----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 13:31:04]------------------------- 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 6.142777690304071 0.000000000000000 0.000000000000000 b 0.000000000000000 6.101238330000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): *1 Ba 0.75582230846056 0.98072835552863 0.74958566192304 137.327 2 Ba 0.24417769153944 0.48072835552863 0.75041433807696 137.327 3 Ba 0.24417769153944 0.01927164447137 0.25041433807696 137.327 4 Ba 0.75582230846056 0.51927164447137 0.24958566192304 137.327 *5 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 6 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 *7 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 8 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 *9 O 0.77957783039835 0.21519775290225 0.53705146484401 15.999 *10 O 0.30712746443346 0.48721983918962 0.23556425823884 15.999 *11 O 0.82669084183773 0.74034061695100 0.54033216030011 15.999 12 O 0.22042216960165 0.78480224709775 0.46294853515599 15.999 13 O 0.30712746443346 0.01278016081038 0.73556425823884 15.999 14 O 0.17330915816227 0.24034061695101 0.95966783969989 15.999 15 O 0.77957783039835 0.28480224709775 0.03705146484401 15.999 16 O 0.22042216960165 0.71519775290225 0.96294853515599 15.999 17 O 0.69287253556654 0.98721983918962 0.26443574176116 15.999 18 O 0.69287253556654 0.51278016081038 0.76443574176116 15.999 19 O 0.82669084183773 0.75965938304900 0.04033216030011 15.999 20 O 0.17330915816227 0.25965938304899 0.45966783969989 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 6.142777690304071 0.000000000000000 0.000000000000000 b 0.000000000000000 6.101238330000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): *1 Ba 0.75582230846056 0.98072835552863 0.74958566192304 137.327 > 1 2 Ba 0.24417769153944 0.48072835552863 0.75041433807696 137.327 > 2 3 Ba 0.24417769153944 0.01927164447137 0.25041433807696 137.327 > 3 4 Ba 0.75582230846056 0.51927164447137 0.24958566192304 137.327 > 4 *5 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 5 6 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 > 6 *7 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 > 7 8 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 > 8 *9 O 0.77957783039835 0.21519775290225 0.53705146484401 15.999 > 9 *10 O 0.30712746443346 0.48721983918962 0.23556425823884 15.999 > 10 *11 O 0.82669084183773 0.74034061695100 0.54033216030011 15.999 > 11 12 O 0.22042216960165 0.78480224709775 0.46294853515599 15.999 > 12 13 O 0.30712746443346 0.01278016081038 0.73556425823884 15.999 > 13 14 O 0.17330915816227 0.24034061695101 0.95966783969989 15.999 > 14 15 O 0.77957783039835 0.28480224709775 0.03705146484401 15.999 > 15 16 O 0.22042216960165 0.71519775290225 0.96294853515599 15.999 > 16 17 O 0.69287253556654 0.98721983918962 0.26443574176116 15.999 > 17 18 O 0.69287253556654 0.51278016081038 0.76443574176116 15.999 > 18 19 O 0.82669084183773 0.75965938304900 0.04033216030011 15.999 > 19 20 O 0.17330915816227 0.25965938304899 0.45966783969989 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.285555380608143 0.000000000000000 0.000000000000000 b 0.000000000000000 12.202476660000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): *1 Ba 0.37791115423028 0.49036417776431 0.74958566192304 137.327 > 1 2 Ba 0.87791115423028 0.49036417776431 0.74958566192304 137.327 > 1 3 Ba 0.37791115423028 0.99036417776431 0.74958566192304 137.327 > 1 4 Ba 0.87791115423028 0.99036417776431 0.74958566192304 137.327 > 1 5 Ba 0.12208884576972 0.24036417776431 0.75041433807696 137.327 > 2 6 Ba 0.62208884576972 0.24036417776431 0.75041433807696 137.327 > 2 7 Ba 0.12208884576972 0.74036417776431 0.75041433807696 137.327 > 2 8 Ba 0.62208884576972 0.74036417776431 0.75041433807696 137.327 > 2 9 Ba 0.12208884576972 0.00963582223569 0.25041433807696 137.327 > 3 10 Ba 0.62208884576972 0.00963582223569 0.25041433807696 137.327 > 3 11 Ba 0.12208884576972 0.50963582223569 0.25041433807696 137.327 > 3 12 Ba 0.62208884576972 0.50963582223569 0.25041433807696 137.327 > 3 13 Ba 0.37791115423028 0.25963582223569 0.24958566192304 137.327 > 4 14 Ba 0.87791115423028 0.25963582223569 0.24958566192304 137.327 > 4 15 Ba 0.37791115423028 0.75963582223569 0.24958566192304 137.327 > 4 16 Ba 0.87791115423028 0.75963582223569 0.24958566192304 137.327 > 4 *17 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 5 18 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 5 19 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 5 20 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 5 21 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 6 22 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 6 23 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 6 24 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 6 *25 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 > 7 26 U 0.50000000000000 0.00000000000000 0.50000000000000 238.029 > 7 27 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 > 7 28 U 0.50000000000000 0.50000000000000 0.50000000000000 238.029 > 7 29 U 0.00000000000000 0.25000000000000 0.00000000000000 238.029 > 8 30 U 0.50000000000000 0.25000000000000 0.00000000000000 238.029 > 8 31 U 0.00000000000000 0.75000000000000 0.00000000000000 238.029 > 8 32 U 0.50000000000000 0.75000000000000 0.00000000000000 238.029 > 8 *33 O 0.38978891519917 0.10759887645113 0.53705146484401 15.999 > 9 34 O 0.88978891519917 0.10759887645113 0.53705146484401 15.999 > 9 35 O 0.38978891519917 0.60759887645113 0.53705146484401 15.999 > 9 36 O 0.88978891519917 0.60759887645113 0.53705146484401 15.999 > 9 *37 O 0.15356373221673 0.24360991959481 0.23556425823884 15.999 > 10 38 O 0.65356373221673 0.24360991959481 0.23556425823884 15.999 > 10 39 O 0.15356373221673 0.74360991959481 0.23556425823884 15.999 > 10 40 O 0.65356373221673 0.74360991959481 0.23556425823884 15.999 > 10 *41 O 0.41334542091886 0.37017030847550 0.54033216030011 15.999 > 11 42 O 0.91334542091886 0.37017030847550 0.54033216030011 15.999 > 11 43 O 0.41334542091886 0.87017030847550 0.54033216030011 15.999 > 11 44 O 0.91334542091886 0.87017030847550 0.54033216030011 15.999 > 11 45 O 0.11021108480083 0.39240112354887 0.46294853515599 15.999 > 12 46 O 0.61021108480083 0.39240112354887 0.46294853515599 15.999 > 12 47 O 0.11021108480083 0.89240112354887 0.46294853515599 15.999 > 12 48 O 0.61021108480083 0.89240112354887 0.46294853515599 15.999 > 12 49 O 0.15356373221673 0.00639008040519 0.73556425823884 15.999 > 13 50 O 0.65356373221673 0.00639008040519 0.73556425823884 15.999 > 13 51 O 0.15356373221673 0.50639008040519 0.73556425823884 15.999 > 13 52 O 0.65356373221673 0.50639008040519 0.73556425823884 15.999 > 13 53 O 0.08665457908114 0.12017030847550 0.95966783969989 15.999 > 14 54 O 0.58665457908114 0.12017030847550 0.95966783969989 15.999 > 14 55 O 0.08665457908114 0.62017030847550 0.95966783969989 15.999 > 14 56 O 0.58665457908114 0.62017030847550 0.95966783969989 15.999 > 14 57 O 0.38978891519917 0.14240112354887 0.03705146484401 15.999 > 15 58 O 0.88978891519917 0.14240112354887 0.03705146484401 15.999 > 15 59 O 0.38978891519917 0.64240112354887 0.03705146484401 15.999 > 15 60 O 0.88978891519917 0.64240112354887 0.03705146484401 15.999 > 15 61 O 0.11021108480083 0.35759887645113 0.96294853515599 15.999 > 16 62 O 0.61021108480083 0.35759887645113 0.96294853515599 15.999 > 16 63 O 0.11021108480083 0.85759887645113 0.96294853515599 15.999 > 16 64 O 0.61021108480083 0.85759887645113 0.96294853515599 15.999 > 16 65 O 0.34643626778327 0.49360991959481 0.26443574176116 15.999 > 17 66 O 0.84643626778327 0.49360991959481 0.26443574176116 15.999 > 17 67 O 0.34643626778327 0.99360991959481 0.26443574176116 15.999 > 17 68 O 0.84643626778327 0.99360991959481 0.26443574176116 15.999 > 17 69 O 0.34643626778327 0.25639008040519 0.76443574176116 15.999 > 18 70 O 0.84643626778327 0.25639008040519 0.76443574176116 15.999 > 18 71 O 0.34643626778327 0.75639008040519 0.76443574176116 15.999 > 18 72 O 0.84643626778327 0.75639008040519 0.76443574176116 15.999 > 18 73 O 0.41334542091886 0.37982969152450 0.04033216030011 15.999 > 19 74 O 0.91334542091886 0.37982969152450 0.04033216030011 15.999 > 19 75 O 0.41334542091886 0.87982969152450 0.04033216030011 15.999 > 19 76 O 0.91334542091886 0.87982969152450 0.04033216030011 15.999 > 19 77 O 0.08665457908114 0.12982969152450 0.45966783969989 15.999 > 20 78 O 0.58665457908114 0.12982969152450 0.45966783969989 15.999 > 20 79 O 0.08665457908114 0.62982969152450 0.45966783969989 15.999 > 20 80 O 0.58665457908114 0.62982969152450 0.45966783969989 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3747714 0.0000000 -0.0268917 0.0000000 4.2833593 0.0000000 -0.0267929 0.0000000 4.2862439 -------------------------- Born effective charges -------------------------- 1 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 2 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 3 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 4 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 5 Ca 3.0567038 0.1155436 0.2933495 -0.0858607 3.0154606 -0.0422773 -0.2150367 -0.0636295 3.0211808 6 Ca 3.0567038 -0.1155436 0.2933495 0.0858607 3.0154606 0.0422773 -0.2150367 0.0636295 3.0211808 7 U 5.1383805 0.0380345 -0.1007581 0.0792216 5.0095522 0.1287106 -0.1044401 0.0701517 5.1675357 8 U 5.1383805 -0.0380345 -0.1007581 -0.0792216 5.0095522 -0.1287106 -0.1044401 -0.0701517 5.1675357 9 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 10 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 11 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 12 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 13 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 14 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 15 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 16 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 17 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 18 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 19 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 20 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 ---------------------------------------------------------------------------- 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: 2.190 Solver_block: 200 / 640 - Time: 2.180 Solver_block: 300 / 640 - Time: 2.174 Solver_block: 400 / 640 - Time: 2.178 Solver_block: 500 / 640 - Time: 2.179 Solver_block: 600 / 640 - Time: 2.177 Solver_block: 640 / 640 - Time: 0.936 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.061 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) 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 13:31:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:31:37]------------------------- 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 6.142777690304071 0.000000000000000 0.000000000000000 b 0.000000000000000 6.101238330000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): 1 Ba 0.75582230846056 0.98072835552863 0.74958566192304 137.327 2 Ba 0.24417769153944 0.48072835552863 0.75041433807696 137.327 3 Ba 0.24417769153944 0.01927164447137 0.25041433807696 137.327 4 Ba 0.75582230846056 0.51927164447137 0.24958566192304 137.327 5 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 6 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 7 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 8 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 9 O 0.77957783039835 0.21519775290225 0.53705146484401 15.999 10 O 0.30712746443346 0.48721983918962 0.23556425823884 15.999 11 O 0.82669084183773 0.74034061695100 0.54033216030011 15.999 12 O 0.22042216960165 0.78480224709775 0.46294853515599 15.999 13 O 0.30712746443346 0.01278016081038 0.73556425823884 15.999 14 O 0.17330915816227 0.24034061695101 0.95966783969989 15.999 15 O 0.77957783039835 0.28480224709775 0.03705146484401 15.999 16 O 0.22042216960165 0.71519775290225 0.96294853515599 15.999 17 O 0.69287253556654 0.98721983918962 0.26443574176116 15.999 18 O 0.69287253556654 0.51278016081038 0.76443574176116 15.999 19 O 0.82669084183773 0.75965938304900 0.04033216030011 15.999 20 O 0.17330915816227 0.25965938304899 0.45966783969989 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.285555380608143 0.000000000000000 0.000000000000000 b 0.000000000000000 12.202476660000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): 1 Ba 0.37791115423028 0.49036417776431 0.74958566192304 137.327 > 1 2 Ba 0.87791115423028 0.49036417776431 0.74958566192304 137.327 > 1 3 Ba 0.37791115423028 0.99036417776431 0.74958566192304 137.327 > 1 4 Ba 0.87791115423028 0.99036417776431 0.74958566192304 137.327 > 1 5 Ba 0.12208884576972 0.24036417776431 0.75041433807696 137.327 > 5 6 Ba 0.62208884576972 0.24036417776431 0.75041433807696 137.327 > 5 7 Ba 0.12208884576972 0.74036417776431 0.75041433807696 137.327 > 5 8 Ba 0.62208884576972 0.74036417776431 0.75041433807696 137.327 > 5 9 Ba 0.12208884576972 0.00963582223569 0.25041433807696 137.327 > 9 10 Ba 0.62208884576972 0.00963582223569 0.25041433807696 137.327 > 9 11 Ba 0.12208884576972 0.50963582223569 0.25041433807696 137.327 > 9 12 Ba 0.62208884576972 0.50963582223569 0.25041433807696 137.327 > 9 13 Ba 0.37791115423028 0.25963582223569 0.24958566192304 137.327 > 13 14 Ba 0.87791115423028 0.25963582223569 0.24958566192304 137.327 > 13 15 Ba 0.37791115423028 0.75963582223569 0.24958566192304 137.327 > 13 16 Ba 0.87791115423028 0.75963582223569 0.24958566192304 137.327 > 13 17 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 17 18 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 17 19 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 17 20 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 17 21 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 21 22 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 21 23 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 21 24 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 21 25 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 > 25 26 U 0.50000000000000 0.00000000000000 0.50000000000000 238.029 > 25 27 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 > 25 28 U 0.50000000000000 0.50000000000000 0.50000000000000 238.029 > 25 29 U 0.00000000000000 0.25000000000000 0.00000000000000 238.029 > 29 30 U 0.50000000000000 0.25000000000000 0.00000000000000 238.029 > 29 31 U 0.00000000000000 0.75000000000000 0.00000000000000 238.029 > 29 32 U 0.50000000000000 0.75000000000000 0.00000000000000 238.029 > 29 33 O 0.38978891519917 0.10759887645113 0.53705146484401 15.999 > 33 34 O 0.88978891519917 0.10759887645113 0.53705146484401 15.999 > 33 35 O 0.38978891519917 0.60759887645113 0.53705146484401 15.999 > 33 36 O 0.88978891519917 0.60759887645113 0.53705146484401 15.999 > 33 37 O 0.15356373221673 0.24360991959481 0.23556425823884 15.999 > 37 38 O 0.65356373221673 0.24360991959481 0.23556425823884 15.999 > 37 39 O 0.15356373221673 0.74360991959481 0.23556425823884 15.999 > 37 40 O 0.65356373221673 0.74360991959481 0.23556425823884 15.999 > 37 41 O 0.41334542091886 0.37017030847550 0.54033216030011 15.999 > 41 42 O 0.91334542091886 0.37017030847550 0.54033216030011 15.999 > 41 43 O 0.41334542091886 0.87017030847550 0.54033216030011 15.999 > 41 44 O 0.91334542091886 0.87017030847550 0.54033216030011 15.999 > 41 45 O 0.11021108480083 0.39240112354887 0.46294853515599 15.999 > 45 46 O 0.61021108480083 0.39240112354887 0.46294853515599 15.999 > 45 47 O 0.11021108480083 0.89240112354887 0.46294853515599 15.999 > 45 48 O 0.61021108480083 0.89240112354887 0.46294853515599 15.999 > 45 49 O 0.15356373221673 0.00639008040519 0.73556425823884 15.999 > 49 50 O 0.65356373221673 0.00639008040519 0.73556425823884 15.999 > 49 51 O 0.15356373221673 0.50639008040519 0.73556425823884 15.999 > 49 52 O 0.65356373221673 0.50639008040519 0.73556425823884 15.999 > 49 53 O 0.08665457908114 0.12017030847550 0.95966783969989 15.999 > 53 54 O 0.58665457908114 0.12017030847550 0.95966783969989 15.999 > 53 55 O 0.08665457908114 0.62017030847550 0.95966783969989 15.999 > 53 56 O 0.58665457908114 0.62017030847550 0.95966783969989 15.999 > 53 57 O 0.38978891519917 0.14240112354887 0.03705146484401 15.999 > 57 58 O 0.88978891519917 0.14240112354887 0.03705146484401 15.999 > 57 59 O 0.38978891519917 0.64240112354887 0.03705146484401 15.999 > 57 60 O 0.88978891519917 0.64240112354887 0.03705146484401 15.999 > 57 61 O 0.11021108480083 0.35759887645113 0.96294853515599 15.999 > 61 62 O 0.61021108480083 0.35759887645113 0.96294853515599 15.999 > 61 63 O 0.11021108480083 0.85759887645113 0.96294853515599 15.999 > 61 64 O 0.61021108480083 0.85759887645113 0.96294853515599 15.999 > 61 65 O 0.34643626778327 0.49360991959481 0.26443574176116 15.999 > 65 66 O 0.84643626778327 0.49360991959481 0.26443574176116 15.999 > 65 67 O 0.34643626778327 0.99360991959481 0.26443574176116 15.999 > 65 68 O 0.84643626778327 0.99360991959481 0.26443574176116 15.999 > 65 69 O 0.34643626778327 0.25639008040519 0.76443574176116 15.999 > 69 70 O 0.84643626778327 0.25639008040519 0.76443574176116 15.999 > 69 71 O 0.34643626778327 0.75639008040519 0.76443574176116 15.999 > 69 72 O 0.84643626778327 0.75639008040519 0.76443574176116 15.999 > 69 73 O 0.41334542091886 0.37982969152450 0.04033216030011 15.999 > 73 74 O 0.91334542091886 0.37982969152450 0.04033216030011 15.999 > 73 75 O 0.41334542091886 0.87982969152450 0.04033216030011 15.999 > 73 76 O 0.91334542091886 0.87982969152450 0.04033216030011 15.999 > 73 77 O 0.08665457908114 0.12982969152450 0.45966783969989 15.999 > 77 78 O 0.58665457908114 0.12982969152450 0.45966783969989 15.999 > 77 79 O 0.08665457908114 0.62982969152450 0.45966783969989 15.999 > 77 80 O 0.58665457908114 0.62982969152450 0.45966783969989 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.3747714 0.0000000 -0.0268917 0.0000000 4.2833593 0.0000000 -0.0267929 0.0000000 4.2862439 -------------------------- Born effective charges -------------------------- 1 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 2 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 3 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 4 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 5 Ca 3.0567038 0.1155436 0.2933495 -0.0858607 3.0154606 -0.0422773 -0.2150367 -0.0636295 3.0211808 6 Ca 3.0567038 -0.1155436 0.2933495 0.0858607 3.0154606 0.0422773 -0.2150367 0.0636295 3.0211808 7 U 5.1383805 0.0380345 -0.1007581 0.0792216 5.0095522 0.1287106 -0.1044401 0.0701517 5.1675357 8 U 5.1383805 -0.0380345 -0.1007581 -0.0792216 5.0095522 -0.1287106 -0.1044401 -0.0701517 5.1675357 9 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 10 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 11 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 12 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 13 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 14 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 15 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 16 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 17 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 18 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 19 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 20 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 ---------------------------------------------------------------------------- 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] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] 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] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] 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] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] Computing fc3[ 37, 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] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0058 0.0000 0.0082] [ 0.0058 0.0000 -0.0082] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000004 (yyy) -0.00000004 (yyy) -0.00000004 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000009 (xz) 0.00000009 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:31:53]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 13:31:54]------------------------- 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 6.142777690304071 0.000000000000000 0.000000000000000 b 0.000000000000000 6.101238330000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): 1 Ba 0.75582230846056 0.98072835552863 0.74958566192304 137.327 2 Ba 0.24417769153944 0.48072835552863 0.75041433807696 137.327 3 Ba 0.24417769153944 0.01927164447137 0.25041433807696 137.327 4 Ba 0.75582230846056 0.51927164447137 0.24958566192304 137.327 5 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 6 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 7 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 8 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 9 O 0.77957783039835 0.21519775290225 0.53705146484401 15.999 10 O 0.30712746443346 0.48721983918962 0.23556425823884 15.999 11 O 0.82669084183773 0.74034061695100 0.54033216030011 15.999 12 O 0.22042216960165 0.78480224709775 0.46294853515599 15.999 13 O 0.30712746443346 0.01278016081038 0.73556425823884 15.999 14 O 0.17330915816227 0.24034061695101 0.95966783969989 15.999 15 O 0.77957783039835 0.28480224709775 0.03705146484401 15.999 16 O 0.22042216960165 0.71519775290225 0.96294853515599 15.999 17 O 0.69287253556654 0.98721983918962 0.26443574176116 15.999 18 O 0.69287253556654 0.51278016081038 0.76443574176116 15.999 19 O 0.82669084183773 0.75965938304900 0.04033216030011 15.999 20 O 0.17330915816227 0.25965938304899 0.45966783969989 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.285555380608143 0.000000000000000 0.000000000000000 b 0.000000000000000 12.202476660000000 0.000000000000000 c -6.119552565405281 0.000000000000000 8.617667609338996 Atomic positions (fractional): 1 Ba 0.37791115423028 0.49036417776431 0.74958566192304 137.327 > 1 2 Ba 0.87791115423028 0.49036417776431 0.74958566192304 137.327 > 1 3 Ba 0.37791115423028 0.99036417776431 0.74958566192304 137.327 > 1 4 Ba 0.87791115423028 0.99036417776431 0.74958566192304 137.327 > 1 5 Ba 0.12208884576972 0.24036417776431 0.75041433807696 137.327 > 5 6 Ba 0.62208884576972 0.24036417776431 0.75041433807696 137.327 > 5 7 Ba 0.12208884576972 0.74036417776431 0.75041433807696 137.327 > 5 8 Ba 0.62208884576972 0.74036417776431 0.75041433807696 137.327 > 5 9 Ba 0.12208884576972 0.00963582223569 0.25041433807696 137.327 > 9 10 Ba 0.62208884576972 0.00963582223569 0.25041433807696 137.327 > 9 11 Ba 0.12208884576972 0.50963582223569 0.25041433807696 137.327 > 9 12 Ba 0.62208884576972 0.50963582223569 0.25041433807696 137.327 > 9 13 Ba 0.37791115423028 0.25963582223569 0.24958566192304 137.327 > 13 14 Ba 0.87791115423028 0.25963582223569 0.24958566192304 137.327 > 13 15 Ba 0.37791115423028 0.75963582223569 0.24958566192304 137.327 > 13 16 Ba 0.87791115423028 0.75963582223569 0.24958566192304 137.327 > 13 17 Ca 0.25000000000000 0.00000000000000 0.00000000000000 40.078 > 17 18 Ca 0.75000000000000 0.00000000000000 0.00000000000000 40.078 > 17 19 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 17 20 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 17 21 Ca 0.25000000000000 0.25000000000000 0.50000000000000 40.078 > 21 22 Ca 0.75000000000000 0.25000000000000 0.50000000000000 40.078 > 21 23 Ca 0.25000000000000 0.75000000000000 0.50000000000000 40.078 > 21 24 Ca 0.75000000000000 0.75000000000000 0.50000000000000 40.078 > 21 25 U 0.00000000000000 0.00000000000000 0.50000000000000 238.029 > 25 26 U 0.50000000000000 0.00000000000000 0.50000000000000 238.029 > 25 27 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 > 25 28 U 0.50000000000000 0.50000000000000 0.50000000000000 238.029 > 25 29 U 0.00000000000000 0.25000000000000 0.00000000000000 238.029 > 29 30 U 0.50000000000000 0.25000000000000 0.00000000000000 238.029 > 29 31 U 0.00000000000000 0.75000000000000 0.00000000000000 238.029 > 29 32 U 0.50000000000000 0.75000000000000 0.00000000000000 238.029 > 29 33 O 0.38978891519917 0.10759887645113 0.53705146484401 15.999 > 33 34 O 0.88978891519917 0.10759887645113 0.53705146484401 15.999 > 33 35 O 0.38978891519917 0.60759887645113 0.53705146484401 15.999 > 33 36 O 0.88978891519917 0.60759887645113 0.53705146484401 15.999 > 33 37 O 0.15356373221673 0.24360991959481 0.23556425823884 15.999 > 37 38 O 0.65356373221673 0.24360991959481 0.23556425823884 15.999 > 37 39 O 0.15356373221673 0.74360991959481 0.23556425823884 15.999 > 37 40 O 0.65356373221673 0.74360991959481 0.23556425823884 15.999 > 37 41 O 0.41334542091886 0.37017030847550 0.54033216030011 15.999 > 41 42 O 0.91334542091886 0.37017030847550 0.54033216030011 15.999 > 41 43 O 0.41334542091886 0.87017030847550 0.54033216030011 15.999 > 41 44 O 0.91334542091886 0.87017030847550 0.54033216030011 15.999 > 41 45 O 0.11021108480083 0.39240112354887 0.46294853515599 15.999 > 45 46 O 0.61021108480083 0.39240112354887 0.46294853515599 15.999 > 45 47 O 0.11021108480083 0.89240112354887 0.46294853515599 15.999 > 45 48 O 0.61021108480083 0.89240112354887 0.46294853515599 15.999 > 45 49 O 0.15356373221673 0.00639008040519 0.73556425823884 15.999 > 49 50 O 0.65356373221673 0.00639008040519 0.73556425823884 15.999 > 49 51 O 0.15356373221673 0.50639008040519 0.73556425823884 15.999 > 49 52 O 0.65356373221673 0.50639008040519 0.73556425823884 15.999 > 49 53 O 0.08665457908114 0.12017030847550 0.95966783969989 15.999 > 53 54 O 0.58665457908114 0.12017030847550 0.95966783969989 15.999 > 53 55 O 0.08665457908114 0.62017030847550 0.95966783969989 15.999 > 53 56 O 0.58665457908114 0.62017030847550 0.95966783969989 15.999 > 53 57 O 0.38978891519917 0.14240112354887 0.03705146484401 15.999 > 57 58 O 0.88978891519917 0.14240112354887 0.03705146484401 15.999 > 57 59 O 0.38978891519917 0.64240112354887 0.03705146484401 15.999 > 57 60 O 0.88978891519917 0.64240112354887 0.03705146484401 15.999 > 57 61 O 0.11021108480083 0.35759887645113 0.96294853515599 15.999 > 61 62 O 0.61021108480083 0.35759887645113 0.96294853515599 15.999 > 61 63 O 0.11021108480083 0.85759887645113 0.96294853515599 15.999 > 61 64 O 0.61021108480083 0.85759887645113 0.96294853515599 15.999 > 61 65 O 0.34643626778327 0.49360991959481 0.26443574176116 15.999 > 65 66 O 0.84643626778327 0.49360991959481 0.26443574176116 15.999 > 65 67 O 0.34643626778327 0.99360991959481 0.26443574176116 15.999 > 65 68 O 0.84643626778327 0.99360991959481 0.26443574176116 15.999 > 65 69 O 0.34643626778327 0.25639008040519 0.76443574176116 15.999 > 69 70 O 0.84643626778327 0.25639008040519 0.76443574176116 15.999 > 69 71 O 0.34643626778327 0.75639008040519 0.76443574176116 15.999 > 69 72 O 0.84643626778327 0.75639008040519 0.76443574176116 15.999 > 69 73 O 0.41334542091886 0.37982969152450 0.04033216030011 15.999 > 73 74 O 0.91334542091886 0.37982969152450 0.04033216030011 15.999 > 73 75 O 0.41334542091886 0.87982969152450 0.04033216030011 15.999 > 73 76 O 0.91334542091886 0.87982969152450 0.04033216030011 15.999 > 73 77 O 0.08665457908114 0.12982969152450 0.45966783969989 15.999 > 77 78 O 0.58665457908114 0.12982969152450 0.45966783969989 15.999 > 77 79 O 0.08665457908114 0.62982969152450 0.45966783969989 15.999 > 77 80 O 0.58665457908114 0.62982969152450 0.45966783969989 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.3747714 0.0000000 -0.0268917 0.0000000 4.2833593 0.0000000 -0.0267929 0.0000000 4.2862439 -------------------------- Born effective charges -------------------------- 1 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 2 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 3 Ba 2.8235223 0.1105122 -0.1456689 0.1256191 2.6565280 -0.0123274 0.1048326 -0.0719319 2.6061465 4 Ba 2.8235223 -0.1105122 -0.1456689 -0.1256191 2.6565280 0.0123274 0.1048326 0.0719319 2.6061465 5 Ca 3.0567038 0.1155436 0.2933495 -0.0858607 3.0154606 -0.0422773 -0.2150367 -0.0636295 3.0211808 6 Ca 3.0567038 -0.1155436 0.2933495 0.0858607 3.0154606 0.0422773 -0.2150367 0.0636295 3.0211808 7 U 5.1383805 0.0380345 -0.1007581 0.0792216 5.0095522 0.1287106 -0.1044401 0.0701517 5.1675357 8 U 5.1383805 -0.0380345 -0.1007581 -0.0792216 5.0095522 -0.1287106 -0.1044401 -0.0701517 5.1675357 9 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 10 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 11 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 12 O -2.7687814 0.9658219 0.2560653 0.9637717 -2.3894664 -0.1963609 0.2744238 -0.1957144 -1.5849637 13 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 14 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 15 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 16 O -2.7687814 -0.9658219 0.2560653 -0.9637717 -2.3894664 0.1963609 0.2744238 0.1957144 -1.5849637 17 O -1.7667264 0.0369728 -0.4760960 0.0578270 -1.4790697 -0.1328690 -0.4865884 -0.1123030 -3.5286603 18 O -1.7667264 -0.0369728 -0.4760960 -0.0578270 -1.4790697 0.1328690 -0.4865884 0.1123030 -3.5286603 19 O -2.3855566 0.9610715 0.2694040 0.9830693 -2.8004983 -0.3342402 0.2670703 -0.3279569 -1.5868808 20 O -2.3855566 -0.9610715 0.2694040 -0.9830693 -2.8004983 0.3342402 0.2670703 0.3279569 -1.5868808 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000004 (yyy) -0.00000004 (yyy) -0.00000004 (yyy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 8 6 ] 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: 0.61, Number of G-points: 319, Lambda: 0.13 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/160) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 1.401 ( 0.000 0.000 0.000) 0.000 1.972 ( 0.000 0.000 0.000) 0.000 2.253 ( 0.000 0.000 0.000) 0.000 2.449 ( 0.000 0.000 0.000) 0.000 2.528 ( 0.000 0.000 0.000) 0.000 2.565 ( 0.000 0.000 0.000) 0.000 2.687 ( 0.000 0.000 0.000) 0.000 2.736 ( 0.000 0.000 0.000) 0.000 2.867 ( 0.000 0.000 0.000) 0.000 2.932 ( 0.000 0.000 0.000) 0.000 3.076 ( 0.000 0.000 0.000) 0.000 3.176 ( 0.000 0.000 0.000) 0.000 3.297 ( 0.000 0.000 0.000) 0.000 3.300 ( 0.000 0.000 0.000) 0.000 3.352 ( 0.000 0.000 0.000) 0.000 3.653 ( 0.000 0.000 0.000) 0.000 3.655 ( 0.000 0.000 0.000) 0.000 3.913 ( 0.000 0.000 0.000) 0.000 4.887 ( 0.000 0.000 0.000) 0.000 5.854 ( 0.000 0.000 0.000) 0.000 6.028 ( 0.000 0.000 0.000) 0.000 6.037 ( 0.000 0.000 0.000) 0.000 6.344 ( 0.000 0.000 0.000) 0.000 6.401 ( 0.000 0.000 0.000) 0.000 6.605 ( 0.000 0.000 0.000) 0.000 7.011 ( 0.000 0.000 0.000) 0.000 7.040 ( 0.000 0.000 0.000) 0.000 7.112 ( 0.000 0.000 0.000) 0.000 7.186 ( 0.000 0.000 0.000) 0.000 7.323 ( 0.000 0.000 0.000) 0.000 7.408 ( 0.000 0.000 0.000) 0.000 7.603 ( 0.000 0.000 0.000) 0.000 7.945 ( 0.000 0.000 0.000) 0.000 8.180 ( 0.000 0.000 0.000) 0.000 8.327 ( 0.000 0.000 0.000) 0.000 8.538 ( 0.000 0.000 0.000) 0.000 8.607 ( 0.000 0.000 0.000) 0.000 8.864 ( 0.000 0.000 0.000) 0.000 8.890 ( 0.000 0.000 0.000) 0.000 9.239 ( 0.000 0.000 0.000) 0.000 9.308 ( 0.000 0.000 0.000) 0.000 9.655 ( 0.000 0.000 0.000) 0.000 10.017 ( 0.000 0.000 0.000) 0.000 10.225 ( 0.000 0.000 0.000) 0.000 11.138 ( 0.000 0.000 0.000) 0.000 13.038 ( 0.000 0.000 0.000) 0.000 13.190 ( 0.000 0.000 0.000) 0.000 13.274 ( 0.000 0.000 0.000) 0.000 15.617 ( 0.000 0.000 0.000) 0.000 15.638 ( 0.000 0.000 0.000) 0.000 15.739 ( 0.000 0.000 0.000) 0.000 15.979 ( 0.000 0.000 0.000) 0.000 15.997 ( 0.000 0.000 0.000) 0.000 16.720 ( 0.000 0.000 0.000) 0.000 17.522 ( 0.000 0.000 0.000) 0.000 21.438 ( 0.000 0.000 0.000) 0.000 21.702 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/160) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.458 ( 21.560 0.000 10.027) 23.778 0.510 ( 18.204 0.000 17.118) 24.988 0.976 ( 40.220 0.000 23.232) 46.447 1.495 ( 10.936 0.000 0.789) 10.965 1.966 ( 1.432 0.000 -3.472) 3.755 2.261 ( -0.563 0.000 1.702) 1.792 2.438 ( -6.615 0.000 -5.875) 8.847 2.479 ( -1.535 0.000 1.234) 1.970 2.536 ( -1.516 0.000 -1.209) 1.938 2.638 ( 2.349 0.000 -0.684) 2.447 2.726 ( 1.529 0.000 -3.190) 3.537 2.877 ( -3.682 0.000 -0.763) 3.760 2.953 ( 3.249 0.000 0.575) 3.299 3.122 ( 0.201 0.000 -1.738) 1.750 3.196 ( 0.682 0.000 8.164) 8.193 3.241 ( 0.104 0.000 1.470) 1.474 3.406 ( -8.975 0.000 16.391) 18.688 3.551 ( 4.830 0.000 11.846) 12.793 3.717 ( 7.173 0.000 1.246) 7.281 3.845 ( -6.398 0.000 -2.793) 6.981 4.097 ( -3.485 0.000 -14.325) 14.742 4.661 ( -11.377 0.000 -17.521) 20.891 5.938 ( -3.774 0.000 1.506) 4.064 6.022 ( 3.157 0.000 8.133) 8.725 6.030 ( -4.440 0.000 3.921) 5.924 6.338 ( -5.796 0.000 -0.733) 5.842 6.382 ( 8.110 0.000 -7.263) 10.887 6.623 ( 1.055 0.000 4.723) 4.839 6.997 ( -0.789 0.000 -2.176) 2.315 7.111 ( -5.816 0.000 2.347) 6.272 7.174 ( 4.005 0.000 3.049) 5.034 7.253 ( -0.913 0.000 0.362) 0.982 7.403 ( -0.264 0.000 -1.275) 1.302 7.618 ( -0.103 0.000 2.650) 2.652 7.618 ( 3.763 0.000 -2.158) 4.338 7.914 ( 3.036 0.000 -7.990) 8.547 8.178 ( 1.981 0.000 -3.249) 3.805 8.311 ( -3.842 0.000 -0.836) 3.932 8.586 ( -0.882 0.000 5.028) 5.105 8.731 ( -10.681 0.000 9.346) 14.193 8.798 ( -5.385 0.000 -2.627) 5.992 9.219 ( -7.232 0.000 3.310) 7.953 9.297 ( 2.309 0.000 -0.671) 2.404 9.636 ( -4.226 0.000 1.962) 4.659 10.035 ( 7.501 0.000 -5.835) 9.503 