479 4.406 ( 3.109 4.775 5.062) 7.622 4.526 ( 3.402 -6.868 6.525) 10.066 4.808 ( -0.650 2.698 -0.198) 2.782 4.873 ( -0.392 -4.032 0.706) 4.112 6.633 ( 4.207 0.368 -4.883) 6.456 6.664 ( 4.125 -2.628 -3.834) 6.214 7.312 ( 0.994 4.076 -0.373) 4.212 7.439 ( 1.424 -8.583 -0.541) 8.717 7.946 ( 0.046 4.386 -9.029) 10.038 8.065 ( -1.453 -7.111 -7.714) 10.591 8.363 ( 5.604 3.993 3.850) 7.884 8.485 ( 7.218 -7.698 3.360) 11.075 8.906 ( -4.181 4.674 7.283) 9.611 9.023 ( -5.390 -7.323 8.769) 12.632 9.438 ( 7.851 1.813 0.777) 8.095 9.469 ( 6.389 -1.453 -0.115) 6.553 9.912 ( -14.684 1.473 -2.999) 15.060 9.928 ( -11.169 -0.171 -1.804) 11.315 10.105 ( -3.258 -0.280 -0.771) 3.360 10.124 ( 0.518 -2.028 -3.928) 4.450 10.637 ( -1.788 7.983 1.664) 8.348 10.784 ( -2.451 -6.973 2.579) 7.828 11.008 ( 0.870 4.643 5.529) 7.272 11.074 ( 0.163 -1.514 5.539) 5.745 11.549 ( 6.982 3.493 -2.931) 8.339 11.638 ( 5.097 -5.084 -3.500) 8.005 12.114 ( -2.421 8.447 1.551) 8.923 12.276 ( -1.485 -7.703 1.735) 8.035 13.117 ( 3.701 3.683 3.922) 6.530 13.194 ( 5.170 -3.259 5.697) 8.355 13.342 ( -3.882 9.685 -4.642) 11.420 13.532 ( -1.421 -8.578 -1.548) 8.832 13.919 ( 2.498 1.855 -1.372) 3.400 13.960 ( 3.634 -2.272 -0.603) 4.328 15.391 ( 1.334 8.761 -2.674) 9.257 15.561 ( 3.058 -8.671 -1.744) 9.358 16.088 ( -4.012 6.378 -1.378) 7.660 16.220 ( 1.469 -6.629 -3.949) 7.855 16.701 ( -11.738 1.148 2.755) 12.111 16.727 ( -14.187 -1.533 3.555) 14.706 17.220 ( -7.193 16.245 3.146) 18.043 17.515 ( -8.662 -11.335 5.224) 15.192 17.787 ( 3.490 -0.387 -6.708) 7.571 17.839 ( 1.435 -4.571 -10.539) 11.577 19.174 ( 14.483 17.360 4.453) 23.042 19.518 ( 15.018 -17.593 0.425) 23.136 ======================= Grid point 350 (194/195) ======================= q-point: (-0.18 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.836 ( 2.385 11.247 1.314) 11.572 1.956 ( 1.018 7.785 -2.597) 8.270 2.009 ( -3.476 0.536 -3.703) 5.107 2.243 ( 6.948 -11.910 -3.536) 14.234 2.723 ( -2.673 8.703 -4.262) 10.052 2.854 ( 7.268 7.456 -0.638) 10.432 2.907 ( 1.031 -9.109 -0.359) 9.174 3.024 ( 3.877 -8.722 -4.200) 10.428 3.147 ( 1.988 2.550 -0.712) 3.310 3.238 ( 0.690 -5.011 2.592) 5.684 3.457 ( -2.037 11.976 6.267) 13.669 3.665 ( 3.627 -8.586 3.267) 9.877 4.249 ( 0.238 2.435 4.281) 4.931 4.322 ( -1.154 -4.775 4.341) 6.556 4.462 ( -0.083 6.521 -0.971) 6.594 4.600 ( -0.525 -6.953 0.373) 