10.330 ( 11.197 0.000 0.418) 11.204 10.447 ( 26.212 0.000 -9.500) 27.881 11.096 ( -1.490 0.000 -4.569) 4.806 13.073 ( 2.284 0.000 2.726) 3.556 13.224 ( -0.425 0.000 6.271) 6.285 13.277 ( 1.040 0.000 -0.924) 1.391 15.590 ( -10.892 0.000 0.615) 10.909 15.626 ( -0.333 0.000 1.340) 1.381 15.806 ( -21.654 0.000 -3.054) 21.868 15.904 ( -5.792 0.000 7.281) 9.304 16.275 ( -1.135 0.000 -33.668) 33.687 18.078 ( 25.759 0.000 28.432) 38.366 19.563 ( 6.047 0.000 -6.953) 9.215 21.440 ( -0.291 0.000 0.728) 0.784 21.685 ( -1.106 0.000 -1.344) 1.740 ======================= Grid point 2 (3/160) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.931 ( 22.177 0.000 9.565) 24.152 0.972 ( 15.926 0.000 13.901) 21.140 1.606 ( 11.526 0.000 7.177) 13.578 1.912 ( 2.511 0.000 -11.736) 12.002 1.924 ( 32.921 0.000 11.664) 34.927 2.264 ( -4.883 0.000 0.621) 4.922 2.276 ( -0.580 0.000 2.634) 2.697 2.449 ( -3.866 0.000 -1.042) 4.004 2.554 ( -0.032 0.000 3.304) 3.304 2.703 ( -0.567 0.000 -5.403) 5.433 2.708 ( 2.375 0.000 4.873) 5.420 2.783 ( -4.863 0.000 -0.370) 4.877 3.019 ( 5.023 0.000 -1.330) 5.196 3.036 ( -3.332 0.000 -3.976) 5.187 3.279 ( -0.713 0.000 6.819) 6.856 3.403 ( 6.584 0.000 9.559) 11.607 3.472 ( -4.033 0.000 13.047) 13.656 3.642 ( -11.690 0.000 -4.629) 12.573 3.740 ( 3.233 0.000 12.207) 12.628 3.857 ( -6.502 0.000 -9.568) 11.568 3.879 ( 11.811 0.000 -3.266) 12.254 4.223 ( -12.310 0.000 -21.374) 24.665 5.817 ( -7.292 0.000 -1.667) 7.481 5.956 ( -9.929 0.000 3.539) 10.541 6.182 ( 0.520 0.000 6.387) 6.408 6.203 ( -5.262 0.000 -4.597) 6.987 6.466 ( 9.657 0.000 -4.602) 10.697 6.760 ( 4.633 0.000 9.569) 10.631 6.920 ( -3.420 0.000 -2.819) 4.432 7.056 ( -4.029 0.000 3.882) 5.595 7.246 ( 0.809 0.000 -1.421) 1.635 7.280 ( 4.785 0.000 2.768) 5.528 7.346 ( -5.675 0.000 -0.683) 5.716 7.665 ( 1.214 0.000 4.032) 4.211 7.679 ( 7.437 0.000 -3.874) 8.386 7.883 ( 5.807 0.000 -9.854) 11.438 8.159 ( 2.484 0.000 -7.086) 7.509 8.215 ( -6.172 0.000 -0.941) 6.244 8.595 ( -5.375 0.000 1.985) 5.730 8.670 ( -6.359 0.000 7.209) 9.612 8.681 ( -2.682 0.000 -3.433) 4.357 9.100 ( -8.037 0.000 -1.334) 8.147 9.359 ( 0.837 0.000 5.386) 5.451 9.554 ( -6.281 0.000 -1.175) 6.390 10.134 ( 9.020 0.000 -1.054) 9.081 10.532 ( 11.424 0.000 -1.298) 11.497 10.824 ( 22.263 0.000 3.406) 22.522 11.020 ( 1.516 0.000 -5.049) 5.272 13.168 ( 4.521 0.000 3.442) 5.682 13.289 ( 2.126 0.000 -1.308) 2.496 13.317 ( -0.635 0.000 11.294) 11.312 14.985 ( -35.308 0.000 -19.290) 40.233 15.622 ( -2.111 0.000 -3.049) 3.708 15.637 ( -0.326 0.000 1.221) 1.263 15.888 ( -2.553 0.000 1.682) 3.057 16.050 ( 1.672 0.000 -15.437) 15.527 18.788 ( 22.157 0.000 24.471) 33.012 19.589 ( 5.092 0.000 -4.226) 6.617 21.445 ( -0.446 0.000 1.198) 1.279 21.637 ( -2.050 0.000 -2.360) 3.126 ======================= Grid point 3 (4/160) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 12.170 0.000 8.999) 15.136 1.377 ( 19.612 0.000 7.246) 20.908 1.804 ( 7.585 0.000 2.328) 7.934 1.838 ( 4.755 0.000 -8.716) 9.929 2.264 ( -1.283 0.000 2.624) 2.921 2.268 ( -1.453 0.000 1.831) 2.337 2.364 ( -4.418 0.000 3.071) 5.381 2.393 ( 3.814 0.000 1.462) 4.084 2.549 ( -4.514 0.000 -8.547) 9.666 2.575 ( -1.612 0.000 2.021) 2.585 2.737 ( -4.647 0.000 2.114) 5.105 2.742 ( -7.396 0.000 4.534) 8.675 3.021 ( 7.477 0.000 -1.545) 7.635 3.090 ( 6.798 0.000 -2.519) 7.250 3.324 ( -2.465 0.000 5.177) 5.734 3.537 ( 6.684 0.000 3.481) 7.536 3.566 ( -1.860 0.000 3.661) 4.107 3.605 ( 3.637 0.000 10.357) 10.977 3.655 ( -9.772 0.000 0.523) 9.786 3.860 ( -3.047 0.000 -15.292) 15.592 3.957 ( 8.060 0.000 7.955) 11.325 3.999 ( 10.305 0.000 -6.533) 12.201 5.693 ( -5.576 0.000 -1.092) 5.682 5.810 ( -10.682 0.000 1.357) 10.768 6.075 ( -3.750 0.000 -4.542) 5.890 6.128 ( -7.114 0.000 -4.562) 8.451 6.570 ( 5.670 0.000 0.528) 5.694 6.894 ( -0.438 0.000 2.910) 2.943 6.942 ( 4.505 0.000 5.155) 6.846 7.064 ( -2.305 0.000 5.909) 6.342 7.219 ( -8.583 0.000 2.006) 8.814 7.260 ( 3.449 0.000 -1.046) 3.604 7.404 ( 5.040 0.000 4.523) 6.772 7.729 ( 4.277 0.000 -5.775) 7.186 7.738 ( 2.180 0.000 2.825) 3.568 7.866 ( 5.323 0.000 -10.578) 11.842 8.101 ( 2.390 0.000 -7.788) 8.147 8.125 ( -2.665 0.000 0.934) 2.824 8.485 ( -8.484 0.000 1.466) 8.610 8.662 ( -4.602 0.000 4.096) 6.161 8.664 ( 4.218 0.000 -2.348) 4.827 8.931 ( -8.802 0.000 -3.967) 9.655 9.420 ( -6.505 0.000 -2.941) 7.139 9.421 ( -2.688 0.000 6.993) 7.492 10.280 ( 7.689 0.000 1.732) 7.882 10.582 ( 3.238 0.000 -9.278) 9.827 11.116 ( 10.605 0.000 3.258) 11.094 11.196 ( 16.300 0.000 4.842) 17.004 13.282 ( 5.255 0.000 1.658) 5.511 13.315 ( 2.597 0.000 -1.123) 2.830 13.460 ( 0.188 0.000 13.587) 13.589 14.250 ( -25.085 0.000 -19.436) 31.733 15.556 ( -2.300 0.000 -2.310) 3.260 15.642 ( -0.728 0.000 1.175) 1.382 15.858 ( -1.764 0.000 -0.784) 1.930 15.895 ( -2.373 0.000 -10.706) 10.966 19.337 ( 14.795 0.000 17.840) 23.177 19.628 ( 4.553 0.000 -2.837) 5.365 21.452 ( -0.414 0.000 1.214) 1.283 21.569 ( -2.414 0.000 -2.613) 3.557 ======================= Grid point 4 (5/160) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( 7.403 0.000 4.141) 8.483 1.696 ( 11.274 0.000 2.861) 11.631 1.865 ( 4.904 0.000 -1.907) 5.261 1.915 ( 3.758 0.000 1.076) 3.909 2.173 ( -10.672 0.000 -3.418) 11.206 2.174 ( -6.445 0.000 -1.489) 6.615 2.304 ( -3.175 0.000 0.123) 3.178 2.428 ( -1.514 0.000 -5.707) 5.905 2.431 ( 1.130 0.000 7.233) 7.321 2.551 ( -1.964 0.000 -0.437) 2.012 2.629 ( -7.062 0.000 -0.553) 7.084 2.677 ( -4.080 0.000 1.067) 4.217 3.164 ( 8.135 0.000 0.374) 8.144 3.187 ( 6.909 0.000 -1.149) 7.004 3.332 ( -2.131 0.000 3.227) 3.867 3.364 ( -6.846 0.000 -7.296) 10.005 3.685 ( 0.004 0.000 4.531) 4.531 3.711 ( 0.274 0.000 -3.226) 3.238 3.749 ( 1.537 0.000 6.790) 6.962 3.881 ( 12.667 0.000 8.519) 15.265 4.083 ( 7.750 0.000 -4.260) 8.843 4.142 ( 5.873 0.000 2.834) 6.521 5.620 ( -2.896 0.000 0.676) 2.974 5.663 ( -7.725 0.000 0.162) 7.726 5.934 ( -6.005 0.000 -7.227) 9.396 5.986 ( -1.845 0.000 -2.685) 3.258 6.665 ( 3.235 0.000 3.920) 5.082 6.920 ( -0.613 0.000 2.198) 2.282 6.926 ( -5.016 0.000 -4.430) 6.692 7.097 ( -1.712 0.000 4.439) 4.758 7.201 ( -0.446 0.000 5.161) 5.180 7.355 ( 6.784 0.000 2.781) 7.331 7.543 ( 3.256 0.000 7.516) 8.191 7.687 ( -1.644 0.000 -4.737) 5.014 7.763 ( 1.054 0.000 -4.486) 4.608 7.772 ( -1.390 0.000 -8.784) 8.893 8.117 ( 5.826 0.000 -0.132) 5.827 8.183 ( 6.216 0.000 0.996) 6.295 8.394 ( -3.572 0.000 1.444) 3.852 8.589 ( -7.770 0.000 0.684) 7.800 8.693 ( -4.656 0.000 -2.026) 5.078 8.769 ( 1.447 0.000 -4.227) 4.468 9.301 ( -3.962 0.000 -1.949) 4.416 9.425 ( -4.904 0.000 4.850) 6.897 10.402 ( 4.399 0.000 1.643) 4.696 10.518 ( 2.450 0.000 -7.601) 7.986 11.332 ( 8.033 0.000 4.086) 9.013 11.443 ( 8.212 0.000 2.923) 8.716 13.339 ( 1.429 0.000 -0.839) 1.657 13.364 ( 3.150 0.000 0.475) 3.185 13.614 ( 1.285 0.000 9.405) 9.493 13.768 ( -11.956 0.000 -10.594) 15.974 15.497 ( -1.784 0.000 -1.862) 2.579 15.641 ( -0.619 0.000 0.711) 0.943 15.743 ( -3.043 0.000 -6.489) 7.167 15.818 ( -1.331 0.000 -1.332) 1.883 19.665 ( 2.857 0.000 -1.422) 3.191 19.673 ( 7.057 0.000 9.468) 11.809 21.459 ( -0.242 0.000 0.746) 0.784 21.508 ( -1.703 0.000 -1.757) 2.446 ======================= Grid point 5 (6/160) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 0.000 0.000 0.000) 0.000 1.803 ( 0.000 0.000 0.000) 0.000 1.905 ( -0.000 0.000 0.000) 0.000 1.955 ( 0.000 0.000 0.000) 0.000 2.032 ( -0.000 0.000 -0.000) 0.000 2.097 ( 0.000 0.000 0.000) 0.000 2.284 ( 0.000 0.000 -0.000) 0.000 2.385 ( 0.000 0.000 0.000) 0.000 2.514 ( -0.000 0.000 0.001) 0.001 2.515 ( 0.000 0.000 -0.001) 0.001 2.549 ( -0.000 0.000 0.000) 0.000 2.649 ( 0.000 0.000 0.000) 0.000 3.234 ( 0.000 0.000 0.000) 0.000 3.242 ( -0.000 0.000 0.000) 0.000 3.276 ( 0.000 0.000 0.000) 0.000 3.331 ( 0.000 0.000 0.000) 0.000 3.663 ( 0.000 0.000 0.000) 0.000 3.734 ( -0.000 0.000 -0.000) 0.000 3.802 ( 0.000 0.000 0.000) 0.000 4.058 ( -0.000 0.000 0.000) 0.000 4.130 ( 0.000 0.000 0.000) 0.000 4.203 ( 0.000 0.000 0.000) 0.000 5.594 ( 0.000 0.000 0.000) 0.000 5.607 ( 0.000 0.000 0.000) 0.000 5.830 ( 0.000 0.000 0.000) 0.000 5.955 ( 0.000 0.000 0.000) 0.000 6.761 ( 0.000 0.000 0.000) 0.000 6.801 ( -0.000 0.000 0.000) 0.000 6.926 ( 0.000 0.000 0.000) 0.000 7.107 ( 0.000 0.000 0.000) 0.000 7.233 ( 0.000 0.000 0.000) 0.000 7.485 ( -0.000 0.000 -0.000) 0.000 7.586 ( 0.000 0.000 0.000) 0.000 7.659 ( 0.000 0.000 -0.000) 0.000 7.696 ( 0.000 0.000 0.000) 0.000 7.706 ( 0.000 0.000 0.000) 0.000 8.202 ( 0.000 0.000 0.000) 0.000 8.251 ( 0.000 0.000 0.000) 0.000 8.442 ( -0.000 0.000 -0.000) 0.000 8.452 ( 0.000 0.000 0.000) 0.000 8.583 ( 0.000 0.000 0.000) 0.000 8.793 ( 0.000 0.000 0.000) 0.000 9.257 ( 0.000 0.000 0.000) 0.000 9.405 ( 0.000 0.000 0.000) 0.000 10.449 ( 0.000 0.000 0.000) 0.000 10.496 ( 0.000 0.000 0.000) 0.000 11.425 ( 0.000 0.000 0.000) 0.000 11.527 ( 0.000 0.000 0.000) 0.000 13.342 ( 0.000 0.000 0.000) 0.000 13.393 ( 0.000 0.000 0.000) 0.000 13.615 ( 0.000 0.000 0.000) 0.000 13.684 ( 0.000 0.000 0.000) 0.000 15.468 ( 0.000 0.000 0.000) 0.000 15.640 ( 0.000 0.000 0.000) 0.000 15.677 ( 0.000 0.000 0.000) 0.000 15.797 ( 0.000 0.000 0.000) 0.000 19.681 ( 0.000 0.000 0.000) 0.000 19.785 ( 0.000 0.000 0.000) 0.000 21.461 ( 0.000 0.000 0.000) 0.000 21.483 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 11 (7/160) ======================= q-point: ( 0.00 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.517 ( 0.000 24.834 0.000) 24.834 0.536 ( 0.000 25.772 0.000) 25.772 0.944 ( 0.000 41.474 0.000) 41.474 1.545 ( 0.000 14.000 0.000) 14.000 2.000 ( 0.000 1.595 0.000) 1.595 2.134 ( 0.000 -6.421 0.000) 6.421 2.526 ( 0.000 -0.181 0.000) 0.181 2.560 ( 0.000 -1.906 0.000) 1.906 2.597 ( 0.000 -2.753 0.000) 2.753 2.655 ( 0.000 10.121 0.000) 10.121 2.750 ( 0.000 1.368 0.000) 1.368 2.877 ( 0.000 -4.968 0.000) 4.968 2.990 ( 0.000 6.946 0.000) 6.946 3.201 ( 0.000 3.898 0.000) 3.898 3.287 ( 0.000 3.612 0.000) 3.612 3.347 ( 0.000 0.447 0.000) 0.447 3.455 ( 0.000 11.050 0.000) 11.050 3.631 ( 0.000 -0.780 0.000) 0.780 3.709 ( 0.000 5.215 0.000) 5.215 3.880 ( 0.000 -4.835 0.000) 4.835 3.994 ( 0.000 1.189 0.000) 1.189 4.759 ( 0.000 -10.923 0.000) 10.923 5.893 ( 0.000 3.252 0.000) 3.252 5.963 ( 0.000 -4.765 0.000) 4.765 6.161 ( 0.000 10.208 0.000) 10.208 6.435 ( 0.000 4.877 0.000) 4.877 6.534 ( 0.000 -5.618 0.000) 5.618 6.540 ( 0.000 6.809 0.000) 6.809 7.020 ( 0.000 -0.259 0.000) 0.259 7.030 ( 0.000 -0.753 0.000) 0.753 7.142 ( 0.000 1.089 0.000) 1.089 7.237 ( 0.000 3.621 0.000) 3.621 7.355 ( 0.000 3.871 0.000) 3.871 7.374 ( 0.000 -3.828 0.000) 3.828 7.924 ( 0.000 -1.819 0.000) 1.819 8.117 ( 0.000 -1.656 0.000) 1.656 8.263 ( 0.000 -6.873 0.000) 6.873 8.382 ( 0.000 -10.124 0.000) 10.124 8.602 ( 0.000 -0.346 0.000) 0.346 8.858 ( 0.000 -1.054 0.000) 1.054 8.995 ( 0.000 7.453 0.000) 7.453 9.197 ( 0.000 -4.071 0.000) 4.071 9.391 ( 0.000 -2.632 0.000) 2.632 9.441 ( 0.000 11.699 0.000) 11.699 9.697 ( 0.000 4.096 0.000) 4.096 9.983 ( 0.000 -3.056 0.000) 3.056 10.320 ( 0.000 3.942 0.000) 3.942 11.091 ( 0.000 -4.398 0.000) 4.398 13.102 ( 0.000 5.358 0.000) 5.358 13.222 ( 0.000 3.781 0.000) 3.781 13.317 ( 0.000 4.075 0.000) 4.075 15.350 ( 0.000 -25.098 0.000) 25.098 15.728 ( 0.000 0.400 0.000) 0.400 15.903 ( 0.000 -2.821 0.000) 2.821 15.909 ( 0.000 -4.843 0.000) 4.843 16.649 ( 0.000 -6.679 0.000) 6.679 17.881 ( 0.000 28.885 0.000) 28.885 19.433 ( 0.000 1.465 0.000) 1.465 21.424 ( 0.000 -1.255 0.000) 1.255 21.684 ( 0.000 -1.748 0.000) 1.748 ======================= Grid point 12 (8/160) ======================= q-point: ( 0.10 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.677 ( 10.987 18.200 9.507) 23.288 0.734 ( 16.750 17.453 6.296) 24.996 1.330 ( 27.655 25.654 15.168) 40.657 1.617 ( 7.435 12.840 1.232) 14.888 1.981 ( 1.128 1.094 -4.087) 4.378 2.166 ( -0.059 -5.008 4.290) 6.595 2.417 ( -6.819 -2.688 -7.584) 10.547 2.526 ( -2.368 -1.544 -3.040) 4.151 2.563 ( -0.688 1.667 0.886) 2.009 2.673 ( -2.800 -0.993 -4.591) 5.468 2.734 ( 3.555 6.967 1.868) 8.041 2.825 ( -3.354 -2.556 -0.190) 4.221 2.987 ( -2.229 5.569 3.066) 6.737 3.228 ( -0.977 5.579 0.357) 5.675 3.294 ( 2.092 6.683 4.489) 8.318 3.327 ( -2.229 5.819 1.876) 6.508 3.449 ( -11.878 2.899 9.232) 15.320 3.550 ( 1.439 0.227 9.502) 9.613 3.753 ( 10.173 4.164 0.461) 11.001 3.884 ( -4.482 3.718 -2.752) 6.441 4.082 ( 5.171 -2.038 -11.359) 12.646 4.578 ( -9.853 -7.266 -14.072) 18.652 5.908 ( -3.898 -2.275 0.068) 4.514 5.990 ( 4.201 -1.060 4.819) 6.481 6.147 ( -5.268 8.121 3.505) 10.295 6.373 ( -4.341 1.782 -5.755) 7.426 6.478 ( 2.667 8.431 -1.733) 9.011 6.616 ( 3.200 0.068 6.199) 6.976 6.965 ( -3.586 -2.627 -1.942) 4.851 7.065 ( -2.464 -2.319 4.405) 5.554 7.224 ( -0.686 -1.864 -0.380) 2.022 7.253 ( 2.889 6.174 0.518) 6.836 7.367 ( 4.345 -4.960 2.710) 7.129 7.435 ( 5.717 1.438 0.376) 5.906 7.884 ( 1.439 -1.694 -7.739) 8.052 8.033 ( -4.634 5.788 -9.158) 11.783 8.213 ( -6.415 6.854 -8.593) 12.727 8.269 ( -1.459 -3.899 -0.435) 4.186 8.490 ( -1.477 -5.645 6.746) 8.919 8.704 ( -9.889 -2.021 8.193) 13.000 8.861 ( -8.207 4.741 -4.067) 10.314 9.216 ( -3.299 -2.164 5.306) 6.612 9.335 ( -2.909 5.358 -6.466) 8.887 9.578 ( -1.546 -6.472 0.293) 6.660 10.051 ( 14.499 2.093 3.997) 15.184 10.186 ( 26.211 -10.012 5.296) 28.553 10.395 ( 8.872 3.274 -0.024) 9.457 11.049 ( -1.720 -4.348 -4.425) 6.437 13.112 ( 0.961 3.343 2.357) 4.202 13.233 ( 0.292 2.749 2.564) 3.771 13.378 ( 7.148 8.320 -2.846) 11.332 15.206 ( -15.437 -26.035 -3.731) 30.496 15.715 ( 1.524 2.707 -4.492) 5.462 15.816 ( -6.379 3.188 3.810) 8.085 15.997 ( 4.807 -1.736 -1.692) 5.383 16.346 ( -9.376 4.055 -24.182) 26.251 18.234 ( 16.970 14.798 23.951) 32.873 19.462 ( 0.390 -4.347 2.456) 5.008 21.425 ( -0.344 -1.321 0.675) 1.523 21.667 ( -1.094 -1.711 -1.312) 2.418 ======================= Grid point 13 (9/160) ======================= q-point: ( 0.20 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.030 ( 15.005 9.352 12.164) 21.461 1.111 ( 17.422 11.892 8.191) 22.628 1.781 ( 9.793 11.829 1.266) 15.409 1.928 ( 4.908 1.318 -8.935) 10.279 1.968 ( 23.426 6.116 8.503) 25.661 2.189 ( -1.508 -3.672 1.943) 4.419 2.268 ( -2.999 -1.835 1.697) 3.904 2.456 ( -4.084 -1.963 -0.659) 4.579 2.558 ( -3.867 -5.581 -3.005) 7.425 2.573 ( -0.973 -0.865 2.181) 2.540 2.774 ( -3.274 -0.507 1.101) 3.491 2.832 ( 1.599 6.624 4.319) 8.068 3.014 ( 2.054 3.888 0.931) 4.494 3.164 ( -1.963 9.015 -2.425) 9.540 3.313 ( -2.377 2.430 1.835) 3.863 3.444 ( 2.553 3.298 9.715) 10.572 3.466 ( -4.276 -0.130 12.366) 13.085 3.718 ( 4.907 0.516 7.663) 9.114 3.736 ( -5.884 6.984 -2.102) 9.371 3.911 ( 8.542 3.085 -2.455) 9.408 3.945 ( -1.233 5.961 -10.695) 12.306 4.204 ( -10.685 -1.664 -17.798) 20.825 5.809 ( -5.774 -0.068 -1.865) 6.068 6.014 ( -10.374 3.921 1.223) 11.157 6.156 ( 3.558 -3.088 4.483) 6.503 6.249 ( -3.141 5.497 -4.594) 7.822 6.524 ( 3.562 4.903 -2.408) 6.521 6.747 ( 0.520 -0.484 6.885) 6.921 6.911 ( -0.605 -0.870 3.058) 3.236 7.063 ( -2.213 -3.867 3.008) 5.376 7.134 ( -4.049 -1.854 -1.523) 4.706 7.319 ( 1.278 1.964 0.437) 2.384 7.428 ( 0.815 3.609 1.152) 3.875 7.578 ( 7.196 -1.533 3.203) 8.024 7.827 ( 2.932 2.704 -6.427) 7.564 7.894 ( 3.392 4.283 -10.870) 12.166 8.093 ( -2.400 -2.865 -3.447) 5.084 8.245 ( -1.198 0.258 -1.470) 1.914 8.550 ( -2.246 -3.858 3.386) 5.603 8.634 ( -7.982 -1.785 3.896) 9.060 8.704 ( -2.851 1.352 -1.748) 3.607 9.100 ( -9.949 0.283 -2.316) 10.219 9.335 ( 0.941 -1.966 4.669) 5.153 9.504 ( -5.828 -4.899 -1.419) 7.745 10.242 ( 7.742 9.101 1.881) 12.096 10.565 ( 11.453 2.838 -0.310) 11.803 10.691 ( 23.961 -10.662 5.405) 26.778 10.960 ( 0.252 -5.346 -5.887) 7.956 13.193 ( 2.602 1.050 5.961) 6.589 13.286 ( 0.567 1.243 5.180) 5.357 13.468 ( 8.315 14.256 -3.309) 16.832 14.779 ( -21.969 -14.574 -14.085) 29.890 15.677 ( -0.215 5.084 -3.489) 6.169 15.760 ( -3.300 5.700 -0.860) 6.643 15.998 ( -5.574 5.889 -10.767) 13.478 16.028 ( 2.987 1.057 -5.810) 6.618 18.797 ( 16.055 1.227 23.318) 28.337 19.492 ( 1.113 -7.654 0.780) 7.773 21.429 ( -0.460 -1.449 1.088) 1.869 21.620 ( -1.978 -1.589 -2.324) 3.441 ======================= Grid point 14 (10/160) ======================= q-point: ( 0.30 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 11.360 5.041 9.994) 15.948 1.471 ( 16.449 8.350 6.146) 19.444 1.859 ( 4.299 2.029 -8.016) 9.319 1.937 ( 8.173 9.653 -1.399) 12.726 2.140 ( -1.255 -5.892 2.838) 6.659 2.246 ( -2.765 -2.261 0.226) 3.579 2.356 ( 5.103 -3.643 1.557) 6.461 2.391 ( -2.833 -4.115 0.248) 5.002 2.458 ( -7.173 -1.096 -0.883) 7.310 2.580 ( -2.392 -0.727 2.667) 3.656 2.730 ( -5.170 -0.792 2.268) 5.701 2.818 ( -8.056 3.545 2.235) 9.081 3.067 ( 5.267 4.682 -1.754) 7.262 3.169 ( 5.809 5.129 -1.463) 7.886 3.359 ( 4.818 6.051 4.408) 8.903 3.523 ( -2.747 -0.525 5.491) 6.162 3.568 ( -0.441 0.372 10.592) 10.607 3.660 ( -3.781 5.165 1.800) 6.649 3.781 ( 1.070 8.880 -4.491) 10.008 3.888 ( 0.676 3.330 -10.249) 10.798 3.999 ( 7.266 0.102 -5.097) 8.876 4.015 ( 7.836 5.598 5.381) 11.032 5.700 ( -4.652 1.420 -1.741) 5.167 5.834 ( -9.823 0.992 -2.221) 10.120 6.141 ( -5.161 5.543 -4.167) 8.644 6.169 ( -4.350 4.418 -1.202) 6.316 6.553 ( 3.349 -1.852 -0.207) 3.833 6.773 ( -2.957 -6.839 2.395) 7.827 6.987 ( 0.869 -2.333 6.617) 7.069 7.084 ( -0.842 -2.871 2.943) 4.197 7.103 ( -1.907 2.781 3.977) 5.214 7.342 ( 0.401 -0.977 4.831) 4.945 7.439 ( 1.842 4.976 -2.720) 5.962 7.716 ( 4.644 -0.407 3.956) 6.113 7.798 ( 2.989 4.828 -8.934) 10.586 7.879 ( 6.873 1.015 -8.681) 11.119 8.053 ( 1.275 -2.391 -0.085) 2.711 8.184 ( -2.011 3.600 -3.269) 5.262 8.465 ( -6.335 -1.480 0.621) 6.535 8.607 ( -1.428 -3.078 1.530) 3.722 8.705 ( 0.483 1.877 1.364) 2.370 8.900 ( -9.435 -2.555 -4.376) 10.710 9.373 ( -6.410 -4.224 -0.948) 7.735 9.396 ( -2.681 -2.578 5.128) 6.335 10.367 ( 5.606 7.591 1.238) 9.517 10.627 ( 2.581 4.029 -8.254) 9.541 11.023 ( 9.983 -8.486 2.069) 13.264 11.092 ( 16.997 -9.307 5.067) 20.030 13.310 ( 4.102 1.944 3.448) 5.700 13.375 ( -0.768 -1.870 11.021) 11.205 13.563 ( 7.975 17.753 -3.723) 19.815 14.260 ( -16.515 2.284 -18.346) 24.789 15.638 ( -0.347 6.552 -1.987) 6.855 15.688 ( -1.682 2.711 -3.270) 4.569 15.850 ( -2.203 0.259 -5.423) 5.859 15.992 ( -2.328 8.678 -2.448) 9.313 19.255 ( 10.785 -7.626 17.224) 21.706 19.519 ( 1.577 -9.791 0.149) 9.918 21.435 ( -0.339 -1.538 1.052) 1.894 21.555 ( -2.283 -1.369 -2.579) 3.707 ======================= Grid point 15 (11/160) ======================= q-point: ( 0.40 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 6.179 4.309 4.629) 8.842 1.755 ( 10.335 4.687 3.552) 11.891 1.886 ( 4.820 2.090 -1.473) 5.456 2.016 ( 4.209 7.768 -2.334) 9.139 2.108 ( -5.333 -4.612 -0.221) 7.054 2.183 ( -5.419 -0.296 -1.561) 5.647 2.253 ( -7.022 -1.417 -1.774) 7.380 2.368 ( 0.458 -4.079 -0.509) 4.136 2.428 ( -0.830 -1.080 5.113) 5.291 2.542 ( -4.035 -1.938 -0.435) 4.497 2.658 ( -5.128 -0.276 0.285) 5.144 2.702 ( -5.263 3.208 0.092) 6.164 3.145 ( 5.875 1.523 -1.554) 6.265 3.266 ( 5.352 2.600 -1.507) 6.137 3.404 ( -4.153 5.259 -4.855) 8.275 3.470 ( 0.861 10.641 3.154) 11.132 3.670 ( 0.056 -0.998 4.884) 4.985 3.718 ( 3.042 1.813 3.779) 5.180 3.833 ( 3.328 5.901 -3.394) 7.577 3.893 ( 5.136 1.528 8.339) 9.912 4.057 ( 5.726 -1.481 -3.150) 6.701 4.207 ( 6.874 6.611 2.514) 9.863 5.620 ( -4.706 0.084 0.386) 4.722 5.674 ( -4.355 1.434 -3.271) 5.632 5.980 ( -6.297 4.782 -4.172) 8.940 6.089 ( -1.846 8.671 -2.602) 9.239 6.576 ( -3.555 -8.162 3.190) 9.457 6.760 ( 1.245 -5.830 -0.313) 5.969 7.071 ( 1.982 -1.104 -1.999) 3.024 7.086 ( -4.048 3.036 4.366) 6.683 7.122 ( 0.405 -3.606 7.089) 7.963 7.420 ( 0.529 -6.495 -1.735) 6.743 7.462 ( 2.292 4.956 7.045) 8.913 7.727 ( 1.987 3.104 -9.519) 10.208 7.810 ( 1.200 3.913 2.315) 4.702 7.854 ( 1.412 6.007 -6.109) 8.684 8.117 ( 5.467 0.129 -0.257) 5.474 8.195 ( 5.779 1.184 1.902) 6.198 8.398 ( -3.205 0.500 1.419) 3.540 8.552 ( -8.024 -3.271 0.201) 8.667 8.676 ( -6.331 -1.394 -2.879) 7.094 8.767 ( 2.655 -0.130 -2.846) 3.894 9.264 ( -3.671 -3.595 -1.609) 5.384 9.394 ( -4.941 -2.899 4.623) 7.361 10.452 ( 3.266 4.624 0.914) 5.735 10.561 ( 1.772 3.931 -7.022) 8.241 11.216 ( 7.485 -10.507 3.223) 13.297 11.348 ( 8.568 -8.905 2.830) 12.677 13.408 ( 3.123 3.883 5.112) 7.138 13.504 ( -0.601 -2.204 11.599) 11.822 13.628 ( 5.777 18.193 -5.133) 19.766 13.853 ( -9.007 9.706 -15.915) 20.703 15.613 ( -0.020 7.940 -1.998) 8.188 15.668 ( 1.402 4.434 0.276) 4.658 15.769 ( -1.594 0.639 -3.090) 3.535 15.902 ( -4.915 9.384 -2.202) 10.820 19.522 ( 3.884 -12.958 3.653) 14.012 19.558 ( 2.353 -11.423 5.481) 12.887 21.441 ( -0.120 -1.562 0.609) 1.680 21.496 ( -1.616 -1.137 -1.731) 2.627 ======================= Grid point 16 (12/160) ======================= q-point: (-0.50 0.12 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 0.000 3.651 0.000) 3.651 1.870 ( 0.000 4.560 0.000) 4.560 1.938 ( 0.000 3.658 0.000) 3.658 2.004 ( -0.000 -2.498 -0.000) 2.498 2.032 ( -0.000 6.376 0.000) 6.376 2.109 ( 0.000 0.991 -0.000) 0.991 2.216 ( 0.000 -3.611 -0.000) 3.611 2.381 ( 0.000 -0.252 0.000) 0.252 2.467 ( 0.000 -3.701 0.000) 3.701 2.477 ( 0.000 -2.798 -0.000) 2.798 2.610 ( 0.000 2.065 -0.000) 2.065 2.663 ( 0.000 1.466 0.000) 1.466 3.192 ( 0.000 0.064 0.000) 0.064 3.283 ( -0.000 3.219 -0.000) 3.219 3.338 ( 0.000 4.764 0.000) 4.764 3.515 ( 0.000 12.905 0.000) 12.905 3.706 ( 0.000 -2.041 0.000) 2.041 3.743 ( 0.000 4.874 0.000) 4.874 3.846 ( 0.000 5.644 0.000) 5.644 4.016 ( 0.000 -3.538 0.000) 3.538 4.089 ( -0.000 -2.701 0.000) 2.701 4.276 ( 0.000 7.036 -0.000) 7.036 5.569 ( 0.000 -2.035 0.000) 2.035 5.631 ( 0.000 2.935 0.000) 2.935 5.897 ( 0.000 5.967 0.000) 5.967 6.057 ( 0.000 8.727 -0.000) 8.727 6.556 ( 0.000 -12.127 0.000) 12.127 6.775 ( 0.000 -2.164 0.000) 2.164 7.067 ( -0.000 6.442 0.000) 6.442 7.073 ( 0.000 -3.403 -0.000) 3.403 7.190 ( 0.000 -4.869 0.000) 4.869 7.402 ( 0.000 -8.285 0.000) 8.285 7.546 ( -0.000 2.797 -0.000) 2.797 7.671 ( 0.000 2.562 0.000) 2.562 7.819 ( 0.000 8.951 -0.000) 8.951 7.826 ( -0.000 6.689 0.000) 6.689 8.209 ( 0.000 0.662 0.000) 0.662 8.284 ( 0.000 2.891 0.000) 2.891 8.410 ( -0.000 -3.447 -0.000) 3.447 8.413 ( 0.000 -2.826 0.000) 2.826 8.576 ( -0.000 -0.644 0.000) 0.644 8.789 ( 0.000 -0.269 -0.000) 0.269 9.226 ( 0.000 -3.111 0.000) 3.111 9.373 ( 0.000 -3.073 0.000) 3.073 10.488 ( 0.000 3.759 -0.000) 3.759 10.533 ( 0.000 3.442 0.000) 3.442 11.300 ( 0.000 -11.415 0.000) 11.415 11.434 ( 0.000 -8.798 0.000) 8.798 13.544 ( 0.000 7.752 0.000) 7.752 13.562 ( -0.000 8.212 -0.000) 8.212 13.603 ( 0.000 1.119 -0.000) 1.119 13.658 ( 0.000 14.619 -0.000) 14.619 15.603 ( 0.000 10.948 0.000) 10.948 15.686 ( -0.000 2.140 -0.000) 2.140 15.755 ( 0.000 8.024 0.000) 8.024 15.821 ( -0.000 4.299 0.000) 4.299 19.546 ( 0.000 -12.814 0.000) 12.814 19.638 ( 0.000 -14.015 0.000) 14.015 21.444 ( 0.000 -1.528 0.000) 1.528 21.471 ( 0.000 -1.065 -0.000) 1.065 ======================= Grid point 22 (13/160) ======================= q-point: ( 0.00 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( 0.000 22.261 0.000) 22.261 1.051 ( 0.000 24.248 0.000) 24.248 1.535 ( 0.000 16.178 0.000) 16.178 2.012 ( 0.000 28.169 0.000) 28.169 2.023 ( 0.000 0.029 0.000) 0.029 2.066 ( 0.000 0.383 0.000) 0.383 2.442 ( 0.000 -5.099 0.000) 5.099 2.501 ( 0.000 -3.601 0.000) 3.601 2.561 ( 0.000 -2.821 0.000) 2.821 2.720 ( 0.000 -7.084 0.000) 7.084 2.813 ( 0.000 3.911 0.000) 3.911 2.817 ( 0.000 2.097 0.000) 2.097 3.085 ( 0.000 2.383 0.000) 2.383 3.306 ( 0.000 -4.821 0.000) 4.821 3.381 ( 0.000 12.107 0.000) 12.107 3.461 ( 0.000 13.807 0.000) 13.807 3.657 ( 0.000 2.829 0.000) 2.829 3.711 ( 0.000 11.526 0.000) 11.526 3.722 ( 0.000 -7.934 0.000) 7.934 3.857 ( 0.000 9.046 0.000) 9.046 4.065 ( 0.000 5.043 0.000) 5.043 4.508 ( 0.000 -12.563 0.000) 12.563 5.876 ( 0.000 -3.344 0.000) 3.344 5.946 ( 0.000 0.576 0.000) 0.576 6.421 ( 0.000 13.940 0.000) 13.940 6.443 ( 0.000 -1.446 0.000) 1.446 6.531 ( 0.000 3.825 0.000) 3.825 6.706 ( 0.000 9.004 0.000) 9.004 6.969 ( 0.000 -3.732 0.000) 3.732 7.016 ( 0.000 -1.838 0.000) 1.838 7.173 ( 0.000 1.304 0.000) 1.304 7.285 ( 0.000 -3.411 0.000) 3.411 7.288 ( 0.000 1.674 0.000) 1.674 7.488 ( 0.000 7.747 0.000) 7.747 7.876 ( 0.000 -2.931 0.000) 2.931 8.049 ( 0.000 -4.739 0.000) 4.739 8.068 ( 0.000 -10.354 0.000) 10.354 8.189 ( 0.000 -9.866 0.000) 9.866 8.600 ( 0.000 0.413 0.000) 0.413 8.851 ( 0.000 0.873 0.000) 0.873 9.069 ( 0.000 -7.884 0.000) 7.884 9.153 ( 0.000 8.155 0.000) 8.155 9.314 ( 0.000 -5.122 0.000) 5.122 9.712 ( 0.000 13.219 0.000) 13.219 9.794 ( 0.000 2.149 0.000) 2.149 9.922 ( 0.000 -0.268 0.000) 0.268 10.425 ( 0.000 6.042 0.000) 6.042 10.971 ( 0.000 -6.804 0.000) 6.804 13.216 ( 0.000 6.046 0.000) 6.046 13.371 ( 0.000 9.929 0.000) 9.929 13.432 ( 0.000 6.735 0.000) 6.735 14.760 ( 0.000 -29.702 0.000) 29.702 15.758 ( 0.000 2.574 0.000) 2.574 15.817 ( 0.000 -4.377 0.000) 4.377 15.825 ( 0.000 -4.417 0.000) 4.417 16.461 ( 0.000 -11.125 0.000) 11.125 18.510 ( 0.000 29.852 0.000) 29.852 19.467 ( 0.000 1.407 0.000) 1.407 21.396 ( 0.000 -1.170 0.000) 1.170 21.629 ( 0.000 -3.664 0.000) 3.664 ======================= Grid point 23 (14/160) ======================= q-point: ( 0.10 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( 5.793 21.124 3.234) 22.141 1.111 ( 9.905 18.208 2.369) 20.862 1.676 ( 11.461 9.677 3.528) 15.409 1.987 ( 1.098 4.234 -3.839) 5.820 2.058 ( 3.525 10.618 1.559) 11.296 2.148 ( 2.359 10.855 7.015) 13.138 2.332 ( -3.989 -4.767 -11.485) 13.060 2.453 ( -4.212 -4.359 -0.440) 6.078 2.557 ( -0.761 -1.989 0.555) 2.201 2.649 ( -6.322 -3.570 -1.719) 7.461 2.781 ( -1.082 1.175 -0.367) 1.639 2.821 ( -0.245 0.588 -0.519) 0.821 3.128 ( -1.145 4.375 7.628) 8.868 3.355 ( -3.446 -1.348 11.122) 11.721 3.431 ( 0.937 7.331 -1.935) 7.640 3.464 ( 0.645 10.944 2.838) 11.325 3.498 ( -8.751 6.895 0.114) 11.142 3.632 ( -0.416 7.719 5.086) 9.253 3.863 ( 9.295 5.036 0.134) 10.572 3.990 ( 4.354 5.559 -3.206) 7.755 4.049 ( 2.852 1.290 -4.487) 5.471 4.404 ( -5.795 -8.899 -8.750) 13.760 5.860 ( -1.890 -1.981 0.473) 2.779 5.963 ( 3.320 -2.625 -0.033) 4.232 6.293 ( -8.408 5.153 -4.310) 10.762 6.473 ( -0.714 9.405 0.450) 9.443 6.627 ( 1.504 1.756 1.310) 2.657 6.669 ( 1.677 8.326 5.893) 10.337 6.906 ( -6.112 -3.267 -1.010) 7.004 7.023 ( -2.108 -1.749 2.078) 3.438 7.163 ( -3.913 -3.687 0.221) 5.381 7.315 ( 5.058 -0.255 1.774) 5.366 7.364 ( 5.649 2.238 -0.113) 6.078 7.497 ( 3.190 5.520 -0.622) 6.406 7.837 ( 0.678 -2.522 -5.866) 6.421 7.973 ( -1.854 -6.445 -5.814) 8.876 8.141 ( 2.612 -7.699 1.672) 8.300 8.228 ( 3.294 -6.889 1.941) 7.879 8.522 ( -7.628 6.648 -6.903) 12.249 8.680 ( -9.392 0.206 5.456) 10.864 8.963 ( -9.033 3.994 -6.248) 11.687 9.155 ( -1.862 -1.958 6.856) 7.369 9.399 ( 1.379 -9.729 0.113) 9.827 9.473 ( -12.213 6.045 -7.434) 15.523 10.032 ( 23.346 -2.143 2.769) 23.607 10.170 ( 13.135 4.291 7.817) 15.876 10.494 ( 5.449 5.953 2.375) 8.413 10.938 ( -1.860 -5.798 -2.973) 6.776 13.172 ( -3.220 3.113 1.527) 4.732 13.362 ( 0.650 8.072 -0.546) 8.117 13.591 ( 16.153 12.062 -2.646) 20.333 14.687 ( -5.158 -23.232 -4.019) 24.135 15.751 ( 1.732 1.899 -4.179) 4.906 15.839 ( 2.146 -1.198 1.114) 2.698 15.902 ( 9.255 -5.797 -3.008) 11.328 16.326 ( -5.348 -5.864 -12.759) 15.026 18.624 ( 1.359 21.201 15.684) 26.407 19.422 ( -8.492 -0.628 5.405) 10.086 21.396 ( -0.320 -1.200 0.470) 1.328 21.614 ( -0.921 -3.494 -1.226) 3.816 ======================= Grid point 24 (15/160) ======================= q-point: ( 0.20 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 9.161 14.053 7.558) 18.400 1.378 ( 14.780 12.845 5.605) 20.368 1.887 ( 10.953 1.387 -1.588) 11.154 1.960 ( 2.261 2.191 -7.364) 8.009 2.145 ( 0.799 -0.899 0.767) 1.426 2.155 ( 1.525 -2.333 -1.573) 3.201 2.249 ( 0.002 7.321 1.177) 7.415 2.378 ( -4.678 -2.569 -1.091) 5.447 2.515 ( -3.231 0.065 0.587) 3.285 2.572 ( -2.265 -0.190 2.643) 3.486 2.757 ( -3.443 -1.063 1.052) 3.753 2.824 ( 0.264 -3.151 1.000) 3.316 3.214 ( -1.078 8.982 9.220) 12.917 3.326 ( -5.920 5.048 -1.550) 7.933 3.389 ( -4.878 4.854 3.916) 7.917 3.459 ( -3.308 0.138 10.563) 11.070 3.556 ( 2.446 9.748 4.870) 11.167 3.808 ( 9.489 7.604 3.254) 12.588 3.928 ( -0.809 10.846 -2.497) 11.160 3.975 ( 4.299 2.810 -1.213) 5.277 4.044 ( 5.255 3.579 -9.488) 11.422 4.171 ( -6.736 -0.616 -9.451) 11.622 5.823 ( -1.908 1.139 -1.719) 2.809 6.024 ( -1.409 -5.687 -5.340) 7.927 6.127 ( -1.634 3.974 2.989) 5.234 6.418 ( -2.884 9.368 -3.006) 10.253 6.604 ( -5.218 1.465 -0.825) 5.482 6.757 ( -4.322 1.392 5.200) 6.904 6.904 ( -3.138 -0.840 7.239) 7.935 6.946 ( -0.015 -2.860 0.543) 2.911 7.119 ( -2.816 -1.645 3.561) 4.829 7.365 ( 0.669 0.680 -4.735) 4.830 7.463 ( 3.900 1.367 3.411) 5.359 7.592 ( 6.621 1.715 1.660) 7.038 7.795 ( 4.750 -2.720 -7.166) 9.017 7.907 ( 1.662 -3.518 -3.955) 5.548 8.165 ( -0.695 1.483 -5.670) 5.902 8.211 ( 0.069 2.504 -2.819) 3.771 8.449 ( 0.489 -5.034 6.126) 7.944 8.648 ( -6.938 2.783 4.088) 8.520 8.740 ( -5.831 2.522 -4.910) 8.029 9.111 ( -12.694 0.514 -1.042) 12.747 9.293 ( -0.061 -2.061 0.823) 2.220 9.360 ( -5.570 -8.648 -0.217) 10.289 10.420 ( 9.449 4.551 4.869) 11.563 10.485 ( 22.510 -6.841 4.146) 23.889 10.627 ( 9.049 3.043 0.411) 9.556 10.850 ( -2.356 -3.673 -5.648) 7.138 13.184 ( -1.025 -0.263 6.368) 6.456 13.369 ( -0.012 3.783 0.478) 3.813 13.836 ( 19.686 20.362 -6.590) 29.079 14.542 ( -1.632 -6.818 -10.049) 12.252 15.721 ( 2.058 0.737 -6.018) 6.402 15.877 ( -0.582 3.703 0.466) 3.778 15.945 ( 3.090 -3.818 -12.724) 13.639 16.142 ( 1.024 1.529 -3.468) 3.926 18.855 ( 0.046 4.686 20.033) 20.574 19.342 ( -9.585 -6.347 6.875) 13.395 21.397 ( -0.313 -1.281 0.679) 1.483 21.572 ( -1.641 -3.045 -2.193) 4.095 ======================= Grid point 25 (16/160) ======================= q-point: ( 0.30 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( 9.312 8.518 7.998) 14.941 1.669 ( 11.815 9.780 5.622) 16.336 1.904 ( 3.556 2.382 -6.268) 7.590 1.994 ( 6.148 -1.962 -3.441) 7.313 2.157 ( 1.048 -1.456 1.310) 2.221 2.182 ( -5.665 0.527 1.342) 5.845 2.263 ( 5.309 -4.015 -1.572) 6.840 2.314 ( -2.294 -0.922 2.504) 3.519 2.488 ( -2.909 1.429 -1.789) 3.702 2.558 ( -4.647 -0.859 3.191) 5.703 2.693 ( -5.773 -2.788 1.247) 6.531 2.810 ( -4.032 -3.240 0.594) 5.206 3.178 ( -2.719 4.524 -2.126) 5.691 3.279 ( -0.408 7.199 1.175) 7.306 3.484 ( 1.877 1.832 9.945) 10.285 3.520 ( -2.070 0.416 10.040) 10.260 3.655 ( 3.411 9.387 3.777) 10.678 3.778 ( -5.275 4.490 -3.639) 7.825 3.928 ( 1.008 3.487 -6.543) 7.483 3.953 ( -0.834 -0.141 -4.548) 4.626 4.079 ( 8.331 11.827 -4.042) 15.021 4.204 ( 12.001 13.544 5.268) 18.848 5.760 ( -2.695 3.904 -4.006) 6.209 5.831 ( -5.524 -1.242 -7.830) 9.662 6.219 ( -3.474 3.507 4.559) 6.720 6.329 ( -2.597 7.323 -2.337) 8.114 6.486 ( -4.166 -4.318 -0.348) 6.010 6.667 ( -7.186 -1.648 -0.902) 7.427 6.894 ( -0.755 -4.593 6.193) 7.747 7.099 ( 0.313 1.801 7.835) 8.046 7.121 ( -2.531 -1.331 5.252) 5.980 7.284 ( -2.300 -3.804 -4.154) 6.084 7.529 ( 3.573 3.384 -1.020) 5.026 7.719 ( 4.934 0.526 4.015) 6.383 7.850 ( 7.807 -1.151 -4.636) 9.153 7.918 ( 7.710 1.935 -7.562) 10.971 8.069 ( -1.432 5.919 -0.977) 6.167 8.234 ( 0.141 0.414 0.651) 0.785 8.474 ( -4.772 3.138 -1.140) 5.824 8.537 ( -1.555 -3.138 0.948) 3.628 8.730 ( 0.892 -0.586 2.083) 2.341 8.859 ( -12.200 -0.002 -4.093) 12.868 9.248 ( -6.232 -7.839 -1.291) 10.098 9.325 ( -2.704 -4.267 5.160) 7.221 10.536 ( 2.541 7.121 0.990) 7.625 10.726 ( 0.850 4.909 -6.183) 7.940 10.815 ( 8.618 -10.277 0.420) 13.419 10.869 ( 17.248 -10.541 3.011) 20.437 13.274 ( 0.344 -2.594 9.388) 9.746 13.380 ( -1.307 0.008 4.330) 4.523 14.055 ( 17.650 27.326 -9.087) 33.776 14.395 ( 2.343 10.968 -18.027) 21.231 15.685 ( 1.578 0.152 -5.222) 5.457 15.773 ( 0.042 2.902 -5.890) 6.566 15.913 ( -0.712 5.753 0.123) 5.798 16.173 ( 1.593 6.669 -0.997) 6.929 19.057 ( -1.417 -10.443 16.169) 19.300 19.274 ( -7.616 -12.990 5.758) 16.122 21.401 ( -0.101 -1.438 0.523) 1.533 21.515 ( -1.844 -2.450 -2.456) 3.928 ======================= Grid point 26 (17/160) ======================= q-point: ( 0.40 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( 5.167 6.925 5.312) 10.143 1.862 ( 6.681 5.382 1.830) 8.772 1.952 ( 5.227 4.426 0.638) 6.879 2.028 ( 2.219 -1.444 -2.189) 3.435 2.139 ( -0.995 0.628 1.180) 1.666 2.175 ( -0.060 1.081 0.023) 1.083 2.245 ( -7.729 -0.861 -3.327) 8.458 2.313 ( 2.022 -0.827 1.064) 2.430 2.424 ( -0.640 1.486 1.076) 1.943 2.489 ( -6.367 -2.593 0.646) 6.905 2.618 ( -4.504 -3.194 1.242) 5.660 2.734 ( -4.370 -0.755 -0.076) 4.435 3.189 ( 4.517 2.053 -1.299) 5.129 3.317 ( 5.028 2.401 -2.052) 5.938 3.461 ( -6.030 1.106 1.079) 6.225 3.618 ( -2.890 0.165 1.277) 3.164 3.756 ( 4.621 8.473 3.679) 10.328 3.764 ( 5.260 2.606 2.408) 6.344 3.900 ( -1.521 -3.193 0.013) 3.536 3.903 ( -1.207 1.886 2.138) 3.096 4.170 ( 5.378 14.260 -1.608) 15.325 4.431 ( 8.927 15.377 1.390) 17.835 5.609 ( -5.769 -0.838 -4.522) 7.378 5.752 ( 1.402 5.696 -4.271) 7.256 6.107 ( -7.900 7.034 0.374) 10.585 6.258 ( -3.253 3.414 -2.794) 5.481 6.438 ( -5.738 -0.749 3.589) 6.809 6.665 ( 5.099 -3.731 1.096) 6.413 6.948 ( -1.320 -6.950 4.986) 8.654 7.071 ( -2.573 -3.119 0.218) 4.049 7.159 ( -2.500 0.930 0.769) 2.776 7.231 ( -1.991 -8.306 1.298) 8.639 7.601 ( 4.002 6.406 2.527) 7.965 7.806 ( 2.796 3.777 -5.823) 7.483 7.892 ( 5.408 3.370 1.152) 6.476 7.967 ( 4.226 4.761 -4.078) 7.560 8.126 ( 4.350 1.050 2.970) 5.371 8.227 ( 1.172 1.527 1.459) 2.416 8.432 ( -0.588 3.660 0.613) 3.757 8.472 ( -8.812 -4.136 -0.947) 9.780 8.643 ( -5.207 -2.211 -5.058) 7.589 8.776 ( 0.978 1.573 0.897) 2.057 9.156 ( -2.915 -6.790 -0.871) 7.441 9.309 ( -5.158 -5.372 3.831) 8.375 10.568 ( 1.415 5.865 0.253) 6.039 10.659 ( 0.451 4.947 -5.482) 7.398 10.959 ( 6.133 -12.763 0.967) 14.193 11.112 ( 8.797 -12.931 1.790) 15.742 13.390 ( 0.770 -4.245 7.876) 8.980 13.447 ( 0.075 -0.903 8.936) 8.982 14.155 ( 3.382 21.970 -15.508) 27.104 14.214 ( 6.692 28.851 -12.185) 32.025 15.673 ( 2.311 1.004 -1.855) 3.128 15.810 ( 6.104 6.432 0.533) 8.883 15.891 ( -1.302 10.875 0.323) 10.957 16.133 ( -4.739 11.224 -1.645) 12.294 19.172 ( -0.928 -19.965 6.388) 20.982 19.234 ( -4.753 -19.023 5.559) 20.381 21.405 ( 0.075 -1.642 0.224) 1.659 21.464 ( -1.300 -1.918 -1.666) 2.854 ======================= Grid point 27 (18/160) ======================= q-point: (-0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( 0.000 6.873 0.000) 6.873 1.968 ( -0.000 0.100 0.000) 0.100 1.976 ( 0.000 6.082 0.000) 6.082 2.035 ( 0.000 5.325 -0.000) 5.325 2.120 ( -0.000 -0.207 0.000) 0.207 2.148 ( 0.000 3.801 -0.000) 3.801 2.176 ( 0.000 -0.860 0.000) 0.860 2.372 ( -0.000 -0.759 -0.000) 0.759 2.393 ( 0.000 -2.954 0.000) 2.954 2.440 ( 0.000 -0.346 0.000) 0.346 2.587 ( 0.000 -3.183 0.000) 3.183 2.692 ( 0.000 0.224 0.000) 0.224 3.230 ( 0.000 2.826 0.000) 2.826 3.353 ( -0.000 2.105 0.000) 2.105 3.405 ( 0.000 1.492 -0.000) 1.492 3.595 ( 0.000 -4.350 -0.000) 4.350 3.820 ( -0.000 3.555 -0.000) 3.555 3.821 ( 0.000 10.084 0.000) 10.084 3.891 ( 0.000 -3.796 -0.000) 3.796 3.932 ( 0.000 -4.027 0.000) 4.027 4.201 ( 0.000 15.031 0.000) 15.031 4.509 ( 0.000 15.800 0.000) 15.800 5.531 ( 0.000 -1.012 0.000) 1.012 5.740 ( 0.000 7.458 0.000) 7.458 6.040 ( 0.000 7.064 0.000) 7.064 6.208 ( 0.000 1.070 0.000) 1.070 6.410 ( 0.000 2.422 -0.000) 2.422 6.727 ( 0.000 -2.290 0.000) 2.290 6.958 ( -0.000 -7.540 0.000) 7.540 7.088 ( 0.000 -8.573 0.000) 8.573 7.098 ( -0.000 -2.731 -0.000) 2.731 7.225 ( 0.000 -3.804 -0.000) 3.804 7.672 ( 0.000 7.802 -0.000) 7.802 7.761 ( 0.000 5.193 0.000) 5.193 7.964 ( 0.000 6.297 -0.000) 6.297 7.974 ( -0.000 5.907 0.000) 5.907 8.231 ( -0.000 1.582 0.000) 1.582 8.274 ( 0.000 -5.125 0.000) 5.125 8.332 ( 0.000 -4.794 0.000) 4.794 8.417 ( -0.000 5.212 0.000) 5.212 8.568 ( -0.000 0.290 0.000) 0.290 8.791 ( 0.000 0.750 -0.000) 0.750 9.131 ( 0.000 -6.004 0.000) 6.004 9.281 ( 0.000 -5.957 0.000) 5.957 10.591 ( -0.000 5.753 -0.000) 5.753 10.622 ( 0.000 4.687 0.000) 4.687 11.016 ( 0.000 -14.463 0.000) 14.463 11.194 ( 0.000 -13.568 0.000) 13.568 13.447 ( 0.000 -5.191 0.000) 5.191 13.531 ( 0.000 -2.787 0.000) 2.787 14.013 ( 0.000 23.483 0.000) 23.483 14.237 ( 0.000 32.234 0.000) 32.234 15.691 ( 0.000 0.407 -0.000) 0.407 15.840 ( -0.000 12.003 0.000) 12.003 15.992 ( 0.000 13.311 0.000) 13.311 15.995 ( -0.000 10.731 -0.000) 10.731 19.187 ( 0.000 -21.111 0.000) 21.111 19.241 ( 0.000 -23.584 0.000) 23.584 21.408 ( 0.000 -1.745 0.000) 1.745 21.442 ( 0.000 -1.695 -0.000) 1.695 ======================= Grid point 33 (19/160) ======================= q-point: ( 0.00 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 0.000 18.712 0.000) 18.712 1.509 ( 0.000 19.648 0.000) 19.648 1.759 ( 0.000 7.005 0.000) 7.005 1.968 ( 0.000 -5.832 0.000) 5.832 2.144 ( 0.000 6.240 0.000) 6.240 2.342 ( 0.000 -1.077 0.000) 1.077 2.374 ( 0.000 -0.810 0.000) 0.810 2.470 ( 0.000 0.771 0.000) 0.771 2.472 ( 0.000 -4.797 0.000) 4.797 2.574 ( 0.000 -5.560 0.000) 5.560 2.857 ( 0.000 1.224 0.000) 1.224 2.863 ( 0.000 1.507 0.000) 1.507 3.103 ( 0.000 0.091 0.000) 0.091 3.197 ( 0.000 -4.761 0.000) 4.761 3.610 ( 0.000 2.750 0.000) 2.750 3.641 ( 0.000 12.460 0.000) 12.460 3.756 ( 0.000 10.952 0.000) 10.952 3.775 ( 0.000 5.019 0.000) 5.019 3.874 ( 0.000 4.830 0.000) 4.830 4.043 ( 0.000 8.137 0.000) 8.137 4.149 ( 0.000 0.182 0.000) 0.182 4.273 ( 0.000 -8.705 0.000) 8.705 5.829 ( 0.000 -1.303 0.000) 1.303 5.898 ( 0.000 -4.153 0.000) 4.153 6.508 ( 0.000 6.797 0.000) 6.797 6.591 ( 0.000 2.494 0.000) 2.494 6.675 ( 0.000 9.722 0.000) 9.722 6.871 ( 0.000 3.965 0.000) 3.965 6.878 ( 0.000 -4.760 0.000) 4.760 6.948 ( 0.000 -4.459 0.000) 4.459 7.191 ( 0.000 4.342 0.000) 4.342 7.300 ( 0.000 4.195 0.000) 4.195 7.314 ( 0.000 0.727 0.000) 0.727 7.623 ( 0.000 4.889 0.000) 4.889 7.798 ( 0.000 -4.542 0.000) 4.542 7.840 ( 0.000 -13.560 0.000) 13.560 7.956 ( 0.000 -3.393 0.000) 3.393 7.995 ( 0.000 -6.894 0.000) 6.894 8.636 ( 0.000 3.466 0.000) 3.466 8.898 ( 0.000 -8.317 0.000) 8.317 8.905 ( 0.000 4.468 0.000) 4.468 9.183 ( 0.000 -7.395 0.000) 7.395 9.333 ( 0.000 9.353 0.000) 9.353 9.706 ( 0.000 -7.658 0.000) 7.658 9.941 ( 0.000 8.517 0.000) 8.517 10.009 ( 0.000 4.728 0.000) 4.728 10.558 ( 0.000 6.732 0.000) 6.732 10.829 ( 0.000 -6.799 0.000) 6.799 13.383 ( 0.000 10.561 0.000) 10.561 13.564 ( 0.000 5.183 0.000) 5.183 13.572 ( 0.000 8.782 0.000) 8.782 14.191 ( 0.000 -25.076 0.000) 25.076 15.734 ( 0.000 -3.327 0.000) 3.327 15.738 ( 0.000 -3.572 0.000) 3.572 15.841 ( 0.000 5.669 0.000) 5.669 16.219 ( 0.000 -11.921 0.000) 11.921 19.040 ( 0.000 20.997 0.000) 20.997 19.468 ( 0.000 -1.927 0.000) 1.927 21.391 ( 0.000 0.998 0.000) 0.998 21.538 ( 0.000 -4.924 0.000) 4.924 ======================= Grid point 34 (20/160) ======================= q-point: ( 0.10 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.462 ( 4.069 15.953 0.201) 16.465 1.502 ( 3.181 17.633 -1.574) 17.987 1.816 ( 4.205 3.694 1.171) 5.718 1.980 ( 1.854 -5.111 -0.367) 5.449 2.128 ( -1.704 4.716 -0.517) 5.041 2.247 ( -3.114 -2.345 -11.239) 11.896 2.365 ( -2.734 -3.107 1.351) 4.353 2.403 ( -0.141 2.130 -2.606) 3.369 2.496 ( -0.163 -3.574 -0.410) 3.601 2.554 ( -3.573 -4.491 3.560) 6.753 2.824 ( -2.567 1.497 -2.097) 3.637 2.845 ( -1.544 1.829 -1.587) 2.872 3.171 ( 0.737 1.248 9.612) 9.721 3.264 ( -1.238 -4.400 11.531) 12.404 3.561 ( -4.693 7.671 0.200) 8.995 3.686 ( 0.968 9.006 0.395) 9.067 3.692 ( -3.475 10.103 2.482) 10.969 3.849 ( 5.483 9.245 0.961) 10.791 3.923 ( 4.053 0.682 1.569) 4.399 4.064 ( 4.235 1.824 -4.937) 6.755 4.142 ( 0.508 3.433 -1.377) 3.734 4.250 ( -0.344 -3.857 -2.929) 4.856 5.827 ( -0.105 -1.326 0.251) 1.353 5.883 ( 0.755 -4.286 -1.637) 4.650 6.413 ( -6.783 7.213 -4.284) 10.789 6.630 ( -0.528 1.769 2.680) 3.254 6.687 ( -3.155 5.722 1.461) 6.696 6.800 ( -6.542 -1.142 -0.149) 6.643 6.845 ( 1.915 1.489 0.423) 2.463 6.985 ( 0.698 -2.601 2.424) 3.624 7.133 ( -7.552 3.333 0.830) 8.296 7.334 ( 2.718 -0.428 -0.902) 2.895 7.371 ( 5.772 2.331 2.134) 6.580 7.627 ( 1.821 5.529 -2.813) 6.465 7.787 ( 0.035 -2.470 -2.003) 3.180 7.802 ( 0.597 -10.659 -4.539) 11.601 7.992 ( 2.969 -4.969 1.959) 6.111 8.074 ( 5.984 -6.919 4.033) 9.998 8.641 ( 0.200 4.754 -2.482) 5.366 8.717 ( -10.158 2.850 -1.320) 10.633 8.959 ( -1.331 -2.225 -0.227) 2.603 9.167 ( -2.433 -6.069 -2.998) 7.193 9.253 ( -7.381 3.763 4.458) 9.408 9.518 ( -15.843 -2.334 -3.306) 16.352 10.053 ( 19.511 4.051 -4.612) 20.453 10.215 ( 13.020 -0.601 2.644) 13.299 10.626 ( 2.975 6.476 5.379) 8.929 10.832 ( -0.700 -4.440 1.298) 4.678 13.265 ( -7.129 6.107 0.127) 9.387 13.477 ( -5.424 1.398 -1.687) 5.849 13.846 ( 24.421 12.119 -2.210) 27.352 14.294 ( 13.408 -14.513 -3.045) 19.992 15.776 ( 3.909 -2.398 -0.125) 4.588 15.797 ( 7.429 -3.968 -1.410) 8.540 15.824 ( 2.079 3.849 -4.347) 6.167 16.150 ( -1.866 -10.101 -8.004) 13.022 19.028 ( -8.945 16.951 10.343) 21.779 19.399 ( -12.606 -2.417 6.407) 14.345 21.390 ( -0.084 0.952 0.041) 0.957 21.528 ( -0.485 -4.609 -0.983) 4.737 ======================= Grid point 35 (21/160) ======================= q-point: ( 0.20 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.551 ( 5.812 11.131 2.438) 12.792 1.627 ( 10.231 11.531 2.352) 15.593 1.893 ( 5.050 -1.462 -0.724) 5.307 2.018 ( 2.199 -4.933 0.517) 5.426 2.033 ( -1.961 2.562 -8.567) 9.154 2.135 ( -0.642 -0.704 -0.431) 1.046 2.320 ( -3.160 0.344 -0.398) 3.203 2.369 ( -1.849 -0.044 -2.020) 2.739 2.485 ( -0.740 -2.297 0.683) 2.508 2.546 ( -1.676 -3.974 1.838) 4.688 2.741 ( -4.443 -0.299 -2.187) 4.961 2.784 ( -2.198 -1.191 -2.264) 3.373 3.320 ( -0.150 2.031 13.350) 13.504 3.376 ( -3.793 -1.755 12.961) 13.618 3.478 ( -7.322 10.817 2.575) 13.314 3.595 ( -6.721 9.035 1.814) 11.406 3.767 ( 3.383 9.193 1.371) 9.891 3.898 ( -1.707 -0.041 -1.752) 2.446 3.964 ( -3.729 -3.797 1.200) 5.455 4.037 ( 3.307 -2.956 -10.573) 11.466 4.206 ( 11.423 12.252 -1.234) 16.796 4.265 ( 7.838 8.602 0.344) 11.642 5.831 ( 1.215 -0.706 -1.539) 2.084 5.891 ( 1.927 -5.885 -4.086) 7.419 6.258 ( -5.356 8.651 -0.723) 10.200 6.563 ( -6.665 3.873 -2.573) 8.127 6.599 ( -7.908 -0.800 -2.918) 8.467 6.715 ( -1.970 -8.084 4.154) 9.300 6.902 ( -9.125 5.283 1.030) 10.594 7.008 ( 4.151 4.527 6.276) 8.781 7.081 ( -3.798 -0.802 7.510) 8.453 7.321 ( -1.993 -4.927 -4.864) 7.204 7.497 ( 5.521 2.479 1.998) 6.373 7.622 ( 5.077 -0.081 -3.122) 5.961 7.752 ( 2.987 -0.774 -5.056) 5.923 7.846 ( 3.905 -2.510 2.149) 5.116 8.081 ( 5.261 -2.882 1.889) 6.289 8.242 ( 10.017 -5.372 0.174) 11.368 8.476 ( -8.194 8.195 -4.286) 12.356 8.689 ( -1.518 0.151 3.165) 3.513 8.818 ( -10.677 4.946 -3.015) 12.147 9.113 ( -8.888 -3.093 2.786) 9.815 9.166 ( -5.152 -5.391 -3.235) 8.129 9.263 ( -7.496 -2.264 -0.504) 7.847 10.355 ( 18.522 -2.810 0.081) 18.734 10.429 ( 11.942 -4.437 -1.171) 12.793 10.728 ( 2.856 5.861 2.854) 7.117 10.831 ( -0.459 0.403 0.017) 0.611 13.208 ( -2.929 2.672 4.104) 5.706 13.376 ( -5.182 -2.942 0.674) 5.997 14.242 ( 30.410 17.469 -8.926) 36.188 14.504 ( 19.811 1.302 -9.784) 22.133 15.755 ( 1.455 3.362 -6.561) 7.515 15.873 ( 3.682 -2.290 -7.822) 8.944 15.896 ( 5.923 -1.659 0.802) 6.203 16.068 ( 5.672 -7.859 -3.497) 10.304 18.980 ( -15.837 6.957 15.956) 23.533 19.229 ( -19.312 -5.081 10.175) 22.412 21.389 ( -0.022 0.711 -0.104) 0.719 21.500 ( -0.929 -3.785 -1.811) 4.297 ======================= Grid point 36 (22/160) ======================= q-point: ( 0.30 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( 6.762 7.471 5.301) 11.386 1.844 ( 9.696 6.940 4.628) 12.791 1.954 ( 2.782 0.221 -1.793) 3.317 1.972 ( 3.616 0.528 -1.292) 3.876 2.070 ( 2.385 -2.212 1.270) 3.492 2.152 ( 2.128 -4.145 0.856) 4.738 2.249 ( -1.633 2.327 -3.051) 4.170 2.336 ( -2.098 1.325 1.368) 2.833 2.474 ( -1.391 -1.807 -0.113) 2.283 2.533 ( -1.463 -3.370 -0.157) 3.677 2.633 ( -5.982 -1.889 -1.727) 6.506 2.729 ( -1.520 -4.170 -2.351) 5.023 3.293 ( -8.535 6.887 0.406) 10.975 3.409 ( -5.499 3.185 5.662) 8.511 3.538 ( -4.887 5.246 4.429) 8.428 3.547 ( 0.520 3.409 14.044) 14.462 3.785 ( -3.598 -0.144 -4.903) 6.083 3.843 ( -0.392 2.469 1.769) 3.062 3.866 ( -5.140 -4.900 1.091) 7.185 3.960 ( 0.134 -0.853 -5.682) 5.747 4.387 ( 12.919 15.348 -3.460) 20.357 4.515 ( 16.177 13.238 2.755) 21.084 5.778 ( -3.830 -1.881 -9.689) 10.587 5.829 ( 3.003 0.557 -4.809) 5.697 6.297 ( 2.566 3.541 8.294) 9.376 6.397 ( -9.218 -1.256 -3.243) 9.852 6.423 ( -10.066 1.895 0.179) 10.244 6.739 ( 0.030 -0.448 -4.704) 4.725 6.775 ( -6.688 -0.362 7.162) 9.806 7.070 ( -6.389 -3.894 3.608) 8.307 7.138 ( -0.958 1.569 7.372) 7.598 7.200 ( -3.943 -3.173 -3.020) 5.893 7.594 ( 6.621 3.362 -0.512) 7.443 7.722 ( 7.154 -0.984 0.479) 7.237 7.812 ( 8.502 -0.705 -1.097) 8.602 7.932 ( 4.981 -1.199 0.167) 5.126 8.194 ( 5.125 2.920 1.078) 5.996 8.287 ( -2.334 8.343 -4.504) 9.765 8.422 ( 2.771 -5.675 2.881) 6.942 8.617 ( -6.506 3.001 -4.169) 8.289 8.668 ( -5.837 -0.435 0.471) 5.872 8.919 ( -9.523 4.011 -0.043) 10.333 9.070 ( -5.250 -8.251 -0.852) 9.817 9.221 ( -3.918 -5.991 3.417) 7.932 10.557 ( 6.926 -3.834 -0.550) 7.936 10.627 ( 10.449 -7.852 1.775) 13.191 10.785 ( 4.257 3.321 -2.298) 5.867 10.822 ( 2.124 2.750 -3.093) 4.652 13.252 ( -0.449 0.509 7.503) 7.534 13.346 ( -2.566 -2.794 5.450) 6.640 14.564 ( 24.005 19.264 -15.901) 34.644 14.653 ( 18.385 12.052 -19.517) 29.397 15.724 ( 3.134 4.960 -4.349) 7.303 15.831 ( 4.598 3.524 -2.547) 6.328 15.994 ( 3.576 1.130 2.034) 4.266 16.203 ( 9.704 -4.381 -1.030) 10.697 18.884 ( -17.747 -5.223 15.230) 23.962 19.025 ( -19.652 -10.572 10.128) 24.506 21.387 ( 0.040 0.186 -0.366) 0.413 21.460 ( -1.093 -2.775 -2.090) 3.641 ======================= Grid point 37 (23/160) ======================= q-point: ( 0.40 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( 4.502 5.772 6.149) 9.560 1.972 ( 3.122 5.506 1.430) 6.489 2.026 ( 3.678 -0.237 1.867) 4.132 2.057 ( 5.898 4.543 1.976) 7.703 2.109 ( 1.523 -0.632 0.140) 1.655 2.195 ( -0.806 -3.399 -1.288) 3.723 2.216 ( 1.288 2.233 -0.433) 2.614 2.322 ( 0.257 1.225 0.052) 1.252 2.434 ( -3.050 -1.447 -1.058) 3.538 2.482 ( -2.973 2.073 -1.617) 3.968 2.529 ( -4.284 -5.030 0.078) 6.608 2.680 ( -1.752 -4.098 -0.960) 4.559 3.236 ( 0.141 3.203 2.326) 3.961 3.366 ( -1.684 1.790 -0.915) 2.622 3.468 ( -7.193 0.173 1.145) 7.286 3.599 ( -5.898 -2.148 -2.767) 6.860 3.762 ( 2.441 -1.206 7.418) 7.902 3.804 ( -1.810 -4.236 2.685) 5.332 3.897 ( 0.582 3.507 0.387) 3.576 3.937 ( 0.195 1.378 1.771) 2.252 4.517 ( 7.436 17.122 -3.652) 19.020 4.755 ( 9.777 12.056 -0.251) 15.524 5.623 ( -1.974 3.743 -6.203) 7.509 5.845 ( 5.615 1.563 -4.256) 7.217 6.226 ( -6.446 -0.708 -1.944) 6.770 6.258 ( -10.212 5.648 2.139) 11.864 6.476 ( 2.806 -0.783 9.689) 10.118 6.670 ( 0.557 5.189 -3.801) 6.456 6.777 ( -4.277 -9.639 5.571) 11.926 6.941 ( -4.666 -8.853 -7.597) 12.565 7.118 ( -4.517 0.829 2.660) 5.307 7.198 ( -1.206 -0.214 3.566) 3.771 7.718 ( 7.431 5.192 1.364) 9.167 7.853 ( 5.091 0.579 3.052) 5.964 7.930 ( 8.159 0.829 -3.060) 8.754 8.027 ( 7.865 0.008 -2.674) 8.307 8.180 ( -5.689 4.262 4.053) 8.182 8.260 ( -2.426 2.654 0.542) 3.636 8.392 ( -6.866 -3.268 -2.321) 7.951 8.548 ( -4.324 -0.800 -3.188) 5.432 8.582 ( 5.733 3.932 -1.943) 7.218 8.842 ( -3.166 3.935 2.095) 5.468 9.000 ( -2.292 -7.420 0.201) 7.769 9.174 ( -5.923 -7.663 2.746) 10.067 10.642 ( 2.923 -0.042 2.133) 3.618 10.718 ( 0.615 -1.163 0.133) 1.322 10.793 ( 2.490 -0.784 -4.985) 5.628 10.881 ( 6.867 -7.615 -2.009) 10.449 13.341 ( 0.410 -0.478 6.600) 6.630 13.409 ( -0.186 -2.470 7.838) 8.220 14.553 ( 5.475 16.749 -19.305) 26.138 14.733 ( 12.815 15.607 -13.756) 24.434 15.764 ( 4.992 10.159 -1.280) 11.392 15.993 ( 11.269 10.613 3.596) 15.892 16.055 ( 2.240 3.969 1.251) 4.726 16.295 ( 2.346 3.069 -1.417) 4.115 18.777 ( -11.358 -16.082 8.721) 21.534 18.843 ( -14.062 -17.266 6.794) 23.281 21.383 ( 0.070 -0.402 -0.368) 0.549 21.423 ( -0.786 -1.946 -1.446) 2.549 ======================= Grid point 38 (24/160) ======================= q-point: (-0.50 0.38 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( 0.000 6.321 0.000) 6.321 2.021 ( 0.000 4.532 0.000) 4.532 2.088 ( -0.000 2.667 -0.000) 2.667 2.110 ( 0.000 -0.340 0.000) 0.340 2.139 ( -0.000 4.491 -0.000) 4.491 2.143 ( 0.000 -2.740 0.000) 2.740 2.221 ( 0.000 4.856 0.000) 4.856 2.359 ( -0.000 -0.680 -0.000) 0.680 2.359 ( 0.000 -0.162 0.000) 0.162 2.451 ( 0.000 1.750 0.000) 1.750 2.497 ( 0.000 -5.476 0.000) 5.476 2.659 ( -0.000 -3.597 0.000) 3.597 3.279 ( 0.000 1.824 0.000) 1.824 3.350 ( -0.000 -1.811 0.000) 1.811 3.409 ( 0.000 -0.579 0.000) 0.579 3.493 ( -0.000 -4.979 -0.000) 4.979 3.814 ( 0.000 -2.354 0.000) 2.354 3.846 ( 0.000 -3.052 0.000) 3.052 3.896 ( 0.000 3.639 -0.000) 3.639 3.959 ( 0.000 2.461 0.000) 2.461 4.551 ( 0.000 16.928 0.000) 16.928 4.824 ( 0.000 10.289 0.000) 10.289 5.579 ( 0.000 7.594 0.000) 7.594 5.883 ( 0.000 3.864 0.000) 3.864 6.151 ( 0.000 3.384 0.000) 3.384 6.180 ( 0.000 0.668 0.000) 0.668 6.549 ( 0.000 5.444 -0.000) 5.444 6.697 ( 0.000 -0.281 0.000) 0.281 6.778 ( -0.000 -9.842 0.000) 9.842 6.810 ( 0.000 -13.137 0.000) 13.137 7.095 ( 0.000 2.364 0.000) 2.364 7.208 ( 0.000 -0.745 -0.000) 0.745 7.827 ( -0.000 6.929 -0.000) 6.929 7.865 ( 0.000 4.860 0.000) 4.860 8.057 ( 0.000 2.246 -0.000) 2.246 8.063 ( -0.000 3.136 0.000) 3.136 8.155 ( -0.000 -5.789 0.000) 5.789 8.200 ( 0.000 -5.588 0.000) 5.588 8.310 ( 0.000 4.283 0.000) 4.283 8.485 ( -0.000 -0.515 -0.000) 0.515 8.636 ( 0.000 7.046 0.000) 7.046 8.829 ( -0.000 2.967 0.000) 2.967 8.990 ( 0.000 -7.210 0.000) 7.210 9.129 ( 0.000 -8.570 0.000) 8.570 10.700 ( 0.000 4.342 0.000) 4.342 10.702 ( 0.000 2.555 0.000) 2.555 10.779 ( 0.000 -7.328 0.000) 7.328 10.930 ( 0.000 -10.988 -0.000) 10.988 13.388 ( 0.000 -0.687 0.000) 0.687 13.467 ( 0.000 -3.286 0.000) 3.286 14.463 ( 0.000 19.087 0.000) 19.087 14.749 ( 0.000 12.932 0.000) 12.932 15.808 ( 0.000 12.744 -0.000) 12.744 16.062 ( -0.000 7.633 0.000) 7.633 16.204 ( 0.000 8.916 0.000) 8.916 16.241 ( -0.000 10.076 0.000) 10.076 18.745 ( 0.000 -19.802 0.000) 19.802 18.748 ( -0.000 -21.674 0.000) 21.674 21.381 ( 0.000 -0.682 0.000) 0.682 21.407 ( 0.000 -1.600 -0.000) 1.600 ======================= Grid point 44 (25/160) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 96 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( 0.000 -11.571 0.000) 11.571 1.749 ( 0.000 11.571 0.000) 11.571 1.806 ( 0.000 -8.388 0.000) 8.388 1.806 ( 0.000 8.388 0.000) 8.388 2.258 ( 0.000 -4.312 0.000) 4.312 2.258 ( 0.000 4.312 0.000) 4.312 2.409 ( 0.000 -2.969 0.000) 2.969 2.409 ( 0.000 2.969 0.000) 2.969 2.456 ( 0.000 -5.501 0.000) 5.501 2.456 ( 0.000 5.501 0.000) 5.501 2.873 ( 0.000 -0.315 0.000) 0.315 2.873 ( 0.000 0.315 0.000) 0.315 3.121 ( 0.000 -2.244 0.000) 2.244 3.121 ( 0.000 2.244 0.000) 2.244 3.770 ( 0.000 -7.174 0.000) 7.174 3.770 ( 0.000 7.174 0.000) 7.174 3.823 ( 0.000 -1.686 0.000) 1.686 3.823 ( 0.000 1.686 0.000) 1.686 3.996 ( 0.000 -9.213 0.000) 9.213 3.996 ( 0.000 9.213 0.000) 9.213 4.187 ( 0.000 -4.913 0.000) 4.913 4.187 ( 0.000 4.913 0.000) 4.913 5.830 ( 0.000 -1.746 0.000) 1.746 5.830 ( 0.000 1.746 0.000) 1.746 6.623 ( 0.000 -1.388 0.000) 1.388 6.623 ( 0.000 1.388 0.000) 1.388 6.810 ( 0.000 -2.486 0.000) 2.486 6.810 ( 0.000 2.486 0.000) 2.486 6.860 ( 0.000 -1.589 0.000) 1.589 6.860 ( 0.000 1.589 0.000) 1.589 7.303 ( 0.000 -2.421 0.000) 2.421 7.303 ( 0.000 2.421 0.000) 2.421 7.507 ( 0.000 -16.030 0.000) 16.030 7.507 ( 0.000 16.030 0.000) 16.030 7.711 ( 0.000 -3.585 0.000) 3.585 7.711 ( 0.000 3.585 0.000) 3.585 7.926 ( 0.000 -0.573 0.000) 0.573 7.926 ( 0.000 0.573 0.000) 0.573 8.742 ( 0.000 -6.642 0.000) 6.642 8.742 ( 0.000 6.642 0.000) 6.642 9.028 ( 0.000 -7.245 0.000) 7.245 9.028 ( 0.000 7.245 0.000) 7.245 9.528 ( 0.000 -9.387 0.000) 9.387 9.528 ( 0.000 9.387 0.000) 9.387 10.046 ( 0.000 -1.550 0.000) 1.550 10.046 ( 0.000 1.550 0.000) 1.550 10.694 ( 0.000 -6.530 0.000) 6.530 10.694 ( 0.000 6.530 0.000) 6.530 13.589 ( 0.000 -4.903 0.000) 4.903 13.589 ( 0.000 4.903 0.000) 4.903 13.767 ( 0.000 -14.565 0.000) 14.565 13.767 ( 0.000 14.565 0.000) 14.565 15.698 ( 0.000 -0.101 0.000) 0.101 15.698 ( 0.000 0.101 0.000) 0.101 15.996 ( 0.000 -9.406 0.000) 9.406 15.996 ( 0.000 9.406 0.000) 9.406 19.355 ( 0.000 -9.914 0.000) 9.914 19.355 ( 0.000 9.914 0.000) 9.914 21.443 ( 0.000 -3.947 0.000) 3.947 21.443 ( 0.000 3.947 0.000) 3.947 ======================= Grid point 46 (26/160) ======================= q-point: ( 0.10 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( 1.414 -5.444 -4.503) 7.205 1.729 ( 1.414 5.444 -4.503) 7.205 1.825 ( 1.366 -5.994 1.811) 6.409 1.825 ( 1.366 5.994 1.811) 6.409 2.210 ( -2.868 -1.936 -4.194) 5.438 2.210 ( -2.868 1.936 -4.194) 5.438 2.368 ( -1.038 -2.908 -1.781) 3.565 2.368 ( -1.038 2.908 -1.781) 3.565 2.466 ( -0.481 -2.449 1.129) 2.740 2.466 ( -0.481 2.449 1.129) 2.740 2.848 ( -2.038 -0.946 -2.762) 3.560 2.848 ( -2.038 0.946 -2.762) 3.560 3.198 ( -0.006 -1.937 12.032) 12.187 3.198 ( -0.006 1.937 12.032) 12.187 3.745 ( -2.925 -5.309 0.404) 6.075 3.745 ( -2.925 5.309 0.404) 6.075 3.865 ( 1.980 -4.429 2.636) 5.521 3.865 ( 1.980 4.429 2.636) 5.521 3.976 ( -0.172 -6.629 -3.174) 7.351 3.976 ( -0.172 6.629 -3.174) 7.351 4.223 ( 4.908 -3.134 -0.715) 5.867 4.223 ( 4.908 3.134 -0.715) 5.867 5.821 ( 0.063 -1.302 -0.776) 1.517 5.821 ( 0.063 1.302 -0.776) 1.517 6.575 ( -5.347 -7.379 0.066) 9.113 6.575 ( -5.347 7.379 0.066) 9.113 6.744 ( -5.324 -2.014 -3.433) 6.648 6.744 ( -5.324 2.014 -3.433) 6.648 6.915 ( 2.768 -3.867 4.725) 6.704 6.915 ( 2.768 3.867 4.725) 6.704 7.264 ( -3.547 -5.814 -0.948) 6.876 7.264 ( -3.547 5.814 -0.948) 6.876 7.527 ( 2.214 -11.848 -0.839) 12.082 7.527 ( 2.214 11.848 -0.839) 12.082 7.735 ( 2.708 -2.998 -0.412) 4.061 7.735 ( 2.708 2.998 -0.412) 4.061 7.971 ( 4.991 -2.551 1.482) 5.798 7.971 ( 4.991 2.551 1.482) 5.798 8.723 ( -2.544 -2.883 -0.612) 3.893 8.723 ( -2.544 2.883 -0.612) 3.893 9.000 ( -1.953 -6.744 -1.068) 7.102 9.000 ( -1.953 6.744 -1.068) 7.102 9.405 ( -12.408 -7.617 -0.107) 14.560 9.405 ( -12.408 7.617 -0.107) 14.560 10.154 ( 13.971 -4.745 -4.036) 15.296 10.154 ( 13.971 4.745 -4.036) 15.296 10.743 ( 1.223 -4.793 5.237) 7.204 10.743 ( 1.223 4.793 5.237) 7.204 13.407 ( -10.245 -6.802 -1.254) 12.361 13.407 ( -10.245 6.802 -1.254) 12.361 14.066 ( 26.725 -9.575 -2.349) 28.485 14.066 ( 26.725 9.575 -2.349) 28.485 15.747 ( 5.681 -0.546 0.167) 5.710 15.747 ( 5.681 0.546 0.167) 5.710 15.954 ( -0.295 -8.357 -6.339) 10.493 15.954 ( -0.295 8.357 -6.339) 10.493 19.292 ( -13.092 -8.681 7.720) 17.503 19.292 ( -13.092 8.681 7.720) 17.503 21.439 ( -0.058 -3.698 -0.521) 3.735 21.439 ( -0.058 3.698 -0.521) 3.735 ======================= Grid point 48 (27/160) ======================= q-point: ( 0.20 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( 4.765 -5.617 -1.991) 7.630 1.733 ( 4.765 5.617 -1.991) 7.630 1.889 ( 3.411 -5.827 2.255) 7.119 1.889 ( 3.411 5.827 2.255) 7.119 2.110 ( -2.107 -2.527 -3.908) 5.108 2.110 ( -2.107 2.527 -3.908) 5.108 2.346 ( -0.592 -2.214 -0.732) 2.406 2.346 ( -0.592 2.214 -0.732) 2.406 2.466 ( -0.898 -1.630 0.957) 2.092 2.466 ( -0.897 1.630 0.957) 2.092 2.753 ( -3.937 -1.408 -4.076) 5.839 2.753 ( -3.937 1.408 -4.076) 5.839 3.344 ( -2.161 -1.133 14.301) 14.508 3.344 ( -2.161 1.133 14.301) 14.508 3.694 ( -5.158 -4.493 2.341) 7.230 3.694 ( -5.158 4.493 2.341) 7.230 3.861 ( -7.091 -1.269 0.777) 7.246 3.861 ( -7.091 1.269 0.777) 7.246 3.937 ( 2.073 -6.403 -4.658) 8.185 3.937 ( 2.073 6.403 -4.658) 8.185 4.362 ( 13.673 -1.376 -0.434) 13.749 4.362 ( 13.673 1.376 -0.434) 13.749 5.819 ( 1.377 -0.766 -2.421) 2.888 5.819 ( 1.377 0.766 -2.421) 2.888 6.473 ( -5.903 -11.522 -1.800) 13.070 6.473 ( -5.903 11.522 -1.800) 13.070 6.605 ( -6.098 -1.266 -0.997) 6.307 6.605 ( -6.098 1.266 -0.997) 6.307 7.007 ( -2.710 -3.332 7.044) 8.250 7.007 ( -2.710 3.332 7.044) 8.250 7.180 ( -3.615 -7.931 -1.022) 8.776 7.180 ( -3.615 7.931 -1.022) 8.776 7.570 ( 5.568 -3.996 -1.974) 7.132 7.570 ( 5.568 3.996 -1.974) 7.132 7.780 ( 3.166 -3.184 0.465) 4.515 7.780 ( 3.166 3.184 0.465) 4.515 8.115 ( 9.297 -5.411 2.069) 10.953 8.115 ( 9.297 5.411 2.069) 10.953 8.634 ( -5.484 -5.682 -3.099) 8.483 8.634 ( -5.484 5.682 -3.099) 8.483 8.945 ( -5.840 -7.896 1.326) 9.910 8.945 ( -5.840 7.897 1.326) 9.910 9.201 ( -9.562 -3.574 -1.406) 10.304 9.201 ( -9.562 3.574 -1.406) 10.304 10.351 ( 13.939 -2.221 -2.768) 14.383 10.351 ( 13.939 2.221 -2.768) 14.383 10.816 ( 1.203 -2.402 2.962) 3.999 10.816 ( 1.203 2.402 2.962) 3.999 13.287 ( -5.099 -4.749 2.231) 7.316 13.287 ( -5.099 4.749 2.231) 7.316 14.485 ( 31.934 -5.515 -10.563) 34.085 14.485 ( 31.934 5.515 -10.563) 34.085 15.852 ( 3.550 -1.409 -5.286) 6.521 15.852 ( 3.550 1.409 -5.286) 6.521 15.887 ( 5.909 -7.040 -1.520) 9.316 15.887 ( 5.909 7.040 -1.520) 9.316 19.117 ( -22.462 -6.096 12.710) 26.519 19.117 ( -22.462 6.096 12.710) 26.519 21.428 ( -0.188 -2.967 -1.060) 3.156 21.428 ( -0.188 2.967 -1.060) 3.156 ======================= Grid point 50 (28/160) ======================= q-point: ( 0.30 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.838 ( 6.157 -5.979 3.230) 9.170 1.838 ( 6.157 5.979 3.230) 9.170 1.979 ( 4.348 -2.866 2.447) 5.754 1.979 ( 4.348 2.866 2.447) 5.754 2.081 ( 1.807 -2.520 -0.724) 3.184 2.081 ( 1.807 2.520 -0.724) 3.184 2.322 ( -0.848 -3.534 -1.197) 3.827 2.322 ( -0.848 3.534 -1.197) 3.827 2.456 ( -1.583 -1.320 0.519) 2.126 2.456 ( -1.583 1.320 0.519) 2.126 2.649 ( -2.514 -3.045 -4.178) 5.749 2.649 ( -2.514 3.045 -4.178) 5.749 3.403 ( -7.125 -2.905 6.692) 10.198 3.403 ( -7.125 2.905 6.692) 10.198 3.665 ( -3.798 -1.804 7.677) 8.754 3.665 ( -3.798 1.804 7.677) 8.754 3.707 ( -9.044 -0.743 -2.075) 9.309 3.707 ( -9.044 0.743 -2.075) 9.309 3.926 ( 1.644 -2.591 -2.074) 3.704 3.926 ( 1.644 2.591 -2.074) 3.704 4.615 ( 16.175 -4.575 -1.239) 16.855 4.615 ( 16.175 4.575 -1.239) 16.855 5.790 ( 1.364 -2.970 -5.908) 6.751 5.790 ( 1.364 2.970 -5.908) 6.751 6.351 ( -6.663 -2.294 -0.377) 7.057 6.351 ( -6.663 2.294 -0.377) 7.057 6.557 ( -2.778 -9.170 3.817) 10.314 6.557 ( -2.778 9.170 3.817) 10.314 6.934 ( -7.541 -8.327 -1.586) 11.346 6.934 ( -7.541 8.327 -1.586) 11.346 7.167 ( -2.876 -1.209 4.868) 5.782 7.167 ( -2.876 1.209 4.868) 5.782 7.667 ( 8.882 -3.577 -1.556) 9.700 7.667 ( 8.882 3.577 -1.556) 9.700 7.860 ( 5.125 -4.498 1.801) 7.052 7.860 ( 5.125 4.498 1.801) 7.052 8.288 ( 7.569 -6.211 2.258) 10.048 8.288 ( 7.569 6.211 2.258) 10.048 8.485 ( -6.978 -8.973 -4.486) 12.220 8.485 ( -6.978 8.973 -4.486) 12.220 8.833 ( -7.289 -9.422 -0.012) 11.912 8.833 ( -7.289 9.422 -0.012) 11.912 9.086 ( -5.524 -6.603 1.280) 8.704 9.086 ( -5.524 6.603 1.280) 8.704 10.524 ( 9.433 -1.692 -0.429) 9.593 10.524 ( 9.433 1.692 -0.429) 9.593 10.841 ( 1.390 -1.121 -2.144) 2.790 10.841 ( 1.390 1.121 -2.144) 2.790 13.287 ( -1.525 -2.616 6.376) 7.059 13.287 ( -1.525 2.616 6.376) 7.059 14.779 ( 23.938 -1.860 -20.605) 31.639 14.779 ( 23.938 1.860 -20.605) 31.639 15.862 ( 7.489 -4.328 -1.911) 8.858 15.862 ( 7.489 4.328 -1.911) 8.858 16.039 ( 9.246 -7.711 1.538) 12.137 16.039 ( 9.246 7.711 1.538) 12.137 18.870 ( -25.651 -3.877 13.227) 29.120 18.870 ( -25.651 3.877 13.227) 29.120 21.409 ( -0.315 -1.959 -1.352) 2.401 21.409 ( -0.315 1.959 -1.352) 2.401 ======================= Grid point 52 (29/160) ======================= q-point: ( 0.40 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( 3.095 -4.167 5.904) 7.861 1.969 ( 3.095 4.167 5.904) 7.861 2.080 ( 3.587 -3.644 1.411) 5.304 2.080 ( 3.587 3.644 1.411) 5.304 2.126 ( 3.355 -1.372 -0.329) 3.640 2.126 ( 3.355 1.372 -0.329) 3.640 2.305 ( 1.469 -4.685 -1.603) 5.165 2.305 ( 1.469 4.685 -1.603) 5.165 2.422 ( -3.476 -1.620 0.876) 3.934 2.422 ( -3.476 1.620 0.876) 3.934 2.578 ( -0.772 -5.407 -3.633) 6.560 2.578 ( -0.772 5.407 -3.633) 6.560 3.327 ( -6.424 -4.843 3.790) 8.893 3.327 ( -6.424 4.843 3.790) 8.893 3.524 ( -7.250 -4.579 -4.486) 9.677 3.524 ( -7.250 4.579 -4.486) 9.677 3.749 ( 0.117 -0.749 7.804) 7.840 3.749 ( 0.117 0.749 7.804) 7.840 3.943 ( 1.438 -1.062 0.112) 1.791 3.943 ( 1.438 1.062 0.112) 1.791 4.794 ( 8.221 -7.934 -3.482) 11.944 4.794 ( 8.221 7.934 -3.482) 11.944 5.774 ( 4.902 -8.151 -4.097) 10.357 5.774 ( 4.902 8.151 -4.097) 10.357 6.253 ( -5.954 -3.772 0.955) 7.113 6.253 ( -5.954 3.772 0.955) 7.113 6.574 ( -3.592 -9.813 7.442) 12.829 6.574 ( -3.592 9.813 7.442) 12.829 6.787 ( -3.772 -5.863 -6.567) 9.578 6.787 ( -3.772 5.863 -6.567) 9.578 7.167 ( -2.522 -2.675 3.177) 4.859 7.167 ( -2.522 2.675 3.177) 4.859 7.815 ( 8.889 -3.962 1.221) 9.808 7.815 ( 8.889 3.962 1.221) 9.808 7.976 ( 6.451 -3.577 0.824) 7.422 7.976 ( 6.451 3.577 0.824) 7.422 8.270 ( -10.583 -3.568 -1.095) 11.221 8.270 ( -10.583 3.568 -1.095) 11.221 8.418 ( 2.624 -6.614 -1.502) 7.272 8.418 ( 2.624 6.614 -1.502) 7.272 8.769 ( 1.149 -9.399 -1.006) 9.523 8.769 ( 1.149 9.399 -1.006) 9.523 9.015 ( -6.366 -7.079 2.611) 9.872 9.015 ( -6.366 7.079 2.611) 9.872 10.648 ( 4.432 -2.790 2.466) 5.789 10.648 ( 4.432 2.790 2.466) 5.789 10.818 ( 1.252 -1.226 -5.280) 5.563 10.818 ( 1.252 1.226 -5.280) 5.563 13.360 ( 0.114 -1.983 6.721) 7.008 13.360 ( 0.114 1.983 6.721) 7.008 14.802 ( 8.868 -6.407 -17.421) 20.572 14.802 ( 8.868 6.407 -17.421) 20.572 16.009 ( 8.401 -8.718 -0.274) 12.110 16.009 ( 8.401 8.718 -0.274) 12.110 16.219 ( 10.031 -9.639 1.889) 14.039 16.219 ( 10.031 9.639 1.889) 14.039 18.620 ( -19.230 -2.264 8.726) 21.238 18.620 ( -19.230 2.264 8.726) 21.238 21.390 ( -0.255 -1.081 -0.990) 1.488 21.390 ( -0.255 1.081 -0.990) 1.488 ======================= Grid point 54 (30/160) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( -0.000 -3.978 -0.000) 3.978 2.056 ( 0.000 3.978 0.000) 3.978 2.096 ( -0.000 -0.239 0.000) 0.239 2.096 ( 0.000 0.239 -0.000) 0.239 2.150 ( -0.000 -3.648 0.000) 3.648 2.150 ( 0.000 3.648 -0.000) 3.648 2.329 ( -0.000 -4.012 0.000) 4.012 2.329 ( 0.000 4.012 -0.000) 4.012 2.386 ( 0.000 -3.544 0.000) 3.544 2.386 ( 0.000 3.544 0.000) 3.544 2.546 ( -0.000 -6.674 0.000) 6.674 2.546 ( 0.000 6.674 -0.000) 6.674 3.312 ( 0.000 -1.606 -0.000) 1.606 3.312 ( 0.000 1.606 0.000) 1.606 3.415 ( 0.000 -2.012 0.000) 2.012 3.415 ( -0.000 2.012 0.000) 2.012 3.802 ( 0.000 -1.015 0.000) 1.015 3.802 ( -0.000 1.015 -0.000) 1.015 3.958 ( 0.000 -1.987 0.000) 1.987 3.958 ( 0.000 1.987 -0.000) 1.987 4.828 ( 0.000 -8.592 0.000) 8.592 4.828 ( 0.000 8.592 0.000) 8.592 5.813 ( 0.000 -10.629 0.000) 10.629 5.813 ( -0.000 10.629 0.000) 10.629 6.198 ( 0.000 -1.405 0.000) 1.405 6.198 ( -0.000 1.405 0.000) 1.405 6.597 ( -0.000 -5.209 0.000) 5.209 6.597 ( 0.000 5.209 -0.000) 5.209 6.702 ( -0.000 -0.349 0.000) 0.349 6.702 ( 0.000 0.349 0.000) 0.349 7.165 ( 0.000 -3.403 0.000) 3.403 7.165 ( -0.000 3.403 0.000) 3.403 7.929 ( -0.000 -1.031 0.000) 1.031 7.929 ( 0.000 1.031 -0.000) 1.031 8.065 ( 0.000 -1.325 0.000) 1.325 8.065 ( 0.000 1.325 -0.000) 1.325 8.114 ( -0.000 -2.342 0.000) 2.342 8.114 ( 0.000 2.342 -0.000) 2.342 8.419 ( 0.000 -5.183 0.000) 5.183 8.419 ( 0.000 5.183 0.000) 5.183 8.800 ( 0.000 -7.714 -0.000) 7.714 8.800 ( 0.000 7.714 0.000) 7.714 8.962 ( -0.000 -6.436 0.000) 6.436 8.962 ( -0.000 6.436 0.000) 6.436 10.714 ( 0.000 -0.519 0.000) 0.519 10.714 ( 0.000 0.519 0.000) 0.519 10.782 ( 0.000 -3.733 -0.000) 3.733 10.782 ( 0.000 3.733 -0.000) 3.733 13.407 ( 0.000 -2.245 -0.000) 2.245 13.407 ( 0.000 2.245 0.000) 2.245 14.759 ( 0.000 -8.951 0.000) 8.951 14.759 ( 0.000 8.951 0.000) 8.951 16.075 ( 0.000 -7.644 0.000) 7.644 16.075 ( 0.000 7.644 -0.000) 7.644 16.333 ( 0.000 -2.273 0.000) 2.273 16.333 ( 0.000 2.273 0.000) 2.273 18.502 ( 0.000 -0.592 0.000) 0.592 18.502 ( 0.000 0.592 0.000) 0.592 21.382 ( 0.000 -0.706 0.000) 0.706 21.382 ( 0.000 0.706 0.000) 0.706 ======================= Grid point 99 (31/160) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.419 ( -3.265 0.000 22.043) 22.283 0.497 ( 3.094 0.000 24.792) 24.985 0.931 ( -4.322 0.000 43.733) 43.946 1.420 ( -0.353 0.000 3.086) 3.106 1.941 ( -1.864 0.000 -4.893) 5.236 2.292 ( -0.970 0.000 1.976) 2.201 2.452 ( 2.486 0.000 -3.741) 4.492 2.471 ( -0.028 0.000 -2.899) 2.899 2.551 ( 0.853 0.000 -1.356) 1.602 2.612 ( -4.756 0.000 -1.736) 5.063 2.667 ( 0.308 0.000 -5.775) 5.783 2.872 ( 0.817 0.000 -3.028) 3.137 2.917 ( 0.574 0.000 -0.995) 1.149 3.092 ( 2.420 0.000 -3.682) 4.406 3.207 ( 1.652 0.000 3.422) 3.800 3.251 ( 2.910 0.000 4.002) 4.949 3.506 ( 4.993 0.000 9.187) 10.456 3.644 ( -0.853 0.000 -1.023) 1.332 3.802 ( -4.810 0.000 13.098) 13.953 3.885 ( 1.134 0.000 -2.505) 2.749 4.054 ( -4.529 0.000 0.204) 4.534 4.660 ( -6.011 0.000 -20.186) 21.062 5.969 ( 3.054 0.000 6.112) 6.832 6.040 ( 1.592 0.000 3.964) 4.272 6.070 ( 4.029 0.000 2.708) 4.854 6.204 ( 2.902 0.000 -9.968) 10.381 6.440 ( -4.132 0.000 4.269) 5.941 6.681 ( -3.535 0.000 4.492) 5.716 7.003 ( -1.936 0.000 -1.951) 2.749 7.116 ( 1.897 0.000 -7.214) 7.459 7.138 ( 2.822 0.000 2.472) 3.752 7.303 ( -0.205 0.000 -1.835) 1.846 7.402 ( -1.197 0.000 -0.447) 1.278 7.627 ( 1.673 0.000 2.426) 2.947 7.697 ( -10.709 0.000 -2.506) 10.998 7.847 ( -2.150 0.000 -6.853) 7.182 8.144 ( -0.594 0.000 -3.141) 3.197 8.326 ( 0.283 0.000 -3.713) 3.723 8.622 ( 3.788 0.000 7.681) 8.565 8.827 ( -0.543 0.000 -2.689) 2.744 8.845 ( 12.639 0.000 -0.646) 12.656 9.233 ( 3.676 0.000 -2.415) 4.398 9.389 ( -6.641 0.000 8.513) 10.797 9.781 ( -6.035 0.000 11.054) 12.594 9.907 ( 7.752 0.000 -0.335) 7.759 10.046 ( -10.172 0.000 2.709) 10.526 10.216 ( 1.331 0.000 -0.951) 1.636 11.061 ( -0.224 0.000 -7.805) 7.808 13.068 ( 0.094 0.000 2.331) 2.333 13.259 ( -0.074 0.000 -1.517) 1.519 13.294 ( 2.685 0.000 11.613) 11.919 15.617 ( 4.252 0.000 -4.146) 5.939 15.657 ( -0.964 0.000 0.116) 0.971 15.879 ( 11.800 0.000 -16.842) 20.564 15.987 ( 7.124 0.000 0.827) 7.172 16.228 ( -27.071 0.000 -24.505) 36.515 18.025 ( 9.808 0.000 34.312) 35.687 19.437 ( -4.981 0.000 -3.875) 6.311 21.450 ( 0.076 0.000 1.231) 1.233 21.681 ( -0.046 0.000 -2.114) 2.114 ======================= Grid point 100 (32/160) ======================= q-point: ( 0.10 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.739 ( 11.099 0.000 17.652) 20.852 0.880 ( 10.319 0.000 18.828) 21.470 1.502 ( 14.225 0.000 0.078) 14.225 1.597 ( 15.683 0.000 33.803) 37.264 1.799 ( -1.185 0.000 -14.359) 14.408 2.303 ( -0.269 0.000 2.166) 2.182 2.356 ( -5.416 0.000 0.413) 5.432 2.471 ( 1.823 0.000 -1.955) 2.673 2.548 ( 1.733 0.000 -0.453) 1.791 2.633 ( 2.912 0.000 -4.515) 5.373 2.654 ( 4.300 0.000 3.119) 5.312 2.814 ( -2.058 0.000 -5.437) 5.814 2.932 ( 3.535 0.000 -2.708) 4.453 3.057 ( -0.037 0.000 -4.731) 4.731 3.316 ( 2.659 0.000 7.123) 7.603 3.400 ( 4.062 0.000 11.904) 12.578 3.595 ( -1.312 0.000 0.429) 1.380 3.688 ( 6.958 0.000 2.122) 7.275 3.784 ( -8.322 0.000 -3.760) 9.132 3.871 ( -4.499 0.000 11.560) 12.404 3.943 ( -10.254 0.000 0.697) 10.277 4.249 ( -11.482 0.000 -22.683) 25.424 5.916 ( -6.668 0.000 -2.370) 7.077 6.089 ( -5.036 0.000 -0.522) 5.063 6.210 ( 6.437 0.000 -4.468) 7.836 6.215 ( 3.244 0.000 8.725) 9.309 6.378 ( -5.545 0.000 4.169) 6.937 6.755 ( 4.228 0.000 7.225) 8.371 6.928 ( -1.711 0.000 -5.334) 5.602 7.079 ( 3.047 