6.983 4.816 ( 0.710 2.715 2.673) 3.875 4.883 ( -0.065 -3.889 2.454) 4.599 6.668 ( 6.324 -0.484 -4.544) 7.802 6.704 ( 5.413 -4.141 -3.500) 7.662 7.331 ( 0.966 3.246 -0.231) 3.395 7.435 ( -0.751 -7.002 -1.855) 7.282 7.876 ( 4.416 4.062 -7.378) 9.510 8.005 ( 5.013 -8.846 -6.193) 11.905 8.508 ( 6.890 5.620 1.933) 9.099 8.626 ( 5.793 -5.647 0.625) 8.114 8.896 ( -7.245 2.852 5.583) 9.581 8.980 ( -10.778 -5.226 5.339) 13.114 9.525 ( -2.639 3.228 1.077) 4.306 9.575 ( 2.804 -1.879 2.427) 4.157 9.636 ( -9.847 2.067 1.822) 10.225 9.707 ( -9.807 -4.923 0.957) 11.015 10.100 ( 3.293 0.577 -2.871) 4.407 10.122 ( 3.605 -1.836 -4.218) 5.844 10.612 ( -3.069 8.019 3.728) 9.361 10.754 ( -3.344 -6.428 3.120) 7.889 11.102 ( 0.831 4.872 5.625) 7.488 11.154 ( 0.472 0.144 4.029) 4.060 11.616 ( 5.332 1.179 -2.007) 5.818 11.673 ( 4.798 -4.146 -2.395) 6.779 12.105 ( -1.298 7.824 1.531) 8.078 12.270 ( -1.878 -8.709 1.622) 9.056 13.134 ( -5.525 8.000 -6.357) 11.616 13.186 ( -5.159 4.096 -5.552) 8.615 13.421 ( 9.448 -0.304 9.675) 13.527 13.525 ( 4.207 -8.447 3.918) 10.218 13.982 ( 4.692 2.912 -0.311) 5.531 14.030 ( 4.258 -2.010 -0.484) 4.733 15.390 ( 1.227 7.726 -0.243) 7.826 15.543 ( -2.146 -7.687 -1.304) 8.087 16.066 ( 1.660 8.469 -0.329) 8.636 16.223 ( 4.662 -6.412 -5.640) 9.729 16.492 ( -16.804 -0.890 4.590) 17.442 16.503 ( -12.935 -1.394 1.353) 13.080 17.043 ( -7.693 8.901 -9.507) 15.125 17.249 ( -14.270 -11.641 -9.418) 20.685 17.862 ( 8.286 6.378 3.489) 11.023 17.969 ( 8.017 -3.984 5.223) 10.364 19.435 ( 10.349 14.400 3.473) 18.070 19.726 ( 10.358 -15.114 -2.297) 18.466 ======================= Grid point 351 (195/195) ======================= q-point: (-0.09 0.44 0.43) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.35e-04 3.35e-04 3.35e-04 3.35e-04 7.45e-05 7.45e-05 Number of triplets: 347 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.847 ( -0.523 7.262 3.660) 8.149 1.941 ( -2.836 1.001 1.323) 3.286 2.029 ( 6.802 13.795 0.080) 15.381 2.334 ( 5.798 -13.790 -0.041) 14.960 2.533 ( -8.512 12.157 -8.728) 17.218 2.789 ( -5.267 -13.253 -8.669) 16.689 2.981 ( 5.968 4.574 -0.032) 7.519 3.071 ( 3.146 -1.672 -1.376) 3.819 3.172 ( 2.500 -1.291 -0.677) 2.894 3.256 ( -0.800 -7.023 0.624) 7.096 3.579 ( 2.685 14.504 11.066) 18.440 3.808 ( 5.139 -8.163 4.881) 10.810 4.310 ( 0.952 1.350 3.476) 3.849 4.350 ( -0.795 -3.214 3.123) 4.551 4.397 ( -2.479 6.456 -3.969) 7.974 4.525 ( -4.430 -5.937 -4.059) 8.447 4.886 ( 1.999 0.740 3.674) 4.248 4.925 ( 0.498 -2.831 3.102) 4.229 6.730 ( 5.596 -2.143 -3.487) 6.933 6.753 ( 4.257 -4.617 -3.129) 7.016 7.325 ( -0.827 0.448 -0.681) 1.161 7.375 ( -2.091 -4.619 -2.935) 5.858 7.960 ( 12.625 5.075 -3.438) 14.035 8.096 ( 10.393 -8.905 -2.415) 13.898 8.623 ( 1.101 4.399 0.961) 4.635 8.681 ( -1.028 0.326 -0.144) 1.088 8.742 ( -13.711 -1.601 -0.213) 13.806 8.772 ( -10.197 -1.659 -0.912) 10.371 9.451 ( -5.660 0.553 5.433) 7.865 9.509 ( -8.201 -5.045 5.829) 11.256 9.683 ( 3.019 1.615 2.107) 4.020 9.713 ( 4.825 -1.364 2.074) 5.426 10.106 ( 1.161 0.175 -3.641) 3.826 10.122 ( 1.596 -1.614 -4.436) 4.983 10.656 ( 1.230 6.470 6.529) 9.274 10.767 ( -0.435 -4.897 4.340) 6.558 11.123 ( -2.445 3.771 0.752) 4.557 11.158 ( -2.769 0.685 0.306) 2.869 11.716 ( 7.041 1.472 1.297) 7.309 11.777 ( 6.729 -4.493 1.241) 8.186 12.102 ( -0.877 6.864 1.991) 7.200 12.245 ( -3.335 -7.636 1.855) 8.536 12.914 ( -6.768 6.507 -8.961) 12.979 12.978 ( -7.730 0.241 -8.548) 11.527 13.698 ( 8.463 0.600 9.426) 12.682 13.728 ( 7.680 -2.364 8.107) 11.415 14.040 ( 2.754 2.603 -1.625) 4.123 14.071 ( 1.866 -0.640 -2.061) 2.853 15.434 ( 1.325 3.825 3.361) 5.262 15.501 ( -1.998 -2.769 1.815) 3.867 16.084 ( 1.660 8.654 -4.335) 9.821 16.210 ( 4.347 -1.889 -10.991) 11.969 16.303 ( -12.940 -2.960 7.162) 15.083 16.353 ( -6.687 -7.398 6.043) 11.660 16.793 ( -5.621 3.731 -11.343) 13.198 16.904 ( -10.375 -7.634 -11.298) 17.133 18.059 ( 6.620 7.197 6.000) 11.473 18.148 ( 5.037 -1.298 4.583) 6.933 19.610 ( 5.350 9.351 3.580) 11.352 19.817 ( 4.785 -11.461 -4.225) 13.119 =================== 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 3/41580 10.0 276.135 298.932 382.855 0.000 -51.439 0.000 3/41580 20.0 56.146 59.142 71.150 0.000 -7.496 0.000 3/41580 30.0 28.228 29.442 34.611 0.000 -3.586 0.000 3/41580 40.0 18.957 19.385 22.514 0.000 -2.088 0.000 3/41580 50.0 14.073 14.253 16.413 0.000 -1.340 0.000 3/41580 60.0 10.958 11.044 12.655 0.000 -0.919 0.000 3/41580 70.0 8.796 8.833 10.099 0.000 -0.662 0.000 3/41580 80.0 7.235 7.241 8.273 0.000 -0.497 0.000 3/41580 90.0 6.079 6.066 6.928 0.000 -0.385 0.000 3/41580 100.0 5.205 5.180 5.914 0.000 -0.306 0.000 3/41580 110.0 4.533 4.500 5.135 0.000 -0.250 0.000 3/41580 120.0 4.006 3.969 4.525 0.000 -0.208 0.000 