0.000 -5.144) 5.979 7.226 ( 3.730 0.000 1.724) 4.109 7.250 ( -3.184 0.000 -1.220) 3.410 7.393 ( -0.453 0.000 1.017) 1.113 7.563 ( 0.462 0.000 -3.964) 3.991 7.691 ( 0.831 0.000 4.668) 4.741 7.764 ( 0.422 0.000 -5.869) 5.884 8.094 ( -0.320 0.000 -4.475) 4.487 8.261 ( -1.815 0.000 -4.450) 4.806 8.713 ( -4.405 0.000 7.475) 8.676 8.727 ( -5.976 0.000 -3.864) 7.116 8.829 ( -5.370 0.000 2.110) 5.769 9.190 ( -4.274 0.000 -4.783) 6.415 9.401 ( -1.953 0.000 8.564) 8.784 9.682 ( -11.053 0.000 2.491) 11.330 10.067 ( 4.036 0.000 7.349) 8.385 10.338 ( 11.681 0.000 0.398) 11.688 10.385 ( 30.808 0.000 1.739) 30.857 10.942 ( 0.293 0.000 -11.097) 11.101 13.121 ( 3.024 0.000 2.258) 3.774 13.247 ( 1.306 0.000 -2.033) 2.416 13.488 ( -2.534 0.000 20.159) 20.317 15.289 ( -24.907 0.000 -42.141) 48.951 15.616 ( -1.103 0.000 -0.885) 1.414 15.658 ( -0.469 0.000 1.594) 1.662 15.946 ( -1.242 0.000 -2.214) 2.538 15.982 ( -5.132 0.000 2.647) 5.774 18.653 ( 19.087 0.000 28.174) 34.031 19.406 ( 7.783 0.000 -9.450) 12.242 21.466 ( -0.434 0.000 1.990) 2.037 21.641 ( -1.080 0.000 -3.083) 3.267 ======================= Grid point 101 (33/160) ======================= q-point: ( 0.20 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 16.562 0.000 11.685) 20.270 1.223 ( 10.362 0.000 10.393) 14.676 1.664 ( 5.954 0.000 -11.631) 13.066 1.667 ( 9.465 0.000 -0.714) 9.492 2.201 ( 15.002 0.000 12.605) 19.595 2.331 ( -2.931 0.000 3.847) 4.836 2.341 ( 1.529 0.000 3.786) 4.083 2.448 ( -3.029 0.000 2.046) 3.656 2.588 ( 2.389 0.000 -0.544) 2.450 2.606 ( -4.702 0.000 -3.123) 5.645 2.738 ( 2.336 0.000 -3.688) 4.365 2.792 ( 7.279 0.000 3.953) 8.283 2.958 ( 5.356 0.000 -4.587) 7.052 2.985 ( -4.107 0.000 -1.512) 4.377 3.411 ( -2.206 0.000 7.000) 7.339 3.540 ( -5.396 0.000 -7.673) 9.380 3.603 ( -2.599 0.000 0.312) 2.617 3.629 ( 4.109 0.000 13.293) 13.914 3.771 ( 7.523 0.000 -6.427) 9.895 3.805 ( -5.921 0.000 -13.350) 14.604 3.871 ( -11.329 0.000 5.493) 12.591 3.936 ( 1.573 0.000 5.411) 5.635 5.771 ( -6.320 0.000 -2.907) 6.957 5.965 ( -7.559 0.000 -2.268) 7.892 6.127 ( -6.622 0.000 -3.383) 7.436 6.225 ( -7.173 0.000 -2.124) 7.481 6.497 ( 6.547 0.000 8.070) 10.392 6.897 ( 2.448 0.000 0.333) 2.471 6.919 ( 3.907 0.000 5.999) 7.159 7.094 ( 3.396 0.000 -2.110) 3.998 7.193 ( 0.102 0.000 -2.607) 2.609 7.279 ( 1.883 0.000 -1.880) 2.661 7.414 ( -1.106 0.000 7.288) 7.372 7.590 ( 6.431 0.000 -4.016) 7.582 7.709 ( 2.503 0.000 -7.734) 8.130 7.751 ( -0.030 0.000 3.594) 3.594 8.031 ( -0.269 0.000 -4.434) 4.442 8.178 ( -2.693 0.000 -2.705) 3.817 8.612 ( -1.153 0.000 -3.024) 3.236 8.643 ( -9.037 0.000 2.235) 9.309 8.805 ( -5.818 0.000 6.915) 9.037 9.027 ( -7.481 0.000 -6.036) 9.612 9.496 ( 0.494 0.000 7.995) 8.010 9.525 ( -8.963 0.000 -1.185) 9.041 10.227 ( 3.971 0.000 8.409) 9.300 10.464 ( 3.821 0.000 -6.501) 7.541 10.878 ( 25.486 0.000 2.573) 25.615 10.923 ( 12.181 0.000 -4.156) 12.871 13.210 ( 4.715 0.000 1.790) 5.043 13.258 ( 2.772 0.000 -1.841) 3.328 13.664 ( -6.669 0.000 22.890) 23.842 14.446 ( -22.808 0.000 -32.742) 39.903 15.577 ( -2.136 0.000 -1.285) 2.492 15.670 ( -0.839 0.000 1.941) 2.114 15.872 ( -2.952 0.000 -4.834) 5.664 15.928 ( -5.398 0.000 2.968) 6.160 19.229 ( 16.339 0.000 19.713) 25.604 19.442 ( 10.842 0.000 -10.888) 15.365 21.480 ( -1.021 0.000 2.432) 2.638 21.579 ( -1.683 0.000 -3.408) 3.800 ======================= Grid point 102 (34/160) ======================= q-point: ( 0.30 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 9.952 0.000 2.587) 10.282 1.502 ( 15.163 0.000 3.446) 15.550 1.729 ( 9.351 0.000 -2.024) 9.568 1.797 ( 8.426 0.000 -1.231) 8.516 2.278 ( -6.044 0.000 0.686) 6.082 2.314 ( -2.927 0.000 0.473) 2.965 2.396 ( -6.728 0.000 -0.779) 6.772 2.422 ( -5.790 0.000 -2.658) 6.371 2.473 ( -0.565 0.000 5.088) 5.120 2.596 ( -1.351 0.000 1.555) 2.059 2.714 ( -1.720 0.000 -3.901) 4.263 2.811 ( -12.181 0.000 1.922) 12.332 3.019 ( 9.891 0.000 1.114) 9.954 3.038 ( 9.336 0.000 -1.613) 9.474 3.371 ( -3.111 0.000 -11.078) 11.507 3.404 ( -3.777 0.000 2.567) 4.567 3.624 ( 2.050 0.000 -8.684) 8.923 3.702 ( 7.301 0.000 9.514) 11.993 3.776 ( 1.041 0.000 5.205) 5.308 3.844 ( 11.842 0.000 -7.791) 14.175 3.874 ( -3.795 0.000 10.090) 10.780 4.068 ( 6.430 0.000 4.624) 7.920 5.664 ( -3.438 0.000 -1.713) 3.841 5.803 ( -9.217 0.000 -1.458) 9.331 6.002 ( -3.238 0.000 -3.084) 4.472 6.020 ( -9.598 0.000 -5.029) 10.835 6.677 ( 2.168 0.000 9.337) 9.585 6.939 ( -0.202 0.000 0.658) 0.688 6.956 ( -2.499 0.000 -2.137) 3.288 7.120 ( 2.713 0.000 -2.379) 3.608 7.240 ( 7.153 0.000 0.788) 7.197 7.254 ( -1.861 0.000 0.585) 1.951 7.551 ( 3.676 0.000 10.180) 10.824 7.614 ( 2.358 0.000 -4.939) 5.473 7.674 ( 4.127 0.000 -8.518) 9.465 7.734 ( -1.496 0.000 -4.455) 4.700 8.048 ( 3.751 0.000 3.822) 5.355 8.147 ( 1.085 0.000 1.487) 1.841 8.513 ( -8.612 0.000 1.285) 8.707 8.637 ( 5.471 0.000 -0.016) 5.471 8.761 ( -9.136 0.000 5.786) 10.814 8.815 ( -8.435 0.000 -7.797) 11.486 9.376 ( -6.881 0.000 -1.401) 7.022 9.554 ( -4.815 0.000 6.024) 7.712 10.375 ( 2.902 0.000 6.845) 7.435 10.397 ( 3.829 0.000 -8.853) 9.646 11.165 ( 14.951 0.000 1.232) 15.002 11.249 ( 17.164 0.000 0.873) 17.186 13.291 ( 3.235 0.000 -1.309) 3.490 13.304 ( 4.501 0.000 0.970) 4.605 13.788 ( -8.533 0.000 19.200) 21.011 13.847 ( -12.125 0.000 -20.165) 23.529 15.523 ( -2.687 0.000 -0.773) 2.796 15.672 ( -1.512 0.000 1.628) 2.222 15.756 ( -3.815 0.000 -4.283) 5.736 15.877 ( -5.084 0.000 3.311) 6.067 19.503 ( 11.334 0.000 -9.980) 15.101 19.613 ( 9.459 0.000 9.858) 13.662 21.487 ( -1.543 0.000 2.410) 2.861 21.516 ( -1.433 0.000 -2.762) 3.111 ======================= Grid point 103 (35/160) ======================= q-point: ( 0.40 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( 6.214 0.000 0.055) 6.215 1.692 ( 11.182 0.000 -6.048) 12.712 1.847 ( 5.811 0.000 -0.601) 5.842 1.923 ( 3.844 0.000 3.808) 5.411 2.121 ( -11.379 0.000 -1.292) 11.452 2.188 ( -6.767 0.000 2.748) 7.304 2.296 ( -0.246 0.000 -1.971) 1.986 2.405 ( -2.310 0.000 2.724) 3.572 2.477 ( -1.689 0.000 -3.056) 3.492 2.583 ( -5.144 0.000 1.457) 5.346 2.636 ( -6.732 0.000 4.052) 7.857 2.639 ( -0.753 0.000 -4.216) 4.283 3.171 ( 6.725 0.000 0.146) 6.727 3.188 ( 6.305 0.000 1.520) 6.485 3.251 ( 1.258 0.000 -4.504) 4.676 3.384 ( -2.543 0.000 2.100) 3.298 3.606 ( 4.385 0.000 -3.755) 5.773 3.783 ( -4.878 0.000 1.892) 5.232 3.793 ( -0.845 0.000 -2.818) 2.942 3.974 ( 13.999 0.000 -6.549) 15.456 4.023 ( 6.261 0.000 4.203) 7.540 4.195 ( 2.207 0.000 3.567) 4.194 5.604 ( -1.547 0.000 -2.608) 3.032 5.652 ( -6.813 0.000 -1.097) 6.901 5.883 ( -4.256 0.000 3.246) 5.353 5.958 ( -0.158 0.000 -0.076) 0.176 6.773 ( -0.682 0.000 4.318) 4.372 6.845 ( -4.834 0.000 -1.728) 5.134 6.913 ( -0.127 0.000 -3.239) 3.242 7.113 ( -0.587 0.000 -2.355) 2.427 7.240 ( -1.002 0.000 -0.604) 1.170 7.402 ( 9.723 0.000 1.587) 9.851 7.546 ( -0.424 0.000 -10.107) 10.116 7.639 ( -1.701 0.000 -6.151) 6.382 7.666 ( 3.301 0.000 -0.475) 3.335 7.721 ( 2.548 0.000 9.363) 9.703 8.193 ( 3.813 0.000 6.413) 7.461 8.243 ( 3.850 0.000 4.929) 6.254 8.420 ( -3.180 0.000 1.287) 3.431 8.602 ( -5.208 0.000 -6.777) 8.547 8.637 ( -12.620 0.000 3.895) 13.208 8.748 ( 5.571 0.000 1.881) 5.880 9.284 ( -3.173 0.000 0.010) 3.173 9.473 ( -7.646 0.000 -0.337) 7.654 10.442 ( 6.676 0.000 0.485) 6.694 10.467 ( 0.004 0.000 4.738) 4.738 11.354 ( 7.734 0.000 -1.934) 7.972 11.449 ( 8.357 0.000 -2.202) 8.643 13.321 ( 2.014 0.000 -1.056) 2.274 13.370 ( 2.619 0.000 0.213) 2.628 13.593 ( -0.549 0.000 -6.852) 6.874 13.809 ( -10.273 0.000 10.232) 14.499 15.486 ( -1.640 0.000 1.028) 1.936 15.660 ( -1.561 0.000 0.772) 1.741 15.686 ( -0.937 0.000 0.286) 0.980 15.847 ( -4.120 0.000 4.834) 6.352 19.571 ( 9.568 0.000 -8.145) 12.565 19.763 ( 2.435 0.000 -0.383) 2.465 21.478 ( -0.097 0.000 -1.226) 1.229 21.485 ( -1.836 0.000 1.887) 2.632 ======================= Grid point 104 (36/160) ======================= q-point: (-0.50 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -2.590 0.000 -3.038) 3.992 1.766 ( 5.577 0.000 -4.956) 7.461 1.902 ( 1.847 0.000 -0.116) 1.851 1.914 ( -5.833 0.000 -0.908) 5.904 2.096 ( 3.567 0.000 5.135) 6.252 2.152 ( -1.972 0.000 4.967) 5.344 2.300 ( 0.117 0.000 1.394) 1.399 2.373 ( -0.343 0.000 -7.728) 7.736 2.425 ( 2.170 0.000 3.275) 3.929 2.573 ( 0.539 0.000 2.313) 2.375 2.596 ( 1.989 0.000 -4.703) 5.106 2.604 ( -4.464 0.000 2.796) 5.268 3.230 ( 1.482 0.000 -1.363) 2.013 3.252 ( 1.388 0.000 0.553) 1.494 3.293 ( 4.491 0.000 1.838) 4.853 3.334 ( -5.870 0.000 0.313) 5.879 3.644 ( 0.047 0.000 -7.079) 7.079 3.702 ( -0.592 0.000 -9.871) 9.889 3.722 ( 1.515 0.000 3.693) 3.991 4.029 ( -7.905 0.000 -0.997) 7.968 4.104 ( 6.713 0.000 -1.899) 6.976 4.207 ( -3.492 0.000 -0.114) 3.494 5.565 ( 1.494 0.000 -2.788) 3.163 5.582 ( 0.639 0.000 -1.340) 1.485 5.943 ( 1.097 0.000 9.253) 9.318 5.984 ( 1.065 0.000 2.949) 3.135 6.719 ( -4.329 0.000 0.115) 4.331 6.871 ( 3.732 0.000 2.833) 4.685 6.878 ( 1.510 0.000 -4.529) 4.774 7.052 ( -1.342 0.000 -4.811) 4.995 7.176 ( -2.501 0.000 -6.328) 6.805 7.395 ( -2.977 0.000 -7.947) 8.487 7.549 ( -2.883 0.000 -3.083) 4.221 7.588 ( 10.565 0.000 0.064) 10.565 7.768 ( 5.446 0.000 4.836) 7.283 7.826 ( -1.338 0.000 5.533) 5.692 8.219 ( -5.148 0.000 2.248) 5.617 8.284 ( -3.495 0.000 2.958) 4.579 8.451 ( -7.948 0.000 0.861) 7.995 8.510 ( 1.831 0.000 5.940) 6.216 8.589 ( 7.395 0.000 0.493) 7.412 8.828 ( 0.208 0.000 2.778) 2.786 9.274 ( 1.044 0.000 1.259) 1.636 9.357 ( -1.986 0.000 -4.349) 4.781 10.483 ( -4.096 0.000 3.878) 5.640 10.578 ( 2.909 0.000 8.066) 8.575 11.360 ( -0.635 0.000 -6.711) 6.741 11.473 ( 0.216 0.000 -5.509) 5.513 13.345 ( 1.347 0.000 0.358) 1.394 13.390 ( -0.288 0.000 -0.316) 0.427 13.637 ( 9.519 0.000 1.907) 9.708 13.686 ( -11.773 0.000 0.132) 11.773 15.496 ( 0.239 0.000 2.338) 2.350 15.642 ( -0.866 0.000 -0.256) 0.903 15.750 ( 3.091 0.000 7.695) 8.292 15.857 ( -2.756 0.000 6.219) 6.802 19.618 ( 6.247 0.000 -6.154) 8.769 19.694 ( -4.183 0.000 -8.744) 9.693 21.472 ( -1.730 0.000 0.973) 1.985 21.488 ( 1.768 0.000 0.493) 1.835 ======================= Grid point 105 (37/160) ======================= q-point: (-0.40 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( -10.500 0.000 -6.144) 12.165 1.647 ( -17.646 0.000 -2.074) 17.767 1.823 ( 1.843 0.000 -6.963) 7.203 1.932 ( -0.136 0.000 5.098) 5.100 2.232 ( 2.631 0.000 2.586) 3.689 2.236 ( 3.862 0.000 3.632) 5.302 2.293 ( 0.106 0.000 -5.516) 5.517 2.347 ( 4.929 0.000 3.940) 6.311 2.542 ( -1.666 0.000 -2.042) 2.636 2.555 ( 7.755 0.000 0.867) 7.804 2.612 ( 3.563 0.000 0.634) 3.619 2.638 ( 3.162 0.000 0.876) 3.281 3.166 ( -9.056 0.000 0.478) 9.069 3.203 ( -5.496 0.000 -0.101) 5.497 3.249 ( 1.371 0.000 -5.726) 5.888 3.473 ( 7.813 0.000 -1.597) 7.974 3.511 ( 1.787 0.000 -6.813) 7.043 3.563 ( -1.249 0.000 -10.883) 10.954 3.737 ( -13.112 0.000 2.235) 13.301 3.927 ( 0.911 0.000 10.429) 10.468 4.054 ( -9.736 0.000 -5.868) 11.367 4.150 ( -2.488 0.000 2.533) 3.550 5.600 ( 5.476 0.000 -1.188) 5.604 5.637 ( 7.792 0.000 -2.443) 8.166 6.060 ( 2.709 0.000 5.074) 5.752 6.084 ( 3.482 0.000 6.628) 7.487 6.671 ( -5.027 0.000 4.414) 6.690 6.854 ( 1.262 0.000 -3.588) 3.804 6.967 ( -1.221 0.000 -3.149) 3.378 6.978 ( 1.179 0.000 -6.537) 6.643 7.053 ( 5.949 0.000 -6.237) 8.619 7.284 ( -0.956 0.000 -4.968) 5.059 7.460 ( -5.147 0.000 -1.613) 5.394 7.742 ( 6.687 0.000 0.705) 6.724 7.788 ( -5.356 0.000 -0.697) 5.401 7.926 ( 5.317 0.000 6.385) 8.309 8.207 ( -2.690 0.000 7.440) 7.911 8.209 ( -10.307 0.000 3.193) 10.790 8.378 ( 1.853 0.000 0.299) 1.877 8.615 ( 1.254 0.000 3.192) 3.430 8.723 ( 3.201 0.000 0.896) 3.324 8.841 ( 1.643 0.000 2.381) 2.893 9.316 ( 3.208 0.000 -5.482) 6.352 9.346 ( 5.138 0.000 1.888) 5.473 10.434 ( -8.383 0.000 5.869) 10.233 10.703 ( -1.513 0.000 10.750) 10.856 11.207 ( -5.849 0.000 -8.387) 10.225 11.333 ( -7.327 0.000 -8.440) 11.177 13.347 ( -4.202 0.000 -1.536) 4.474 13.354 ( -1.119 0.000 0.667) 1.303 13.469 ( -9.461 0.000 -4.966) 10.685 13.964 ( 22.649 0.000 8.656) 24.247 15.540 ( 1.705 0.000 2.386) 2.933 15.629 ( 0.088 0.000 -0.902) 0.906 15.886 ( -2.327 0.000 5.117) 5.621 15.936 ( 4.236 0.000 12.560) 13.255 19.430 ( -11.849 0.000 -14.218) 18.508 19.632 ( 2.988 0.000 -4.299) 5.235 21.453 ( -1.182 0.000 0.048) 1.183 21.541 ( 3.021 0.000 1.487) 3.367 ======================= Grid point 106 (38/160) ======================= q-point: (-0.30 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -16.645 0.000 -8.315) 18.606 1.252 ( -23.610 0.000 -4.961) 24.126 1.732 ( -6.373 0.000 -3.473) 7.258 2.035 ( -0.225 0.000 10.499) 10.501 2.202 ( 0.395 0.000 -2.809) 2.836 2.241 ( -2.032 0.000 -0.044) 2.033 2.343 ( -16.671 0.000 -2.370) 16.839 2.383 ( 5.547 0.000 3.027) 6.319 2.503 ( 2.035 0.000 -5.566) 5.927 2.635 ( 8.948 0.000 -7.281) 11.536 2.669 ( 0.511 0.000 -1.934) 2.000 2.715 ( 2.524 0.000 7.738) 8.139 3.050 ( -2.294 0.000 -1.232) 2.604 3.112 ( -5.043 0.000 -0.198) 5.047 3.213 ( 0.873 0.000 -4.688) 4.768 3.367 ( -0.899 0.000 -7.673) 7.725 3.423 ( -3.068 0.000 -6.927) 7.576 3.543 ( 2.482 0.000 2.700) 3.667 3.778 ( -11.583 0.000 -9.018) 14.680 3.786 ( 8.896 0.000 5.937) 10.695 4.089 ( -9.170 0.000 2.562) 9.521 4.187 ( 10.168 0.000 16.285) 19.198 5.703 ( 7.595 0.000 -0.005) 7.595 5.749 ( 10.343 0.000 -4.331) 11.214 6.148 ( -0.078 0.000 -2.903) 2.904 6.181 ( 3.523 0.000 6.096) 7.041 6.646 ( -6.646 0.000 6.565) 9.342 6.770 ( -6.147 0.000 -10.037) 11.769 6.869 ( 4.082 0.000 1.046) 4.214 6.957 ( 3.795 0.000 -4.452) 5.850 7.216 ( 10.534 0.000 1.375) 10.623 7.247 ( 0.970 0.000 -2.249) 2.450 7.343 ( -5.836 0.000 -2.573) 6.378 7.689 ( -4.435 0.000 -1.748) 4.767 7.783 ( -1.912 0.000 -0.703) 2.038 8.069 ( -5.092 0.000 9.897) 11.130 8.110 ( 3.598 0.000 -0.937) 3.718 8.265 ( -2.561 0.000 7.854) 8.261 8.468 ( 7.283 0.000 -0.232) 7.287 8.618 ( -2.476 0.000 0.025) 2.476 8.694 ( -2.401 0.000 -0.346) 2.425 8.970 ( 8.662 0.000 0.482) 8.675 9.310 ( 2.391 0.000 -3.871) 4.550 9.460 ( 6.341 0.000 0.596) 6.369 10.361 ( -11.873 0.000 10.519) 15.862 10.724 ( -9.077 0.000 4.486) 10.125 11.053 ( -13.191 0.000 -9.864) 16.471 11.064 ( -1.878 0.000 -1.253) 2.257 13.206 ( -6.105 0.000 -4.935) 7.850 13.323 ( -5.116 0.000 -1.304) 5.279 13.333 ( -2.131 0.000 0.685) 2.238 14.532 ( 32.758 0.000 8.891) 33.943 15.602 ( 2.420 0.000 2.320) 3.353 15.625 ( 0.607 0.000 -0.784) 0.991 15.886 ( -2.360 0.000 1.268) 2.679 16.157 ( 3.669 0.000 14.481) 14.938 18.982 ( -21.013 0.000 -16.568) 26.759 19.623 ( 0.958 0.000 -2.564) 2.737 21.437 ( -0.417 0.000 -0.417) 0.590 21.610 ( 3.071 0.000 1.382) 3.368 ======================= Grid point 107 (39/160) ======================= q-point: (-0.20 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.754 ( -21.113 0.000 -6.479) 22.085 0.816 ( -25.073 0.000 0.101) 25.073 1.509 ( -22.827 0.000 0.951) 22.847 1.799 ( -32.299 0.000 -2.388) 32.387 2.045 ( -5.061 0.000 2.802) 5.785 2.249 ( 0.091 0.000 0.155) 0.179 2.344 ( 9.752 0.000 6.147) 11.528 2.461 ( 2.122 0.000 -1.757) 2.755 2.482 ( 2.369 0.000 -3.610) 4.318 2.652 ( 0.182 0.000 2.146) 2.154 2.688 ( 5.557 0.000 -4.311) 7.034 2.838 ( 2.953 0.000 4.239) 5.167 3.018 ( -5.600 0.000 -1.045) 5.697 3.057 ( 6.587 0.000 -7.217) 9.771 3.158 ( -2.710 0.000 -0.881) 2.849 3.278 ( 0.217 0.000 -5.023) 5.027 3.295 ( -6.388 0.000 -2.366) 6.812 3.552 ( -5.162 0.000 -3.932) 6.489 3.729 ( 10.022 0.000 3.980) 10.783 3.912 ( -13.305 0.000 0.198) 13.307 4.016 ( 12.375 0.000 3.305) 12.808 4.568 ( 13.891 0.000 12.030) 18.376 5.834 ( 7.730 0.000 0.352) 7.738 5.868 ( 10.321 0.000 -4.522) 11.268 6.024 ( -4.788 0.000 -8.299) 9.582 6.292 ( 2.639 0.000 3.238) 4.177 6.525 ( -7.417 0.000 -4.487) 8.669 6.668 ( -4.547 0.000 6.013) 7.539 6.985 ( 3.042 0.000 -0.020) 3.042 7.007 ( 7.213 0.000 3.065) 7.837 7.221 ( -4.886 0.000 -2.989) 5.727 7.242 ( 0.683 0.000 -1.394) 1.552 7.374 ( 5.615 0.000 1.726) 5.874 7.613 ( -2.353 0.000 -1.477) 2.778 7.702 ( -4.499 0.000 -1.744) 4.825 8.028 ( -4.193 0.000 2.143) 4.709 8.248 ( 5.112 0.000 4.508) 6.816 8.262 ( -5.282 0.000 2.757) 5.958 8.534 ( 2.456 0.000 -6.248) 6.713 8.591 ( 0.799 0.000 1.768) 1.940 8.712 ( 5.367 0.000 -0.648) 5.406 9.096 ( 6.746 0.000 -0.650) 6.777 9.314 ( 0.915 0.000 0.674) 1.137 9.558 ( 5.264 0.000 0.581) 5.296 10.278 ( -13.868 0.000 9.147) 16.614 10.541 ( -13.971 0.000 0.060) 13.972 10.734 ( -12.646 0.000 -4.852) 13.545 11.089 ( 1.863 0.000 1.661) 2.496 13.096 ( -3.032 0.000 -0.980) 3.186 13.242 ( -4.065 0.000 0.605) 4.109 13.306 ( -1.848 0.000 0.334) 1.878 15.153 ( 34.092 0.000 -0.044) 34.092 15.630 ( 0.299 0.000 0.488) 0.572 15.673 ( 3.440 0.000 1.961) 3.959 15.834 ( -1.863 0.000 -4.601) 4.964 16.407 ( 6.335 0.000 15.528) 16.771 18.382 ( -30.097 0.000 -13.496) 32.984 19.613 ( 0.396 0.000 -0.574) 0.697 21.431 ( 0.170 0.000 -0.255) 0.306 21.665 ( 2.237 0.000 0.434) 2.279 ======================= Grid point 108 (40/160) ======================= q-point: (-0.10 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.397 ( -19.653 0.000 9.461) 21.812 0.477 ( -23.722 0.000 11.412) 26.324 0.971 ( -46.613 0.000 22.864) 51.919 1.483 ( -9.367 0.000 -0.275) 9.371 1.999 ( -2.973 0.000 0.425) 3.004 2.267 ( 0.439 0.000 2.435) 2.474 2.448 ( 3.066 0.000 -4.283) 5.267 2.469 ( 0.600 0.000 0.403) 0.723 2.526 ( 4.732 0.000 -1.894) 5.097 2.710 ( 1.549 0.000 -2.445) 2.895 2.712 ( -1.562 0.000 2.950) 3.338 2.901 ( -1.022 0.000 2.254) 2.475 2.924 ( -1.578 0.000 -2.438) 2.904 3.044 ( 4.556 0.000 -3.711) 5.876 3.182 ( 3.397 0.000 0.584) 3.447 3.201 ( -0.336 0.000 -2.580) 2.602 3.343 ( 8.003 0.000 13.420) 15.625 3.455 ( -8.653 0.000 4.367) 9.692 3.762 ( -6.440 0.000 6.075) 8.853 3.870 ( 4.465 0.000 -0.855) 4.546 4.182 ( 7.508 0.000 -9.818) 12.360 4.812 ( 6.851 0.000 -4.173) 8.022 5.872 ( -1.286 0.000 0.418) 1.352 5.974 ( 7.218 0.000 -1.785) 7.435 5.978 ( 5.545 0.000 -0.010) 5.545 6.289 ( 0.500 0.000 -8.243) 8.258 6.435 ( -2.769 0.000 3.866) 4.755 6.684 ( -4.012 0.000 7.450) 8.462 7.031 ( 1.420 0.000 -0.009) 1.420 7.124 ( 2.676 0.000 2.293) 3.523 7.127 ( -2.505 0.000 -1.450) 2.894 7.253 ( 2.746 0.000 1.083) 2.952 7.425 ( -0.861 0.000 0.889) 1.238 7.590 ( 0.914 0.000 -0.205) 0.936 7.674 ( 4.169 0.000 3.578) 5.494 7.965 ( -3.110 0.000 -3.940) 5.020 8.196 ( -2.747 0.000 -1.517) 3.138 8.331 ( 0.202 0.000 0.496) 0.535 8.517 ( 2.129 0.000 -1.238) 2.463 8.605 ( 0.419 0.000 2.127) 2.168 8.804 ( 5.688 0.000 -1.452) 5.870 9.179 ( 4.686 0.000 -0.722) 4.741 9.358 ( -0.322 0.000 5.373) 5.382 9.669 ( 3.203 0.000 7.170) 7.853 10.079 ( -10.908 0.000 -6.627) 12.763 10.321 ( -11.440 0.000 -0.527) 11.452 10.528 ( -14.003 0.000 -8.774) 16.525 11.114 ( 1.279 0.000 -2.709) 2.996 13.064 ( -2.171 0.000 1.746) 2.786 13.215 ( -1.853 0.000 2.324) 2.972 13.281 ( -1.077 0.000 -0.527) 1.199 15.534 ( 16.238 0.000 -6.550) 17.510 15.676 ( 3.270 0.000 3.945) 5.125 15.737 ( -0.607 0.000 -1.435) 1.558 15.781 ( 10.761 0.000 -3.125) 11.206 16.650 ( 6.106 0.000 -4.659) 7.681 17.824 ( -26.258 0.000 10.805) 28.394 19.611 ( -1.630 0.000 -2.365) 2.873 21.436 ( 0.330 0.000 0.387) 0.509 21.689 ( 1.095 0.000 -0.869) 1.398 ======================= Grid point 109 (41/160) ======================= q-point: ( 0.00 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.664 ( -2.683 19.113 12.810) 23.164 0.778 ( -4.506 17.741 18.266) 25.859 1.237 ( 0.746 24.344 23.648) 33.948 1.583 ( -0.520 16.341 5.776) 17.340 1.952 ( -1.948 0.728 -5.297) 5.690 2.205 ( 0.257 -4.679 5.801) 7.457 2.433 ( -3.230 -6.732 -9.239) 11.879 2.523 ( 1.234 2.981 -2.739) 4.232 2.538 ( 1.731 -0.624 -3.501) 3.955 2.634 ( 0.457 3.752 -1.715) 4.151 2.739 ( -1.933 4.228 -1.587) 4.912 2.798 ( 3.054 -3.270 -4.961) 6.681 3.018 ( 1.444 9.238 -1.846) 9.531 3.208 ( 2.048 4.971 2.320) 5.855 3.304 ( 0.832 10.044 1.059) 10.134 3.370 ( 0.521 8.670 1.384) 8.795 3.525 ( 6.568 1.822 8.708) 11.058 3.698 ( 1.927 4.628 -0.251) 5.020 3.754 ( -7.417 -3.932 10.231) 13.234 3.898 ( -1.288 -9.357 -0.206) 9.448 3.932 ( -1.152 3.816 -1.746) 4.352 4.582 ( -4.970 -7.074 -16.428) 18.564 5.918 ( 3.611 -2.145 0.407) 4.220 5.969 ( 1.285 -4.672 0.900) 4.928 6.211 ( -0.219 9.247 3.641) 9.940 6.288 ( 4.866 7.011 -5.112) 9.948 6.526 ( -2.562 6.428 2.168) 7.251 6.665 ( -4.422 -1.623 4.437) 6.471 6.989 ( -1.327 -1.347 -2.611) 3.224 7.123 ( 1.534 -2.703 3.378) 4.590 7.149 ( 4.041 2.116 -6.452) 7.902 7.250 ( -1.435 -4.523 7.342) 8.742 7.339 ( 2.063 2.399 0.300) 3.178 7.376 ( 1.150 -2.860 0.224) 3.091 7.823 ( -1.804 -1.625 -8.272) 8.621 8.051 ( -4.827 1.428 -6.673) 8.359 8.224 ( -3.309 5.745 -10.467) 12.390 8.258 ( 0.035 -5.445 -4.706) 7.196 8.560 ( 2.059 -2.749 8.449) 9.120 8.837 ( 3.102 0.440 -1.347) 3.410 8.919 ( 2.335 4.987 -4.621) 7.189 9.244 ( 2.675 2.268 -3.170) 4.727 9.357 ( -3.630 -1.535 6.110) 7.271 9.671 ( -7.247 -10.760 15.629) 20.312 9.881 ( 1.504 1.295 2.485) 3.180 10.039 ( 0.383 1.694 9.016) 9.182 10.307 ( 0.938 6.633 -0.869) 6.755 11.020 ( -0.277 -3.779 -7.249) 8.179 13.128 ( -0.884 5.442 2.914) 6.236 13.273 ( -0.874 1.275 5.739) 5.943 13.316 ( -0.294 4.332 0.765) 4.409 15.242 ( 4.624 -29.148 -13.922) 32.631 15.652 ( 1.282 1.562 -3.168) 3.758 15.864 ( 5.957 -1.523 -2.597) 6.675 15.953 ( -5.381 -4.243 1.439) 7.002 16.324 ( -9.571 2.835 -22.270) 24.404 18.245 ( 6.660 19.832 28.530) 35.379 19.472 ( -0.917 2.539 0.286) 2.714 21.435 ( 0.061 -1.324 1.172) 1.769 21.663 ( -0.022 -1.748 -2.120) 2.748 ======================= Grid point 110 (42/160) ======================= q-point: ( 0.10 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( 9.801 14.394 15.042) 23.011 1.021 ( 6.473 11.037 17.692) 21.834 1.582 ( 14.628 6.629 2.058) 16.191 1.773 ( 7.756 14.749 17.114) 23.887 1.827 ( 0.765 3.680 -10.658) 11.301 2.230 ( -1.983 -4.104 -0.417) 4.577 2.329 ( -1.747 -3.975 3.565) 5.618 2.490 ( -1.449 -1.355 -2.004) 2.820 2.566 ( 3.283 1.226 -0.826) 3.600 2.588 ( -2.114 -1.383 -2.581) 3.611 2.746 ( 3.996 3.753 -0.962) 5.565 2.789 ( 2.849 1.624 -1.955) 3.818 2.992 ( 0.581 8.181 -3.142) 8.783 3.210 ( -2.684 10.769 -1.313) 11.176 3.354 ( 0.756 3.686 4.390) 5.782 3.471 ( 3.009 6.104 10.276) 12.325 3.620 ( -2.649 2.006 2.776) 4.330 3.720 ( 4.089 0.897 4.939) 6.474 3.805 ( -1.675 -3.196 5.611) 6.671 3.845 ( -6.213 5.314 -1.997) 8.416 3.899 ( -2.052 -2.656 -2.258) 4.046 4.236 ( -9.863 -1.463 -18.702) 21.194 5.884 ( -5.365 -2.173 -2.236) 6.205 6.070 ( 7.553 -6.462 -1.351) 10.031 6.159 ( -5.268 4.293 2.737) 7.326 6.296 ( -4.996 4.500 -1.577) 6.906 6.517 ( -0.441 10.226 5.573) 11.655 6.758 ( 4.707 0.664 6.529) 8.076 6.917 ( -1.198 -1.254 -3.043) 3.502 7.109 ( 2.587 2.080 -4.368) 5.486 7.140 ( -3.787 -4.014 -2.110) 5.908 7.274 ( 3.921 -0.719 0.573) 4.027 7.412 ( 1.749 0.776 0.682) 2.031 7.496 ( 5.824 -1.237 5.472) 8.087 7.724 ( 2.010 -1.277 -6.495) 6.918 7.849 ( -5.638 6.120 -8.419) 11.837 8.092 ( -2.146 0.544 -3.938) 4.517 8.239 ( 0.657 -2.527 -3.312) 4.217 8.654 ( -3.659 -4.441 9.080) 10.750 8.756 ( -6.653 2.197 -3.913) 8.026 8.803 ( -7.044 -1.767 1.429) 7.401 9.202 ( -3.943 1.933 -6.510) 7.852 9.371 ( -2.194 -2.789 8.739) 9.432 9.632 ( -10.584 -4.624 4.092) 12.254 10.188 ( 9.083 7.170 6.961) 13.504 10.274 ( 24.658 -6.644 6.075) 26.250 10.394 ( 9.936 4.859 0.083) 11.060 10.900 ( -0.789 -3.481 -10.755) 11.332 13.176 ( 2.218 4.953 2.865) 6.137 13.314 ( 3.584 4.825 0.201) 6.014 13.420 ( -0.864 -2.348 13.747) 13.973 14.929 ( -13.213 -24.047 -26.626) 38.233 15.640 ( 0.688 1.225 -2.149) 2.567 15.821 ( -3.567 5.757 -7.184) 9.873 15.903 ( -0.792 -2.772 -1.624) 3.308 16.056 ( -2.701 4.704 -2.978) 6.188 18.749 ( 13.238 9.218 26.026) 30.620 19.443 ( 1.785 3.006 -5.034) 6.129 21.449 ( -0.512 -1.486 1.894) 2.462 21.624 ( -1.033 -1.675 -3.077) 3.653 ======================= Grid point 111 (43/160) ======================= q-point: ( 0.20 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( 13.573 10.303 12.694) 21.249 1.320 ( 8.663 8.700 10.799) 16.351 1.700 ( 5.329 3.218 -10.764) 12.435 1.757 ( 10.364 6.327 -4.235) 12.860 2.131 ( 7.498 -2.489 6.411) 10.174 2.242 ( 2.581 -4.341 2.343) 5.567 2.359 ( -2.020 -1.787 5.648) 6.259 2.441 ( -2.036 -4.340 -0.163) 4.797 2.546 ( -2.616 -0.557 1.412) 3.025 2.604 ( 0.396 -0.350 0.117) 0.542 2.748 ( 1.808 0.577 -2.817) 3.396 2.887 ( 3.520 -0.367 -0.188) 3.544 2.997 ( 3.740 13.145 -0.529) 13.677 3.127 ( -3.791 9.832 -1.908) 10.709 3.380 ( -3.323 0.482 5.252) 6.234 3.601 ( -3.534 3.025 0.462) 4.675 3.623 ( 1.569 3.582 -0.516) 3.944 3.737 ( -1.660 6.416 5.193) 8.419 3.785 ( 1.050 0.009 0.644) 1.232 3.814 ( -2.161 0.333 -8.020) 8.313 3.842 ( 0.452 2.209 0.978) 2.458 3.989 ( -0.187 4.293 0.658) 4.347 5.753 ( -5.244 -0.741 -3.624) 6.418 5.964 ( -8.382 -2.382 -5.060) 10.076 6.179 ( -4.583 6.771 -3.027) 8.718 6.245 ( -1.481 0.907 3.927) 4.294 6.527 ( -0.664 2.939 3.070) 4.301 6.850 ( -1.687 -1.758 4.135) 4.799 6.991 ( 5.406 3.648 2.843) 7.115 7.056 ( 1.518 -6.483 -2.890) 7.258 7.131 ( 1.623 1.540 0.624) 2.322 7.351 ( 3.641 -0.940 1.299) 3.979 7.418 ( -1.368 3.385 0.937) 3.769 7.608 ( 7.432 -0.295 -2.832) 7.959 7.683 ( -0.200 1.590 -10.623) 10.743 7.781 ( 2.951 0.599 4.153) 5.130 8.033 ( -0.763 0.239 -1.939) 2.097 8.199 ( -0.782 1.595 -3.045) 3.526 8.567 ( -6.969 -1.819 -2.540) 7.638 8.661 ( -4.795 -0.273 3.454) 5.916 8.782 ( -3.794 -1.597 6.212) 7.452 9.015 ( -8.842 -0.535 -6.140) 10.778 9.459 ( -1.197 -3.786 5.065) 6.436 9.494 ( -7.642 -2.798 2.368) 8.475 10.337 ( 2.300 9.375 6.589) 11.687 10.527 ( 3.885 5.531 -4.605) 8.179 10.767 ( 24.463 -9.579 2.619) 26.402 10.845 ( 11.274 -7.254 -4.541) 14.154 13.258 ( 4.209 4.872 2.214) 6.808 13.397 ( 6.769 11.868 -0.924) 13.694 13.564 ( -4.715 -7.248 18.321) 20.259 14.344 ( -15.219 -7.959 -28.353) 33.149 15.624 ( -0.254 2.501 -1.027) 2.715 15.702 ( -2.502 2.286 -4.070) 5.296 15.865 ( -2.612 0.820 0.036) 2.738 16.024 ( -2.097 6.783 0.458) 7.114 19.212 ( 11.107 -1.135 17.696) 20.924 19.430 ( 5.487 -0.982 -6.931) 8.894 21.461 ( -1.077 -1.711 2.287) 3.053 21.563 ( -1.588 -1.523 -3.364) 4.020 ======================= Grid point 112 (44/160) ======================= q-point: ( 0.30 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 7.901 6.926 3.552) 11.091 1.609 ( 12.424 8.194 6.811) 16.367 1.756 ( 8.733 2.741 -1.908) 9.349 1.847 ( 8.795 3.748 -5.984) 11.279 2.204 ( -2.523 -5.364 2.278) 6.350 2.250 ( -2.563 -2.531 1.117) 3.771 2.367 ( -1.651 -4.024 1.515) 4.606 2.402 ( -9.533 -0.224 -1.834) 9.710 2.492 ( -2.289 -1.505 3.971) 4.824 2.592 ( -1.759 0.126 -1.535) 2.338 2.718 ( -2.299 -0.850 -2.960) 3.843 2.831 ( -9.644 0.685 -0.674) 9.692 3.034 ( 5.105 4.353 -0.661) 6.741 3.137 ( 7.303 5.108 -1.408) 9.022 3.409 ( -0.856 7.195 -2.970) 7.831 3.492 ( -1.981 6.307 -2.495) 7.066 3.661 ( 4.551 -0.780 3.136) 5.582 3.693 ( 2.886 4.881 -2.982) 6.407 3.809 ( -1.346 -0.548 3.115) 3.437 3.876 ( 5.193 2.518 -2.907) 6.462 3.916 ( 3.387 6.397 8.263) 10.986 4.112 ( 7.635 4.657 4.254) 9.904 5.657 ( -2.084 0.262 -2.387) 3.180 5.763 ( -8.996 -3.646 -3.944) 10.478 6.078 ( -5.283 7.569 -1.824) 9.409 6.120 ( -7.201 7.801 -3.493) 11.176 6.653 ( 1.853 -2.370 9.171) 9.651 6.786 ( -5.784 -9.183 -0.566) 10.868 7.018 ( 0.832 0.626 -4.011) 4.144 7.131 ( 3.124 -1.258 1.520) 3.695 7.175 ( 0.270 0.939 4.198) 4.310 7.358 ( 2.135 2.257 -5.117) 5.986 7.501 ( 1.253 -2.540 9.558) 9.968 7.575 ( 3.993 -0.293 -12.090) 12.735 7.688 ( 7.712 1.611 -5.009) 9.336 7.850 ( -0.686 6.956 2.191) 7.325 8.052 ( 3.309 0.621 2.610) 4.260 8.176 ( 1.058 2.642 1.527) 3.230 8.477 ( -4.079 -2.591 0.869) 4.910 8.644 ( -0.915 -0.249 2.130) 2.331 8.767 ( -5.211 -0.337 2.165) 5.653 8.787 ( -10.225 -1.038 -4.670) 11.289 9.339 ( -6.821 -3.688 -1.182) 7.844 9.521 ( -4.831 -3.134 5.702) 8.104 10.430 ( 2.006 5.245 2.445) 6.124 10.469 ( 2.167 6.232 -4.996) 8.276 11.051 ( 14.456 -10.254 0.314) 17.726 11.153 ( 16.953 -8.890 1.446) 19.197 13.366 ( 5.450 6.918 3.187) 9.366 13.497 ( 6.781 16.320 -1.512) 17.738 13.679 ( -6.726 -8.014 17.104) 20.050 13.856 ( -8.830 1.948 -20.965) 22.832 15.611 ( -0.846 4.986 0.417) 5.074 15.652 ( 0.280 1.512 -0.946) 1.805 15.816 ( -4.308 2.695 1.376) 5.264 15.972 ( -4.650 9.549 -0.097) 10.622 19.422 ( 7.443 -7.484 -6.741) 12.525 19.532 ( 5.960 -7.437 7.036) 11.846 21.466 ( -1.429 -1.876 2.024) 3.108 21.503 ( -1.356 -1.236 -2.434) 3.048 ======================= Grid point 113 (45/160) ======================= q-point: ( 0.40 0.12 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 4.340 5.168 0.543) 6.770 1.799 ( 9.328 7.384 -4.110) 12.587 1.870 ( 5.904 2.799 -0.864) 6.591 1.933 ( 4.782 0.726 1.240) 4.993 2.094 ( -8.978 -1.590 -0.906) 9.163 2.205 ( -6.236 1.136 3.090) 7.051 2.273 ( -2.200 -1.228 1.795) 3.094 2.373 ( -0.458 -1.691 0.819) 1.934 2.479 ( -4.692 -0.555 -3.417) 5.831 2.519 ( -2.053 -5.089 1.274) 5.634 2.636 ( -3.737 -0.536 -1.280) 3.986 2.672 ( -3.708 2.101 -3.256) 5.363 3.153 ( 5.558 1.256 2.683) 6.298 3.238 ( 5.256 1.547 -1.158) 5.600 3.340 ( -0.682 7.961 -1.530) 8.135 3.506 ( 2.766 10.256 0.626) 10.641 3.715 ( 2.756 6.816 -2.441) 7.747 3.748 ( -3.519 -2.591 2.488) 5.028 3.808 ( 1.709 2.695 -1.787) 3.658 3.944 ( 9.304 -1.996 -4.617) 10.576 4.041 ( 2.775 2.522 2.313) 4.406 4.256 ( 3.463 5.894 3.049) 7.486 5.596 ( -3.393 -1.470 -3.640) 5.189 5.633 ( -2.026 0.195 0.573) 2.114 5.957 ( -5.550 6.609 1.853) 8.827 6.058 ( -0.235 8.480 0.002) 8.484 6.621 ( -7.232 -10.781 0.016) 12.982 6.793 ( -0.403 -2.587 3.348) 4.250 6.968 ( 2.114 0.785 -5.745) 6.171 7.165 ( -1.876 1.096 2.109) 3.028 7.198 ( -1.498 -3.001 -0.418) 3.380 7.355 ( 4.189 -5.179 -3.864) 7.701 7.490 ( 2.369 0.714 -8.346) 8.705 7.630 ( 3.857 1.945 1.781) 4.672 7.758 ( 4.472 2.918 -0.172) 5.343 7.845 ( -0.120 10.492 1.217) 10.563 8.175 ( 4.540 -0.825 5.935) 7.518 8.279 ( 3.531 2.326 5.373) 6.837 8.422 ( -3.844 0.219 0.758) 3.924 8.557 ( -7.071 -3.695 -3.690) 8.791 8.618 ( -8.434 -1.847 1.449) 8.754 8.763 ( 2.323 1.356 2.102) 3.413 9.252 ( -3.028 -3.202 0.196) 4.411 9.441 ( -7.565 -3.066 -0.155) 8.164 10.488 ( 5.374 4.213 0.187) 6.831 10.507 ( -0.073 3.744 4.330) 5.725 11.229 ( 7.703 -11.345 -2.079) 13.870 11.358 ( 8.311 -8.577 -1.672) 12.059 13.484 ( 3.978 9.825 -2.092) 10.804 13.539 ( -2.027 9.401 -11.187) 14.752 13.600 ( 3.673 5.744 3.638) 7.728 13.760 ( -6.174 2.962 13.075) 14.760 15.613 ( -0.658 9.385 2.012) 9.621 15.685 ( 2.752 4.793 1.630) 5.762 15.771 ( -3.489 2.982 2.774) 5.363 15.883 ( -5.691 6.976 0.596) 9.023 19.454 ( 7.278 -11.079 -7.899) 15.431 19.624 ( 1.036 -13.009 -1.419) 13.127 21.461 ( -0.489 -1.561 0.279) 1.660 21.472 ( -1.219 -1.195 0.436) 1.762 ======================= Grid point 114 (46/160) ======================= q-point: (-0.50 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -3.102 3.813 -2.670) 5.594 1.858 ( 3.133 6.595 -4.222) 8.435 1.922 ( 1.260 2.234 -0.722) 2.664 1.931 ( -1.720 0.812 -1.858) 2.659 2.095 ( 4.528 0.046 5.756) 7.323 2.170 ( -2.939 1.974 4.770) 5.941 2.272 ( -3.563 -1.856 3.840) 5.558 2.353 ( 0.184 -2.715 -4.519) 5.275 2.378 ( 1.225 -0.265 -2.382) 2.691 2.525 ( -0.502 -5.591 0.662) 5.652 2.580 ( 0.375 -2.076 -4.933) 5.365 2.640 ( 2.491 3.180 -0.194) 4.044 3.216 ( -0.544 1.498 0.700) 1.741 3.310 ( 1.797 3.067 2.941) 4.613 3.355 ( 2.841 5.734 1.270) 6.524 3.510 ( -4.458 11.466 -0.476) 12.312 3.641 ( -1.744 -0.300 -7.856) 8.053 3.707 ( 0.451 3.479 -5.740) 6.727 3.832 ( 1.991 6.839 1.419) 7.263 3.986 ( -5.519 -3.435 -0.821) 6.553 4.068 ( 4.113 -1.529 -1.362) 4.595 4.282 ( -2.880 7.383 0.198) 7.928 5.552 ( 1.784 -0.007 -0.935) 2.015 5.632 ( 1.923 3.890 -0.508) 4.369 5.971 ( 0.577 3.516 6.560) 7.465 6.085 ( 0.978 8.079 2.827) 8.615 6.541 ( -1.397 -12.055 -0.023) 12.136 6.785 ( -0.963 -3.095 -0.609) 3.298 6.969 ( 3.927 0.886 -4.010) 5.682 7.098 ( -3.987 -3.712 -7.208) 9.035 7.130 ( -3.330 1.709 -0.729) 3.813 7.358 ( 3.422 -5.636 -8.914) 11.088 7.473 ( 0.757 1.292 2.000) 2.498 7.709 ( 5.695 6.627 -1.553) 8.875 7.807 ( 0.914 1.547 2.133) 2.789 7.896 ( 0.923 7.172 3.701) 8.124 8.213 ( -5.207 -0.388 1.211) 5.360 8.318 ( -4.515 2.977 3.008) 6.188 8.419 ( -2.293 -2.712 1.219) 3.755 8.475 ( -2.102 -2.836 6.049) 7.004 8.589 ( 6.351 -0.202 1.234) 6.473 8.823 ( -0.016 -0.476 2.625) 2.668 9.242 ( 0.728 -3.171 1.249) 3.485 9.327 ( -2.079 -2.869 -4.119) 5.433 10.517 ( -3.011 3.226 3.521) 5.645 10.615 ( 2.441 3.407 7.754) 8.814 11.243 ( -0.136 -10.599 -5.862) 12.112 11.387 ( -0.085 -8.095 -4.820) 9.421 13.381 ( -0.008 0.447 -7.274) 7.288 13.457 ( -2.123 -0.327 -6.609) 6.949 13.776 ( -4.854 18.264 9.070) 20.962 13.818 ( 6.644 17.078 10.638) 21.189 15.630 ( -0.139 10.779 2.175) 10.997 15.709 ( -3.329 5.669 0.895) 6.635 15.798 ( 1.013 3.472 5.623) 6.686 15.865 ( 1.009 3.036 4.917) 5.867 19.474 ( 5.655 -13.673 -7.021) 16.378 19.539 ( -3.556 -14.728 -9.463) 17.864 21.456 ( -1.704 -1.406 1.094) 2.466 21.477 ( 1.761 -1.025 0.515) 2.101 ======================= Grid point 115 (47/160) ======================= q-point: (-0.40 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( -10.151 4.365 -5.510) 12.348 1.705 ( -15.681 5.215 -1.843) 16.628 1.934 ( 5.517 6.989 -6.624) 11.098 1.946 ( 0.134 1.266 4.521) 4.697 2.167 ( -4.244 -2.087 3.384) 5.815 2.232 ( -0.208 -1.235 1.799) 2.192 2.322 ( 8.768 -0.379 3.585) 9.480 2.331 ( 1.692 0.349 -1.950) 2.605 2.429 ( 2.151 -7.547 5.001) 9.306 2.503 ( 1.837 -3.866 -4.240) 6.025 2.578 ( 7.114 -1.099 -6.802) 9.904 2.703 ( 4.585 2.661 -0.238) 5.307 3.172 ( -5.496 2.632 0.355) 6.104 3.292 ( -5.277 3.527 0.757) 6.392 3.365 ( -2.518 6.104 -8.089) 10.442 3.471 ( 1.769 2.067 0.370) 2.746 3.502 ( -2.808 1.211 -10.726) 11.154 3.637 ( -1.407 7.009 -2.217) 7.485 3.817 ( -2.240 5.497 1.749) 6.189 3.969 ( 0.546 3.708 9.410) 10.129 4.083 ( -3.339 -0.512 -1.189) 3.581 4.161 ( -8.805 6.237 -1.071) 10.844 5.615 ( 5.810 2.470 -0.151) 6.315 5.700 ( 7.119 4.999 -0.760) 8.732 6.093 ( 3.739 1.667 6.317) 7.527 6.143 ( 2.171 6.678 3.054) 7.657 6.575 ( 1.969 -8.435 3.343) 9.285 6.763 ( -1.750 -5.213 -0.322) 5.509 6.935 ( -1.464 -6.087 -10.204) 11.971 6.994 ( 4.260 -0.007 -3.294) 5.385 7.054 ( -0.853 2.335 -6.479) 6.940 7.305 ( 1.278 0.608 -4.772) 4.978 7.497 ( -2.564 3.287 2.584) 4.905 7.730 ( -0.370 -0.622 -4.118) 4.181 7.853 ( 1.878 5.399 2.638) 6.295 7.950 ( 2.584 1.989 2.402) 4.050 8.173 ( -8.765 -1.780 5.810) 10.665 8.239 ( -4.629 1.462 4.864) 6.872 8.386 ( 1.432 1.091 0.743) 1.948 8.588 ( 1.560 -2.353 3.831) 4.759 8.714 ( 4.308 -0.488 1.079) 4.468 8.825 ( 0.116 -1.689 2.004) 2.623 9.282 ( 3.154 -3.468 -3.430) 5.809 9.313 ( 4.813 -2.986 0.222) 5.668 10.487 ( -6.608 4.754 5.080) 9.595 10.732 ( -1.237 2.637 9.970) 10.386 11.113 ( -5.245 -8.499 -7.129) 12.270 11.247 ( -8.186 -7.791 -7.556) 13.594 13.314 ( -3.993 -4.179 -7.836) 9.737 13.341 ( 0.134 -0.569 -1.803) 1.895 13.736 ( -8.447 25.165 5.598) 27.129 14.119 ( 13.901 15.299 10.301) 23.096 15.641 ( -0.664 8.819 0.222) 8.847 15.704 ( 1.184 5.187 3.708) 6.484 15.875 ( -0.480 -0.614 6.481) 6.528 15.987 ( 3.558 5.678 7.479) 10.042 19.294 ( -9.242 -12.954 -14.596) 21.593 19.476 ( 3.754 -14.579 -6.065) 16.230 21.438 ( -1.270 -1.275 0.203) 1.811 21.529 ( 2.889 -1.154 1.467) 3.439 ======================= Grid point 116 (48/160) ======================= q-point: (-0.30 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( -16.172 6.972 -5.970) 18.595 1.374 ( -19.393 9.760 -3.591) 22.005 1.894 ( -3.885 13.031 -4.068) 14.194 2.034 ( -0.668 -0.591 7.850) 7.901 2.131 ( 0.031 -4.477 2.383) 5.072 2.227 ( -0.765 -1.137 -1.444) 1.991 2.327 ( -11.316 -1.794 -0.206) 11.459 2.401 ( -0.499 1.249 0.345) 1.388 2.496 ( 4.265 -0.785 -4.147) 6.001 2.520 ( 4.391 -11.065 3.334) 12.362 2.640 ( 8.765 -0.190 -5.837) 10.532 2.759 ( 4.056 4.242 -2.926) 6.558 3.065 ( -4.974 2.591 -2.351) 6.081 3.196 ( -4.126 5.433 0.623) 6.850 3.264 ( 0.805 3.172 -6.006) 6.840 3.360 ( -1.098 -0.590 -6.057) 6.184 3.419 ( -2.176 2.777 -3.733) 5.136 3.651 ( 3.543 8.126 1.275) 8.956 3.840 ( -11.937 6.960 -7.912) 15.923 3.940 ( 4.573 11.045 7.507) 14.116 4.065 ( -5.336 -1.670 2.821) 6.262 4.186 ( 6.488 -0.228 13.389) 14.880 5.719 ( 6.450 2.291 0.303) 6.851 5.822 ( 10.325 6.000 -3.211) 12.366 6.149 ( -0.662 -0.147 -2.730) 2.813 6.249 ( 2.999 6.263 6.103) 9.245 6.632 ( -2.691 -1.369 5.975) 6.694 6.700 ( -1.450 -5.129 -5.284) 7.506 6.854 ( 1.820 -2.368 -4.357) 5.282 6.987 ( 2.845 -1.613 -5.875) 6.724 7.054 ( 5.842 -4.729 -0.317) 7.523 7.306 ( 2.250 3.179 -0.633) 3.946 7.442 ( -3.540 4.812 -2.771) 6.585 7.654 ( -4.207 -1.045 -1.364) 4.544 7.893 ( 0.011 7.143 0.867) 7.196 8.038 ( 4.461 -5.179 0.872) 6.891 8.075 ( -7.949 0.767 8.117) 11.387 8.280 ( -1.886 -0.013 5.219) 5.549 8.463 ( 6.084 0.370 0.712) 6.136 8.589 ( -3.828 -2.612 -0.187) 4.638 8.700 ( -1.200 0.685 -0.070) 1.383 8.954 ( 9.557 -1.430 1.338) 9.755 9.290 ( 2.645 -1.824 -2.857) 4.300 9.421 ( 6.160 -3.933 1.395) 7.440 10.420 ( -10.508 5.248 7.202) 13.778 10.746 ( -8.999 1.985 3.089) 9.719 10.949 ( -14.368 -8.593 -9.143) 19.075 10.999 ( -2.094 -5.937 -0.028) 6.296 13.174 ( -2.628 -2.612 -5.734) 6.827 13.312 ( -2.825 3.204 -0.059) 4.272 13.648 ( -9.186 23.635 4.570) 25.766 14.500 ( 20.604 -0.545 6.004) 21.468 15.655 ( 2.274 8.162 0.248) 8.476 15.778 ( -0.044 5.359 4.858) 7.234 15.940 ( 3.278 7.470 1.460) 8.287 16.140 ( 1.825 -1.222 12.540) 12.731 18.905 ( -16.122 -7.223 -16.472) 24.154 19.459 ( 2.125 -14.400 -4.955) 15.377 21.422 ( -0.516 -1.267 -0.308) 1.402 21.595 ( 2.934 -1.435 1.334) 3.528 ======================= Grid point 117 (49/160) ======================= q-point: (-0.20 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.890 ( -17.817 13.623 0.308) 22.431 1.028 ( -19.436 15.248 -0.195) 24.704 1.733 ( -13.259 18.622 -1.225) 22.893 1.843 ( -32.201 4.859 -2.084) 32.632 2.048 ( -3.099 -0.140 3.389) 4.595 2.148 ( -1.514 -5.278 -1.642) 5.731 2.338 ( 8.474 -0.772 4.893) 9.816 2.471 ( 5.417 -1.331 -1.355) 5.740 2.524 ( 3.434 0.892 -0.302) 3.560 2.631 ( 4.156 -7.128 2.846) 8.728 2.716 ( 6.611 -1.746 -3.244) 7.568 2.771 ( 0.268 7.568 -0.384) 7.583 2.974 ( -2.131 0.795 -3.011) 3.773 3.150 ( 1.219 7.020 -4.780) 8.580 3.268 ( 2.451 5.186 -1.815) 6.016 3.286 ( 0.488 1.264 -4.558) 4.755 3.354 ( -2.910 4.396 -0.118) 5.273 3.573 ( -7.576 3.022 -3.245) 8.779 3.801 ( 7.439 6.498 3.326) 10.422 3.935 ( -10.430 2.088 -0.114) 10.637 4.119 ( 6.361 6.015 3.692) 9.501 4.495 ( 11.381 -6.151 10.207) 16.479 5.819 ( 6.125 -1.009 -0.939) 6.278 5.962 ( 11.377 8.220 -3.447) 14.453 6.031 ( -4.974 0.309 -6.487) 8.180 6.350 ( 1.790 5.279 3.986) 6.853 6.554 ( -5.053 2.533 -5.349) 7.782 6.667 ( -3.262 0.209 6.303) 7.100 6.907 ( 4.790 -7.141 1.730) 8.771 6.995 ( 3.304 -1.542 -2.906) 4.662 7.162 ( 6.273 -2.796 0.891) 6.925 7.296 ( -4.175 4.808 -2.661) 6.901 7.372 ( 1.288 -1.132 -2.991) 3.448 7.547 ( -7.477 0.324 -0.930) 7.541 7.926 ( 2.638 4.862 1.960) 5.869 8.046 ( 0.568 5.033 3.347) 6.071 8.174 ( 3.133 -1.371 5.186) 6.212 8.270 ( -2.422 -2.282 1.695) 3.735 8.472 ( -4.146 -5.900 -5.808) 9.259 8.559 ( 3.913 -0.886 -0.273) 4.021 8.761 ( 6.226 3.850 1.809) 7.540 9.106 ( 7.564 -0.156 -0.199) 7.569 9.321 ( 2.553 0.838 1.861) 3.269 9.532 ( 5.174 -3.174 2.090) 6.420 10.298 ( -14.837 2.052 6.388) 16.283 10.546 ( -21.018 -8.414 -6.114) 23.450 10.569 ( -12.270 -1.557 -1.862) 12.508 11.040 ( 2.004 -4.581 1.929) 5.359 13.112 ( -0.587 0.427 -0.511) 0.887 13.256 ( -3.482 5.225 0.122) 6.280 13.547 ( -9.145 17.517 3.609) 20.088 14.888 ( 22.384 -18.190 -1.374) 28.876 15.705 ( 3.635 9.516 -0.955) 10.232 15.784 ( -3.027 1.401 1.314) 3.585 16.001 ( 3.151 11.626 -1.483) 12.137 16.374 ( 7.396 -2.886 14.504) 16.535 18.416 ( -21.881 3.700 -12.047) 25.251 19.437 ( 0.903 -12.885 -2.583) 13.172 21.416 ( 0.156 -1.294 -0.213) 1.321 21.647 ( 2.178 -1.662 0.390) 2.767 ======================= Grid point 118 (50/160) ======================= q-point: (-0.10 0.12 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.696 ( -12.919 20.409 9.118) 25.818 0.782 ( -15.506 19.734 9.280) 26.758 1.266 ( -31.906 25.242 11.557) 42.294 1.611 ( -6.932 13.041 0.727) 14.787 2.022 ( -2.911 1.474 -0.153) 3.266 2.140 ( 0.577 -6.715 2.724) 7.269 2.462 ( 4.986 -2.619 -1.766) 5.903 2.526 ( 4.257 1.090 -4.079) 5.996 2.578 ( 1.215 3.142 -0.657) 3.433 2.687 ( -0.866 -1.759 -3.463) 3.980 2.749 ( -1.303 3.542 3.728) 5.305 2.784 ( 4.335 -2.694 -3.048) 5.944 2.964 ( 2.958 5.387 1.008) 6.228 3.141 ( 5.365 5.206 -4.116) 8.534 3.277 ( 1.227 6.555 0.404) 6.681 3.327 ( 5.737 4.220 1.161) 7.216 3.380 ( 5.579 6.091 2.517) 8.635 3.511 ( -2.630 3.503 6.850) 8.131 3.773 ( -7.545 1.935 2.899) 8.311 3.922 ( 3.443 4.499 0.332) 5.675 4.135 ( -5.703 -4.280 -7.402) 10.278 4.698 ( 5.710 -9.518 -2.871) 11.464 5.880 ( 2.065 -0.027 -2.110) 2.952 5.933 ( 1.910 -2.151 -1.479) 3.235 6.101 ( 7.530 10.391 0.543) 12.845 6.348 ( 0.895 4.980 -8.331) 9.747 6.491 ( -1.040 4.068 4.480) 6.140 6.701 ( -4.270 -0.070 8.007) 9.074 6.988 ( 3.057 -5.032 -0.195) 5.891 7.025 ( 2.492 -2.525 2.287) 4.221 7.173 ( -3.971 0.482 -2.195) 4.563 7.254 ( 1.739 4.698 -1.504) 5.231 7.335 ( -1.503 -4.339 -1.151) 4.734 7.425 ( -5.187 0.253 -0.787) 5.252 7.930 ( -1.354 -2.596 -3.873) 4.855 8.131 ( -1.042 0.407 0.496) 1.224 8.269 ( -1.341 -6.006 -0.878) 6.216 8.338 ( 22.078 17.788 -3.387) 28.554 8.398 ( 0.158 -7.149 -1.781) 7.369 8.603 ( 3.256 0.846 4.940) 5.977 8.877 ( 6.503 5.099 -1.968) 8.494 9.200 ( 3.349 -0.594 2.152) 4.025 9.382 ( 2.258 3.342 -1.652) 4.359 9.656 ( 1.234 -3.562 8.526) 9.322 10.057 ( -18.187 -2.676 -6.706) 19.568 10.127 ( -24.808 -11.609 9.992) 29.155 10.388 ( -8.645 2.183 -0.729) 8.946 11.067 ( 1.357 -4.343 -2.515) 5.199 13.122 ( -1.157 4.131 2.786) 5.115 13.227 ( -0.473 3.784 1.587) 4.131 13.421 ( -8.966 8.872 -0.397) 12.620 15.167 ( 17.369 -26.537 -7.284) 32.541 15.694 ( 0.170 3.430 -6.087) 6.989 15.786 ( 2.786 4.635 1.336) 5.570 16.003 ( -1.198 3.099 -0.530) 3.365 16.584 ( 4.953 -6.297 -5.919) 9.961 18.048 ( -14.821 20.096 9.717) 26.794 19.446 ( 0.314 -6.656 2.874) 7.257 21.422 ( 0.366 -1.286 0.372) 1.388 21.672 ( 1.109 -1.748 -0.877) 2.248 ======================= Grid point 119 (51/160) ======================= q-point: ( 0.00 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -2.577 19.966 5.919) 20.983 1.149 ( -4.189 18.371 10.391) 21.517 1.622 ( -0.317 12.982 6.637) 14.584 1.953 ( -0.953 2.227 -4.251) 4.893 2.052 ( -0.920 15.498 3.054) 15.823 2.183 ( 1.031 6.570 8.347) 10.673 2.282 ( -1.574 -5.723 -11.122) 12.606 2.496 ( -1.561 -3.563 -2.518) 4.634 2.540 ( 1.767 -1.878 -1.598) 3.033 2.650 ( 3.372 -2.672 -5.040) 6.627 2.777 ( -0.322 2.147 -2.400) 3.237 2.803 ( 0.079 1.422 -1.897) 2.372 3.209 ( 1.969 4.355 7.379) 8.792 3.337 ( 4.176 7.864 0.699) 8.931 3.490 ( -0.494 9.893 4.863) 11.035 3.505 ( -3.519 0.395 12.191) 12.695 3.596 ( 4.351 4.425 -4.538) 7.688 3.721 ( 3.709 5.480 3.550) 7.509 3.763 ( -6.148 -1.132 1.152) 6.357 3.852 ( 0.830 8.726 -0.519) 8.781 4.042 ( -1.014 6.185 -1.714) 6.498 4.408 ( -3.511 -9.023 -9.562) 13.607 5.875 ( 0.347 -3.118 -0.834) 3.246 5.894 ( 3.387 -1.902 -3.533) 5.251 6.377 ( -4.905 5.941 -2.373) 8.061 6.479 ( 2.993 11.877 3.599) 12.766 6.610 ( 2.964 -0.023 4.768) 5.614 6.690 ( -3.112 6.007 -0.258) 6.770 6.947 ( 0.837 -2.963 -4.108) 5.134 7.057 ( 1.518 -2.506 5.158) 5.932 7.194 ( 0.925 1.626 0.030) 1.871 7.230 ( -0.525 -0.452 -3.506) 3.573 7.307 ( 2.662 -1.582 1.408) 3.402 7.462 ( 0.572 7.525 -1.099) 7.627 7.776 ( -0.019 -3.140 -7.855) 8.459 7.980 ( -3.518 -6.483 -4.204) 8.490 8.090 ( 2.581 -7.859 0.039) 8.272 8.240 ( -1.823 -4.815 -1.174) 5.281 8.552 ( -0.061 1.523 1.109) 1.885 8.839 ( -3.084 0.480 -0.501) 3.161 9.002 ( -1.435 1.459 -5.165) 5.556 9.212 ( 1.227 -3.570 3.814) 5.366 9.413 ( 0.038 -1.360 -3.145) 3.427 9.551 ( 1.035 5.824 7.956) 9.914 9.837 ( -5.432 -4.729 -1.979) 7.469 10.112 ( 1.687 3.247 10.459) 11.080 10.469 ( 1.746 8.834 4.776) 10.193 10.927 ( -0.155 -4.612 -4.355) 6.346 13.234 ( -1.742 4.652 2.661) 5.635 13.383 ( -2.680 9.074 1.300) 9.551 13.443 ( 0.045 7.457 0.993) 7.523 14.630 ( 4.291 -29.030 -13.505) 32.304 15.686 ( 0.921 2.019 -4.944) 5.420 15.813 ( 1.297 -3.180 0.014) 3.435 15.852 ( -4.135 -5.148 1.387) 6.747 16.270 ( -1.616 -7.079 -15.988) 17.560 18.730 ( 2.644 24.868 19.363) 31.628 19.525 ( 0.810 2.361 4.146) 4.840 21.404 ( 0.039 -1.404 0.882) 1.658 21.608 ( 0.031 -3.576 -2.042) 4.118 ======================= Grid point 120 (52/160) ======================= q-point: ( 0.10 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.232 ( 8.838 15.268 10.173) 20.365 1.268 ( 2.602 12.976 12.407) 18.141 1.731 ( 6.696 6.944 1.097) 9.708 1.868 ( 0.109 3.232 -10.012) 10.521 2.090 ( 2.648 7.291 0.583) 7.779 2.137 ( -0.391 -6.020 -4.602) 7.587 2.293 ( -0.507 4.137 6.121) 7.406 2.438 ( -3.184 -2.766 -2.102) 4.712 2.552 ( 0.120 -2.519 0.029) 2.522 2.601 ( -0.802 1.092 -2.951) 3.247 2.767 ( 0.234 1.586 -1.234) 2.023 2.801 ( 2.235 -1.761 -0.630) 2.914 3.271 ( 1.559 13.900 2.571) 14.221 3.388 ( -1.776 5.275 5.115) 7.559 3.497 ( -5.778 10.280 -0.439) 11.801 3.592 ( 0.024 4.876 8.299) 9.625 3.613 ( -2.672 -2.395 11.426) 11.976 3.716 ( 1.375 4.924 2.858) 5.857 3.858 ( 6.461 3.258 -1.437) 7.378 3.906 ( 4.180 5.104 -5.033) 8.298 3.981 ( -3.749 7.204 -1.010) 8.184 4.195 ( -5.643 -1.827 -10.619) 12.163 5.846 ( -2.455 -1.496 -2.000) 3.502 5.938 ( 5.324 -6.219 -2.824) 8.660 6.241 ( -8.409 4.458 1.088) 9.580 6.449 ( -4.100 9.417 -2.394) 10.546 6.681 ( -0.892 3.035 4.868) 5.805 6.806 ( 5.449 5.384 4.059) 8.669 6.880 ( 0.240 -2.192 -0.520) 2.265 7.059 ( -6.913 -3.505 0.503) 7.767 7.151 ( -0.406 0.808 -1.696) 1.922 7.258 ( 6.766 0.265 -4.463) 8.110 7.412 ( 5.475 -0.270 2.860) 6.183 7.519 ( 3.328 2.226 2.804) 4.888 7.695 ( 1.803 -1.120 -5.778) 6.155 7.870 ( -2.559 -3.088 -5.928) 7.157 8.141 ( -2.389 2.467 -7.686) 8.419 8.146 ( 4.424 -6.082 -1.309) 7.634 8.568 ( -4.999 -2.857 8.920) 10.616 8.761 ( -4.359 -0.620 3.247) 5.471 8.845 ( -9.403 4.816 -5.540) 11.929 9.240 ( 0.795 -1.723 -7.882) 8.108 9.310 ( -7.854 -1.218 6.022) 9.972 9.526 ( -12.208 -4.273 6.184) 14.337 10.085 ( 26.108 -6.621 3.147) 27.118 10.310 ( 10.952 -0.607 4.780) 11.965 10.560 ( 1.599 10.390 4.214) 11.325 10.844 ( -2.351 -0.916 -6.365) 6.847 13.255 ( -1.068 1.189 6.972) 7.153 13.376 ( 0.030 5.458 2.638) 6.062 13.554 ( 10.149 11.424 -0.902) 15.308 14.459 ( -0.793 -20.431 -19.266) 28.093 15.653 ( 1.132 0.428 -3.837) 4.023 15.825 ( 1.506 -3.079 -5.363) 6.365 15.866 ( 2.222 -1.567 1.214) 2.978 16.085 ( 0.566 -2.860 -8.617) 9.097 19.005 ( 1.282 14.685 20.594) 25.326 19.508 ( -5.990 2.917 1.698) 6.876 21.414 ( -0.534 -1.702 1.453) 2.301 21.572 ( -0.830 -3.274 -2.923) 4.467 ======================= Grid point 121 (53/160) ======================= q-point: ( 0.20 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.472 ( 6.590 9.421 10.791) 15.768 1.547 ( 10.698 11.101 11.254) 19.087 1.774 ( 4.453 3.944 -9.075) 10.851 1.838 ( 7.800 2.269 -3.829) 8.980 2.146 ( 4.796 -4.338 -1.391) 6.615 2.155 ( 2.091 0.344 1.015) 2.350 2.296 ( -4.973 -2.006 1.597) 5.595 2.370 ( -1.934 -1.221 2.946) 3.730 2.528 ( -2.548 -2.064 -0.563) 3.327 2.598 ( 1.347 -0.489 -0.858) 1.670 2.741 ( -1.187 -1.643 -2.264) 3.038 2.828 ( 0.693 -4.232 -0.059) 4.289 3.261 ( -6.528 9.463 -1.873) 11.647 3.355 ( -7.666 11.769 -0.749) 14.066 3.499 ( 4.310 9.572 10.066) 14.544 3.631 ( -3.965 0.258 3.604) 5.364 3.689 ( -1.179 2.800 5.694) 6.454 3.792 ( -0.905 1.600 -7.178) 7.410 3.832 ( 3.621 5.436 -2.407) 6.961 3.914 ( 3.991 4.972 -3.999) 7.526 3.954 ( 0.986 9.108 3.769) 9.906 4.119 ( 4.079 8.763 1.979) 9.866 5.758 ( -2.634 1.017 -4.457) 5.276 5.874 ( -5.452 -5.473 -7.747) 10.940 6.267 ( 2.107 2.115 9.613) 10.066 6.361 ( -3.459 8.972 -2.235) 9.872 6.589 ( -9.107 1.926 -0.700) 9.335 6.801 ( -8.303 -2.544 -2.676) 9.087 6.939 ( 0.903 -4.712 3.581) 5.987 7.065 ( 7.516 3.425 3.730) 9.062 7.173 ( 0.604 1.752 0.120) 1.857 7.286 ( 0.639 -3.693 0.078) 3.749 7.476 ( 1.192 1.255 -2.266) 2.852 7.587 ( 8.088 -1.112 -3.533) 8.895 7.764 ( 4.280 3.468 -4.604) 7.179 7.766 ( 1.763 -0.427 -0.043) 1.814 8.060 ( 0.510 3.018 -1.236) 3.300 8.200 ( 4.196 -1.980 -1.326) 4.825 8.581 ( -6.801 -0.342 3.867) 7.831 8.626 ( -8.309 1.371 0.294) 8.427 8.769 ( -1.853 -0.066 4.317) 4.699 9.021 ( -10.648 1.152 -6.550) 12.554 9.341 ( -4.636 -7.480 2.182) 9.067 9.418 ( -5.146 -4.524 5.601) 8.850 10.493 ( 11.949 -2.487 1.777) 12.334 10.573 ( 17.404 -6.056 5.216) 19.152 10.631 ( 6.345 3.623 0.033) 7.307 10.720 ( -1.710 1.629 -7.169) 7.548 13.343 ( 0.731 0.575 7.614) 7.671 13.441 ( -1.156 -1.290 9.210) 9.372 13.729 ( 14.926 17.868 -4.060) 23.634 14.212 ( 1.030 -3.221 -22.181) 22.437 15.636 ( 0.790 -0.422 -1.683) 1.906 15.730 ( -0.970 0.455 -6.488) 6.576 15.915 ( 1.504 2.546 1.279) 3.222 16.111 ( 5.142 0.279 -0.602) 5.185 19.208 ( -2.164 1.188 14.232) 14.444 19.408 ( -6.035 -1.106 -0.479) 6.154 21.420 ( -0.979 -1.986 1.740) 2.816 21.519 ( -1.270 -2.746 -3.125) 4.350 ======================= Grid point 122 (54/160) ======================= q-point: ( 0.30 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.688 ( 6.315 7.330 6.657) 11.744 1.780 ( 6.388 7.806 3.770) 10.768 1.841 ( 8.339 5.167 1.875) 9.987 1.901 ( 7.031 2.187 -5.962) 9.475 2.157 ( 0.089 -0.733 -2.478) 2.585 2.198 ( 0.460 -2.178 2.258) 3.171 2.276 ( -0.426 -4.392 3.460) 5.607 2.384 ( -5.698 -1.267 1.897) 6.137 2.447 ( -2.504 -1.983 -1.478) 3.519 2.586 ( -3.030 -1.018 -0.984) 3.345 2.666 ( -3.113 -3.989 -3.423) 6.109 2.805 ( -3.844 -3.632 -0.761) 5.343 3.151 ( -1.572 6.593 -0.032) 6.777 3.250 ( -0.837 6.967 -3.209) 7.716 3.555 ( -4.498 4.424 -0.933) 6.377 3.651 ( -0.019 4.275 -5.916) 7.299 3.697 ( 5.578 6.554 4.874) 9.890 3.743 ( -1.425 0.086 4.438) 4.662 3.872 ( 2.972 6.252 -2.579) 7.387 3.918 ( 1.342 1.805 -0.713) 2.359 4.097 ( 4.251 10.807 7.566) 13.860 4.286 ( 10.354 12.829 2.676) 16.702 5.675 ( -6.054 -2.826 -4.478) 8.043 5.696 ( -0.450 1.709 -4.935) 5.242 6.257 ( -7.522 9.160 -0.096) 11.853 6.301 ( -5.279 8.076 -1.213) 9.724 6.576 ( -5.312 -5.429 5.140) 9.171 6.615 ( -0.083 -5.235 0.721) 5.285 6.998 ( -0.571 -2.117 1.459) 2.634 7.079 ( -1.968 -3.727 -5.124) 6.635 7.214 ( 0.972 0.981 3.063) 3.360 7.273 ( -3.467 -6.564 -0.481) 7.439 7.526 ( 5.983 2.549 2.143) 6.848 7.645 ( 6.988 5.682 -10.590) 13.902 7.724 ( 8.273 2.207 -5.617) 10.241 7.931 ( 4.533 0.496 7.914) 9.134 8.107 ( 1.682 5.059 3.430) 6.339 8.240 ( 1.467 2.630 -0.100) 3.013 8.457 ( -2.862 2.040 0.090) 3.516 8.604 ( -5.591 -3.498 5.009) 8.282 8.699 ( -7.490 -4.383 -6.428) 10.799 8.845 ( -6.449 4.737 3.333) 8.668 9.226 ( -6.408 -7.129 -0.564) 9.602 9.429 ( -4.829 -5.769 4.536) 8.785 10.560 ( 0.657 6.012 0.228) 6.052 10.617 ( -0.456 7.375 -3.103) 8.014 10.806 ( 12.135 -11.423 -1.222) 16.710 10.922 ( 15.767 -12.385 2.207) 20.170 13.450 ( 0.705 -1.596 7.631) 7.828 13.515 ( -1.862 -3.850 7.028) 8.226 13.946 ( 13.101 22.191 -0.844) 25.783 14.004 ( 4.641 14.315 -17.560) 23.126 15.644 ( 0.822 0.195 1.353) 1.595 15.718 ( 4.432 3.635 -0.151) 5.734 15.929 ( -1.439 7.064 0.708) 7.244 16.161 ( 0.551 6.674 -0.189) 6.699 19.231 ( -3.416 -10.049 -1.383) 10.704 19.339 ( -4.383 -10.508 2.743) 11.711 21.422 ( -1.090 -2.115 1.560) 2.845 21.467 ( -1.057 -2.141 -2.113) 3.189 ======================= Grid point 123 (55/160) ======================= q-point: ( 0.40 0.25 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.799 ( 1.617 7.600 1.257) 7.871 1.904 ( 6.062 3.901 -2.320) 7.573 1.942 ( 5.378 2.798 -1.761) 6.313 1.980 ( 4.514 4.061 2.788) 6.682 2.102 ( -4.176 2.293 -3.032) 5.646 2.212 ( -2.199 -0.631 2.735) 3.566 2.263 ( -5.280 -0.071 2.647) 5.907 2.335 ( 2.914 -1.995 1.171) 3.720 2.430 ( -1.358 -3.052 -1.040) 3.498 2.468 ( -6.292 -0.377 -1.983) 6.608 2.594 ( -1.796 -3.316 -3.169) 4.925 2.704 ( -3.763 0.439 -2.829) 4.729 3.207 ( 4.232 3.056 3.349) 6.202 3.259 ( 4.458 1.102 -2.843) 5.401 3.492 ( -3.938 5.427 2.420) 7.129 3.616 ( -0.890 -2.573 -0.643) 2.798 3.747 ( 3.671 2.276 -5.763) 7.202 3.792 ( 1.732 3.371 0.709) 3.856 3.899 ( 3.957 2.338 -4.143) 6.188 3.928 ( -2.113 1.590 2.675) 3.761 4.210 ( 0.653 14.274 5.074) 15.163 4.456 ( 6.757 14.224 1.292) 15.800 5.549 ( -2.883 -1.813 -1.208) 3.613 5.696 ( 3.172 5.099 -1.290) 6.142 6.121 ( -7.948 8.366 1.159) 11.598 6.232 ( -1.862 5.745 -0.125) 6.040 6.438 ( -5.285 -4.475 -2.273) 7.289 6.742 ( 0.330 -2.181 3.806) 4.399 6.935 ( -0.404 -4.205 -3.821) 5.696 7.053 ( 0.980 -6.300 -0.290) 6.382 7.181 ( -4.756 -8.610 -2.126) 10.063 7.214 ( -0.974 -1.184 -1.985) 2.508 7.596 ( 5.107 7.654 -6.436) 11.229 7.714 ( 6.388 5.027 3.036) 8.677 7.813 ( 8.377 2.559 -5.346) 10.262 8.044 ( -1.170 7.749 4.915) 9.251 8.171 ( 3.793 1.021 4.263) 5.796 8.307 ( 1.727 -0.154 4.174) 4.520 8.432 ( -6.708 -0.242 -2.759) 7.258 8.483 ( -3.630 -1.638 1.882) 4.405 8.572 ( -4.768 -2.359 0.277) 5.327 8.806 ( -2.137 2.993 1.951) 4.163 9.155 ( -2.663 -6.158 0.752) 6.751 9.349 ( -7.258 -5.981 -0.057) 9.405 10.594 ( 2.205 5.491 -0.831) 5.975 10.608 ( 0.416 5.642 3.703) 6.762 10.951 ( 7.113 -13.956 -1.761) 15.763 11.128 ( 7.819 -12.848 -0.135) 15.041 13.471 ( -3.061 -5.652 -0.588) 6.454 13.507 ( -0.892 -2.850 -8.072) 8.607 13.986 ( 6.585 23.301 7.103) 25.234 14.196 ( 8.485 29.262 7.889) 31.473 15.695 ( 0.824 -0.157 4.414) 4.493 15.849 ( 7.690 8.399 3.148) 11.815 15.888 ( -2.232 10.780 -0.729) 11.032 16.110 ( -6.078 11.840 -0.743) 13.330 19.146 ( 0.605 -17.918 -7.591) 19.469 19.267 ( -4.265 -20.549 -3.727) 21.316 21.423 ( -0.629 -1.898 1.223) 2.344 21.440 ( -0.543 -1.740 -0.320) 1.851 ======================= Grid point 124 (56/160) ======================= q-point: (-0.50 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( -3.347 6.090 -2.905) 7.532 1.939 ( 3.256 1.682 -3.590) 5.130 1.969 ( -2.624 3.853 0.386) 4.678 2.002 ( -1.183 4.652 -4.050) 6.280 2.112 ( 6.328 1.775 5.199) 8.380 2.192 ( -3.466 -1.143 1.810) 4.074 2.250 ( -2.671 0.476 3.726) 4.609 2.337 ( -1.510 0.570 -1.585) 2.263 2.401 ( 1.995 0.662 -0.448) 2.149 2.419 ( 0.026 -2.321 -1.801) 2.938 2.529 ( 1.376 -2.869 -5.404) 6.271 2.671 ( 2.539 0.199 -1.680) 3.051 3.267 ( -1.354 2.370 -0.183) 2.736 3.321 ( 3.941 -1.702 0.881) 4.382 3.463 ( -4.407 3.010 3.131) 6.188 3.576 ( -0.455 -1.350 -3.731) 3.994 3.760 ( 4.756 3.471 -6.053) 8.444 3.793 ( 1.540 4.040 -2.465) 4.977 3.842 ( -4.918 -3.453 -4.653) 7.600 3.909 ( -1.079 -1.365 0.924) 1.970 4.259 ( -2.138 18.437 5.444) 19.342 4.520 ( -1.211 15.800 1.034) 15.880 5.567 ( 2.960 1.675 3.627) 4.972 5.754 ( 3.936 8.082 0.725) 9.019 6.059 ( -1.591 3.794 2.303) 4.715 6.245 ( 1.350 3.191 3.360) 4.827 6.359 ( -0.452 -1.419 -3.272) 3.595 6.714 ( -1.403 -4.708 -3.066) 5.791 6.914 ( -1.271 -4.731 -1.746) 5.201 7.011 ( -0.754 -2.647 -6.198) 6.782 7.153 ( -0.395 -1.136 -6.441) 6.553 7.173 ( 3.117 -10.346 2.997) 11.214 7.594 ( 1.861 8.227 -3.104) 8.988 7.827 ( 0.750 0.923 -3.918) 4.094 7.858 ( 6.160 7.260 1.534) 9.644 8.044 ( -2.333 5.716 0.437) 6.189 8.209 ( -5.663 0.129 0.133) 5.666 8.319 ( -0.461 -3.286 3.414) 4.760 8.403 ( -4.476 -3.530 6.894) 8.946 8.440 ( -0.494 4.823 2.293) 5.363 8.588 ( 4.969 0.683 1.927) 5.374 8.810 ( -1.281 -0.618 1.264) 1.903 9.146 ( -0.126 -6.119 1.222) 6.241 9.240 ( -1.823 -5.624 -3.633) 6.939 10.601 ( -1.272 4.305 2.074) 4.945 10.698 ( 1.565 3.889 6.253) 7.528 10.988 ( 0.717 -12.259 -2.819) 12.599 11.172 ( -0.627 -11.708 -2.189) 11.928 13.367 ( -1.354 -2.856 -8.661) 9.220 13.372 ( -2.091 -3.123 -8.160) 8.984 14.276 ( 5.556 25.151 19.867) 32.529 14.382 ( -0.911 34.942 12.577) 37.147 15.742 ( -2.898 -0.602 5.082) 5.881 15.844 ( -0.220 8.912 0.960) 8.966 15.964 ( -8.799 12.685 -1.378) 15.499 16.039 ( 8.504 11.488 2.889) 14.582 19.090 ( 4.638 -22.729 -9.530) 25.079 19.121 ( -2.427 -24.900 -11.501) 27.535 21.423 ( -1.472 -1.606 1.364) 2.570 21.449 ( 1.553 -1.544 0.684) 2.294 ======================= Grid point 125 (57/160) ======================= q-point: (-0.40 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.633 ( -8.505 7.232 -4.208) 11.931 1.830 ( -11.171 6.370 -1.560) 12.954 1.977 ( 5.160 -0.366 -3.316) 6.145 1.981 ( -0.430 1.622 2.497) 3.009 2.160 ( -0.776 -4.550 0.695) 4.668 2.207 ( -4.157 2.581 3.639) 6.098 2.262 ( 1.107 -1.536 -1.582) 2.467 2.340 ( -1.891 -2.048 2.502) 3.746 2.434 ( 6.457 1.331 -1.636) 6.793 2.441 ( 5.271 3.722 1.005) 6.531 2.548 ( 7.486 -1.856 -5.174) 9.288 2.715 ( 4.793 -0.924 -1.803) 5.203 3.215 ( -3.552 0.284 -0.146) 3.566 3.302 ( -2.904 -1.320 -3.470) 4.713 3.412 ( -1.629 2.458 -6.399) 7.045 3.469 ( -3.958 -1.112 -9.414) 10.272 3.687 ( -1.639 9.014 -3.444) 9.788 3.762 ( -2.257 3.910 3.266) 5.572 3.881 ( 8.101 -3.765 0.211) 8.935 3.960 ( 3.849 0.556 4.488) 5.938 4.244 ( -7.347 16.698 5.649) 19.097 4.410 ( -12.759 16.638 -0.547) 20.974 5.702 ( 6.619 5.393 4.376) 9.594 5.829 ( 2.880 7.446 2.498) 8.365 6.116 ( 4.153 0.620 1.721) 4.538 6.313 ( 2.310 7.635 0.800) 8.017 6.398 ( 6.629 -7.346 3.665) 10.551 6.634 ( -2.823 -6.818 -4.428) 8.606 6.846 ( 0.336 -1.536 -5.342) 5.568 6.988 ( 3.236 -2.519 -2.761) 4.944 7.043 ( 0.471 -1.622 -12.192) 12.308 7.271 ( 3.467 -4.283 3.481) 6.518 7.585 ( -1.812 5.076 0.366) 5.402 7.729 ( -2.518 0.738 -6.130) 6.668 7.956 ( -0.251 2.525 2.760) 3.749 8.002 ( 2.051 3.558 -4.821) 6.333 8.149 ( -9.861 0.301 8.137) 12.788 8.258 ( -2.475 0.154 2.956) 3.858 8.446 ( -0.111 5.297 2.105) 5.701 8.529 ( 2.312 -3.214 4.779) 6.206 8.723 ( 7.561 1.289 2.608) 8.101 8.767 ( -3.549 -3.539 -0.165) 5.015 9.170 ( 2.969 -7.275 -0.334) 7.864 9.235 ( 4.502 -4.627 -2.356) 6.872 10.595 ( -3.374 4.612 2.846) 6.384 10.787 ( -0.109 0.961 7.007) 7.074 10.916 ( -5.049 -7.971 -3.199) 9.963 11.059 ( -9.012 -9.151 -3.625) 13.345 13.233 ( -2.807 -2.993 -7.224) 8.308 13.310 ( 3.109 -2.252 -4.368) 5.815 14.395 ( -12.540 35.743 11.877) 39.698 14.559 ( -0.969 26.248 15.400) 30.448 15.757 ( -1.658 0.436 6.499) 6.721 15.830 ( -4.066 6.367 1.437) 7.690 15.903 ( 1.715 5.333 3.392) 6.548 16.172 ( 3.497 10.741 2.272) 11.522 18.926 ( -1.301 -21.737 -16.104) 27.083 19.082 ( 8.029 -22.496 -10.238) 25.987 21.411 ( -1.300 -1.135 0.625) 1.836 21.496 ( 2.374 -1.930 1.483) 3.400 ======================= Grid point 126 (58/160) ======================= q-point: (-0.30 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -11.760 11.690 -2.411) 16.756 1.589 ( -14.365 10.315 -2.451) 17.853 2.013 ( 0.212 -0.399 1.577) 1.640 2.061 ( 1.010 -2.846 4.951) 5.799 2.110 ( -4.826 4.969 -3.245) 7.649 2.167 ( 0.263 -5.848 1.871) 6.146 2.280 ( 0.411 -0.978 1.144) 1.560 2.357 ( 0.766 -1.261 4.977) 5.191 2.468 ( 3.360 -1.307 -4.201) 5.536 2.512 ( -1.240 5.089 -1.299) 5.397 2.636 ( 8.278 0.235 -3.453) 8.972 2.769 ( 4.635 -1.544 -3.492) 6.005 3.161 ( -1.766 4.731 -4.912) 7.045 3.243 ( 2.789 0.687 -0.031) 2.873 3.277 ( 2.042 -1.888 -10.194) 10.567 3.372 ( -0.310 3.070 -3.138) 4.401 3.602 ( -4.630 11.476 -1.595) 12.477 3.821 ( 2.616 6.776 2.016) 7.538 3.964 ( 1.005 -1.414 -3.584) 3.981 4.115 ( 2.658 5.930 2.256) 6.879 4.153 ( -12.235 13.460 6.878) 19.447 4.206 ( -5.408 5.691 8.121) 11.295 5.804 ( 1.815 5.618 -0.242) 5.909 5.948 ( 8.733 4.842 2.567) 10.310 6.136 ( -2.159 -0.811 -3.049) 3.823 6.392 ( 3.139 4.897 4.898) 7.604 6.565 ( 3.418 -3.819 5.733) 7.690 6.609 ( 8.347 -2.054 -4.066) 9.509 6.798 ( 1.012 -2.726 -6.484) 7.107 6.920 ( 1.264 0.010 -8.198) 8.295 7.022 ( 4.283 -3.162 -2.356) 5.822 7.361 ( 3.529 0.353 1.507) 3.854 7.509 ( -4.862 2.685 -2.634) 6.147 7.661 ( -2.630 1.519 -0.773) 3.135 7.926 ( -2.734 -3.502 -3.687) 5.773 7.953 ( -3.806 -2.411 5.302) 6.958 8.187 ( 2.407 8.412 6.451) 10.871 8.238 ( -3.972 -2.462 1.745) 4.989 8.499 ( -3.013 -0.809 2.113) 3.768 8.531 ( 1.001 0.853 -1.939) 2.343 8.721 ( 0.782 0.792 2.301) 2.556 8.923 ( 11.328 -0.969 1.624) 11.485 9.230 ( 4.668 -4.715 -1.245) 6.750 9.306 ( 4.565 -6.500 2.007) 8.193 10.535 ( -7.596 4.531 1.167) 8.922 10.743 ( -12.120 -6.542 -4.974) 14.644 10.813 ( -12.433 -0.309 -0.757) 12.460 10.868 ( -0.763 -4.525 4.173) 6.202 13.134 ( -0.456 -0.899 -4.491) 4.603 13.347 ( 3.085 -0.988 0.440) 3.269 14.238 ( -20.364 31.921 8.308) 38.764 14.609 ( -4.168 11.848 3.752) 13.109 15.807 ( -2.632 -0.006 6.052) 6.600 15.845 ( 2.411 7.935 0.201) 8.295 16.041 ( 4.905 -1.407 12.721) 13.706 16.196 ( -3.055 6.636 1.345) 7.428 18.716 ( -1.037 -10.060 -16.314) 19.194 19.115 ( 9.942 -17.418 -8.991) 21.979 21.397 ( -0.745 -0.874 0.016) 1.149 21.553 ( 2.406 -2.583 1.247) 3.744 ======================= Grid point 127 (59/160) ======================= q-point: (-0.20 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( -10.869 18.040 3.129) 21.293 1.336 ( -15.003 14.153 1.210) 20.660 1.896 ( -14.767 3.012 -0.433) 15.077 2.029 ( -0.030 0.884 2.215) 2.385 2.089 ( -2.227 -1.753 -1.949) 3.440 2.219 ( -9.704 19.368 0.246) 21.664 2.311 ( 5.407 -1.487 5.167) 7.625 2.374 ( 5.623 -5.775 0.522) 8.077 2.503 ( 4.138 -1.860 -2.602) 5.230 2.543 ( 5.800 -3.245 0.275) 6.652 2.722 ( 5.934 1.683 -0.859) 6.227 2.787 ( 3.065 -2.393 -3.013) 4.919 3.086 ( -0.810 4.467 -3.329) 5.630 3.235 ( 2.721 -0.974 -4.045) 4.972 3.345 ( 7.178 3.451 -0.810) 8.005 3.371 ( 3.773 7.530 -1.927) 8.640 3.516 ( -4.345 11.769 0.082) 12.545 3.724 ( -10.777 11.745 -3.860) 16.401 3.942 ( 1.099 2.534 -0.767) 2.867 4.020 ( -4.087 9.454 3.139) 10.767 4.179 ( -4.224 1.141 2.995) 5.302 4.365 ( 6.191 -5.994 8.039) 11.785 5.811 ( 2.516 0.374 -2.828) 3.804 5.999 ( -2.362 -3.234 -4.909) 6.336 6.169 ( 9.285 10.210 2.797) 14.081 6.476 ( 0.139 5.369 3.906) 6.641 6.607 ( 0.776 1.805 -9.097) 9.307 6.674 ( -1.115 0.813 6.452) 6.598 6.796 ( 7.800 -1.970 -2.002) 8.291 6.940 ( 5.549 -2.072 -2.070) 6.274 7.082 ( 5.263 -5.370 -0.119) 7.520 7.352 ( -2.958 0.488 -4.048) 5.037 7.444 ( -2.148 5.854 0.244) 6.240 7.569 ( -6.146 1.957 -1.249) 6.569 7.864 ( -0.405 -5.544 -2.307) 6.019 8.018 ( 0.064 -4.770 9.431) 10.568 8.165 ( -3.440 -6.844 0.114) 7.660 8.330 ( -8.995 -4.696 -2.897) 10.553 8.378 ( 11.134 10.124 2.322) 15.227 8.573 ( 2.251 2.258 -1.044) 3.355 8.855 ( 8.028 4.802 5.462) 10.833 9.066 ( 5.740 -3.015 -2.944) 7.121 9.320 ( 6.782 -3.169 0.938) 7.544 9.425 ( 4.697 -5.496 6.197) 9.522 10.346 ( -16.211 1.033 -1.564) 16.319 10.408 ( -19.317 -0.538 -3.475) 19.635 10.616 ( -10.429 2.960 -0.664) 10.862 10.924 ( 1.670 -6.009 1.752) 6.478 13.121 ( 2.047 1.124 -0.152) 2.340 13.388 ( -0.395 4.921 2.180) 5.396 13.951 ( -22.632 21.109 3.931) 31.197 14.597 ( 3.639 -8.035 -3.315) 9.423 15.802 ( -2.436 1.194 0.255) 2.725 15.863 ( -0.983 4.040 0.476) 4.185 16.104 ( -9.833 -1.394 2.639) 10.275 16.297 ( 7.816 -5.081 7.971) 12.266 18.544 ( -1.044 8.665 -8.513) 12.192 19.210 ( 11.436 -8.624 -4.178) 14.920 21.390 ( -0.032 -0.929 -0.106) 0.936 21.597 ( 1.841 -3.192 0.303) 3.697 ======================= Grid point 128 (60/160) ======================= q-point: (-0.10 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( -8.864 20.385 4.477) 22.675 1.163 ( -11.013 18.803 7.970) 23.203 1.660 ( -12.705 11.719 3.213) 17.580 2.021 ( -1.738 0.124 -3.677) 4.069 2.074 ( -6.219 22.457 1.736) 23.367 2.081 ( 0.414 3.717 6.147) 7.195 2.378 ( 2.762 -4.226 -5.212) 7.256 2.523 ( 4.024 -2.145 -3.092) 5.510 2.537 ( 0.590 -4.528 3.443) 5.718 2.590 ( 7.642 -6.454 -5.732) 11.528 2.797 ( 2.513 2.751 -0.269) 3.736 2.814 ( 1.482 0.996 -1.082) 2.087 3.079 ( 1.830 2.589 3.414) 4.659 3.264 ( 2.799 2.861 1.142) 4.163 3.422 ( 1.613 8.573 2.994) 9.223 3.462 ( 7.252 7.710 -1.300) 10.664 3.495 ( 2.945 6.965 -0.384) 7.572 3.612 ( -0.662 8.498 4.284) 9.539 3.851 ( -6.472 4.333 -1.286) 7.894 4.040 ( -6.904 4.046 1.289) 8.105 4.061 ( -4.231 1.954 -3.424) 5.783 4.484 ( 2.174 -10.472 -0.906) 10.734 5.839 ( 3.772 -2.270 -1.270) 4.581 5.926 ( 0.239 -0.758 -4.684) 4.751 6.342 ( 8.092 11.268 1.631) 13.968 6.458 ( -1.435 5.724 -3.858) 7.050 6.551 ( -1.539 1.663 3.591) 4.246 6.726 ( -1.022 4.290 3.939) 5.914 6.919 ( 6.759 -2.856 -0.195) 7.340 6.978 ( 2.688 -2.075 -1.683) 3.790 7.159 ( 2.440 -1.849 0.513) 3.104 7.282 ( -0.427 -0.338 -0.863) 1.020 7.344 ( -6.962 1.138 -2.564) 7.506 7.493 ( -1.541 7.395 -1.615) 7.724 7.840 ( 1.481 -6.159 -4.816) 7.958 8.066 ( -1.962 -4.551 0.912) 5.039 8.119 ( -6.531 -7.342 -2.794) 10.216 8.213 ( 0.009 -9.484 5.982) 11.213 8.543 ( 5.829 2.810 -6.493) 9.166 8.700 ( 12.531 7.074 6.804) 15.917 9.006 ( 6.528 7.173 -4.015) 10.498 9.119 ( 1.507 -5.932 5.890) 8.494 9.399 ( 3.347 -6.418 -1.397) 7.372 9.559 ( 1.611 -0.763 -0.137) 1.788 10.063 ( -15.638 3.121 6.055) 17.057 10.088 ( -17.559 3.556 1.853) 18.011 10.468 ( -5.684 5.030 -0.246) 7.594 10.951 ( 1.453 -6.536 -1.701) 6.908 13.184 ( 3.054 3.088 2.698) 5.113 13.388 ( -2.008 9.636 1.937) 10.032 13.626 ( -18.521 11.148 -0.022) 21.618 14.640 ( 8.390 -23.588 -8.123) 26.320 15.744 ( -1.224 2.529 -4.346) 5.175 15.828 ( -2.550 -0.872 -0.132) 2.698 15.957 ( -10.431 -5.210 2.218) 11.869 16.405 ( 3.382 -10.576 -6.838) 13.040 18.531 ( 0.866 24.459 7.631) 25.636 19.385 ( 9.824 -0.845 2.778) 10.244 21.394 ( 0.316 -1.143 0.265) 1.216 21.617 ( 0.982 -3.552 -0.892) 3.791 ======================= Grid point 129 (61/160) ======================= q-point: ( 0.00 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.456 ( -2.371 16.628 2.030) 16.918 1.505 ( -2.979 15.507 1.743) 15.886 1.819 ( -2.128 6.124 4.321) 7.791 1.957 ( 0.457 -2.974 -0.894) 3.139 2.133 ( -1.379 2.911 -4.063) 5.185 2.188 ( -0.488 -1.165 -8.782) 8.872 2.394 ( -1.429 -1.679 -3.349) 4.010 2.406 ( -0.697 -1.520 0.187) 1.683 2.468 ( 2.260 -3.921 -1.932) 4.921 2.579 ( 2.992 -4.887 -0.859) 5.794 2.816 ( 0.685 1.285 -4.302) 4.541 2.843 ( -1.010 1.547 -0.489) 1.911 3.229 ( 2.930 1.952 12.083) 12.586 3.367 ( 1.002 -3.449 13.051) 13.536 3.601 ( -0.312 7.143 0.845) 7.200 3.659 ( 1.420 8.249 1.526) 8.508 3.759 ( 1.534 10.686 0.013) 10.795 3.799 ( -0.426 3.640 1.750) 4.061 3.886 ( 0.144 5.886 1.203) 6.009 4.022 ( -1.330 5.464 -1.765) 5.894 4.144 ( -1.328 2.224 -0.485) 2.635 4.250 ( -2.425 -4.647 -2.180) 5.677 5.824 ( 0.817 -1.784 -0.549) 2.037 5.845 ( 1.140 -2.727 -4.434) 5.329 6.504 ( -5.588 6.908 0.054) 8.885 6.611 ( 5.038 0.727 1.653) 5.352 6.703 ( 1.246 8.100 0.734) 8.228 6.803 ( 0.087 3.055 -1.835) 3.565 6.867 ( 0.638 -3.664 -2.763) 4.633 7.004 ( -1.728 -3.865 4.622) 6.268 7.199 ( 1.770 2.841 -0.404) 3.372 7.265 ( 1.147 2.368 -3.570) 4.435 7.317 ( 2.236 2.057 0.876) 3.162 7.601 ( -1.095 3.001 -4.316) 5.369 7.680 ( 4.073 -4.544 -3.203) 6.892 7.842 ( -4.516 -5.573 -2.062) 7.463 7.963 ( 0.382 -4.006 0.070) 4.025 8.090 ( -0.663 -8.518 5.443) 10.130 8.617 ( 1.130 4.991 -0.673) 5.162 8.870 ( -8.363 0.676 -0.669) 8.417 8.937 ( 3.605 -4.079 1.393) 5.619 9.151 ( -0.491 -5.217 -3.775) 6.459 9.383 ( -0.385 3.545 3.804) 5.214 9.673 ( 11.704 -4.969 -2.686) 12.996 9.816 ( -13.164 9.413 -3.314) 16.519 10.122 ( -0.877 -2.552 2.936) 3.988 10.645 ( 1.843 7.730 8.005) 11.280 10.847 ( 0.656 -3.340 1.611) 3.766 13.365 ( -1.795 8.764 -1.337) 9.046 13.562 ( -8.085 6.440 0.248) 10.340 13.599 ( 4.391 7.248 2.043) 8.717 14.089 ( 4.838 -23.067 -10.003) 25.604 15.726 ( -0.130 -0.303 -2.758) 2.778 15.748 ( -0.043 -3.165 0.801) 3.265 15.779 ( -1.365 1.353 -3.130) 3.673 16.083 ( 0.234 -10.066 -12.130) 15.764 19.186 ( 1.008 18.439 13.279) 22.745 19.548 ( 0.861 -0.818 6.849) 6.951 21.392 ( 0.045 0.556 0.171) 0.584 21.521 ( 0.071 -4.642 -1.658) 4.929 ======================= Grid point 130 (62/160) ======================= q-point: ( 0.10 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( 4.557 10.811 3.959) 12.382 1.544 ( 2.244 12.099 4.986) 13.277 1.836 ( 1.379 2.821 -0.405) 3.166 1.966 ( 0.886 5.710 -5.379) 7.895 2.003 ( -0.197 -5.975 -4.309) 7.369 2.123 ( -0.082 -0.376 -3.131) 3.155 2.365 ( -1.031 -0.748 0.054) 1.275 2.373 ( -1.110 -2.847 -2.434) 3.907 2.488 ( 0.493 -2.471 0.231) 2.530 2.577 ( -0.546 -4.051 -1.224) 4.266 2.757 ( -1.288 -0.920 -4.076) 4.372 2.805 ( -2.495 -0.055 -2.187) 3.319 3.422 ( 1.068 3.261 14.179) 14.588 3.510 ( -0.679 2.796 8.801) 9.259 3.597 ( -4.053 5.869 6.377) 9.568 3.702 ( -2.532 6.828 1.344) 7.405 3.743 ( -0.079 8.097 2.394) 8.444 3.840 ( 5.219 5.298 -3.857) 8.378 3.924 ( 1.377 2.638 -1.389) 3.284 3.997 ( -0.431 1.541 -0.496) 1.675 4.124 ( 0.117 6.391 0.014) 6.392 4.200 ( 1.090 2.432 -1.648) 3.134 5.815 ( -0.416 -1.901 -1.707) 2.588 5.831 ( 2.051 -3.656 -3.333) 5.356 6.367 ( -8.352 7.997 0.526) 11.575 6.621 ( -5.269 5.965 -3.678) 8.768 6.679 ( -0.504 -0.978 1.724) 2.045 6.784 ( -4.001 -7.553 -1.843) 8.743 6.941 ( 7.618 5.452 4.255) 10.289 7.008 ( -2.992 -0.625 1.178) 3.276 7.171 ( -2.631 1.864 2.711) 4.213 7.268 ( 3.532 -0.159 -6.112) 7.061 7.415 ( 6.016 0.970 2.327) 6.523 7.539 ( 0.557 -1.671 -5.717) 5.982 7.696 ( 1.221 1.804 -1.327) 2.551 7.801 ( 1.704 -2.541 -0.044) 3.060 8.015 ( 4.884 -4.973 0.428) 6.983 8.128 ( 2.754 -4.345 -1.036) 5.248 8.586 ( -6.127 4.882 1.310) 7.943 8.759 ( -4.668 -0.186 3.233) 5.681 8.935 ( -5.033 3.125 -2.604) 6.471 9.114 ( 3.114 -8.027 -3.125) 9.159 9.317 ( -10.166 1.656 1.989) 10.490 9.477 ( -16.593 -2.250 0.305) 16.748 10.019 ( 21.242 0.625 0.920) 21.271 10.224 ( 10.794 -6.324 -1.334) 12.581 10.752 ( -0.234 7.503 6.334) 9.822 10.858 ( -1.582 1.185 1.063) 2.244 13.294 ( -3.797 3.530 3.246) 6.117 13.463 ( -5.255 0.695 0.301) 5.309 13.794 ( 17.743 10.922 -2.611) 20.998 14.132 ( 14.637 -10.921 -12.790) 22.295 15.680 ( 1.223 2.672 -6.180) 6.843 15.772 ( 2.447 -1.596 -1.939) 3.506 15.812 ( 5.268 -3.169 1.085) 6.242 15.957 ( 2.527 -8.424 -9.103) 12.658 19.297 ( -7.933 12.571 14.943) 21.078 19.544 ( -10.537 0.072 6.645) 12.458 21.393 ( -0.276 0.048 0.409) 0.496 21.495 ( -0.430 -4.003 -2.309) 4.641 ======================= Grid point 131 (63/160) ======================= q-point: ( 0.20 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 4.773 7.066 7.196) 11.158 1.718 ( 10.603 5.461 6.435) 13.552 1.858 ( 5.871 3.651 -5.364) 8.750 1.914 ( 1.178 5.357 0.293) 5.493 2.044 ( 2.955 -3.945 0.847) 5.001 2.120 ( 2.066 -2.726 -0.160) 3.424 2.285 ( -4.278 -0.215 -2.426) 4.923 2.374 ( -0.241 -0.365 0.933) 1.031 2.473 ( -1.373 -2.024 -1.589) 2.917 2.551 ( 0.077 -4.108 -2.144) 4.634 2.685 ( -3.599 -3.009 -2.190) 5.177 2.738 ( -1.970 -4.075 -2.106) 4.992 3.440 ( -7.891 8.325 0.412) 11.478 3.561 ( -8.019 5.529 3.992) 10.527 3.643 ( -0.051 4.855 10.445) 11.519 3.656 ( -4.109 4.910 4.244) 7.682 3.778 ( -0.566 2.544 -1.480) 2.998 3.822 ( 1.473 2.552 -7.470) 8.030 3.907 ( 0.911 0.790 1.963) 2.304 3.962 ( -3.451 -0.369 -1.451) 3.762 4.196 ( 8.211 12.533 1.375) 15.046 4.322 ( 10.860 8.822 4.035) 14.562 5.771 ( -1.134 -1.652 -5.736) 6.076 5.774 ( -2.098 -2.156 -4.982) 5.820 6.340 ( -0.685 5.131 8.300) 9.782 6.503 ( -5.347 4.316 -1.689) 7.076 6.569 ( -9.087 -2.581 -1.684) 9.595 6.762 ( -4.731 -7.024 -0.991) 8.527 6.880 ( -2.572 4.390 0.490) 5.111 7.116 ( 2.576 -0.442 -1.074) 2.825 7.188 ( -1.244 0.621 0.606) 1.517 7.234 ( -0.386 -0.893 1.627) 1.895 7.485 ( 3.879 0.031 -4.329) 5.813 7.551 ( 8.545 -2.397 -2.643) 9.260 7.748 ( 3.237 1.005 4.427) 5.576 7.845 ( 4.137 2.263 -2.402) 5.292 8.113 ( 5.934 -0.055 1.756) 6.188 8.175 ( 7.218 1.334 -4.588) 8.656 8.520 ( -6.557 -1.234 6.921) 9.614 8.705 ( -6.691 -2.296 -2.127) 7.386 8.798 ( -8.168 7.127 1.155) 10.902 9.062 ( -5.092 2.396 -4.806) 7.401 9.175 ( -9.788 -7.473 2.860) 12.643 9.311 ( -5.348 -5.835 3.552) 8.675 10.357 ( 17.091 -5.120 -0.329) 17.845 10.411 ( 13.961 -7.363 0.346) 15.787 10.775 ( -2.145 6.526 1.672) 7.070 10.817 ( -2.745 4.204 -1.471) 5.232 13.325 ( -1.098 0.020 7.512) 7.592 13.424 ( -2.348 -2.398 3.907) 5.150 14.076 ( 22.847 14.147 -6.648) 27.683 14.227 ( 16.855 3.222 -16.407) 23.741 15.647 ( 2.090 2.379 -3.509) 4.726 15.748 ( 2.217 1.516 -4.220) 5.002 15.921 ( 6.390 -1.900 0.789) 6.713 16.031 ( 10.221 -7.048 -0.234) 12.418 19.260 ( -15.170 3.543 10.939) 19.035 19.381 ( -16.369 -1.678 4.347) 17.019 21.392 ( -0.566 -0.458 0.578) 0.929 21.457 ( -0.738 -3.009 -2.386) 3.911 ======================= Grid point 132 (64/160) ======================= q-point: ( 0.30 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( 6.314 5.728 6.471) 10.702 1.917 ( 7.343 2.466 -0.592) 7.769 1.927 ( 6.387 6.774 -0.801) 9.344 1.990 ( 2.438 4.892 4.825) 7.291 2.106 ( 3.990 -3.319 0.602) 5.225 2.172 ( 1.539 -3.552 3.389) 5.145 2.212 ( -1.566 1.366 0.008) 2.078 2.369 ( -2.851 -1.047 1.003) 3.198 2.411 ( -0.606 -0.940 -4.977) 5.101 2.533 ( 0.115 -4.657 -1.553) 4.910 2.582 ( -5.578 -2.811 -2.464) 6.715 2.690 ( -1.283 -6.680 -1.699) 7.011 3.313 ( -6.604 9.103 1.889) 11.404 3.421 ( -7.957 8.749 -2.776) 12.148 3.607 ( -5.907 0.442 1.666) 6.153 3.668 ( -4.797 -1.080 -4.073) 6.385 3.749 ( 2.512 1.837 2.526) 4.008 3.810 ( 0.227 1.134 -1.948) 2.266 3.923 ( -1.314 0.620 3.784) 4.054 3.952 ( 0.739 -0.172 1.543) 1.719 4.374 ( 9.048 14.854 2.944) 17.641 4.568 ( 13.123 10.909 2.054) 17.189 5.629 ( -4.230 0.188 -4.990) 6.544 5.740 ( 2.835 0.711 -3.706) 4.720 6.340 ( -7.960 -1.240 -0.311) 8.062 6.425 ( -7.524 1.979 -0.180) 7.782 6.522 ( 0.446 2.366 10.587) 10.857 6.602 ( -1.917 3.230 -6.976) 7.923 6.914 ( -2.787 -5.920 5.529) 8.566 6.976 ( -6.497 -5.166 -7.892) 11.454 7.178 ( -2.357 -0.422 -2.553) 3.500 7.235 ( -1.986 -0.733 0.638) 2.211 7.570 ( 9.857 2.107 -1.111) 10.140 7.681 ( 11.391 -1.663 -3.382) 11.998 7.828 ( 3.610 6.060 -1.433) 7.198 7.937 ( 6.060 0.938 4.683) 7.716 8.217 ( 3.468 5.014 1.364) 6.247 8.265 ( 5.347 1.039 1.338) 5.609 8.512 ( -6.821 -4.795 4.630) 9.537 8.537 ( -4.770 -1.038 -3.217) 5.847 8.641 ( -9.373 4.206 -2.393) 10.549 8.954 ( -7.754 4.463 2.929) 9.414 9.062 ( -4.584 -7.395 0.243) 8.704 9.288 ( -4.807 -7.772 2.885) 9.583 10.556 ( 10.006 -4.584 0.689) 11.028 10.660 ( 10.494 -7.960 1.245) 13.230 10.744 ( -1.707 4.401 -1.686) 5.012 10.764 ( 1.900 1.813 -2.107) 3.367 13.393 ( -0.970 -1.477 5.394) 5.676 13.457 ( -0.156 -3.081 3.407) 4.596 14.287 ( 12.528 14.161 -10.384) 21.571 14.388 ( 20.570 14.602 -3.043) 25.409 15.673 ( 4.038 4.427 -0.797) 6.045 15.825 ( 9.769 5.625 0.873) 11.306 16.022 ( 4.478 1.554 0.576) 4.775 16.199 ( 8.519 -2.974 0.940) 9.072 19.059 ( -17.231 -5.671 1.263) 18.184 19.137 ( -17.334 -8.427 1.281) 19.316 21.390 ( -0.632 -0.851 0.762) 1.305 21.422 ( -0.636 -2.058 -1.480) 2.613 ======================= Grid point 133 (65/160) ======================= q-point: ( 0.40 0.38 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 0.611 5.853 -1.557) 6.087 1.997 ( 5.818 4.469 -1.191) 7.432 2.019 ( 3.032 3.344 3.425) 5.666 2.040 ( 4.193 2.587 -2.917) 5.725 2.167 ( -0.167 3.821 1.511) 4.112 2.179 ( -1.944 -1.943 1.795) 3.283 2.258 ( -1.749 -0.928 2.926) 3.533 2.309 ( 1.593 -0.326 -1.408) 2.151 2.387 ( 0.922 -0.999 -1.847) 2.293 2.466 ( -4.374 0.097 -0.977) 4.483 2.508 ( -1.325 -4.493 -1.904) 5.057 2.660 ( -0.513 -5.055 -0.943) 5.168 3.273 ( -1.390 4.587 -2.544) 5.427 3.316 ( -0.648 3.975 1.851) 4.432 3.531 ( -6.684 -1.739 2.619) 7.386 3.538 ( -5.486 -4.298 -1.254) 7.081 3.758 ( 3.055 0.016 -7.544) 8.139 3.814 ( 0.791 -0.742 -1.396) 1.768 3.933 ( -1.737 1.203 0.350) 2.142 3.973 ( -0.959 1.470 2.178) 2.797 4.536 ( 4.651 15.759 5.865) 17.446 4.758 ( 8.136 10.836 0.656) 13.567 5.572 ( 0.583 5.498 1.105) 5.638 5.797 ( 7.128 3.008 -0.705) 7.769 6.207 ( -7.715 -0.002 -0.208) 7.718 6.296 ( -8.835 3.658 1.794) 9.729 6.465 ( 2.703 2.743 -8.896) 9.694 6.728 ( -1.274 1.552 4.137) 4.599 6.751 ( -1.173 -12.889 -5.113) 13.915 6.924 ( -5.849 -5.830 7.432) 11.110 7.091 ( -2.031 0.643 -5.583) 5.975 7.188 ( -0.166 -1.715 -4.552) 4.867 7.724 ( 9.253 4.280 -2.189) 10.428 7.813 ( 7.783 2.313 -3.904) 9.009 7.879 ( 5.985 5.785 -0.658) 8.350 8.092 ( 4.070 -1.604 7.038) 8.287 8.259 ( -8.203 3.594 -1.056) 9.018 8.286 ( -0.318 0.564 4.905) 4.948 8.366 ( -5.050 -3.504 -0.543) 6.171 8.492 ( -3.961 -2.466 -0.972) 4.766 8.584 ( 3.620 6.250 1.620) 7.403 8.875 ( -4.062 2.053 1.098) 4.682 9.014 ( -3.173 -5.878 1.045) 6.761 9.203 ( -7.189 -7.823 0.107) 10.625 10.685 ( 0.731 2.583 -1.766) 3.213 10.710 ( 0.280 1.556 -0.152) 1.588 10.729 ( 5.872 -4.259 2.112) 7.555 10.883 ( 6.466 -9.625 2.123) 11.788 13.392 ( -1.622 -1.726 -1.963) 3.076 13.444 ( -0.289 -3.032 -6.092) 6.811 14.439 ( 7.975 19.450 10.083) 23.315 14.696 ( 11.848 14.680 9.885) 21.298 15.747 ( 4.985 7.859 -0.087) 9.307 16.034 ( 9.577 4.407 -0.833) 10.575 16.081 ( 4.677 10.539 2.673) 11.836 16.291 ( 0.266 4.649 0.946) 4.751 18.785 ( -10.121 -15.077 -7.601) 19.686 18.853 ( -13.327 -17.790 -6.218) 23.082 21.392 ( -0.446 -0.968 1.202) 1.607 21.406 ( -0.194 -1.443 -0.065) 1.457 ======================= Grid point 134 (66/160) ======================= q-point: (-0.50 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( -2.107 4.030 -5.422) 7.076 2.011 ( -1.338 3.264 -0.015) 3.528 2.026 ( -2.022 1.153 -5.038) 5.549 2.087 ( 1.094 2.739 -2.702) 4.000 2.136 ( 0.814 2.813 -0.955) 3.080 2.203 ( -1.713 0.691 4.721) 5.069 2.248 ( -0.545 0.459 1.087) 1.300 2.350 ( -0.723 0.558 -0.536) 1.059 2.369 ( 2.021 -0.380 0.503) 2.117 2.453 ( 1.268 -3.632 -2.179) 4.421 2.474 ( 1.699 3.173 1.340) 3.841 2.658 ( 0.869 -1.721 0.362) 1.962 3.267 ( 5.439 -2.147 -4.607) 7.444 3.286 ( -6.165 -1.251 -0.388) 6.303 3.473 ( -1.883 -0.498 3.099) 3.660 3.542 ( 1.994 -2.746 3.553) 4.914 3.692 ( 2.350 -3.064 -12.168) 12.766 3.736 ( -0.911 -4.890 -8.920) 10.213 3.914 ( -0.940 4.493 0.638) 4.635 3.957 ( -2.432 2.450 1.203) 3.656 4.650 ( -2.268 17.557 8.980) 19.850 4.853 ( 0.180 12.748 2.765) 13.046 5.649 ( 1.848 7.624 7.136) 10.605 5.922 ( 4.017 5.582 3.313) 7.634 6.106 ( 0.479 2.407 -3.176) 4.014 6.221 ( -3.046 -0.956 3.292) 4.586 6.426 ( 1.809 0.608 -7.771) 8.002 6.568 ( 1.445 -8.841 -9.464) 13.031 6.836 ( -3.213 -2.305 5.746) 6.975 6.944 ( -1.297 -7.237 2.438) 7.746 7.017 ( 3.755 1.084 -4.443) 5.917 7.132 ( 1.632 -1.510 -6.845) 7.197 7.759 ( 0.553 7.075 -3.883) 8.089 7.842 ( 1.278 0.799 -5.294) 5.505 7.997 ( 5.970 5.720 0.499) 8.283 8.092 ( -5.050 -0.665 -2.549) 5.696 8.216 ( -0.497 -0.215 4.397) 4.431 8.254 ( -7.916 -3.325 4.614) 9.747 8.355 ( 0.307 0.702 5.390) 5.444 8.503 ( 4.476 -0.650 1.554) 4.782 8.657 ( 1.136 6.520 2.111) 6.947 8.821 ( -3.228 2.498 -0.990) 4.200 8.998 ( -0.123 -8.082 0.655) 8.109 9.098 ( -1.792 -8.021 -2.855) 8.701 10.658 ( -0.882 0.438 -1.059) 1.446 10.717 ( 0.612 -2.593 -0.494) 2.710 10.848 ( 1.426 -0.118 5.732) 5.908 10.962 ( -0.471 -7.509 2.763) 8.015 13.308 ( -1.949 -1.332 -6.629) 7.037 13.337 ( -0.003 -1.721 -9.703) 9.854 14.751 ( 2.860 19.480 25.047) 31.859 14.984 ( 0.225 17.470 21.605) 27.786 15.804 ( 1.269 9.895 -0.137) 9.977 16.025 ( -1.385 7.029 -2.921) 7.736 16.202 ( -10.915 9.941 -0.383) 14.768 16.274 ( 7.291 10.147 2.669) 12.777 18.595 ( -0.521 -23.378 -14.855) 27.703 18.609 ( 3.022 -21.965 -13.447) 25.931 21.398 ( -0.851 -0.671 1.523) 1.869 21.418 ( 0.951 -1.388 1.037) 1.976 ======================= Grid point 135 (67/160) ======================= q-point: (-0.40 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.763 ( -4.899 5.337 -3.966) 8.259 1.945 ( 1.142 -2.106 -4.173) 4.812 1.959 ( -6.224 5.448 -0.399) 8.281 2.029 ( -3.373 2.403 0.043) 4.142 2.112 ( -1.561 -0.244 -1.567) 2.225 2.200 ( -2.895 -4.245 -0.145) 5.141 2.259 ( -0.785 2.734 2.731) 3.943 2.331 ( -1.362 0.914 1.196) 2.030 2.400 ( 3.703 -1.361 -3.252) 5.113 2.490 ( 5.984 -4.303 -2.856) 7.904 2.573 ( 2.632 5.140 6.438) 8.648 2.704 ( 3.407 -0.067 1.826) 3.866 3.209 ( -0.011 0.710 -0.530) 0.886 3.280 ( 4.011 -1.111 -8.391) 9.367 3.451 ( -2.275 0.341 -15.925) 16.090 3.480 ( -0.619 4.001 -0.449) 4.073 3.692 ( 8.117 -6.797 -1.738) 10.729 3.736 ( 7.191 -6.890 -0.966) 10.006 3.884 ( -3.072 5.930 0.939) 6.744 3.985 ( 1.957 0.399 4.562) 4.980 4.633 ( -11.498 18.210 6.955) 22.631 4.771 ( -13.789 15.490 1.562) 20.797 5.798 ( 3.765 3.456 10.981) 12.112 5.944 ( -5.723 1.550 5.181) 7.874 6.185 ( 10.298 8.288 -5.585) 14.351 6.296 ( 6.211 -2.992 3.423) 7.696 6.329 ( -1.605 -5.278 -2.184) 5.933 6.575 ( 9.177 -1.197 -7.541) 11.938 6.813 ( -4.090 -1.821 1.049) 4.599 6.912 ( 5.203 -2.951 -9.053) 10.850 7.037 ( 2.998 0.667 -7.738) 8.325 7.156 ( 4.793 -5.573 3.547) 8.161 7.686 ( -5.057 4.481 -2.641) 7.254 7.760 ( -1.488 1.889 -4.046) 4.706 7.965 ( -5.387 -0.624 0.210) 5.427 8.026 ( -7.341 -1.495 -2.651) 7.947 8.222 ( 3.765 5.735 6.072) 9.162 8.262 ( -2.069 1.150 1.133) 2.625 8.463 ( 1.866 -2.910 4.573) 5.732 8.585 ( 2.967 4.392 1.149) 5.423 8.644 ( -4.443 -3.229 2.572) 6.065 8.816 ( 4.544 5.563 0.063) 7.183 8.999 ( 2.118 -8.920 -0.296) 9.173 9.118 ( 5.707 -6.730 -2.112) 9.073 10.629 ( -2.600 -1.276 0.525) 2.943 10.700 ( -2.108 -5.376 -1.269) 5.912 10.893 ( -3.623 1.781 4.807) 6.278 10.935 ( -6.259 -2.137 2.806) 7.184 13.201 ( -1.062 -0.170 -6.505) 6.593 13.261 ( 2.367 -2.389 -5.872) 6.767 14.996 ( -10.640 21.424 22.158) 32.607 15.143 ( -17.032 23.837 24.967) 38.492 15.795 ( -1.722 6.740 2.260) 7.314 15.938 ( -7.122 6.922 -1.229) 10.008 16.020 ( -3.798 2.959 -1.892) 5.173 16.336 ( -3.768 2.817 2.502) 5.328 18.487 ( 12.663 -18.010 -19.145) 29.176 18.618 ( 17.043 -20.876 -15.156) 30.918 21.400 ( -0.842 0.126 1.118) 1.405 21.454 ( 1.399 -2.079 1.524) 2.933 ======================= Grid point 136 (68/160) ======================= q-point: (-0.30 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -6.228 9.104 -0.479) 11.041 1.794 ( -10.704 9.978 -0.806) 14.655 1.959 ( -0.023 -6.425 0.519) 6.446 2.041 ( 1.359 0.470 2.685) 3.046 2.072 ( -1.891 -1.394 1.493) 2.784 2.125 ( -2.502 -1.885 -0.807) 3.234 2.300 ( 0.413 2.050 1.562) 2.610 2.346 ( 2.614 -0.548 2.643) 3.758 2.425 ( 3.849 -1.948 -3.505) 5.559 2.522 ( 1.441 -4.031 -2.375) 4.896 2.678 ( 3.463 2.658 3.559) 5.632 2.767 ( 1.142 0.350 0.760) 1.415 3.215 ( 2.128 -0.682 -10.039) 10.285 3.228 ( 1.015 -2.049 -11.865) 12.083 3.317 ( 9.203 9.653 -2.253) 13.526 3.494 ( 3.621 7.625 -1.133) 8.517 3.780 ( 1.033 3.824 -2.535) 4.703 3.833 ( 8.001 -6.005 -0.778) 10.034 3.910 ( 1.714 -0.200 4.423) 4.747 4.094 ( 3.118 -4.119 5.571) 7.597 4.467 ( -14.871 14.537 3.937) 21.166 4.496 ( -19.528 15.408 1.696) 24.933 5.888 ( -4.950 0.610 0.954) 5.078 5.956 ( -1.066 -3.824 5.062) 6.433 6.184 ( 4.240 7.569 -1.167) 8.754 6.412 ( 9.952 1.605 -0.982) 10.128 6.514 ( 9.468 -3.231 7.343) 12.410 6.635 ( 4.877 -2.076 -5.379) 7.552 6.759 ( 3.107 1.947 -4.708) 5.967 6.911 ( 7.290 -3.865 -9.674) 12.715 6.996 ( 0.644 4.400 -3.666) 5.763 7.289 ( 5.478 -6.774 3.414) 9.357 7.567 ( -5.226 3.632 -2.204) 6.735 7.703 ( -3.057 1.140 -1.187) 3.472 7.882 ( -6.502 -3.358 4.558) 8.621 7.887 ( -5.115 -0.943 -2.918) 5.963 8.182 ( -7.480 0.135 0.300) 7.488 8.366 ( 2.202 0.455 0.339) 2.274 8.424 ( -4.241 2.174 3.124) 5.699 8.636 ( 2.651 4.881 -1.106) 5.663 8.700 ( 6.464 -1.457 3.958) 7.718 8.942 ( 8.684 1.822 1.188) 8.952 9.080 ( 6.684 -7.786 -0.077) 10.262 9.194 ( 4.669 -4.925 1.462) 6.942 10.558 ( -7.503 -1.471 -0.978) 7.708 10.609 ( -7.924 -5.306 0.330) 9.542 10.820 ( -8.415 2.346 1.026) 8.796 10.869 ( -4.775 1.197 1.544) 5.159 13.143 ( 1.309 1.683 -3.376) 3.993 13.284 ( 5.195 -4.244 -0.938) 6.773 14.855 ( -29.976 24.725 11.183) 40.435 14.930 ( -27.254 17.259 7.302) 33.075 15.820 ( -1.094 2.408 4.528) 5.244 15.938 ( -0.075 1.357 3.389) 3.651 15.993 ( -0.763 -2.295 6.887) 7.299 16.227 ( -11.229 -5.252 1.333) 12.468 18.557 ( 19.838 -3.996 -15.695) 25.609 18.791 ( 22.803 -13.613 -11.906) 29.104 21.396 ( -0.665 0.892 0.468) 1.207 21.493 ( 1.377 -3.106 1.118) 3.577 ======================= Grid point 137 (69/160) ======================= q-point: (-0.20 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.557 ( -5.985 12.537 2.545) 14.124 1.633 ( -9.324 15.257 2.758) 18.092 1.916 ( -6.445 -2.212 2.071) 7.122 2.024 ( -3.126 -4.459 -0.304) 5.454 2.088 ( 2.753 4.235 0.299) 5.060 2.231 ( 7.091 -3.623 6.380) 10.203 2.316 ( 1.772 -0.088 -0.979) 2.026 2.419 ( 1.001 -2.373 1.120) 2.808 2.464 ( 3.707 -2.119 -0.252) 4.277 2.491 ( -0.569 -1.215 -3.463) 3.714 2.770 ( 5.020 1.725 -0.346) 5.319 2.790 ( 4.101 3.007 -1.069) 5.197 3.117 ( -0.262 -0.219 -5.941) 5.951 3.171 ( 1.909 -3.680 -3.725) 5.573 3.455 ( 7.653 9.177 -0.736) 11.971 3.569 ( 6.583 9.976 -0.944) 11.989 3.740 ( -2.796 9.091 -1.209) 9.588 3.909 ( 1.239 -2.313 -3.634) 4.482 3.936 ( -1.897 2.541 1.282) 3.421 4.172 ( -0.383 -2.942 2.148) 3.663 4.257 ( -13.220 7.803 4.220) 15.921 4.315 ( -7.201 6.264 4.810) 10.688 5.823 ( -1.050 0.347 -2.545) 2.774 5.906 ( -2.495 -4.962 -1.801) 5.838 6.346 ( 7.302 6.804 5.887) 11.587 6.537 ( 8.294 2.859 -3.663) 9.507 6.592 ( 2.005 -2.760 -6.097) 6.986 6.740 ( 5.008 1.879 7.446) 9.168 6.811 ( 5.629 1.844 -2.612) 6.474 6.917 ( 4.942 -4.195 -6.657) 9.291 7.013 ( 5.030 5.353 0.995) 7.413 7.360 ( 0.083 -2.560 -0.563) 2.622 7.459 ( -6.333 0.528 -1.483) 6.526 7.659 ( 0.396 2.088 -0.207) 2.135 7.771 ( -4.076 -2.194 -4.155) 6.220 7.899 ( -1.967 -5.995 9.143) 11.109 8.059 ( -6.987 -2.005 0.085) 7.269 8.200 ( -10.616 -6.305 -3.160) 12.745 8.568 ( 8.750 6.703 -0.205) 11.024 8.656 ( 1.290 5.380 3.065) 6.324 8.885 ( 8.517 -2.157 3.341) 9.400 9.065 ( 7.385 1.985 -1.913) 7.883 9.168 ( 4.022 -6.998 -0.648) 8.098 9.347 ( 8.963 -4.069 5.064) 11.070 10.364 ( -14.287 1.911 1.218) 14.466 10.437 ( -14.309 0.533 -0.172) 14.320 10.682 ( -7.527 3.486 -1.607) 8.449 10.820 ( -0.995 -3.874 -1.008) 4.124 13.171 ( 4.348 3.869 0.237) 5.825 13.394 ( 6.688 -4.052 2.198) 8.123 14.365 ( -35.054 17.613 2.607) 39.317 14.573 ( -20.436 3.583 -2.090) 20.852 15.826 ( -2.035 0.856 -0.104) 2.210 15.898 ( -5.072 1.263 1.295) 5.385 16.012 ( -13.814 -6.164 4.583) 15.806 16.146 ( 3.437 -8.964 2.453) 9.909 18.745 ( 17.637 10.019 -5.581) 21.038 19.066 ( 21.831 -6.178 -4.354) 23.103 21.391 ( -0.269 1.215 0.020) 1.245 21.521 ( 1.031 -4.091 0.212) 4.224 ======================= Grid point 138 (70/160) ======================= q-point: (-0.10 0.38 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.488 ( -5.653 15.513 3.034) 16.788 1.565 ( -5.174 18.043 2.855) 18.986 1.833 ( -6.456 5.233 3.955) 9.204 1.979 ( -1.505 -4.621 -0.973) 4.957 2.132 ( 1.426 4.697 1.062) 5.022 2.290 ( 0.609 -1.474 -6.245) 6.446 2.405 ( 1.129 -2.432 3.037) 4.051 2.445 ( 2.803 -4.625 -2.876) 6.125 2.460 ( 2.611 -5.249 -4.412) 7.337 2.485 ( 3.347 2.210 1.336) 4.227 2.834 ( 3.287 1.665 -2.238) 4.311 2.851 ( 1.911 1.562 -0.266) 2.483 3.088 ( 1.331 0.562 2.528) 2.911 3.219 ( 1.542 -4.758 7.488) 9.005 3.552 ( 5.246 7.439 -0.395) 9.111 3.652 ( 1.967 11.541 -1.221) 11.771 3.696 ( 1.232 7.988 1.260) 8.181 3.831 ( -3.861 7.613 -0.581) 8.556 3.905 ( -2.351 2.079 -0.401) 3.164 4.110 ( -6.857 5.637 -0.993) 8.932 4.171 ( -2.828 0.996 1.914) 3.557 4.298 ( -2.562 -5.444 1.637) 6.235 5.809 ( 1.785 -0.754 -1.444) 2.416 5.874 ( 1.109 -3.642 -3.068) 4.889 6.477 ( 4.611 3.538 0.502) 5.834 6.575 ( 1.959 0.778 -2.418) 3.207 6.628 ( 4.562 8.868 1.788) 10.132 6.818 ( 1.749 1.041 -0.690) 2.149 6.889 ( 2.243 0.052 -2.377) 3.269 6.931 ( 2.926 -1.742 3.180) 4.659 7.138 ( 6.206 2.522 0.717) 6.737 7.322 ( -1.710 3.018 -1.416) 3.747 7.332 ( -5.053 -0.703 -2.534) 5.697 7.656 ( -2.501 7.133 0.290) 7.564 7.686 ( 2.377 -8.826 -7.212) 11.643 7.953 ( -5.715 -8.222 1.429) 10.115 7.995 ( -3.668 -3.710 3.620) 6.350 8.028 ( -3.027 -6.301 2.051) 7.284 8.607 ( 2.298 4.393 -2.868) 5.728 8.812 ( 7.426 2.667 4.428) 9.048 8.960 ( -0.978 -4.917 -0.020) 5.013 9.178 ( 1.265 -0.020 -2.049) 2.408 9.238 ( 9.716 -0.316 3.439) 10.311 9.528 ( 10.237 -4.163 -2.746) 11.388 10.140 ( -17.052 4.534 -3.738) 18.036 10.188 ( -14.085 3.753 7.573) 16.426 10.581 ( -2.510 5.758 1.170) 6.390 10.818 ( 1.235 -6.199 -0.035) 6.321 13.280 ( 7.101 6.516 1.624) 9.773 13.524 ( 4.546 1.600 3.015) 5.685 13.859 ( -26.184 10.899 -1.195) 28.387 14.248 ( -11.276 -13.755 -7.323) 19.235 15.768 ( -3.346 -2.239 -0.669) 4.081 15.808 ( -5.511 -0.637 -1.226) 5.681 15.864 ( -6.561 -0.180 -0.010) 6.563 16.177 ( 1.986 -11.017 -5.999) 12.701 18.978 ( 10.145 18.130 5.851) 21.584 19.363 ( 13.830 -2.338 3.303) 14.410 21.389 ( 0.087 1.018 -0.034) 1.023 21.531 ( 0.565 -4.675 -0.778) 4.773 ======================= Grid point 139 (71/160) ======================= q-point: ( 0.00 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( -1.911 -2.242 -3.076) 4.259 1.699 ( -1.911 2.242 -3.076) 4.259 1.859 ( -2.376 -1.809 3.375) 4.506 1.859 ( -2.376 1.809 3.375) 4.506 2.194 ( -0.846 -0.661 -6.575) 6.662 2.194 ( -0.846 0.661 -6.575) 6.662 2.358 ( -0.256 -2.738 -4.210) 5.029 2.358 ( -0.256 2.738 -4.210) 5.029 2.457 ( 2.805 -3.904 1.094) 4.930 2.457 ( 2.805 3.904 1.094) 4.930 2.841 ( -0.347 -1.006 -2.961) 3.146 2.841 ( -0.347 1.006 -2.961) 3.146 3.287 ( 1.922 -3.407 14.384) 14.906 3.287 ( 1.922 3.407 14.384) 14.906 3.769 ( -0.223 -3.746 -0.685) 3.815 3.769 ( -0.223 3.746 -0.685) 3.815 3.831 ( 2.271 -1.045 0.923) 2.665 3.831 ( 2.271 1.045 0.923) 2.665 3.991 ( -1.881 -5.288 0.306) 5.621 3.991 ( -1.881 5.288 0.306) 5.621 4.200 ( -1.569 -3.349 0.849) 3.795 4.200 ( -1.569 3.349 0.849) 3.795 5.808 ( 0.575 -0.518 -2.016) 2.160 5.808 ( 0.575 0.518 -2.016) 2.160 6.618 ( 1.414 -2.262 -0.343) 2.690 6.618 ( 1.414 2.262 -0.343) 2.690 6.777 ( -1.100 -1.093 -2.542) 2.978 6.777 ( -1.100 1.093 -2.542) 2.978 6.902 ( -0.358 -4.742 3.498) 5.903 6.902 ( -0.358 4.742 3.498) 5.903 7.280 ( 1.365 -1.615 -3.060) 3.720 7.280 ( 1.365 1.615 -3.060) 3.720 7.441 ( 3.688 -10.519 -4.257) 11.932 7.441 ( 3.688 10.519 -4.257) 11.932 7.746 ( -3.050 -4.697 1.812) 5.886 7.746 ( -3.050 4.697 1.812) 5.886 7.953 ( -0.193 -3.509 2.448) 4.283 7.953 ( -0.193 3.509 2.448) 4.283 8.750 ( -0.188 -7.531 0.989) 7.598 8.750 ( -0.188 7.531 0.989) 7.598 9.011 ( -1.714 -6.888 -1.750) 7.311 9.011 ( -1.714 6.888 -1.750) 7.311 9.520 ( 2.406 -8.088 -0.712) 8.468 9.520 ( 2.406 8.088 -0.712) 8.468 10.013 ( -3.895 -7.903 -2.486) 9.155 10.013 ( -3.895 7.903 -2.486) 9.155 10.771 ( 1.489 -4.574 6.659) 8.214 10.771 ( 1.489 4.574 6.659) 8.214 13.572 ( -6.390 -7.917 -2.614) 10.505 13.572 ( -6.390 7.917 -2.614) 10.505 13.736 ( 5.998 -9.062 -1.889) 11.030 13.736 ( 5.998 9.062 -1.889) 11.030 15.707 ( -0.349 -0.308 0.770) 0.899 15.707 ( -0.349 0.308 0.770) 0.899 15.893 ( 0.048 -7.977 -9.197) 12.175 15.893 ( 0.048 7.977 -9.197) 12.175 19.461 ( 0.696 -8.407 9.571) 12.758 19.461 ( 0.696 8.407 9.571) 12.758 21.434 ( 0.070 -3.477 -0.836) 3.577 21.434 ( 0.070 3.477 -0.836) 3.577 ======================= Grid point 141 (72/160) ======================= q-point: ( 0.10 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 1.804 -3.291 -1.509) 4.044 1.660 ( 1.804 3.291 -1.509) 4.044 1.880 ( 0.855 -4.383 2.371) 5.056 1.880 ( 0.855 4.383 2.371) 5.056 2.095 ( -1.062 -4.326 -5.601) 7.157 2.095 ( -1.062 4.326 -5.601) 7.157 2.326 ( 1.280 -1.980 -3.247) 4.013 2.326 ( 1.280 1.980 -3.247) 4.013 2.491 ( -0.836 -2.738 1.990) 3.487 2.491 ( -0.836 2.738 1.990) 3.487 2.774 ( -2.566 -2.041 -4.518) 5.582 2.774 ( -2.566 2.041 -4.518) 5.582 3.480 ( -0.211 -2.729 14.290) 14.550 3.480 ( -0.211 2.729 14.290) 14.550 3.747 ( -0.586 -3.433 -0.970) 3.615 3.747 ( -0.586 3.433 -0.970) 3.615 3.871 ( 1.384 -2.982 -1.230) 3.510 3.871 ( 1.384 2.982 -1.230) 3.510 3.967 ( -3.861 -2.448 2.492) 5.207 3.967 ( -3.861 2.448 2.492) 5.207 4.221 ( 4.350 -1.979 0.470) 4.802 4.221 ( 4.350 1.979 0.470) 4.802 5.791 ( 0.281 -0.494 -2.225) 2.296 5.791 ( 0.281 0.494 -2.225) 2.296 6.564 ( -5.496 -10.520 0.068) 11.869 6.564 ( -5.496 10.520 0.068) 11.869 6.685 ( -5.691 -1.236 -2.610) 6.382 6.685 ( -5.691 1.236 -2.610) 6.382 7.006 ( 5.871 -0.903 3.447) 6.868 7.006 ( 5.871 0.903 3.447) 6.868 7.231 ( -2.632 -3.254 -2.625) 4.940 7.231 ( -2.632 3.254 -2.625) 4.940 7.466 ( 4.178 -3.933 -3.527) 6.735 7.466 ( 4.178 3.933 -3.527) 6.735 7.750 ( 1.485 -2.924 0.969) 3.420 7.750 ( 1.485 2.924 0.969) 3.420 8.014 ( 4.598 -4.765 2.429) 7.053 8.014 ( 4.598 4.765 2.429) 7.053 8.712 ( -5.654 -5.259 -0.172) 7.723 8.712 ( -5.654 5.259 -0.172) 7.723 8.985 ( 0.840 -3.453 -0.479) 3.586 8.985 ( 0.840 3.453 -0.479) 3.586 9.395 ( -13.342 -5.069 -0.819) 14.296 9.395 ( -13.342 5.069 -0.819) 14.296 10.094 ( 13.526 -5.737 -1.684) 14.788 10.094 ( 13.526 5.737 -1.684) 14.788 10.853 ( -0.831 -2.318 5.127) 5.688 10.853 ( -0.831 2.318 5.127) 5.688 13.396 ( -6.948 -5.653 0.097) 8.958 13.396 ( -6.948 5.653 0.097) 8.958 13.974 ( 21.812 -6.771 -6.202) 23.666 13.974 ( 21.812 6.771 -6.202) 23.666 15.754 ( 4.416 -2.628 -1.323) 5.306 15.754 ( 4.416 2.628 -1.323) 5.306 15.794 ( 1.863 -5.749 -6.610) 8.956 15.794 ( 1.863 5.749 -6.610) 8.956 19.489 ( -11.612 -5.879 10.584) 16.776 19.489 ( -11.612 5.879 10.584) 16.776 21.422 ( -0.124 -2.736 -1.069) 2.940 21.422 ( -0.124 2.736 -1.069) 2.940 ======================= Grid point 143 (73/160) ======================= q-point: ( 0.20 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 6.857 -2.511 3.705) 8.189 1.747 ( 6.857 2.511 3.705) 8.189 1.938 ( 4.061 -3.690 0.938) 5.566 1.938 ( 4.061 3.690 0.938) 5.566 2.056 ( 0.239 -4.076 -0.141) 4.086 2.056 ( 0.239 4.076 -0.141) 4.086 2.314 ( 1.030 -3.619 -2.540) 4.540 2.314 ( 1.030 3.619 -2.540) 4.540 2.478 ( -2.171 -2.094 0.251) 3.027 2.478 ( -2.171 2.094 0.251) 3.027 2.671 ( -3.446 -1.963 -4.009) 5.639 2.671 ( -3.446 1.963 -4.009) 5.639 3.563 ( -5.376 -3.274 6.784) 9.254 3.563 ( -5.376 3.274 6.784) 9.254 3.734 ( -0.678 -2.953 -0.825) 3.140 3.734 ( -0.678 2.953 -0.825) 3.140 3.825 ( -5.396 -5.078 -0.640) 7.437 3.825 ( -5.396 5.078 -0.640) 7.437 3.918 ( -2.684 -2.850 1.553) 4.212 3.918 ( -2.684 2.850 1.553) 4.212 4.383 ( 12.317 -3.870 2.376) 13.127 4.383 ( 12.317 3.870 2.376) 13.127 5.750 ( -0.906 -1.023 -4.189) 4.407 5.750 ( -0.906 1.023 -4.189) 4.407 6.469 ( -7.566 -6.185 1.142) 9.838 6.469 ( -7.566 6.185 1.142) 9.838 6.604 ( -1.615 -5.451 1.182) 5.806 6.604 ( -1.615 5.451 1.182) 5.806 7.022 ( -4.462 -7.093 -3.846) 9.220 7.022 ( -4.462 7.093 -3.846) 9.220 7.220 ( 0.426 -1.252 2.622) 2.937 7.220 ( 0.426 1.252 2.622) 2.937 7.501 ( 7.051 -1.936 -4.269) 8.467 7.501 ( 7.051 1.936 -4.269) 8.467 7.815 ( 3.621 -4.258 2.935) 6.313 7.815 ( 3.621 4.258 2.935) 6.313 8.150 ( 9.022 -3.509 0.859) 9.719 8.150 ( 9.022 3.509 0.859) 9.719 8.589 ( -7.857 -6.686 -0.834) 10.351 8.589 ( -7.857 6.686 -0.834) 10.351 8.974 ( -5.886 -8.502 1.238) 10.414 8.974 ( -5.886 8.502 1.238) 10.414 9.188 ( -8.285 -5.718 0.139) 10.068 9.188 ( -8.285 5.718 0.139) 10.068 10.319 ( 14.291 -1.388 -0.337) 14.362 10.319 ( 14.291 1.388 -0.337) 14.362 10.854 ( -2.871 -0.965 0.686) 3.106 10.854 ( -2.871 0.965 0.686) 3.106 13.359 ( -1.836 -3.016 4.615) 5.811 13.359 ( -1.836 3.016 4.615) 5.811 14.252 ( 23.917 -2.713 -11.071) 26.495 14.252 ( 23.917 2.713 -11.071) 26.495 15.737 ( 4.480 -4.572 -4.947) 8.090 15.737 ( 4.480 4.572 -4.947) 8.090 15.903 ( 8.815 -3.102 1.759) 9.509 15.903 ( 8.815 3.102 1.759) 9.509 19.333 ( -20.334 -3.123 7.832) 22.013 19.333 ( -20.334 3.123 7.832) 22.013 21.406 ( -0.367 -1.760 -1.013) 2.064 21.406 ( -0.367 1.760 -1.013) 2.064 ======================= Grid point 145 (74/160) ======================= q-point: ( 0.30 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.916 ( 6.825 -2.947 3.862) 8.378 1.916 ( 6.825 2.947 3.862) 8.378 2.039 ( 6.065 -3.664 -0.165) 7.088 2.039 ( 6.065 3.664 -0.165) 7.088 2.082 ( 0.513 -4.625 4.381) 6.391 2.082 ( 0.513 4.625 4.381) 6.391 2.297 ( -0.614 -5.216 -0.896) 5.328 2.297 ( -0.614 5.216 -0.896) 5.328 2.440 ( -0.411 -3.306 -2.556) 4.199 2.440 ( -0.411 3.306 -2.556) 4.199 2.579 ( -2.879 -2.993 -2.679) 4.942 2.579 ( -2.879 2.993 -2.679) 4.942 3.486 ( -8.905 -5.727 2.954) 10.992 3.486 ( -8.905 5.727 2.954) 10.992 3.621 ( -7.562 -3.475 -4.966) 9.691 3.621 ( -7.562 3.475 -4.966) 9.691 3.789 ( -0.741 -2.111 2.059) 3.041 3.789 ( -0.741 2.111 2.059) 3.041 3.933 ( 0.639 -0.699 2.388) 2.569 3.933 ( 0.639 0.699 2.388) 2.569 4.615 ( 12.063 -6.471 1.317) 13.753 4.615 ( 12.063 6.471 1.317) 13.753 5.695 ( 1.034 -4.602 -3.129) 5.660 5.695 ( 1.034 4.602 -3.129) 5.660 6.361 ( -6.283 -3.719 0.322) 7.308 6.361 ( -6.283 3.719 0.322) 7.308 6.620 ( -0.604 -2.908 1.191) 3.200 6.620 ( -0.604 2.908 1.191) 3.200 6.877 ( -7.914 -3.298 -1.262) 8.666 6.877 ( -7.914 3.298 -1.262) 8.666 7.203 ( -1.764 -1.986 -2.404) 3.583 7.203 ( -1.764 1.986 -2.404) 3.583 7.625 ( 11.768 -3.141 -2.159) 12.370 7.625 ( 11.768 3.141 -2.159) 12.370 7.924 ( 3.956 -3.084 4.395) 6.669 7.924 ( 3.956 3.084 4.395) 6.669 8.292 ( 7.840 -1.390 -2.701) 8.408 8.292 ( 7.840 1.390 -2.701) 8.408 8.454 ( -8.647 -1.810 2.205) 9.105 8.454 ( -8.647 1.810 2.205) 9.105 8.830 ( -8.693 -10.444 -0.387) 13.594 8.830 ( -8.693 10.444 -0.387) 13.594 9.126 ( -4.390 -7.637 2.429) 9.138 9.126 ( -4.390 7.637 2.429) 9.138 10.534 ( 11.051 -2.902 1.435) 11.515 10.534 ( 11.051 2.902 1.435) 11.515 10.796 ( -2.254 -0.355 -2.197) 3.168 10.796 ( -2.254 0.355 -2.197) 3.168 13.401 ( -0.183 -1.966 3.313) 3.857 13.401 ( -0.183 1.966 3.313) 3.857 14.491 ( 17.844 -4.085 -5.627) 19.150 14.491 ( 17.844 4.085 -5.627) 19.150 15.823 ( 10.558 -7.250 -2.312) 13.014 15.823 ( 10.558 7.250 -2.312) 13.014 16.083 ( 9.728 -6.292 2.868) 11.935 16.083 ( 9.728 6.292 2.868) 11.935 19.023 ( -23.738 -2.184 1.526) 23.887 19.023 ( -23.738 2.184 1.526) 23.887 21.390 ( -0.417 -0.899 -0.398) 1.068 21.390 ( -0.417 0.899 -0.398) 1.068 ======================= Grid point 147 (75/160) ======================= q-point: ( 0.40 -0.50 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.031 ( 3.129 -1.290 -3.126) 4.608 2.031 ( 3.129 1.290 -3.126) 4.608 2.056 ( 1.485 -3.532 0.458) 3.858 2.056 ( 1.485 3.532 0.458) 3.858 2.188 ( 1.086 -4.378 5.742) 7.301 2.188 ( 1.086 4.378 5.742) 7.301 2.278 ( 0.820 -3.969 -2.073) 4.552 2.278 ( 0.820 3.969 -2.073) 4.552 2.411 ( -0.359 -3.122 -1.656) 3.552 2.411 ( -0.359 3.122 -1.656) 3.552 2.531 ( 0.253 -5.749 -0.593) 5.785 2.531 ( 0.253 5.749 -0.593) 5.785 3.375 ( -7.703 -2.085 -0.562) 8.000 3.375 ( -7.703 2.085 -0.562) 8.000 3.467 ( -4.887 -1.072 0.492) 5.027 3.467 ( -4.887 1.072 0.492) 5.027 3.779 ( 0.321 -1.970 -4.851) 5.246 3.779 ( 0.321 1.970 -4.851) 5.246 3.967 ( -0.157 -1.623 2.077) 2.640 3.967 ( -0.157 1.623 2.077) 2.640 4.789 ( 6.575 -7.190 3.218) 10.261 4.789 ( 6.575 7.190 3.218) 10.261 5.748 ( 6.360 -8.041 1.567) 10.372 5.748 ( 6.360 8.041 1.567) 10.372 6.267 ( -5.951 -5.439 0.094) 8.063 6.267 ( -5.951 5.439 0.094) 8.063 6.539 ( -2.110 -6.386 -10.117) 12.149 6.539 ( -2.110 6.386 -10.117) 12.149 6.808 ( -5.142 -5.404 8.187) 11.075 6.808 ( -5.142 5.404 8.187) 11.075 7.141 ( 0.039 -2.933 -5.545) 6.273 7.141 ( 0.039 2.933 -5.545) 6.273 7.794 ( 11.251 -2.762 -2.972) 11.960 7.794 ( 11.251 2.762 -2.972) 11.960 8.018 ( 1.815 -5.784 2.785) 6.671 8.018 ( 1.815 5.784 2.785) 6.671 8.272 ( -6.631 -1.847 1.806) 7.116 8.272 ( -6.631 1.847 1.806) 7.116 8.412 ( -0.527 -4.840 0.374) 4.883 8.412 ( -0.527 4.840 0.374) 4.883 8.759 ( 0.965 -9.642 0.096) 9.691 8.759 ( 0.965 9.642 0.096) 9.691 9.052 ( -7.272 -6.412 0.902) 9.737 9.052 ( -7.272 6.412 0.902) 9.737 10.677 ( 3.774 -1.519 -1.494) 4.334 10.677 ( 3.774 1.519 -1.494) 4.334 10.776 ( 1.962 -2.160 3.082) 4.244 10.776 ( 1.962 2.160 3.082) 4.244 13.394 ( -0.477 -1.577 -4.059) 4.381 13.394 ( -0.477 1.577 -4.059) 4.381 14.737 ( 8.874 -8.370 11.590) 16.826 14.737 ( 8.874 8.370 11.590) 16.826 15.973 ( 9.868 -9.745 -2.965) 14.182 15.973 ( 9.868 9.745 -2.965) 14.182 16.274 ( 8.175 -6.196 3.398) 10.806 16.274 ( 8.175 6.196 3.398) 10.806 18.632 ( -18.233 -1.890 -7.646) 19.862 18.632 ( -18.233 1.890 -7.646) 19.862 21.386 ( -0.210 -0.412 0.620) 0.774 21.386 ( -0.210 0.412 0.620) 0.774 ======================= Grid point 149 (76/160) ======================= q-point: (-0.50 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.958 ( -2.192 -4.199 -5.770) 7.465 1.958 ( -2.192 4.199 -5.770) 7.465 2.096 ( 1.086 -2.819 -1.419) 3.338 2.096 ( 1.086 2.819 -1.419) 3.338 2.189 ( -4.033 -0.855 0.393) 4.141 2.189 ( -4.033 0.855 0.393) 4.141 2.316 ( 4.779 -4.686 -0.474) 6.710 2.316 ( 4.779 4.686 -0.474) 6.710 2.379 ( -2.395 -1.852 -0.041) 3.028 2.379 ( -2.395 1.852 -0.041) 3.028 2.582 ( 2.658 -5.614 3.848) 7.307 2.582 ( 2.658 5.614 3.848) 7.307 3.253 ( -1.881 -1.057 -3.673) 4.260 3.253 ( -1.881 1.057 -3.673) 4.260 3.484 ( 1.927 -1.929 4.101) 4.925 3.484 ( 1.927 1.929 4.101) 4.925 3.673 ( -0.602 -1.069 -12.207) 12.268 3.673 ( -0.602 1.069 -12.207) 12.268 3.972 ( -1.422 -1.111 1.341) 2.248 3.972 ( -1.422 1.111 1.341) 2.248 4.915 ( -0.287 -6.613 8.124) 10.479 4.915 ( -0.287 6.613 8.124) 10.479 5.872 ( 0.367 -10.256 5.863) 11.819 5.872 ( 0.367 10.256 5.863) 11.819 6.182 ( -0.607 -3.884 -1.784) 4.317 6.182 ( -0.607 3.884 -1.784) 4.317 6.424 ( 3.947 -4.831 -9.895) 11.698 6.424 ( 3.947 4.831 -9.895) 11.698 6.839 ( -2.520 -2.535 5.998) 6.983 6.839 ( -2.520 2.535 5.998) 6.983 7.082 ( 2.322 -3.492 -7.173) 8.309 7.082 ( 2.322 3.492 -7.173) 8.309 7.848 ( 0.992 -1.187 -5.696) 5.902 7.848 ( 0.992 1.187 -5.696) 5.902 8.070 ( 0.809 -1.301 -0.097) 1.535 8.070 ( 0.809 1.301 -0.097) 1.535 8.203 ( -4.696 -0.377 6.395) 7.943 8.203 ( -4.696 0.377 6.395) 7.943 8.431 ( 1.926 -5.112 1.429) 5.647 8.431 ( 1.926 5.112 1.429) 5.647 8.814 ( 1.708 -7.958 1.387) 8.257 8.814 ( 1.708 7.958 1.387) 8.257 8.937 ( -3.325 -6.771 -2.377) 7.910 8.937 ( -3.325 6.771 -2.377) 7.910 10.664 ( -0.505 -1.798 -2.072) 2.789 10.664 ( -0.505 1.798 -2.072) 2.789 10.877 ( 0.795 -1.996 6.407) 6.757 10.877 ( 0.795 1.996 6.407) 6.757 13.307 ( -0.661 -0.982 -8.002) 8.089 13.307 ( -0.661 0.982 -8.002) 8.089 15.040 ( 0.645 -8.037 25.795) 27.026 15.040 ( 0.645 8.037 25.795) 27.026 16.044 ( 2.578 -6.891 -2.653) 7.821 16.044 ( 2.578 6.891 -2.653) 7.821 16.358 ( -4.124 -3.541 2.290) 5.899 16.358 ( -4.124 3.541 2.290) 5.899 18.331 ( 1.501 -1.149 -16.984) 17.089 18.331 ( 1.501 1.149 -16.984) 17.089 21.397 ( 0.054 -0.561 1.390) 1.500 21.397 ( 0.054 0.561 1.390) 1.500 ======================= Grid point 151 (77/160) ======================= q-point: (-0.40 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( -1.607 -4.745 -4.030) 6.430 1.865 ( -1.607 4.745 -4.030) 6.430 2.056 ( -4.113 -2.226 -0.688) 4.727 2.056 ( -4.113 2.226 -0.688) 4.727 2.116 ( -3.188 -2.221 -1.472) 4.155 2.116 ( -3.188 2.221 -1.472) 4.155 2.333 ( -1.529 -2.913 0.632) 3.350 2.333 ( -1.529 2.913 0.632) 3.350 2.396 ( 4.203 -3.008 -1.175) 5.300 2.396 ( 4.203 3.008 -1.175) 5.300 2.667 ( 0.303 -3.792 6.010) 7.113 2.667 ( 0.303 3.792 6.010) 7.113 3.248 ( 5.375 -2.105 -5.057) 7.674 3.248 ( 5.375 2.105 -5.057) 7.674 3.514 ( 3.990 -5.544 -13.064) 14.742 3.514 ( 3.990 5.544 -13.064) 14.742 3.604 ( 5.396 -5.253 2.395) 7.902 3.604 ( 5.396 5.253 2.395) 7.902 3.968 ( -1.209 -2.276 2.409) 3.528 3.968 ( -1.209 2.276 2.409) 3.528 4.896 ( -13.449 -4.965 6.092) 15.576 4.896 ( -13.449 4.965 6.092) 15.576 5.890 ( -4.509 -5.831 6.951) 10.131 5.890 ( -4.509 5.831 6.951) 10.131 6.244 ( 7.253 -0.285 0.159) 7.260 6.244 ( 7.253 0.285 0.159) 7.260 6.435 ( 7.090 -11.157 -5.345) 14.259 6.435 ( 7.090 11.157 -5.345) 14.259 6.842 ( 2.238 -3.656 -4.435) 6.168 6.842 ( 2.238 3.656 -4.435) 6.168 7.073 ( 3.836 -2.771 -2.880) 5.540 7.073 ( 3.836 2.771 -2.880) 5.540 7.762 ( -3.630 -2.398 -3.550) 5.615 7.762 ( -3.630 2.398 -3.550) 5.615 7.976 ( -8.561 -2.282 0.448) 8.872 7.976 ( -8.561 2.282 0.448) 8.872 8.297 ( 4.361 -0.862 1.573) 4.716 8.297 ( 4.361 0.862 1.573) 4.716 8.469 ( -0.275 -5.470 2.965) 6.228 8.469 ( -0.275 5.470 2.965) 6.228 8.793 ( -1.747 -9.121 1.206) 9.365 8.793 ( -1.747 9.121 1.206) 9.365 8.970 ( 7.109 -7.189 -1.396) 10.206 8.970 ( 7.109 7.189 -1.396) 10.206 10.622 ( -3.256 -1.805 -0.293) 3.735 10.622 ( -3.256 1.805 -0.293) 3.735 10.921 ( -3.555 -0.730 4.612) 5.869 10.921 ( -3.555 0.730 4.612) 5.869 13.218 ( 0.667 -1.629 -6.307) 6.548 13.218 ( 0.667 1.629 -6.307) 6.548 15.287 ( -12.743 -6.329 28.932) 32.241 15.287 ( -12.743 6.329 28.932) 32.241 15.988 ( -6.225 -6.101 -1.518) 8.848 15.988 ( -6.225 6.101 -1.518) 8.848 16.199 ( -12.808 -15.672 -0.636) 20.250 16.199 ( -12.808 15.672 -0.636) 20.250 18.329 ( 23.389 -4.431 -19.609) 30.841 18.329 ( 23.389 4.431 -19.609) 30.841 21.416 ( 0.180 -1.433 1.440) 2.039 21.416 ( 0.180 1.433 1.440) 2.039 ======================= Grid point 153 (78/160) ======================= q-point: (-0.30 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -2.878 -7.726 0.163) 8.246 1.809 ( -2.878 7.726 0.163) 8.246 1.975 ( -6.451 -6.629 1.688) 9.403 1.975 ( -6.451 6.629 1.688) 9.403 2.087 ( 2.059 -1.165 0.058) 2.366 2.087 ( 2.059 1.165 0.058) 2.366 2.336 ( 0.840 -0.717 0.452) 1.193 2.336 ( 0.840 0.717 0.452) 1.193 2.431 ( 2.273 -3.376 -1.880) 4.483 2.431 ( 2.273 3.376 -1.880) 4.483 2.736 ( 1.037 -2.786 4.341) 5.261 2.736 ( 1.037 2.786 4.341) 5.261 3.203 ( 2.310 -0.354 -11.940) 12.167 3.203 ( 2.310 0.354 -11.940) 12.167 3.550 ( 9.728 -8.652 -3.175) 13.401 3.550 ( 9.728 8.652 -3.175) 13.401 3.732 ( 7.652 -3.648 0.264) 8.482 3.732 ( 7.652 3.648 0.264) 8.482 3.992 ( -0.519 -5.513 3.774) 6.701 3.992 ( -0.519 5.513 3.774) 6.701 4.657 ( -19.657 -1.483 2.849) 19.918 4.657 ( -19.657 1.483 2.849) 19.918 5.883 ( -4.131 -1.582 2.681) 5.172 5.883 ( -4.131 1.582 2.681) 5.172 6.399 ( 7.155 -10.085 4.142) 13.040 6.399 ( 7.155 10.085 4.142) 13.040 6.490 ( 6.650 -6.104 -3.201) 9.578 6.490 ( 6.650 6.104 -3.201) 9.578 6.843 ( 7.569 -3.437 -9.106) 12.329 6.843 ( 7.569 3.437 -9.106) 12.329 7.128 ( 3.980 -7.903 0.931) 8.898 7.128 ( 3.980 7.903 0.931) 8.898 7.659 ( -4.980 -4.592 -2.221) 7.129 7.659 ( -4.980 4.592 -2.221) 7.129 7.863 ( -6.331 -1.115 1.887) 6.700 7.863 ( -6.331 1.115 1.887) 6.700 8.252 ( -8.135 -5.971 -1.093) 10.150 8.252 ( -8.135 5.971 -1.093) 10.150 8.564 ( 6.329 -6.730 2.890) 9.680 8.564 ( 6.329 6.730 2.890) 9.680 8.833 ( 4.897 -9.280 -0.038) 10.493 8.833 ( 4.897 9.280 -0.038) 10.493 9.087 ( 7.213 -5.224 1.437) 9.021 9.087 ( 7.213 5.224 1.437) 9.021 10.544 ( -7.256 -0.952 1.335) 7.439 10.544 ( -7.256 0.952 1.335) 7.439 10.868 ( -6.167 -1.448 0.401) 6.348 10.868 ( -6.167 1.448 0.401) 6.348 13.199 ( 3.423 -3.690 -2.353) 5.556 13.199 ( 3.423 3.690 -2.353) 5.556 15.137 ( -35.265 -2.471 12.711) 37.567 15.137 ( -35.265 2.471 12.711) 37.567 15.926 ( -1.151 -3.436 4.647) 5.893 15.926 ( -1.151 3.436 4.647) 5.893 16.021 ( -9.279 -9.879 0.265) 13.556 16.021 ( -9.279 9.879 0.265) 13.556 18.581 ( 29.735 -6.237 -14.021) 33.462 18.581 ( 29.735 6.237 -14.021) 33.462 21.433 ( 0.142 -2.546 0.869) 2.694 21.433 ( 0.142 2.546 0.869) 2.694 ======================= Grid point 155 (79/160) ======================= q-point: (-0.20 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.782 ( -2.014 -9.579 1.755) 9.944 1.782 ( -2.014 9.579 1.755) 9.944 1.898 ( -5.985 -9.348 3.620) 11.675 1.898 ( -5.985 9.348 3.620) 11.675 2.165 ( 4.790 -3.098 1.164) 5.822 2.165 ( 4.790 3.098 1.164) 5.822 2.358 ( 0.952 -3.106 0.415) 3.275 2.358 ( 0.952 3.106 0.415) 3.275 2.439 ( 1.561 -1.398 -1.642) 2.662 2.439 ( 1.561 1.398 -1.642) 2.662 2.805 ( 4.259 -1.233 0.147) 4.436 2.805 ( 4.259 1.233 0.147) 4.436 3.119 ( 0.630 -1.140 -5.491) 5.643 3.119 ( 0.630 1.140 -5.491) 5.643 3.665 ( 6.559 -5.967 -0.615) 8.888 3.665 ( 6.559 5.967 -0.615) 8.888 3.823 ( 3.894 -0.597 -2.619) 4.730 3.823 ( 3.894 0.597 -2.619) 4.730 4.023 ( -1.201 -7.752 3.322) 8.518 4.023 ( -1.201 7.752 3.322) 8.518 4.396 ( -14.708 -1.749 2.733) 15.062 4.396 ( -14.708 1.749 2.733) 15.062 5.834 ( -1.956 -1.588 -0.994) 2.708 5.834 ( -1.956 1.588 -0.994) 2.708 6.480 ( 4.679 -6.530 -2.291) 8.354 6.480 ( 4.679 6.530 -2.291) 8.354 6.655 ( 9.611 -6.760 3.319) 12.210 6.655 ( 9.611 6.760 3.319) 12.210 6.857 ( 4.121 -2.002 -4.962) 6.754 6.857 ( 4.121 2.002 -4.962) 6.754 7.211 ( 4.047 -10.279 0.982) 11.091 7.211 ( 4.047 10.279 0.982) 11.091 7.554 ( -3.782 -7.244 -3.164) 8.763 7.554 ( -3.782 7.244 -3.164) 8.763 7.813 ( -4.198 -3.175 3.745) 6.460 7.813 ( -4.198 3.175 3.745) 6.460 8.086 ( -9.475 -4.143 -0.929) 10.382 8.086 ( -9.475 4.143 -0.929) 10.382 8.678 ( 4.120 -3.970 1.111) 5.828 8.678 ( 4.120 3.970 1.111) 5.828 8.932 ( 6.799 -7.948 0.030) 10.460 8.932 ( 6.799 7.948 0.030) 10.460 9.235 ( 8.403 -6.517 1.799) 10.785 9.235 ( 8.403 6.517 1.799) 10.785 10.413 ( -12.238 -2.337 3.198) 12.863 10.413 ( -12.238 2.337 3.198) 12.863 10.753 ( -4.736 -3.196 -3.096) 6.498 10.753 ( -4.736 3.196 -3.096) 6.498 13.277 ( 6.957 -6.141 0.953) 9.329 13.277 ( 6.957 6.141 0.953) 9.329 14.600 ( -36.278 -4.162 0.789) 36.525 14.600 ( -36.278 4.162 0.789) 36.525 15.870 ( -8.021 -4.591 -0.510) 9.257 15.870 ( -8.021 4.591 -0.510) 9.257 15.987 ( -0.709 -5.659 3.804) 6.855 15.987 ( -0.709 5.659 3.804) 6.855 18.929 ( 24.949 -7.702 -4.447) 26.487 18.929 ( 24.949 7.702 -4.447) 26.487 21.440 ( 0.088 -3.443 0.125) 3.446 21.440 ( 0.088 3.443 0.125) 3.446 ======================= Grid point 157 (80/160) ======================= q-point: (-0.10 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -2.033 -8.286 -0.836) 8.573 1.757 ( -2.033 8.286 -0.836) 8.573 1.870 ( -4.283 -5.688 4.832) 8.605 1.870 ( -4.283 5.688 4.832) 8.605 2.229 ( 2.574 -4.445 -1.606) 5.382 2.229 ( 2.574 4.445 -1.606) 5.382 2.385 ( 2.743 -0.598 -0.271) 2.820 2.385 ( 2.743 0.598 -0.271) 2.820 2.427 ( 0.527 -4.546 -3.947) 6.043 2.427 ( 0.527 4.546 -3.947) 6.043 2.857 ( 2.184 -0.551 -1.741) 2.848 2.857 ( 2.184 0.551 -1.741) 2.848 3.129 ( 1.291 -3.277 6.288) 7.207 3.129 ( 1.291 3.277 6.288) 7.207 3.748 ( 3.188 -6.372 0.716) 7.161 3.748 ( 3.188 6.372 0.716) 7.161 3.813 ( 0.421 -2.967 -2.271) 3.760 3.813 ( 0.421 2.967 -2.271) 3.760 4.020 ( -2.075 -8.647 0.939) 8.942 4.020 ( -2.075 8.647 0.939) 8.942 4.252 ( -7.103 -4.212 2.091) 8.519 4.252 ( -7.103 4.212 2.091) 8.519 5.814 ( 0.990 -1.577 -1.603) 2.457 5.814 ( 0.990 1.577 -1.603) 2.457 6.547 ( 6.682 -3.150 -2.186) 7.704 6.547 ( 6.682 3.150 -2.186) 7.704 6.784 ( 3.113 -5.678 -0.309) 6.483 6.784 ( 3.113 5.678 -0.309) 6.483 6.881 ( 0.574 -3.169 2.209) 3.906 6.881 ( 0.574 3.169 2.210) 3.906 7.265 ( 3.060 -5.454 -1.391) 6.407 7.265 ( 3.060 5.454 -1.391) 6.407 7.471 ( -0.505 -10.714 -4.977) 11.824 7.471 ( -0.505 10.714 -4.977) 11.824 7.789 ( -5.098 -6.601 3.894) 9.205 7.789 ( -5.098 6.601 3.894) 9.205 7.964 ( -4.330 -0.640 0.713) 4.435 7.964 ( -4.330 0.640 0.713) 4.435 8.729 ( 1.800 -7.012 0.054) 7.239 8.729 ( 1.800 7.012 0.054) 7.239 9.021 ( 2.164 -7.707 0.933) 8.059 9.021 ( 2.164 7.707 0.933) 8.059 9.396 ( 10.672 -8.145 -1.063) 13.467 9.396 ( 10.672 8.145 -1.063) 13.467 10.210 ( -14.992 -1.561 0.725) 15.090 10.210 ( -14.992 1.561 0.725) 15.090 10.698 ( 0.085 -5.635 1.570) 5.850 10.698 ( 0.085 5.635 1.570) 5.850 13.439 ( 10.651 -7.951 1.742) 13.405 13.439 ( 10.651 7.951 1.742) 13.405 14.051 ( -27.488 -7.910 -3.730) 28.845 14.051 ( -27.488 7.910 -3.730) 28.845 15.752 ( -5.771 -1.570 0.448) 5.997 15.752 ( -5.771 1.570 0.448) 5.997 15.976 ( -0.198 -8.239 -4.300) 9.296 15.976 ( -0.198 8.239 -4.300) 9.296 19.255 ( 14.077 -8.913 4.419) 17.238 19.255 ( 14.077 8.913 4.419) 17.238 21.440 ( 0.107 -3.767 -0.456) 3.796 21.440 ( 0.107 3.767 -0.456) 3.796 ======================= Grid point 189 (81/160) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.855 ( -1.780 0.000 22.966) 23.035 0.934 ( 1.875 0.000 19.612) 19.701 1.332 ( 2.258 0.000 0.121) 2.261 1.715 ( -3.430 0.000 -17.931) 18.256 1.810 ( -5.749 0.000 32.662) 33.164 2.329 ( -2.046 0.000 1.176) 2.360 2.366 ( 2.887 0.000 -4.429) 5.287 2.439 ( -3.252 0.000 0.124) 3.255 2.516 ( 3.312 0.000 -0.698) 3.385 2.570 ( 1.369 0.000 -2.629) 2.964 2.657 ( -1.887 0.000 2.584) 3.200 2.771 ( 0.201 0.000 -6.920) 6.923 2.888 ( -0.216 0.000 -1.978) 1.990 2.955 ( 4.224 0.000 -8.205) 9.229 3.328 ( 3.702 0.000 9.242) 9.956 3.422 ( 4.344 0.000 11.790) 12.565 3.602 ( -3.076 0.000 -3.638) 4.765 3.660 ( 2.519 0.000 6.679) 7.138 3.828 ( -0.270 0.000 -3.326) 3.337 4.043 ( -4.909 0.000 8.966) 10.222 4.056 ( -1.029 0.000 -1.323) 1.676 4.221 ( -5.478 0.000 -21.860) 22.536 5.984 ( -2.636 0.000 -0.965) 2.807 6.004 ( 8.449 0.000 -5.466) 10.063 6.192 ( -1.245 0.000 5.722) 5.856 6.202 ( 6.258 0.000 7.883) 10.065 6.544 ( -7.542 0.000 5.744) 9.480 6.752 ( 0.158 0.000 3.773) 3.777 6.901 ( -0.649 0.000 -11.714) 11.732 6.958 ( 1.051 0.000 -5.205) 5.310 7.189 ( 2.953 0.000 2.285) 3.734 7.261 ( 0.219 0.000 -2.279) 2.289 7.401 ( -0.579 0.000 0.800) 0.988 7.579 ( -5.476 0.000 -8.036) 9.724 7.691 ( 3.261 0.000 3.840) 5.038 7.780 ( -3.871 0.000 -1.051) 4.011 8.091 ( -1.609 0.000 -1.476) 2.184 8.216 ( 1.585 0.000 -6.478) 6.669 8.783 ( 8.531 0.000 4.434) 9.614 8.788 ( -2.936 0.000 -1.074) 3.126 8.848 ( -0.709 0.000 4.396) 4.452 9.150 ( 2.577 0.000 -5.927) 6.463 9.576 ( -7.559 0.000 9.742) 12.331 9.838 ( 10.466 0.000 -3.078) 10.909 10.046 ( -17.179 0.000 6.912) 18.517 10.174 ( 5.167 0.000 14.604) 15.491 10.186 ( 3.983 0.000 -2.180) 4.540 10.843 ( -0.680 0.000 -14.430) 14.446 13.115 ( 0.038 0.000 2.548) 2.548 13.219 ( -0.114 0.000 -2.500) 2.503 13.656 ( 3.999 0.000 25.727) 26.036 15.078 ( 3.357 0.000 -43.092) 43.222 15.660 ( 1.264 0.000 0.154) 1.273 15.674 ( -3.941 0.000 -1.342) 4.163 16.008 ( 4.671 0.000 1.254) 4.837 16.063 ( -10.649 0.000 -2.181) 10.870 18.630 ( 8.959 0.000 27.133) 28.574 19.313 ( -6.314 0.000 -9.311) 11.250 21.487 ( 0.087 0.000 2.668) 2.669 21.624 ( -0.060 0.000 -3.587) 3.587 ======================= Grid point 190 (82/160) ======================= q-point: ( 0.10 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.085 ( 2.604 0.000 15.161) 15.383 1.179 ( 4.272 0.000 9.919) 10.800 1.477 ( 12.548 0.000 -1.066) 12.594 1.479 ( 3.802 0.000 -15.819) 16.269 2.151 ( 6.032 0.000 21.036) 21.883 2.328 ( 1.780 0.000 0.572) 1.870 2.386 ( -0.702 0.000 -1.266) 1.447 2.439 ( 7.964 0.000 -0.822) 8.007 2.527 ( -1.726 0.000 0.700) 1.863 2.617 ( 2.829 0.000 3.806) 4.742 2.678 ( -0.780 0.000 -8.218) 8.255 2.715 ( 5.510 0.000 1.326) 5.667 2.864 ( 1.387 0.000 -3.658) 3.912 2.940 ( 4.219 0.000 -6.257) 7.547 3.484 ( 1.368 0.000 8.535) 8.643 3.510 ( -1.167 0.000 -7.083) 7.179 3.682 ( 5.106 0.000 18.145) 18.850 3.699 ( -7.918 0.000 -6.163) 10.034 3.717 ( -1.853 0.000 1.626) 2.465 3.798 ( -7.733 0.000 -16.918) 18.602 4.005 ( -6.498 0.000 1.573) 6.686 4.076 ( -5.994 0.000 5.390) 8.061 5.863 ( -7.642 0.000 -2.799) 8.138 6.017 ( -1.517 0.000 -3.291) 3.624 6.203 ( -4.288 0.000 -0.585) 4.327 6.300 ( -2.456 0.000 -0.729) 2.562 6.526 ( -1.265 0.000 11.386) 11.456 6.812 ( 4.733 0.000 -5.251) 7.069 6.887 ( 5.985 0.000 6.162) 8.590 6.950 ( 6.393 0.000 -7.636) 9.958 7.210 ( -2.778 0.000 -2.482) 3.726 7.232 ( 1.444 0.000 -0.475) 1.520 7.460 ( 2.315 0.000 5.664) 6.119 7.481 ( 2.814 0.000 -3.497) 4.488 7.693 ( -4.181 0.000 -2.340) 4.791 7.775 ( 0.914 0.000 3.090) 3.222 8.046 ( -2.908 0.000 0.593) 2.968 8.166 ( 0.254 0.000 -4.540) 4.547 8.665 ( -7.709 0.000 -2.391) 8.071 8.793 ( -6.369 0.000 0.081) 6.370 8.913 ( -1.109 0.000 7.363) 7.446 9.066 ( -3.416 0.000 -7.950) 8.652 9.562 ( -2.878 0.000 7.689) 8.209 9.707 ( -13.256 0.000 -0.725) 13.275 10.202 ( 11.345 0.000 5.054) 12.420 10.335 ( 9.510 0.000 -1.417) 9.615 10.515 ( 17.754 0.000 11.462) 21.133 10.686 ( 6.617 0.000 -14.391) 15.839 13.167 ( 2.517 0.000 2.506) 3.552 13.203 ( 1.781 0.000 -2.496) 3.066 13.982 ( -5.379 0.000 30.502) 30.973 14.457 ( -13.673 0.000 -40.780) 43.011 15.615 ( -2.976 0.000 0.235) 2.986 15.685 ( 0.710 0.000 1.158) 1.358 15.928 ( -6.380 0.000 -0.793) 6.429 16.039 ( -2.983 0.000 3.542) 4.631 19.118 ( 15.486 0.000 19.494) 24.897 19.176 ( 6.555 0.000 -14.953) 16.326 21.517 ( -0.704 0.000 3.302) 3.376 21.572 ( -0.919 0.000 -3.785) 3.895 ======================= Grid point 191 (83/160) ======================= q-point: ( 0.20 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 10.535 0.000 -5.608) 11.935 1.283 ( 11.459 0.000 -2.348) 11.697 1.562 ( 10.440 0.000 1.814) 10.596 1.668 ( 8.443 0.000 5.654) 10.162 2.334 ( -0.561 0.000 2.773) 2.829 2.353 ( -1.697 0.000 -1.276) 2.123 2.408 ( 3.118 0.000 2.547) 4.026 2.504 ( 0.249 0.000 -1.939) 1.955 2.541 ( -5.025 0.000 -5.542) 7.481 2.582 ( 5.333 0.000 4.276) 6.835 2.713 ( -1.624 0.000 1.986) 2.565 2.848 ( 8.551 0.000 -0.184) 8.553 2.881 ( 7.457 0.000 -2.189) 7.772 2.938 ( 1.923 0.000 -2.762) 3.365 3.342 ( -4.973 0.000 -11.514) 12.542 3.510 ( -8.109 0.000 2.619) 8.522 3.529 ( 0.644 0.000 -9.759) 9.780 3.664 ( 3.167 0.000 4.225) 5.281 3.672 ( -0.587 0.000 -2.470) 2.539 3.857 ( -4.164 0.000 3.753) 5.606 4.023 ( 5.560 0.000 11.564) 12.832 4.040 ( -7.024 0.000 4.585) 8.388 5.725 ( -5.768 0.000 -1.025) 5.859 5.915 ( -6.137 0.000 -2.238) 6.533 6.058 ( -6.946 0.000 -4.067) 8.048 6.139 ( -9.120 0.000 -5.096) 10.447 6.721 ( 3.314 0.000 13.284) 13.691 6.913 ( 6.117 0.000 0.687) 6.155 6.953 ( 7.277 0.000 -10.286) 12.600 6.986 ( -1.021 0.000 1.300) 1.653 7.171 ( 2.012 0.000 -0.885) 2.198 7.246 ( 1.559 0.000 -1.274) 2.014 7.540 ( 6.035 0.000 -2.637) 6.585 7.589 ( 2.551 0.000 9.819) 10.145 7.598 ( -3.226 0.000 -2.643) 4.171 7.743 ( -4.150 0.000 -3.558) 5.466 8.058 ( 0.363 0.000 6.618) 6.628 8.134 ( 0.760 0.000 -1.033) 1.282 8.580 ( 0.718 0.000 -0.216) 0.750 8.670 ( -8.812 0.000 0.632) 8.835 8.876 ( -6.975 0.000 -9.277) 11.607 8.935 ( -5.730 0.000 6.194) 8.438 9.503 ( -9.951 0.000 -1.555) 10.071 9.652 ( -0.255 0.000 7.803) 7.807 10.279 ( 0.253 0.000 -11.575) 11.578 10.393 ( 3.854 0.000 7.695) 8.606 10.870 ( 20.766 0.000 -1.801) 20.844 10.934 ( 20.834 0.000 3.407) 21.111 13.221 ( 3.551 0.000 -1.904) 4.030 13.245 ( 3.735 0.000 1.837) 4.162 13.844 ( -10.377 0.000 -27.262) 29.170 14.163 ( -13.973 0.000 27.617) 30.951 15.570 ( -3.055 0.000 0.454) 3.089 15.701 ( -0.574 0.000 1.092) 1.234 15.806 ( -5.771 0.000 -2.697) 6.370 16.021 ( -6.342 0.000 7.121) 9.536 19.169 ( 15.138 0.000 -17.352) 23.027 19.522 ( 11.390 0.000 10.386) 15.415 21.513 ( -1.141 0.000 -3.205) 3.402 21.538 ( -1.639 0.000 3.433) 3.805 ======================= Grid point 192 (84/160) ======================= q-point: ( 0.30 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( 14.510 0.000 -12.038) 18.853 1.440 ( 13.804 0.000 -3.441) 14.227 1.733 ( 7.460 0.000 0.889) 7.512 1.888 ( 6.517 0.000 9.977) 11.917 2.286 ( -3.344 0.000 -2.145) 3.973 2.302 ( -4.232 0.000 1.214) 4.403 2.343 ( -12.740 0.000 -1.905) 12.882 2.456 ( -0.445 0.000 1.448) 1.515 2.487 ( -0.213 0.000 -1.980) 1.991 2.628 ( -3.604 0.000 -3.328) 4.906 2.666 ( -1.890 0.000 1.719) 2.555 2.808 ( -8.387 0.000 -0.716) 8.418 3.049 ( 8.605 0.000 1.677) 8.767 3.052 ( 11.746 0.000 2.054) 11.924 3.186 ( -0.170 0.000 -7.283) 7.285 3.381 ( 0.530 0.000 -5.520) 5.545 3.491 ( 4.844 0.000 -5.321) 7.196 3.712 ( 8.055 0.000 -1.961) 8.290 3.805 ( -3.185 0.000 -2.962) 4.349 3.880 ( 3.085 0.000 7.327) 7.950 3.936 ( 0.196 0.000 -3.494) 3.500 4.220 ( 0.359 0.000 10.711) 10.717 5.638 ( -4.709 0.000 -0.854) 4.786 5.771 ( -8.485 0.000 -1.851) 8.685 5.957 ( -0.643 0.000 -1.430) 1.568 5.992 ( -5.463 0.000 3.112) 6.287 6.855 ( -3.603 0.000 6.351) 7.302 6.875 ( 0.509 0.000 -7.432) 7.449 6.912 ( -4.394 0.000 -0.554) 4.428 7.040 ( 6.695 0.000 -4.002) 7.800 7.245 ( -0.248 0.000 -1.401) 1.423 7.253 ( 7.915 0.000 -0.137) 7.916 7.484 ( -1.683 0.000 -7.685) 7.867 7.619 ( 2.843 0.000 1.223) 3.095 7.633 ( -2.334 0.000 -3.856) 4.507 7.751 ( 2.528 0.000 9.772) 10.093 8.191 ( 3.615 0.000 9.025) 9.722 8.201 ( 5.247 0.000 4.625) 6.994 8.535 ( -8.340 0.000 1.008) 8.401 8.621 ( -2.484 0.000 -7.646) 8.039 8.684 ( 1.412 0.000 0.286) 1.440 8.868 ( -10.379 0.000 4.822) 11.445 9.355 ( -5.997 0.000 -1.187) 6.113 9.615 ( -9.511 0.000 -0.729) 9.539 10.297 ( 10.929 0.000 0.237) 10.932 10.515 ( 0.598 0.000 7.246) 7.270 11.148 ( 14.858 0.000 -3.276) 15.214 11.235 ( 14.806 0.000 -2.228) 14.973 13.263 ( 3.605 0.000 -1.751) 4.008 13.322 ( 3.494 0.000 0.855) 3.597 13.530 ( -0.766 0.000 -11.880) 11.905 14.163 ( -18.727 0.000 18.490) 26.317 15.533 ( -2.672 0.000 1.798) 3.220 15.689 ( -1.549 0.000 0.030) 1.549 15.711 ( -2.280 0.000 -0.378) 2.311 16.004 ( -7.595 0.000 9.825) 12.418 19.252 ( 17.824 0.000 -15.462) 23.596 19.707 ( 4.073 0.000 0.123) 4.075 21.469 ( -0.374 0.000 -1.932) 1.968 21.541 ( -2.517 0.000 2.982) 3.902 ======================= Grid point 193 (85/160) ======================= q-point: ( 0.40 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.513 ( 14.958 0.000 -9.841) 17.905 1.587 ( 6.697 0.000 -2.027) 6.997 1.821 ( 5.397 0.000 -2.297) 5.866 2.061 ( -2.300 0.000 8.266) 8.580 2.137 ( -7.384 0.000 2.867) 7.921 2.255 ( -4.295 0.000 3.117) 5.307 2.260 ( 2.220 0.000 -1.227) 2.537 2.385 ( -7.436 0.000 -5.041) 8.984 2.445 ( -0.581 0.000 0.194) 0.613 2.556 ( -1.703 0.000 -2.841) 3.312 2.590 ( -1.266 0.000 0.118) 1.271 2.736 ( -6.845 0.000 4.437) 8.157 3.160 ( 6.096 0.000 -4.315) 7.469 3.163 ( 4.529 0.000 -1.075) 4.655 3.240 ( 5.443 0.000 1.975) 5.790 3.400 ( 2.633 0.000 -0.918) 2.789 3.551 ( 5.581 0.000 -4.115) 6.934 3.652 ( -5.214 0.000 -9.058) 10.451 3.740 ( -3.022 0.000 -3.008) 4.264 3.884 ( 14.215 0.000 -2.597) 14.450 4.090 ( 2.026 0.000 3.642) 4.167 4.269 ( -3.750 0.000 3.151) 4.898 5.553 ( -2.773 0.000 -1.868) 3.344 5.621 ( -6.320 0.000 -1.999) 6.629 5.987 ( 1.991 0.000 3.077) 3.665 6.024 ( -1.513 0.000 9.493) 9.613 6.780 ( -3.477 0.000 0.284) 3.489 6.807 ( 1.748 0.000 -6.865) 7.084 6.891 ( -3.270 0.000 2.391) 4.051 7.043 ( -0.064 0.000 -4.313) 4.313 7.178 ( -3.508 0.000 -5.584) 6.594 7.335 ( -0.041 0.000 -10.545) 10.545 7.417 ( 8.934 0.000 -0.027) 8.934 7.587 ( -2.210 0.000 1.397) 2.614 7.705 ( 5.200 0.000 3.022) 6.014 7.882 ( 0.562 0.000 6.946) 6.968 8.308 ( -2.504 0.000 4.147) 4.844 8.354 ( 0.916 0.000 5.351) 5.429 8.463 ( -0.252 0.000 4.046) 4.054 8.483 ( 3.150 0.000 -4.550) 5.534 8.720 ( -13.231 0.000 4.259) 13.900 8.795 ( 5.271 0.000 1.961) 5.624 9.282 ( -1.753 0.000 -0.658) 1.872 9.419 ( -8.697 0.000 -4.277) 9.692 10.544 ( 9.648 0.000 9.529) 13.561 10.583 ( -2.389 0.000 7.320) 7.700 11.251 ( 6.429 0.000 -8.813) 10.909 11.361 ( 7.187 0.000 -6.797) 9.892 13.300 ( 3.767 0.000 -0.941) 3.883 13.373 ( 1.964 0.000 0.020) 1.964 13.501 ( 6.374 0.000 -3.180) 7.123 13.986 ( -20.928 0.000 7.489) 22.228 15.525 ( -1.483 0.000 2.402) 2.823 15.657 ( -1.513 0.000 -0.982) 1.804 15.757 ( 3.241 0.000 7.057) 7.766 16.003 ( -6.930 0.000 10.273) 12.392 19.372 ( 15.433 0.000 -11.499) 19.246 19.678 ( -1.808 0.000 -7.157) 7.382 21.462 ( 1.282 0.000 -0.474) 1.366 21.525 ( -3.064 0.000 2.011) 3.665 ======================= Grid point 194 (86/160) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.569 ( -5.919 0.000 -2.288) 6.346 1.642 ( 11.415 0.000 -6.144) 12.964 1.912 ( 7.001 0.000 1.411) 7.141 1.933 ( -15.957 0.000 1.500) 16.028 2.190 ( 4.222 0.000 3.375) 5.405 2.213 ( -1.538 0.000 -2.977) 3.351 2.275 ( -1.428 0.000 1.610) 2.152 2.312 ( 3.964 0.000 -1.368) 4.194 2.466 ( -1.046 0.000 0.916) 1.390 2.559 ( 6.525 0.000 3.753) 7.527 2.603 ( -0.379 0.000 -1.336) 1.388 2.644 ( -6.747 0.000 2.859) 7.328 3.180 ( 1.502 0.000 -3.894) 4.174 3.233 ( 2.831 0.000 -3.392) 4.418 3.316 ( 7.271 0.000 0.246) 7.275 3.340 ( -10.829 0.000 0.166) 10.830 3.455 ( -1.226 0.000 -8.229) 8.320 3.484 ( 0.623 0.000 -10.007) 10.027 3.863 ( 4.558 0.000 9.064) 10.146 4.047 ( -8.918 0.000 2.376) 9.229 4.069 ( 8.902 0.000 -1.926) 9.108 4.184 ( -6.285 0.000 -2.566) 6.789 5.525 ( 1.688 0.000 -1.217) 2.081 5.547 ( 0.576 0.000 -1.978) 2.060 6.067 ( 1.732 0.000 5.229) 5.508 6.111 ( -0.145 0.000 6.541) 6.543 6.783 ( -2.467 0.000 5.307) 5.852 6.787 ( 3.409 0.000 -3.590) 4.951 6.890 ( 4.451 0.000 -0.354) 4.465 6.957 ( -3.568 0.000 -4.327) 5.608 7.014 ( -6.103 0.000 -8.115) 10.154 7.212 ( 1.792 0.000 -10.423) 10.576 7.552 ( -5.606 0.000 1.967) 5.941 7.589 ( 10.528 0.000 0.040) 10.528 7.850 ( 7.570 0.000 3.123) 8.189 7.884 ( -5.805 0.000 1.034) 5.896 8.291 ( -1.725 0.000 4.461) 4.783 8.343 ( -3.551 0.000 2.575) 4.386 8.484 ( -9.742 0.000 2.497) 10.057 8.588 ( 9.773 0.000 -1.058) 9.830 8.654 ( -0.861 0.000 8.257) 8.302 8.862 ( 0.957 0.000 -0.195) 0.976 9.274 ( -3.162 0.000 -3.073) 4.409 9.283 ( 2.879 0.000 -0.650) 2.952 10.616 ( -5.601 0.000 10.029) 11.487 10.781 ( 3.344 0.000 11.789) 12.254 11.175 ( 0.058 0.000 -11.729) 11.729 11.317 ( -0.144 0.000 -10.413) 10.414 13.355 ( 1.873 0.000 0.594) 1.965 13.381 ( -0.824 0.000 -0.601) 1.020 13.672 ( 17.175 0.000 1.381) 17.230 13.689 ( -19.489 0.000 0.115) 19.489 15.542 ( 0.273 0.000 2.318) 2.334 15.623 ( -0.679 0.000 -1.593) 1.732 15.944 ( 5.805 0.000 10.518) 12.014 16.005 ( -5.897 0.000 7.460) 9.509 19.475 ( 10.463 0.000 -7.360) 12.793 19.500 ( -8.103 0.000 -9.465) 12.460 21.491 ( -2.926 0.000 0.875) 3.054 21.498 ( 2.978 0.000 0.450) 3.012 ======================= Grid point 195 (87/160) ======================= q-point: (-0.40 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -14.290 0.000 -3.085) 14.619 1.598 ( -20.125 0.000 -3.282) 20.391 1.729 ( 2.049 0.000 -1.118) 2.334 2.059 ( 4.243 0.000 7.532) 8.645 2.188 ( 1.778 0.000 -3.073) 3.551 2.267 ( -0.038 0.000 0.642) 0.644 2.317 ( 4.041 0.000 1.178) 4.209 2.387 ( 9.247 0.000 -2.810) 9.664 2.482 ( -5.795 0.000 -3.226) 6.633 2.486 ( 0.566 0.000 2.207) 2.279 2.653 ( 1.818 0.000 -0.720) 1.955 2.741 ( 4.456 0.000 5.974) 7.452 3.079 ( -6.186 0.000 -7.210) 9.500 3.169 ( -2.836 0.000 -3.069) 4.178 3.215 ( -2.797 0.000 2.481) 3.739 3.349 ( -1.546 0.000 -2.835) 3.229 3.407 ( -0.723 0.000 -4.273) 4.334 3.507 ( 8.007 0.000 0.526) 8.024 3.806 ( -10.482 0.000 3.249) 10.974 3.928 ( -12.714 0.000 -6.962) 14.495 4.145 ( 7.660 0.000 10.299) 12.835 4.177 ( 0.357 0.000 0.112) 0.374 5.581 ( 6.327 0.000 -0.529) 6.349 5.582 ( 6.210 0.000 -2.825) 6.822 6.142 ( -0.890 0.000 -1.113) 1.425 6.168 ( 3.327 0.000 4.906) 5.928 6.758 ( -4.090 0.000 -3.447) 5.349 6.827 ( 2.246 0.000 1.424) 2.659 6.837 ( -7.682 0.000 2.281) 8.013 6.873 ( 1.434 0.000 -3.921) 4.175 7.048 ( 11.147 0.000 2.419) 11.406 7.169 ( 4.518 0.000 -6.192) 7.665 7.444 ( -8.028 0.000 -0.742) 8.062 7.723 ( 6.297 0.000 -2.368) 6.728 7.773 ( -6.726 0.000 -0.745) 6.768 8.002 ( 7.305 0.000 1.389) 7.436 8.271 ( -9.280 0.000 2.743) 9.677 8.342 ( -0.174 0.000 5.577) 5.580 8.413 ( -0.250 0.000 2.684) 2.695 8.701 ( 2.986 0.000 -3.587) 4.667 8.701 ( -4.124 0.000 5.288) 6.705 8.851 ( 3.511 0.000 -1.478) 3.810 9.245 ( 1.890 0.000 -1.339) 2.317 9.356 ( 6.367 0.000 -0.615) 6.397 10.637 ( -9.183 0.000 13.865) 16.631 10.874 ( -4.580 0.000 2.259) 5.107 11.065 ( -0.387 0.000 -1.504) 1.553 11.125 ( -6.699 0.000 -12.229) 13.943 13.307 ( -7.590 0.000 -1.877) 7.818 13.365 ( -1.064 0.000 0.452) 1.156 13.429 ( -9.888 0.000 0.169) 9.890 14.079 ( 27.996 0.000 3.121) 28.170 15.586 ( 1.677 0.000 2.299) 2.846 15.603 ( 0.630 0.000 -1.663) 1.778 15.968 ( -5.560 0.000 1.758) 5.831 16.156 ( 6.724 0.000 7.759) 10.267 19.199 ( -16.654 0.000 -7.559) 18.289 19.542 ( 5.611 0.000 -3.457) 6.591 21.455 ( -1.984 0.000 0.122) 1.988 21.560 ( 3.718 0.000 0.414) 3.741 ======================= Grid point 196 (88/160) ======================= q-point: (-0.30 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( -19.472 0.000 -0.231) 19.473 1.232 ( -23.131 0.000 3.512) 23.396 1.706 ( -4.806 0.000 0.680) 4.854 2.153 ( -4.680 0.000 0.826) 4.752 2.234 ( 7.859 0.000 5.602) 9.651 2.256 ( -2.761 0.000 1.719) 3.252 2.349 ( -22.671 0.000 3.486) 22.937 2.367 ( 2.103 0.000 -7.659) 7.943 2.428 ( 4.240 0.000 0.887) 4.332 2.525 ( 10.426 0.000 -2.625) 10.751 2.673 ( 1.846 0.000 0.236) 1.861 2.827 ( 1.756 0.000 3.530) 3.943 2.943 ( -1.666 0.000 -3.700) 4.058 3.096 ( -4.389 0.000 -1.028) 4.508 3.203 ( -2.999 0.000 0.225) 3.008 3.267 ( -2.880 0.000 -3.014) 4.168 3.370 ( -2.920 0.000 1.469) 3.269 3.628 ( 5.964 0.000 5.243) 7.941 3.655 ( -9.599 0.000 -2.298) 9.870 3.830 ( 8.621 0.000 -1.505) 8.752 4.097 ( -9.033 0.000 -1.729) 9.197 4.416 ( 12.599 0.000 6.064) 13.982 5.671 ( 9.103 0.000 -3.255) 9.667 5.705 ( 8.335 0.000 0.609) 8.357 6.046 ( -4.676 0.000 -6.098) 7.684 6.257 ( 3.241 0.000 -1.129) 3.432 6.608 ( -6.546 0.000 -1.641) 6.748 6.814 ( -5.541 0.000 7.985) 9.719 6.880 ( 6.008 0.000 -1.430) 6.176 6.947 ( 5.136 0.000 3.696) 6.328 7.194 ( 3.717 0.000 -2.253) 4.346 7.256 ( 8.834 0.000 2.086) 9.077 7.300 ( -6.265 0.000 -1.139) 6.367 7.668 ( -4.949 0.000 -0.744) 5.004 7.719 ( -0.739 0.000 -4.982) 5.037 8.050 ( -0.196 0.000 -5.188) 5.191 8.252 ( 0.649 0.000 9.021) 9.044 8.370 ( -4.431 0.000 2.056) 4.885 8.449 ( 2.355 0.000 -2.614) 3.518 8.631 ( 1.393 0.000 -5.284) 5.465 8.669 ( -5.276 0.000 4.133) 6.702 8.967 ( 8.841 0.000 -0.663) 8.866 9.284 ( 3.000 0.000 0.966) 3.151 9.466 ( 7.005 0.000 1.336) 7.131 10.574 ( -14.682 0.000 3.340) 15.057 10.736 ( -9.011 0.000 -2.812) 9.440 10.881 ( -9.614 0.000 -1.719) 9.767 11.090 ( -1.025 0.000 3.555) 3.700 13.171 ( -6.051 0.000 1.182) 6.165 13.330 ( -5.421 0.000 1.553) 5.639 13.340 ( -2.105 0.000 0.060) 2.106 14.594 ( 32.571 0.000 -2.046) 32.635 15.607 ( 1.825 0.000 -1.100) 2.131 15.644 ( 2.257 0.000 1.951) 2.983 15.863 ( -5.163 0.000 -4.353) 6.753 16.340 ( 9.000 0.000 1.796) 9.177 18.796 ( -26.107 0.000 -0.735) 26.118 19.587 ( 2.316 0.000 0.440) 2.358 21.434 ( -0.700 0.000 0.090) 0.706 21.619 ( 3.298 0.000 -0.446) 3.328 ======================= Grid point 197 (89/160) ======================= q-point: (-0.20 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 160 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.786 ( -18.966 0.000 9.752) 21.327 0.941 ( -22.628 0.000 9.748) 24.638 1.612 ( -8.988 0.000 4.056) 9.860 1.875 ( -39.131 0.000 14.102) 41.594 2.062 ( -5.099 0.000 -2.574) 5.712 2.290 ( -0.283 0.000 3.767) 3.778 2.331 ( 4.478 0.000 -5.512) 7.102 2.415 ( 6.970 0.000 1.634) 7.158 2.480 ( 0.807 0.000 0.090) 0.812 2.650 ( 4.722 0.000 -0.549) 4.754 2.767 ( 3.352 0.000 6.016) 6.887 2.880 ( 1.988 0.000 -0.727) 2.117 2.888 ( 1.937 0.000 -7.042) 7.304 2.988 ( -5.930 0.000 -1.832) 6.206 3.144 ( -0.719 0.000 -1.455) 1.623 3.284 ( -6.452 0.000 1.900) 6.726 3.298 ( 7.247 0.000 7.080) 10.131 3.643 ( -5.393 0.000 10.485) 11.791 3.777 ( 5.742 0.000 0.158) 5.744 3.902 ( -7.985 0.000 -0.263) 7.990 3.945 ( 10.860 0.000 -8.211) 13.614 4.621 ( 10.381 0.000 -6.855) 12.440 5.800 ( 10.474 0.000 -2.620) 10.797 5.856 ( 7.970 0.000 2.272) 8.288 5.918 ( -2.867 0.000 -1.886) 3.432 6.217 ( 0.564 0.000 -8.839) 8.857 6.554 ( -5.569 0.000 7.885) 9.653 6.815 ( -5.011 0.000 6.729) 8.390 6.977 ( 5.597 0.000 0.298) 5.605 7.063 ( 4.914 0.000 -0.927) 5.001 7.172 ( -4.692 0.000 -1.868) 5.050 7.222 ( 1.472 0.000 0.197) 1.485 7.412 ( 4.265 0.000 2.348) 4.868 7.599 ( -2.452 0.000 -0.187) 2.460 7.647 ( -0.109 0.000 -2.227) 2.230 7.959 ( -1.509 0.000 -7.083) 7.242 8.247 ( -6.003 0.000 -3.956) 7.189 8.339 ( -1.566 0.000 -1.215) 1.982 8.469 ( 4.564 0.000 3.555) 5.785 8.639 ( -2.649 0.000 1.949) 3.289 8.685 ( 7.275 0.000 -1.143) 7.364 9.083 ( 6.422 0.000 -1.239) 6.540 9.368 ( 3.733 0.000 4.270) 5.672 9.635 ( 7.890 0.000 7.399) 10.817 10.244 ( -16.429 0.000 -10.668) 19.589 10.537 ( -13.040 0.000 -0.690) 13.059 10.750 ( -14.099 0.000 5.114) 14.998 11.081 ( -1.182 0.000 -2.413) 2.687 13.130 ( -3.461 0.000 3.107) 4.651 13.283 ( -3.561 0.000 3.700) 5.136 13.302 ( -2.073 0.000 -0.744) 2.202 15.032 ( 29.819 0.000 -12.362) 32.280 15.636 ( 2.779 0.000 -1.031) 2.964 15.700 ( 2.367 0.000 0.949) 2.550 15.742 ( -1.819 0.000 -2.383) 2.998 16.465 ( 9.400 0.000 -9.118) 13.095 18.395 ( -29.295 0.000 14.220) 32.564 19.624 ( -0.311 0.000 1.811) 1.837 21.435 ( 0.240 0.000 0.723) 0.762 21.652 ( 2.231 0.000 -1.655) 2.778 ======================= Grid point 198 (90/160) ======================= q-point: (-0.10 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.736 ( -8.572 0.000 20.833) 22.527 0.744 ( -15.665 0.000 15.363) 21.941 1.444 ( -16.470 0.000 2.561) 16.668 1.634 ( -19.985 0.000 32.185) 37.885 1.926 ( -2.876 0.000 -10.061) 10.464 2.328 ( -1.081 0.000 3.839) 3.988 2.367 ( 2.890 0.000 -0.533) 2.939 2.471 ( 0.151 0.000 -2.155) 2.160 2.488 ( 2.621 0.000 -2.099) 3.358 2.628 ( -1.191 0.000 -5.431) 5.560 2.719 ( -7.402 0.000 0.851) 7.451 2.848 ( -0.878 0.000 -5.361) 5.432 2.915 ( -1.473 0.000 -0.643) 1.607 2.960 ( 7.957 0.000 -6.406) 10.215 3.186 ( 3.827 0.000 4.006) 5.540 3.278 ( -0.723 0.000 7.566) 7.601 3.580 ( -5.650 0.000 5.676) 8.009 3.611 ( 7.583 0.000 9.730) 12.336 3.795 ( 4.717 0.000 -5.899) 7.553 3.956 ( -0.499 0.000 12.297) 12.307 4.001 ( 7.558 0.000 -5.409) 9.294 4.542 ( 0.252 0.000 -20.841) 20.842 5.924 ( 9.277 0.000 -4.891) 10.487 5.947 ( 3.788 0.000 3.054) 4.866 6.013 ( 5.957 0.000 5.644) 8.206 6.155 ( 1.146 0.000 -1.837) 2.165 6.560 ( -5.607 0.000 8.124) 9.871 6.789 ( -5.599 0.000 2.915) 6.312 7.010 ( -0.139 0.000 -3.705) 3.707 7.042 ( -0.806 0.000 -7.231) 7.276 7.126 ( 0.331 0.000 1.257) 1.299 7.257 ( 2.753 0.000 -1.126) 2.974 7.436 ( -2.548 0.000 0.286) 2.564 7.607 ( 2.381 0.000 1.763) 2.963 7.706 ( 3.398 0.000 -1.225) 3.612 7.841 ( -1.501 0.000 -6.245) 6.423 8.141 ( -1.918 0.000 -3.131) 3.672 8.267 ( 0.816 0.000 -6.577) 6.627 8.575 ( 4.597 0.000 4.772) 6.626 8.715 ( 5.320 0.000 7.493) 9.190 8.779 ( 4.519 0.000 -0.644) 4.564 9.144 ( 4.388 0.000 -3.303) 5.492 9.499 ( 2.562 0.000 8.254) 8.642 9.845 ( 1.782 0.000 -3.985) 4.365 9.929 ( -5.098 0.000 9.219) 10.535 10.305 ( -12.822 0.000 -1.229) 12.881 10.436 ( -26.231 0.000 -0.517) 26.236 10.996 ( -0.863 0.000 -9.284) 9.324 13.109 ( -2.655 0.000 2.407) 3.583 13.258 ( -1.412 0.000 -1.782) 2.274 13.350 ( 1.948 0.000 13.902) 14.038 15.244 ( 21.703 0.000 -24.941) 33.062 15.645 ( 1.489 0.000 -1.614) 2.196 15.729 ( 0.977 0.000 -1.810) 2.057 15.842 ( 9.475 0.000 4.547) 10.510 16.348 ( -5.906 0.000 -16.200) 17.243 18.297 ( -11.631 0.000 29.194) 31.426 19.547 ( -8.738 0.000 -4.555) 9.854 21.456 ( 0.486 0.000 1.708) 1.775 21.653 ( 1.059 0.000 -2.782) 2.977 ======================= Grid point 199 (91/160) ======================= q-point: ( 0.00 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( -0.196 11.008 19.080) 22.028 1.122 ( -1.292 13.781 16.509) 21.544 1.460 ( 0.613 10.990 0.587) 11.023 1.741 ( -2.555 3.157 -15.756) 16.271 1.905 ( -4.750 8.679 19.614) 21.968 2.249 ( -3.008 -6.298 -4.374) 8.237 2.373 ( 1.094 -4.227 5.520) 7.038 2.474 ( 3.791 1.306 -0.551) 4.048 2.485 ( 0.239 3.189 -1.831) 3.685 2.573 ( 1.561 -1.925 -3.050) 3.930 2.712 ( -0.047 0.059 -2.273) 2.274 2.734 ( 0.015 4.404 -0.540) 4.437 2.959 ( 0.579 8.147 -2.237) 8.468 3.171 ( 2.517 16.149 -7.507) 17.985 3.378 ( 2.348 4.533 9.131) 10.461 3.497 ( 3.014 6.399 8.982) 11.433 3.648 ( -3.282 3.790 -1.138) 5.141 3.686 ( 3.123 3.001 3.538) 5.593 3.855 ( 2.359 -0.650 -1.680) 2.968 3.944 ( -2.486 -5.546 3.432) 6.980 3.974 ( -4.505 -5.857 5.116) 8.987 4.217 ( -5.197 -0.778 -18.304) 19.044 5.899 ( 5.974 -4.851 -0.825) 7.740 5.966 ( -0.374 -4.098 -1.821) 4.500 6.235 ( -0.628 5.367 3.539) 6.459 6.333 ( 2.014 8.482 3.246) 9.302 