3/41580 130.0 3.585 3.547 4.039 0.000 -0.176 0.000 3/41580 140.0 3.245 3.206 3.645 0.000 -0.152 0.000 3/41580 150.0 2.964 2.926 3.321 0.000 -0.132 0.000 3/41580 160.0 2.730 2.693 3.051 0.000 -0.117 0.000 3/41580 170.0 2.532 2.497 2.823 0.000 -0.104 0.000 3/41580 180.0 2.363 2.329 2.629 0.000 -0.093 0.000 3/41580 190.0 2.217 2.184 2.461 0.000 -0.084 0.000 3/41580 200.0 2.089 2.058 2.314 0.000 -0.077 0.000 3/41580 210.0 1.976 1.947 2.185 0.000 -0.071 0.000 3/41580 220.0 1.876 1.848 2.071 0.000 -0.065 0.000 3/41580 230.0 1.787 1.760 1.969 0.000 -0.060 0.000 3/41580 240.0 1.706 1.681 1.877 0.000 -0.056 0.000 3/41580 250.0 1.633 1.609 1.795 0.000 -0.053 0.000 3/41580 260.0 1.567 1.543 1.719 0.000 -0.049 0.000 3/41580 270.0 1.506 1.484 1.651 0.000 -0.046 0.000 3/41580 280.0 1.450 1.429 1.587 0.000 -0.044 0.000 3/41580 290.0 1.399 1.378 1.529 0.000 -0.042 0.000 3/41580 300.0 1.351 1.331 1.476 0.000 -0.039 0.000 3/41580 310.0 1.306 1.287 1.426 0.000 -0.038 0.000 3/41580 320.0 1.265 1.246 1.379 0.000 -0.036 0.000 3/41580 330.0 1.226 1.208 1.336 0.000 -0.034 0.000 3/41580 340.0 1.190 1.173 1.295 0.000 -0.033 0.000 3/41580 350.0 1.155 1.139 1.257 0.000 -0.031 0.000 3/41580 360.0 1.123 1.107 1.222 0.000 -0.030 0.000 3/41580 370.0 1.093 1.078 1.188 0.000 -0.029 0.000 3/41580 380.0 1.064 1.049 1.156 0.000 -0.028 0.000 3/41580 390.0 1.037 1.023 1.126 0.000 -0.027 0.000 3/41580 400.0 1.011 0.997 1.097 0.000 -0.026 0.000 3/41580 410.0 0.987 0.973 1.070 0.000 -0.025 0.000 3/41580 420.0 0.963 0.950 1.045 0.000 -0.024 0.000 3/41580 430.0 0.941 0.928 1.020 0.000 -0.024 0.000 3/41580 440.0 0.920 0.908 0.997 0.000 -0.023 0.000 3/41580 450.0 0.900 0.888 0.974 0.000 -0.022 0.000 3/41580 460.0 0.880 0.869 0.953 0.000 -0.022 0.000 3/41580 470.0 0.862 0.850 0.933 0.000 -0.021 0.000 3/41580 480.0 0.844 0.833 0.913 0.000 -0.020 0.000 3/41580 490.0 0.827 0.816 0.895 0.000 -0.020 0.000 3/41580 500.0 0.811 0.800 0.877 0.000 -0.019 0.000 3/41580 510.0 0.795 0.785 0.860 0.000 -0.019 0.000 3/41580 520.0 0.780 0.770 0.843 0.000 -0.018 0.000 3/41580 530.0 0.765 0.756 0.827 0.000 -0.018 0.000 3/41580 540.0 0.751 0.742 0.812 0.000 -0.018 0.000 3/41580 550.0 0.738 0.729 0.797 0.000 -0.017 0.000 3/41580 560.0 0.725 0.716 0.783 0.000 -0.017 0.000 3/41580 570.0 0.712 0.703 0.769 0.000 -0.016 0.000 3/41580 580.0 0.700 0.691 0.756 0.000 -0.016 0.000 3/41580 590.0 0.689 0.680 0.743 0.000 -0.016 0.000 3/41580 600.0 0.677 0.669 0.731 0.000 -0.015 0.000 3/41580 610.0 0.666 0.658 0.719 0.000 -0.015 0.000 3/41580 620.0 0.656 0.647 0.707 0.000 -0.015 0.000 3/41580 630.0 0.645 0.637 0.696 0.000 -0.015 0.000 3/41580 640.0 0.635 0.627 0.685 0.000 -0.014 0.000 3/41580 650.0 0.626 0.618 0.675 0.000 -0.014 0.000 3/41580 660.0 0.616 0.609 0.665 0.000 -0.014 0.000 3/41580 670.0 0.607 0.600 0.655 0.000 -0.014 0.000 3/41580 680.0 0.599 0.591 0.645 0.000 -0.013 0.000 3/41580 690.0 0.590 0.583 0.636 0.000 -0.013 0.000 3/41580 700.0 0.582 0.574 0.627 0.000 -0.013 0.000 3/41580 710.0 0.574 0.566 0.618 0.000 -0.013 0.000 3/41580 720.0 0.566 0.559 0.610 0.000 -0.012 0.000 3/41580 730.0 0.558 0.551 0.601 0.000 -0.012 0.000 3/41580 740.0 0.551 0.544 0.593 0.000 -0.012 0.000 3/41580 750.0 0.543 0.537 0.585 0.000 -0.012 0.000 3/41580 760.0 0.536 0.530 0.578 0.000 -0.012 0.000 3/41580 770.0 0.529 0.523 0.570 0.000 -0.012 0.000 3/41580 780.0 0.523 0.516 0.563 0.000 -0.011 0.000 3/41580 790.0 0.516 0.510 0.556 0.000 -0.011 0.000 3/41580 800.0 0.510 0.503 0.549 0.000 -0.011 0.000 3/41580 810.0 0.503 0.497 0.542 0.000 -0.011 0.000 3/41580 820.0 0.497 0.491 0.536 0.000 -0.011 0.000 3/41580 830.0 0.491 0.485 0.529 0.000 -0.011 0.000 3/41580 840.0 0.486 0.480 0.523 0.000 -0.010 0.000 3/41580 850.0 0.480 0.474 0.517 0.000 -0.010 0.000 3/41580 860.0 0.474 0.469 0.511 0.000 -0.010 0.000 3/41580 870.0 0.469 0.463 0.505 0.000 -0.010 0.000 3/41580 880.0 0.464 0.458 0.499 0.000 -0.010 0.000 3/41580 890.0 0.459 0.453 0.494 0.000 -0.010 0.000 3/41580 900.0 0.454 0.448 0.488 0.000 -0.010 0.000 3/41580 910.0 0.449 0.443 0.483 0.000 -0.010 0.000 3/41580 920.0 0.444 0.438 0.478 0.000 -0.009 0.000 3/41580 930.0 0.439 0.434 0.472 0.000 -0.009 0.000 3/41580 940.0 0.434 0.429 0.467 0.000 -0.009 0.000 3/41580 950.0 0.430 0.425 0.463 0.000 -0.009 0.000 3/41580 960.0 0.425 0.420 0.458 0.000 -0.009 0.000 3/41580 970.0 0.421 0.416 0.453 0.000 -0.009 0.000 3/41580 980.0 0.417 0.412 0.448 0.000 -0.009 0.000 3/41580 990.0 0.413 0.408 0.444 0.000 -0.009 0.000 3/41580 1000.0 0.409 0.404 0.440 0.000 -0.009 0.000 3/41580 Thermal conductivity related properties were written into "kappa-m1197.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:12:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|