6.604 ( -4.511 5.459 5.448) 8.935 6.737 ( 0.872 -1.415 3.965) 4.300 6.924 ( -3.542 -0.535 -5.180) 6.298 6.958 ( 4.862 2.257 -10.729) 11.994 7.168 ( 2.073 -1.604 1.938) 3.260 7.259 ( -3.369 -0.682 -2.706) 4.375 7.390 ( 1.646 -1.166 1.717) 2.649 7.478 ( 3.272 -3.079 7.116) 8.416 7.665 ( -0.008 -1.655 -5.438) 5.685 7.896 ( -6.927 4.105 -8.122) 11.437 8.101 ( -1.520 1.021 -2.235) 2.889 8.181 ( 2.184 -3.661 -4.484) 6.187 8.738 ( 3.953 -2.645 6.784) 8.285 8.828 ( -2.408 1.862 0.783) 3.143 8.854 ( -0.812 1.214 -0.481) 1.538 9.133 ( 3.685 -0.454 -6.815) 7.761 9.537 ( -5.473 -3.412 9.954) 11.861 9.833 ( 7.990 -1.892 -4.739) 9.480 9.971 ( -11.931 -7.095 13.768) 19.551 10.190 ( 3.843 2.172 3.422) 5.585 10.323 ( 1.584 11.676 5.145) 12.857 10.819 ( -0.792 -1.610 -13.078) 13.201 13.184 ( -0.706 6.455 2.676) 7.023 13.278 ( -0.536 5.419 -1.904) 5.768 13.564 ( 1.550 -6.635 21.680) 22.726 14.764 ( 3.110 -24.078 -33.070) 41.025 15.641 ( -0.592 -0.298 1.275) 1.437 15.774 ( 0.769 3.582 -5.642) 6.727 15.976 ( -2.683 -3.553 1.170) 4.604 16.058 ( -3.455 -0.714 -5.659) 6.669 18.781 ( 6.630 13.730 24.922) 29.216 19.402 ( -3.496 7.235 -7.486) 10.982 21.471 ( 0.058 -1.490 2.590) 2.989 21.606 ( -0.022 -1.729 -3.581) 3.977 ======================= Grid point 200 (92/160) ======================= q-point: ( 0.10 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 3.871 12.159 16.831) 21.121 1.306 ( 2.832 10.196 9.132) 13.977 1.536 ( 3.533 5.145 -12.942) 14.368 1.547 ( 10.501 6.144 -4.371) 12.928 2.089 ( 4.349 -2.256 10.909) 11.959 2.214 ( 2.543 -5.635 -1.089) 6.277 2.421 ( -0.686 -1.874 2.977) 3.584 2.466 ( -1.189 -1.854 0.481) 2.254 2.510 ( 3.286 -0.176 -3.042) 4.481 2.607 ( 0.986 -2.442 -0.946) 2.798 2.696 ( 1.385 3.044 0.295) 3.357 2.784 ( 6.088 3.905 -0.845) 7.281 2.958 ( 0.799 13.234 2.013) 13.410 3.114 ( 2.273 14.079 -8.266) 16.483 3.494 ( -2.558 1.322 7.757) 8.274 3.565 ( -0.088 4.811 -4.869) 6.846 3.663 ( -1.026 2.159 4.327) 4.943 3.725 ( -0.375 1.604 -3.201) 3.600 3.809 ( -5.905 0.559 -7.124) 9.270 3.828 ( -0.862 5.892 4.403) 7.406 3.955 ( -4.544 -3.595 4.716) 7.470 4.035 ( -4.098 -1.859 0.135) 4.502 5.826 ( -7.062 -2.464 -3.580) 8.292 5.991 ( 0.914 -4.185 -3.203) 5.348 6.254 ( -6.151 5.814 -1.285) 8.561 6.299 ( -1.400 0.954 5.495) 5.750 6.612 ( -5.076 6.765 4.009) 9.360 6.856 ( 5.285 3.646 -1.808) 6.670 6.870 ( 6.761 -1.881 4.346) 8.254 6.953 ( 5.925 -0.003 -8.249) 10.156 7.142 ( -3.213 -2.199 0.268) 3.902 7.282 ( 4.702 0.348 0.062) 4.715 7.440 ( 0.154 0.114 1.349) 1.363 7.499 ( 3.405 -0.163 -1.901) 3.903 7.675 ( -6.021 -0.108 -6.326) 8.734 7.774 ( 3.792 -0.461 6.096) 7.194 8.058 ( -2.491 0.255 0.476) 2.549 8.161 ( 1.429 -0.918 -3.966) 4.315 8.676 ( -9.326 1.482 -2.897) 9.878 8.795 ( -6.179 0.244 2.002) 6.500 8.867 ( -0.715 -3.660 7.399) 8.286 9.060 ( -2.920 -0.120 -8.238) 8.741 9.534 ( -3.666 -2.936 7.411) 8.774 9.681 ( -12.531 -2.613 0.229) 12.803 10.263 ( 18.431 1.364 2.373) 18.633 10.393 ( 12.559 3.507 0.037) 13.040 10.480 ( 7.802 0.802 12.976) 15.162 10.646 ( 2.111 -1.981 -14.974) 15.251 13.223 ( 1.857 5.527 2.138) 6.210 13.293 ( 4.476 8.173 -1.243) 9.401 13.828 ( -4.876 -12.302 26.468) 29.592 14.294 ( -8.609 -13.459 -34.545) 38.061 15.643 ( -1.403 1.287 2.145) 2.868 15.705 ( -1.592 1.263 -3.719) 4.238 15.926 ( -3.589 -0.862 1.764) 4.091 16.045 ( 0.832 0.129 0.726) 1.111 19.174 ( 9.157 5.717 15.760) 19.102 19.274 ( 3.587 8.219 -10.949) 14.153 21.499 ( -0.836 -1.709 3.172) 3.699 21.555 ( -0.843 -1.604 -3.704) 4.124 ======================= Grid point 201 (93/160) ======================= q-point: ( 0.20 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 9.928 9.017 -5.399) 14.458 1.458 ( 9.137 14.418 -0.429) 17.075 1.619 ( 8.050 4.967 3.413) 10.056 1.689 ( 8.182 1.848 4.068) 9.322 2.232 ( 0.922 -6.969 3.509) 7.857 2.261 ( 2.550 -4.679 0.889) 5.402 2.427 ( -3.126 -3.749 0.858) 4.956 2.485 ( -0.568 -0.468 2.590) 2.692 2.523 ( 1.793 -0.998 -3.918) 4.423 2.561 ( 1.673 -0.841 -3.406) 3.887 2.732 ( -1.481 -1.086 1.706) 2.507 2.842 ( 4.307 -0.458 -2.950) 5.240 3.003 ( 1.544 12.294 -2.269) 12.596 3.067 ( 0.796 9.531 -2.437) 9.870 3.406 ( -3.745 6.548 -6.582) 10.011 3.532 ( -6.441 2.283 0.157) 6.836 3.576 ( 1.321 4.444 -8.689) 9.848 3.647 ( 0.912 -0.656 2.144) 2.421 3.748 ( 1.351 6.065 -0.197) 6.216 3.931 ( -0.994 6.046 2.279) 6.537 3.987 ( -3.946 -3.283 5.198) 7.306 4.054 ( 4.876 2.575 11.095) 12.390 5.691 ( -4.596 -1.739 -1.950) 5.287 5.873 ( -7.917 -4.929 -3.791) 10.067 6.132 ( -4.759 8.078 -1.646) 9.519 6.237 ( -8.315 7.713 -3.754) 11.946 6.680 ( 3.266 -2.755 10.764) 11.581 6.880 ( -4.183 -5.163 -1.694) 6.857 6.966 ( 2.973 -0.030 -3.496) 4.589 7.010 ( 9.425 2.550 -1.925) 9.952 7.164 ( 2.861 2.175 2.377) 4.309 7.295 ( 0.587 2.070 -4.254) 4.767 7.476 ( -1.693 -4.806 -9.027) 10.366 7.520 ( 6.395 -2.256 1.832) 7.025 7.581 ( 0.454 -0.490 4.641) 4.689 7.892 ( -0.505 7.330 5.209) 9.006 8.053 ( 0.023 0.114 4.455) 4.457 8.149 ( 1.912 1.277 -1.460) 2.724 8.529 ( -3.765 -2.385 -0.780) 4.525 8.718 ( -5.905 2.876 1.773) 6.803 8.848 ( -7.077 -2.571 -6.606) 10.017 8.929 ( -4.895 -0.172 4.536) 6.676 9.466 ( -9.624 -3.634 -1.359) 10.377 9.621 ( -1.461 -3.034 6.893) 7.671 10.369 ( -0.522 7.798 -9.591) 12.372 10.463 ( 3.135 6.269 4.813) 8.502 10.760 ( 19.620 -9.377 -1.978) 21.835 10.856 ( 19.544 -7.232 4.071) 21.233 13.297 ( 4.828 7.622 1.220) 9.105 13.383 ( 6.670 11.749 0.696) 13.528 13.798 ( -7.291 -4.035 -24.938) 26.294 13.997 ( -10.947 -12.781 23.796) 29.145 15.647 ( -1.192 3.947 0.753) 4.191 15.649 ( -1.664 -0.476 0.774) 1.896 15.899 ( -3.298 3.381 2.575) 5.380 16.049 ( -3.155 3.703 2.692) 5.560 19.191 ( 9.154 2.084 -15.407) 18.042 19.484 ( 6.977 -3.048 7.871) 10.951 21.494 ( -1.227 -1.782 -2.435) 3.257 21.521 ( -1.534 -1.557 2.668) 3.449 ======================= Grid point 202 (94/160) ======================= q-point: ( 0.30 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( 11.467 8.576 -3.385) 14.714 1.549 ( 12.501 10.978 -10.592) 19.723 1.770 ( 5.878 3.492 1.611) 7.024 1.897 ( 5.467 1.042 10.004) 11.448 2.215 ( -4.211 -4.598 0.291) 6.242 2.296 ( -1.576 -0.983 0.538) 1.933 2.336 ( -6.217 -2.061 -1.751) 6.780 2.427 ( -4.575 -1.217 1.771) 5.054 2.502 ( 0.539 -0.754 -2.444) 2.614 2.549 ( -3.093 -3.352 -2.212) 5.069 2.682 ( -3.254 -2.687 0.065) 4.220 2.776 ( -8.549 -0.188 -5.696) 10.274 3.066 ( 7.541 3.672 3.978) 9.283 3.121 ( 6.895 3.958 -0.349) 7.958 3.320 ( 0.700 11.268 -4.002) 11.978 3.421 ( 3.124 3.817 -6.705) 8.324 3.568 ( 8.362 6.077 -7.133) 12.560 3.749 ( 3.888 -0.250 2.928) 4.873 3.836 ( 1.528 4.906 5.194) 7.306 3.863 ( -6.932 -0.683 -3.856) 7.961 3.995 ( 4.268 6.912 0.038) 8.123 4.248 ( 1.973 2.706 9.120) 9.715 5.621 ( -3.384 -0.584 -0.930) 3.558 5.715 ( -6.736 -4.204 -0.633) 7.965 6.056 ( -4.056 8.259 -2.740) 9.600 6.089 ( -4.309 8.223 3.377) 9.878 6.754 ( -7.902 -8.372 -1.113) 11.566 6.824 ( 0.053 -4.173 2.305) 4.768 6.928 ( -0.800 2.042 -0.999) 2.410 7.109 ( 7.229 0.316 -4.221) 8.377 7.208 ( 0.384 1.907 -3.129) 3.684 7.261 ( 1.272 -4.060 -3.052) 5.236 7.379 ( 2.642 -1.473 -5.904) 6.634 7.597 ( 2.319 1.545 -1.325) 3.085 7.704 ( 3.949 -3.392 7.513) 9.140 7.879 ( -3.039 13.263 2.083) 13.765 8.166 ( 3.487 -1.239 7.487) 8.351 8.231 ( 6.347 1.449 4.366) 7.839 8.508 ( -3.420 -1.916 2.215) 4.503 8.590 ( -5.672 -2.833 -9.431) 11.364 8.707 ( -1.862 1.681 1.778) 3.075 8.876 ( -9.452 0.851 5.089) 10.769 9.322 ( -5.819 -3.210 -0.813) 6.695 9.582 ( -8.960 -3.324 -0.126) 9.558 10.368 ( 8.743 6.405 -0.380) 10.845 10.552 ( 0.242 3.460 5.984) 6.916 11.021 ( 14.733 -11.109 -3.666) 18.813 11.154 ( 14.337 -7.592 -1.257) 16.272 13.391 ( 5.592 10.863 -1.677) 12.333 13.470 ( -1.335 5.949 -12.784) 14.163 13.546 ( 5.972 8.526 3.155) 10.877 14.041 ( -13.070 -7.721 18.010) 23.554 15.648 ( 1.038 5.141 0.547) 5.274 15.660 ( -0.707 5.063 4.153) 6.586 15.868 ( -4.446 6.973 2.641) 8.681 16.008 ( -6.911 2.970 5.288) 9.195 19.196 ( 12.914 -5.195 -15.084) 20.525 19.587 ( 1.739 -10.851 -2.000) 11.170 21.454 ( -0.245 -1.384 -1.804) 2.287 21.523 ( -2.443 -1.681 2.945) 4.179 ======================= Grid point 203 (95/160) ======================= q-point: ( 0.40 0.12 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.626 ( 12.507 8.932 -9.124) 17.873 1.653 ( 4.526 5.926 -1.376) 7.582 1.845 ( 4.819 2.370 -2.238) 5.818 2.050 ( -2.031 -0.334 7.371) 7.654 2.122 ( -4.887 -1.307 4.080) 6.499 2.263 ( 0.316 0.282 -0.323) 0.533 2.283 ( -1.698 1.405 1.634) 2.743 2.356 ( -4.615 -2.790 -2.980) 6.162 2.420 ( -6.284 0.096 -1.695) 6.510 2.515 ( 0.023 -4.110 -0.395) 4.129 2.599 ( -3.204 -2.396 -3.584) 5.371 2.628 ( -3.139 -3.828 -0.343) 4.962 3.170 ( 4.350 2.729 -2.335) 5.641 3.270 ( 5.371 1.744 4.357) 7.132 3.330 ( 3.005 11.518 -0.174) 11.905 3.487 ( 9.309 5.709 -3.533) 11.477 3.589 ( 1.189 1.709 -10.226) 10.436 3.665 ( -5.769 1.688 -6.243) 8.666 3.840 ( 2.907 6.927 2.972) 8.079 3.897 ( 5.427 3.086 0.608) 6.273 4.069 ( 0.620 0.734 1.665) 1.922 4.316 ( -1.341 4.759 2.306) 5.456 5.554 ( -2.502 0.322 -0.441) 2.561 5.635 ( -3.357 1.455 -0.422) 3.683 6.022 ( -0.368 4.402 3.750) 5.794 6.115 ( -1.063 7.001 6.108) 9.352 6.618 ( -6.865 -10.450 0.751) 12.526 6.766 ( -0.255 -3.799 -5.665) 6.826 6.930 ( -0.968 2.469 0.124) 2.655 7.114 ( -3.276 -4.999 -7.470) 9.567 7.163 ( 2.205 5.587 -2.998) 6.713 7.207 ( 1.025 -8.269 -7.500) 11.211 7.430 ( 5.874 1.275 0.697) 6.051 7.633 ( 2.563 3.971 0.682) 4.775 7.792 ( 1.442 2.726 1.658) 3.501 7.914 ( 0.672 5.975 4.761) 7.669 8.296 ( -1.890 -0.529 4.180) 4.618 8.373 ( 2.046 -0.087 4.061) 4.548 8.407 ( 0.584 -2.453 -0.919) 2.683 8.510 ( 1.419 1.167 1.125) 2.154 8.690 ( -10.049 -2.247 4.135) 11.096 8.812 ( 0.849 1.029 2.009) 2.412 9.257 ( -2.033 -2.551 -0.055) 3.263 9.395 ( -8.889 -2.448 -3.818) 9.979 10.562 ( 5.681 1.986 7.001) 9.232 10.625 ( 1.136 3.664 7.975) 8.850 11.132 ( 7.026 -10.510 -7.967) 14.943 11.287 ( 6.875 -6.931 -5.616) 11.263 13.311 ( 0.695 -1.318 -8.648) 8.775 13.431 ( 1.101 5.000 -3.673) 6.301 13.749 ( 8.187 20.985 7.746) 23.820 14.005 ( -11.668 7.574 11.380) 17.972 15.651 ( -0.621 10.059 0.872) 10.116 15.759 ( 1.550 6.794 5.563) 8.917 15.813 ( -2.231 7.565 1.699) 8.068 15.979 ( -6.451 -1.825 9.239) 11.415 19.249 ( 12.516 -11.643 -12.169) 20.984 19.515 ( -2.305 -15.249 -8.586) 17.651 21.450 ( 1.410 -1.059 -0.414) 1.811 21.509 ( -2.948 -1.469 2.099) 3.906 ======================= Grid point 204 (96/160) ======================= q-point: (-0.50 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( -6.807 4.919 -0.861) 8.442 1.731 ( 10.831 6.392 -6.231) 14.036 1.921 ( 3.856 0.940 1.051) 4.106 1.966 ( -11.475 2.735 2.089) 11.980 2.190 ( 5.194 -0.153 2.597) 5.809 2.240 ( -2.183 2.360 -1.315) 3.473 2.274 ( -2.006 1.414 1.142) 2.707 2.324 ( 2.949 0.087 -0.213) 2.958 2.381 ( 2.310 -7.114 2.365) 7.844 2.476 ( -1.809 -5.036 -2.824) 6.050 2.516 ( -2.903 -6.408 -0.495) 7.052 2.638 ( 3.241 0.022 -0.735) 3.323 3.191 ( 2.270 0.969 -2.979) 3.869 3.304 ( -3.034 5.236 -8.176) 10.172 3.369 ( 1.338 2.624 1.543) 3.325 3.454 ( -0.171 0.640 -4.620) 4.668 3.524 ( -6.398 11.939 -0.451) 13.553 3.577 ( 5.525 9.437 -4.699) 11.902 3.907 ( -2.837 0.358 4.721) 5.520 4.002 ( 3.139 -4.561 0.475) 5.557 4.075 ( 1.618 5.645 3.515) 6.844 4.264 ( -5.156 8.298 -2.416) 10.064 5.548 ( 1.673 3.100 0.637) 3.580 5.608 ( 2.034 5.168 -1.724) 5.815 6.099 ( 2.355 2.745 5.852) 6.880 6.159 ( -1.324 4.376 3.992) 6.069 6.590 ( -0.488 -11.656 5.068) 12.719 6.738 ( 2.968 -3.670 -2.680) 5.428 6.894 ( -0.536 -3.911 -6.360) 7.485 6.940 ( -3.345 -1.781 -8.556) 9.358 7.067 ( -5.762 1.088 -2.109) 6.232 7.208 ( 5.388 1.863 -5.916) 8.216 7.542 ( 2.293 -0.064 3.983) 4.596 7.662 ( 2.085 4.596 -2.488) 5.627 7.849 ( 2.336 0.646 1.966) 3.121 7.922 ( -1.051 3.254 -0.843) 3.522 8.278 ( -1.047 -0.797 4.863) 5.038 8.371 ( -4.565 2.139 1.649) 5.304 8.464 ( -5.789 -1.420 3.503) 6.914 8.581 ( 4.781 -0.559 0.845) 4.887 8.643 ( 1.121 -1.054 6.905) 7.075 8.851 ( 0.373 -1.200 -0.639) 1.410 9.249 ( -1.336 -2.486 -2.209) 3.584 9.256 ( 0.252 -2.787 -0.807) 2.912 10.634 ( -4.126 1.675 8.631) 9.712 10.805 ( 2.791 2.164 11.067) 11.616 11.081 ( 0.730 -8.216 -10.313) 13.206 11.252 ( -0.680 -5.933 -9.011) 10.810 13.289 ( 3.635 -4.260 -2.354) 6.075 13.347 ( -4.738 -3.723 -4.594) 7.577 13.928 ( -9.319 24.701 6.431) 27.173 13.980 ( 10.023 25.588 5.148) 27.959 15.665 ( 0.156 10.461 1.388) 10.554 15.707 ( -2.384 7.517 -0.735) 7.921 15.959 ( 2.836 0.699 9.205) 9.657 15.997 ( -2.263 0.411 7.297) 7.651 19.310 ( 9.319 -15.661 -8.446) 20.086 19.329 ( -6.904 -16.276 -10.248) 20.435 21.478 ( -2.878 -1.171 0.999) 3.264 21.487 ( 2.945 -0.972 0.447) 3.133 ======================= Grid point 205 (97/160) ======================= q-point: (-0.40 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( -13.601 6.547 -0.758) 15.113 1.674 ( -19.196 5.872 -1.528) 20.132 1.819 ( 6.625 7.122 -4.169) 10.583 2.059 ( 3.776 -0.062 6.640) 7.639 2.185 ( -3.107 0.344 -0.656) 3.194 2.253 ( -0.232 -0.297 0.541) 0.659 2.348 ( 3.962 1.210 0.877) 4.235 2.376 ( 6.790 -2.489 0.351) 7.240 2.391 ( 0.875 -4.923 -3.862) 6.318 2.468 ( 3.723 -1.985 -1.954) 4.650 2.550 ( 0.957 -9.195 5.092) 10.554 2.675 ( 3.945 -0.251 -3.400) 5.214 3.122 ( -5.689 3.448 -5.965) 8.935 3.199 ( 1.791 0.882 -1.760) 2.661 3.331 ( -7.001 1.124 1.360) 7.220 3.367 ( -5.750 5.424 -2.714) 8.357 3.455 ( -2.087 6.294 -1.163) 6.732 3.620 ( 2.228 9.011 -0.067) 9.283 3.872 ( -1.419 5.176 1.885) 5.688 4.018 ( -5.998 5.558 -3.446) 8.874 4.133 ( -2.171 1.180 1.460) 2.870 4.192 ( 2.988 3.893 7.053) 8.593 5.615 ( 5.621 3.885 0.126) 6.834 5.653 ( 6.506 6.219 -3.569) 9.682 6.155 ( -1.475 0.884 -0.488) 1.787 6.226 ( 4.670 5.366 4.408) 8.369 6.664 ( 0.367 -7.444 4.403) 8.656 6.728 ( -4.743 -5.516 -6.229) 9.577 6.793 ( 4.523 -3.303 -0.414) 5.616 6.902 ( 4.295 -8.713 -4.044) 10.522 6.993 ( -1.853 4.350 1.713) 5.029 7.234 ( 4.746 3.641 -3.403) 6.882 7.506 ( -6.404 4.332 -1.725) 7.922 7.685 ( 0.634 -1.803 -0.692) 2.033 7.853 ( 1.074 5.087 -1.355) 5.373 7.975 ( 5.078 -1.785 0.525) 5.408 8.263 ( -9.197 -0.525 2.432) 9.527 8.346 ( -0.317 -0.028 5.542) 5.551 8.429 ( -0.584 1.790 2.825) 3.395 8.671 ( -1.126 -2.220 0.536) 2.546 8.707 ( -0.025 0.289 1.153) 1.189 8.832 ( 3.806 -1.892 -1.115) 4.394 9.229 ( 2.206 -1.704 -0.563) 2.844 9.324 ( 6.201 -3.209 -0.029) 6.982 10.653 ( -8.114 1.370 11.465) 14.113 10.882 ( -4.707 0.428 -0.942) 4.819 10.998 ( -0.365 -5.761 1.587) 5.987 11.064 ( -7.512 -5.008 -10.732) 14.025 13.207 ( -5.397 -4.994 -3.036) 7.955 13.334 ( 1.220 -1.082 0.870) 1.848 13.828 ( -9.174 29.893 3.444) 31.458 14.229 ( 15.701 15.760 1.186) 22.278 15.645 ( -0.907 7.395 0.356) 7.458 15.760 ( 4.990 10.930 1.888) 12.162 15.969 ( -4.463 0.448 2.241) 5.014 16.151 ( 5.624 -0.165 6.358) 8.490 19.056 ( -13.601 -13.729 -7.736) 20.816 19.357 ( 5.585 -17.143 -4.372) 18.552 21.443 ( -2.074 -1.044 0.210) 2.331 21.547 ( 3.561 -1.195 0.366) 3.774 ======================= Grid point 206 (98/160) ======================= q-point: (-0.30 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( -16.698 11.370 3.795) 20.555 1.354 ( -19.512 10.193 2.211) 22.125 1.824 ( -1.400 9.957 -2.558) 10.375 2.123 ( -3.581 -3.193 3.499) 5.938 2.200 ( -0.353 -0.889 -1.541) 1.814 2.231 ( -0.168 -2.431 5.400) 5.925 2.349 ( -7.894 0.605 -3.431) 8.628 2.362 ( -6.417 -0.375 0.607) 6.457 2.445 ( 6.006 0.466 0.453) 6.041 2.535 ( 9.891 0.640 -1.251) 9.990 2.622 ( 2.990 -11.975 3.242) 12.761 2.701 ( 5.947 0.268 -4.312) 7.351 2.999 ( -4.931 5.513 -0.487) 7.412 3.189 ( -4.775 6.823 2.105) 8.590 3.234 ( -2.048 1.369 -0.346) 2.488 3.292 ( -2.862 1.450 -1.859) 3.708 3.405 ( -2.425 3.814 1.404) 4.732 3.667 ( -1.222 4.423 -0.826) 4.662 3.754 ( -3.465 9.232 0.683) 9.885 4.008 ( 5.249 12.368 -0.751) 13.457 4.075 ( -5.830 -1.342 -1.572) 6.186 4.386 ( 9.032 -2.166 5.929) 11.019 5.699 ( 6.506 1.056 -3.321) 7.380 5.752 ( 9.978 5.969 -2.201) 11.833 6.073 ( -4.530 2.209 -4.092) 6.492 6.324 ( 3.488 6.164 -1.405) 7.221 6.604 ( -4.418 -0.529 -0.331) 4.462 6.727 ( 2.774 -4.535 3.501) 6.366 6.880 ( 3.171 -5.350 3.768) 7.272 6.929 ( -0.343 -4.124 1.897) 4.552 7.059 ( 6.463 -3.071 0.499) 7.173 7.288 ( 4.998 1.618 -1.396) 5.436 7.366 ( -6.144 3.764 -3.619) 8.063 7.638 ( -4.415 0.602 -1.307) 4.644 7.865 ( 2.976 6.066 -2.517) 7.211 8.030 ( 1.593 0.232 -2.364) 2.860 8.216 ( -1.615 -2.154 7.049) 7.545 8.355 ( -4.648 -2.459 1.876) 5.583 8.451 ( 0.216 0.315 -3.766) 3.785 8.583 ( -3.042 -3.198 -1.051) 4.537 8.708 ( 0.515 3.327 1.708) 3.775 8.967 ( 9.677 -0.669 0.277) 9.704 9.282 ( 3.356 -0.481 1.041) 3.546 9.444 ( 7.388 -2.410 2.106) 8.052 10.589 ( -14.280 1.357 3.710) 14.816 10.730 ( -8.448 -2.680 -2.035) 9.093 10.781 ( -12.808 -5.352 -4.330) 14.541 11.042 ( -1.177 -4.349 3.578) 5.753 13.135 ( -1.972 -2.360 1.670) 3.500 13.326 ( -3.562 5.140 1.327) 6.393 13.711 ( -8.673 25.637 0.941) 27.081 14.509 ( 20.348 -4.385 -4.496) 21.295 15.659 ( 1.638 8.015 0.156) 8.182 15.841 ( -1.618 4.957 0.952) 5.300 15.917 ( 3.020 11.832 -3.322) 12.655 16.306 ( 8.136 -3.138 1.266) 8.812 18.724 ( -20.524 -6.727 -0.171) 21.599 19.399 ( 2.624 -16.348 0.569) 16.567 21.421 ( -0.819 -1.147 0.113) 1.414 21.603 ( 3.167 -1.520 -0.503) 3.548 ======================= Grid point 207 (99/160) ======================= q-point: (-0.20 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( -15.189 16.733 10.259) 24.818 1.108 ( -17.478 14.413 7.382) 23.826 1.733 ( -6.758 9.789 -1.080) 11.944 1.940 ( -32.652 8.078 13.191) 36.131 2.084 ( -5.055 1.199 -1.910) 5.536 2.165 ( -0.388 -6.494 4.765) 8.064 2.360 ( 4.783 -0.829 -3.740) 6.128 2.396 ( 6.235 -0.290 -0.886) 6.304 2.539 ( 3.808 0.867 -0.396) 3.925 2.641 ( 2.299 -4.672 -2.384) 5.726 2.698 ( 4.714 -4.431 0.978) 6.543 2.789 ( 5.763 -1.552 -0.269) 5.974 2.962 ( -2.495 8.622 4.287) 9.947 3.073 ( -5.085 8.054 -4.152) 10.391 3.223 ( 1.915 5.613 -1.705) 6.171 3.290 ( 4.195 1.685 4.779) 6.579 3.385 ( -2.279 5.080 3.080) 6.363 3.655 ( -3.028 1.037 10.366) 10.849 3.834 ( 3.356 4.438 -0.630) 5.599 3.918 ( -6.602 2.760 -1.215) 7.258 4.050 ( 4.309 6.859 -8.629) 11.836 4.550 ( 7.977 -5.719 -4.767) 10.912 5.774 ( 7.205 -1.664 -3.453) 8.161 5.858 ( 5.612 -0.288 -4.620) 7.275 6.017 ( 2.472 8.981 3.247) 9.865 6.288 ( 0.470 6.215 -7.365) 9.648 6.588 ( -4.300 2.867 7.703) 9.277 6.808 ( -1.060 -0.316 5.499) 5.609 6.942 ( 1.281 -7.626 0.602) 7.756 6.982 ( 4.096 -4.757 2.460) 6.743 7.160 ( 5.698 -0.433 -0.786) 5.768 7.237 ( -4.837 3.755 -2.426) 6.587 7.332 ( 1.301 -3.440 -1.338) 3.913 7.524 ( -6.798 0.382 -1.190) 6.912 7.883 ( 2.270 -1.199 -5.394) 5.974 8.045 ( 7.200 16.283 -2.804) 18.023 8.212 ( -5.014 -3.049 -1.654) 6.097 8.297 ( -3.935 -3.711 -3.749) 6.581 8.413 ( 1.805 -5.185 5.185) 7.551 8.587 ( 1.909 -1.446 1.317) 2.733 8.772 ( 4.909 5.420 0.031) 7.313 9.108 ( 7.433 0.983 -1.158) 7.587 9.351 ( 3.154 -1.468 2.094) 4.061 9.628 ( 8.226 -1.638 7.028) 10.943 10.271 ( -16.515 2.902 -7.700) 18.451 10.548 ( -15.109 -1.293 1.326) 15.222 10.582 ( -15.689 -9.425 6.208) 19.326 11.032 ( -0.831 -4.531 -2.635) 5.307 13.172 ( -0.405 0.988 6.365) 6.454 13.273 ( -3.708 6.332 1.693) 7.530 13.554 ( -9.094 17.013 -3.363) 19.583 14.762 ( 21.259 -19.200 -11.428) 30.841 15.664 ( -0.415 5.161 -2.610) 5.798 15.774 ( -0.646 4.048 -2.005) 4.564 15.970 ( 3.492 13.225 -1.278) 13.738 16.411 ( 8.236 -5.194 -9.726) 13.763 18.448 ( -20.595 5.260 14.393) 25.671 19.463 ( 1.134 -12.196 4.763) 13.142 21.421 ( 0.214 -1.301 0.691) 1.488 21.634 ( 2.202 -1.727 -1.694) 3.271 ======================= Grid point 208 (100/160) ======================= q-point: (-0.10 0.12 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.909 ( -13.273 14.254 12.065) 22.911 1.010 ( -8.125 18.826 14.315) 25.007 1.546 ( -13.994 8.923 3.554) 16.973 1.777 ( -13.488 14.798 21.331) 29.256 1.953 ( -4.406 1.356 -6.939) 8.330 2.249 ( 0.557 -4.195 7.704) 8.790 2.385 ( 2.285 -6.193 -5.774) 8.770 2.428 ( 2.220 1.565 -2.833) 3.924 2.534 ( -1.726 3.074 -3.548) 5.002 2.598 ( 1.091 -5.117 -4.789) 7.092 2.738 ( 0.079 -0.645 -1.277) 1.432 2.777 ( -3.897 2.332 -0.683) 4.592 2.954 ( 2.994 6.589 -2.130) 7.544 3.147 ( 7.759 11.659 0.440) 14.011 3.261 ( 2.610 7.279 2.549) 8.143 3.388 ( 0.171 7.306 5.749) 9.298 3.554 ( 5.267 -1.565 9.734) 11.178 3.659 ( -0.565 3.577 6.113) 7.105 3.838 ( 0.796 3.456 -8.514) 9.223 3.906 ( -1.175 -3.946 9.450) 10.308 3.981 ( -0.562 -0.352 -4.110) 4.163 4.488 ( 0.019 -4.736 -16.925) 17.575 5.824 ( 5.481 -3.054 -3.864) 7.369 5.924 ( 5.233 -4.716 0.811) 7.091 6.168 ( 7.450 11.355 4.277) 14.239 6.238 ( 0.491 7.390 -1.140) 7.494 6.605 ( -4.052 3.629 6.859) 8.754 6.783 ( -6.329 -0.804 1.474) 6.548 6.968 ( 1.280 -5.064 -1.785) 5.520 7.034 ( 2.491 -1.540 -5.421) 6.161 7.154 ( -2.968 2.897 -0.436) 4.171 7.266 ( 6.465 2.085 3.329) 7.565 7.333 ( -0.272 -7.060 3.088) 7.710 7.412 ( -5.509 -2.242 -0.430) 5.963 7.793 ( -2.022 -2.182 -8.910) 9.394 8.069 ( -2.202 6.312 -6.509) 9.331 8.156 ( 2.052 5.261 -5.928) 8.187 8.207 ( 0.676 -4.961 -5.008) 7.082 8.538 ( 6.588 -1.463 7.998) 10.464 8.719 ( 7.556 1.032 6.014) 9.712 8.838 ( 3.824 4.396 -1.430) 6.000 9.155 ( 3.495 1.111 -5.957) 6.995 9.450 ( 1.528 -4.295 7.622) 8.881 9.776 ( 1.389 -6.601 -0.405) 6.758 10.041 ( -7.995 7.698 8.640) 14.065 10.290 ( -20.338 -5.212 5.503) 21.704 10.372 ( -11.067 1.961 -0.607) 11.256 10.956 ( -0.305 -3.532 -8.826) 9.512 13.189 ( -3.575 7.295 3.065) 8.682 13.333 ( 2.105 -0.022 11.008) 11.207 13.367 ( -6.890 8.281 -3.305) 11.268 14.901 ( 16.924 -25.327 -20.733) 36.848 15.634 ( 0.119 0.032 -0.323) 0.345 15.781 ( 2.818 4.225 -2.026) 5.468 15.987 ( 0.572 5.140 -1.099) 5.287 16.289 ( -3.593 -5.452 -16.456) 17.705 18.462 ( -6.497 15.002 26.358) 31.017 19.501 ( -2.076 -2.551 0.495) 3.326 21.441 ( 0.513 -1.388 1.643) 2.211 21.635 ( 1.086 -1.775 -2.804) 3.492 ======================= Grid point 209 (101/160) ======================= q-point: ( 0.00 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( 0.157 13.275 11.307) 17.439 1.383 ( -3.430 11.634 12.346) 17.307 1.695 ( -1.044 9.850 -0.415) 9.913 1.817 ( -3.843 4.221 -10.739) 12.162 2.084 ( -1.895 4.703 -0.427) 5.088 2.107 ( -0.529 -6.403 -3.883) 7.507 2.354 ( -0.964 2.266 6.392) 6.850 2.427 ( 1.727 -2.696 -3.112) 4.465 2.513 ( 4.064 -3.876 -3.058) 6.395 2.544 ( 1.088 1.213 -4.134) 4.444 2.759 ( 1.843 -0.267 0.354) 1.895 2.785 ( -2.085 4.162 0.606) 4.694 3.238 ( 2.726 16.907 2.865) 17.363 3.479 ( -1.171 4.043 9.302) 10.210 3.512 ( 3.339 12.673 -4.372) 13.816 3.626 ( 1.157 4.903 7.526) 9.056 3.709 ( -0.200 -2.030 2.221) 3.015 3.729 ( 1.675 5.889 3.165) 6.892 3.822 ( 0.520 5.537 0.293) 5.569 3.858 ( -2.388 -2.392 2.643) 4.291 4.015 ( -1.598 6.545 -0.644) 6.768 4.193 ( -4.397 -1.061 -10.726) 11.641 5.818 ( 4.967 -3.123 -1.667) 6.099 5.875 ( 0.087 -4.201 -1.272) 4.390 6.374 ( -4.436 7.547 2.250) 9.039 6.507 ( -3.370 8.539 -0.969) 9.231 6.695 ( 2.874 -2.576 3.788) 5.408 6.734 ( 2.253 5.837 4.357) 7.624 6.876 ( 0.559 -2.560 -2.726) 3.781 7.031 ( 6.070 2.874 -8.880) 11.134 7.156 ( -2.933 0.911 1.223) 3.306 7.222 ( -4.509 -2.735 -1.081) 5.384 7.355 ( 4.186 -1.266 3.405) 5.543 7.508 ( 2.125 3.609 4.103) 5.863 7.631 ( 1.438 -1.085 -4.516) 4.862 7.891 ( -4.991 -3.636 -5.519) 8.282 8.072 ( 2.535 -6.272 -1.587) 6.948 8.122 ( -2.153 0.536 -6.949) 7.294 8.681 ( 0.624 -2.507 8.539) 8.921 8.854 ( -3.037 1.060 2.683) 4.189 8.904 ( -3.348 3.085 -4.805) 6.619 9.132 ( 4.333 -1.609 -8.690) 9.843 9.467 ( -2.024 -2.328 8.161) 8.724 9.747 ( 10.871 -5.876 -2.617) 12.632 9.841 ( -14.140 -3.735 12.376) 19.159 10.198 ( 2.038 -2.299 -1.147) 3.279 10.588 ( 1.370 12.531 6.351) 14.115 10.818 ( -0.350 2.020 -6.348) 6.671 13.330 ( -2.393 4.468 5.802) 7.704 13.413 ( -2.964 7.142 0.807) 7.775 13.497 ( 1.168 3.332 7.410) 8.208 14.256 ( 4.381 -23.641 -23.662) 33.734 15.633 ( -0.075 -0.393 0.083) 0.409 15.791 ( 0.135 -1.174 -3.361) 3.563 15.877 ( -4.089 -5.441 1.244) 6.919 15.994 ( 1.251 -5.793 -9.766) 11.423 19.127 ( 2.953 18.211 19.394) 26.767 19.556 ( -0.419 7.009 -2.017) 7.306 21.433 ( 0.011 -2.018 2.149) 2.948 21.554 ( 0.055 -3.283 -3.379) 4.712 ======================= Grid point 210 (102/160) ======================= q-point: ( 0.10 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.469 ( 5.531 9.635 11.344) 15.879 1.508 ( 4.848 8.185 10.185) 13.936 1.648 ( 1.709 4.894 -7.190) 8.864 1.711 ( 3.545 9.567 -3.993) 10.957 2.070 ( 1.905 -2.205 -1.138) 3.128 2.127 ( 3.367 -2.433 1.360) 4.371 2.361 ( -2.556 -1.817 -0.362) 3.157 2.424 ( -1.518 -2.412 3.247) 4.321 2.496 ( 3.269 -1.084 -6.025) 6.939 2.549 ( 1.708 -2.865 -2.138) 3.962 2.745 ( -2.014 1.479 -1.157) 2.754 2.812 ( 2.219 -0.749 1.500) 2.781 3.318 ( -0.803 17.175 3.615) 17.569 3.437 ( -3.353 15.250 -6.309) 16.841 3.547 ( -1.558 5.167 7.662) 9.372 3.675 ( 0.455 1.307 -2.188) 2.589 3.726 ( -3.931 4.396 -0.711) 5.939 3.769 ( -1.097 3.683 -5.792) 6.950 3.814 ( 1.048 -2.697 8.161) 8.658 3.850 ( 1.572 5.371 -0.097) 5.597 4.009 ( -1.572 5.730 3.942) 7.130 4.076 ( 1.160 5.921 -1.859) 6.313 5.785 ( -4.532 -1.458 -4.059) 6.256 5.872 ( 0.355 -6.157 -2.853) 6.795 6.346 ( -3.611 4.022 7.364) 9.134 6.419 ( -4.307 8.714 0.325) 9.726 6.731 ( -7.295 1.749 -0.065) 7.502 6.826 ( 3.036 -0.184 -0.239) 3.051 6.886 ( 6.965 -1.807 -2.210) 7.528 6.979 ( 1.425 3.094 -5.415) 6.397 7.144 ( 0.895 1.635 1.609) 2.462 7.249 ( 4.791 -2.304 2.583) 5.911 7.450 ( -0.588 -0.291 -3.531) 3.592 7.476 ( 3.910 -1.405 -0.046) 4.155 7.709 ( -3.832 2.852 -7.529) 8.917 7.762 ( 3.394 -0.446 6.736) 7.556 8.046 ( -0.150 -0.672 -1.435) 1.592 8.109 ( 4.306 -4.044 -1.914) 6.209 8.721 ( -7.174 0.670 0.620) 7.232 8.791 ( -8.549 0.655 5.412) 10.139 8.825 ( -0.364 0.574 3.513) 3.578 9.061 ( -2.103 -0.385 -9.401) 9.641 9.447 ( -5.864 -5.063 5.808) 9.683 9.602 ( -11.724 -4.894 1.252) 12.766 10.167 ( 21.610 -6.815 4.698) 23.141 10.337 ( 15.554 -7.302 -1.723) 17.269 10.648 ( -1.655 10.965 4.857) 12.107 10.714 ( -3.112 7.526 -6.427) 10.375 13.364 ( 0.753 6.602 3.490) 7.505 13.497 ( 8.944 8.635 3.749) 12.985 13.601 ( -3.183 -5.755 11.922) 13.615 14.012 ( 1.443 -12.058 -24.138) 27.021 15.640 ( -0.862 -1.218 2.552) 2.956 15.712 ( -1.982 -0.690 -4.985) 5.409 15.888 ( 2.112 -2.668 1.039) 3.557 16.004 ( 6.526 -4.580 -1.282) 8.075 19.339 ( -1.239 9.636 11.978) 15.423 19.459 ( -3.405 8.816 -6.149) 11.274 21.454 ( -0.936 -2.455 2.652) 3.733 21.509 ( -0.622 -2.840 -3.342) 4.429 ======================= Grid point 211 (103/160) ======================= q-point: ( 0.20 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 9.482 9.684 -3.559) 14.012 1.710 ( 4.370 6.260 3.558) 8.423 1.724 ( 7.616 2.919 -3.286) 8.793 1.794 ( 5.362 12.282 10.931) 17.294 2.109 ( 2.802 -4.811 -0.005) 5.567 2.200 ( 1.891 -1.406 2.091) 3.150 2.321 ( -1.543 -5.363 1.414) 5.757 2.445 ( 0.023 -4.115 0.193) 4.120 2.478 ( -1.742 -1.943 -1.649) 3.086 2.546 ( 3.026 -1.698 -2.995) 4.584 2.692 ( -2.719 -2.344 -2.150) 4.184 2.837 ( -0.909 -1.882 0.332) 2.117 3.232 ( -7.445 9.802 -1.338) 12.381 3.291 ( -5.578 12.253 -4.758) 14.279 3.571 ( 0.076 3.919 -8.155) 9.048 3.603 ( -3.786 6.052 -3.616) 8.002 3.662 ( 1.527 5.800 2.641) 6.554 3.742 ( 4.097 9.711 -2.916) 10.936 3.854 ( -2.755 -0.420 2.814) 3.960 3.908 ( 1.329 2.216 2.472) 3.575 4.129 ( 3.151 5.738 11.590) 13.311 4.145 ( 7.513 11.299 0.381) 13.574 5.681 ( -2.437 0.585 -2.488) 3.531 5.759 ( -7.096 -5.280 -3.949) 9.686 6.322 ( -3.908 9.189 -0.964) 10.032 6.415 ( -5.430 8.362 1.412) 10.070 6.637 ( -1.508 -1.071 7.407) 7.634 6.726 ( -8.810 -8.076 -3.176) 12.366 6.949 ( 5.784 -1.322 -3.985) 7.148 7.044 ( 3.635 -0.433 -2.802) 4.611 7.195 ( 2.052 -0.391 1.391) 2.509 7.297 ( -1.514 -1.702 -2.473) 3.362 7.451 ( 7.249 -2.008 2.095) 7.808 7.514 ( -0.897 4.923 -7.142) 8.720 7.586 ( 3.295 2.397 -2.105) 4.586 7.922 ( 4.303 -2.578 8.588) 9.945 8.100 ( 3.499 2.804 4.068) 6.054 8.169 ( 4.878 0.151 -0.899) 4.963 8.549 ( -8.780 4.557 -1.996) 10.091 8.745 ( -6.379 -1.120 5.362) 8.408 8.785 ( -8.414 -2.763 -4.830) 10.087 8.951 ( -2.243 2.777 2.735) 4.497 9.357 ( -9.447 -6.812 -0.793) 11.674 9.525 ( -2.928 -6.300 4.602) 8.333 10.473 ( 12.448 -4.738 -3.934) 13.888 10.599 ( 9.594 -1.267 -2.373) 9.964 10.613 ( 4.142 5.399 -2.729) 7.332 10.704 ( 6.277 -2.116 6.638) 9.377 13.457 ( 3.829 4.685 4.566) 7.580 13.600 ( -2.013 -2.257 -2.297) 3.798 13.750 ( 10.944 9.605 -0.499) 14.570 13.839 ( 2.019 1.937 0.604) 2.862 15.647 ( 0.789 1.289 -0.083) 1.514 15.692 ( -0.187 -1.140 4.939) 5.072 15.934 ( 1.383 1.021 0.925) 1.952 16.111 ( 5.636 0.234 0.504) 5.664 19.249 ( -4.318 3.397 -10.508) 11.857 19.428 ( -4.042 -1.903 2.761) 5.252 21.448 ( -1.150 -2.402 -1.255) 2.944 21.478 ( -1.228 -2.516 1.522) 3.187 ======================= Grid point 212 (104/160) ======================= q-point: ( 0.30 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.720 ( 9.725 9.508 -2.124) 13.765 1.748 ( 7.234 6.991 -7.852) 12.762 1.854 ( 4.313 3.626 2.917) 6.345 1.968 ( 2.070 6.416 8.458) 10.816 2.141 ( -0.419 -2.089 1.377) 2.536 2.243 ( 0.671 -2.984 1.850) 3.575 2.309 ( -1.282 -1.069 -2.262) 2.811 2.368 ( -4.373 -3.980 -1.652) 6.139 2.445 ( -1.867 -3.296 0.239) 3.796 2.534 ( -2.598 -0.093 -2.713) 3.757 2.610 ( -3.716 -3.856 -1.540) 5.572 2.771 ( -5.449 -1.867 -3.232) 6.605 3.176 ( 0.182 5.838 1.387) 6.003 3.205 ( 0.836 6.290 0.119) 6.346 3.496 ( 6.134 3.051 -10.533) 12.565 3.546 ( -0.979 7.841 0.216) 7.905 3.730 ( 5.877 5.511 -1.059) 8.126 3.748 ( -1.552 1.418 -7.677) 7.959 3.808 ( -1.852 2.233 2.482) 3.818 3.979 ( 0.600 4.452 4.702) 6.504 4.237 ( 2.563 15.017 3.684) 15.673 4.341 ( 7.833 7.421 4.794) 11.807 5.609 ( -5.549 -2.029 -1.413) 6.075 5.662 ( 0.061 1.049 1.307) 1.677 6.250 ( -3.922 9.155 -3.586) 10.585 6.277 ( -7.152 9.413 2.238) 12.031 6.549 ( -9.025 -10.389 -0.690) 13.779 6.766 ( 0.609 -1.646 3.866) 4.245 6.926 ( -0.226 -3.576 -1.727) 3.978 7.028 ( 1.116 -3.680 -4.258) 5.737 7.149 ( -1.527 -5.437 -8.568) 10.261 7.266 ( -2.049 -0.252 -0.540) 2.134 7.463 ( 4.327 7.392 -3.855) 9.393 7.635 ( 9.187 -1.919 2.870) 9.814 7.651 ( 4.793 3.821 0.867) 6.191 8.092 ( 2.529 2.182 7.913) 8.590 8.179 ( -1.003 7.033 3.540) 7.937 8.248 ( 7.145 -0.023 1.422) 7.286 8.475 ( 0.916 -2.397 -0.915) 2.725 8.531 ( -9.656 -0.825 -6.770) 11.821 8.718 ( -6.418 -1.345 5.413) 8.503 8.915 ( -7.722 3.312 2.883) 8.883 9.224 ( -5.201 -6.300 0.239) 8.173 9.478 ( -7.563 -6.738 0.254) 10.133 10.524 ( 5.024 7.719 -1.144) 9.280 10.644 ( -0.352 5.026 3.291) 6.018 10.766 ( 12.837 -11.950 -3.088) 17.808 10.955 ( 12.816 -10.786 1.159) 16.791 13.440 ( -1.106 -2.759 -12.630) 12.975 13.520 ( -3.041 -2.842 -1.745) 4.513 13.913 ( 10.867 21.306 10.439) 26.096 14.113 ( 10.324 17.228 14.114) 24.548 15.716 ( 4.621 3.931 3.855) 7.188 15.774 ( 1.158 0.395 7.458) 7.558 15.937 ( -2.322 4.738 0.754) 5.330 16.166 ( -0.430 7.591 0.641) 7.630 19.060 ( -0.588 -7.360 -14.195) 16.001 19.317 ( -6.658 -14.012 -6.035) 16.646 21.420 ( 0.053 -1.627 -1.275) 2.068 21.479 ( -2.063 -2.504 2.721) 4.234 ======================= Grid point 213 (105/160) ======================= q-point: ( 0.40 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( 4.207 4.803 -6.201) 8.900 1.819 ( 4.237 8.467 -1.086) 9.530 1.920 ( 4.527 4.575 -2.342) 6.849 2.083 ( -2.394 3.159 3.570) 5.334 2.091 ( -1.976 -1.420 4.338) 4.974 2.244 ( -1.290 -2.107 -0.090) 2.472 2.279 ( 1.537 -0.329 -0.972) 1.848 2.336 ( -1.347 -1.364 -1.228) 2.276 2.407 ( -0.769 -3.303 0.072) 3.392 2.447 ( -5.447 1.729 -0.530) 5.740 2.521 ( -4.098 -2.958 -3.567) 6.186 2.649 ( -2.606 2.344 -2.208) 4.143 3.200 ( 3.244 -1.119 -2.847) 4.459 3.308 ( 4.487 3.349 5.198) 7.640 3.505 ( 4.773 0.980 -6.411) 8.052 3.557 ( 0.109 -2.082 -11.673) 11.858 3.583 ( 0.670 4.606 -0.539) 4.686 3.789 ( 0.127 7.499 -1.452) 7.640 3.822 ( 1.326 -3.355 0.513) 3.644 3.992 ( -4.783 2.623 3.160) 6.305 4.313 ( 1.417 19.945 4.639) 20.527 4.486 ( 5.439 12.268 1.489) 13.501 5.573 ( -0.184 1.983 3.695) 4.198 5.698 ( 1.818 4.838 1.346) 5.341 6.141 ( -4.576 5.726 0.282) 7.335 6.255 ( -1.403 5.299 3.026) 6.262 6.426 ( -6.754 -7.023 1.998) 9.946 6.689 ( -2.167 -3.974 -5.840) 7.388 6.942 ( -4.321 -2.282 -5.223) 7.153 7.005 ( 0.951 -2.577 1.083) 2.953 7.034 ( 4.045 -8.236 -10.182) 13.706 7.201 ( -3.323 -2.869 -0.226) 4.396 7.517 ( 4.671 7.256 -1.240) 8.718 7.732 ( 5.501 3.671 -2.177) 6.962 7.793 ( 4.993 1.228 3.289) 6.104 8.094 ( -4.326 8.779 0.043) 9.787 8.293 ( -1.814 -5.025 -1.571) 5.569 8.299 ( 0.731 0.693 5.332) 5.426 8.408 ( 7.381 0.003 1.268) 7.489 8.535 ( 0.639 1.314 3.006) 3.342 8.643 ( -10.659 -2.254 5.249) 12.093 8.832 ( -2.241 1.382 0.208) 2.641 9.174 ( -2.615 -5.749 0.756) 6.360 9.314 ( -8.854 -5.406 -2.907) 10.773 10.619 ( 2.680 2.977 3.202) 5.128 10.708 ( 2.463 3.353 6.017) 7.315 10.894 ( 7.487 -10.288 -3.868) 13.299 11.106 ( 6.288 -9.672 -2.126) 11.730 13.283 ( -0.036 -1.257 -10.672) 10.746 13.406 ( -5.602 -5.111 -4.702) 8.922 14.281 ( 11.679 28.837 17.538) 35.715 14.426 ( 7.470 29.394 13.266) 33.102 15.843 ( -0.362 -0.741 9.205) 9.242 15.864 ( -0.442 9.501 -0.705) 9.538 15.931 ( 4.030 5.121 5.579) 8.578 16.101 ( -7.550 13.231 -0.349) 15.238 18.920 ( 4.128 -19.455 -14.423) 24.568 19.101 ( -6.215 -23.641 -11.893) 27.184 21.425 ( 1.489 -1.167 -0.077) 1.893 21.471 ( -2.441 -2.038 2.223) 3.880 ======================= Grid point 214 (106/160) ======================= q-point: (-0.50 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.729 ( -4.455 4.425 -0.766) 6.325 1.842 ( 4.388 4.562 -5.092) 8.124 1.959 ( 1.726 2.975 0.153) 3.443 2.025 ( -6.898 2.365 3.060) 7.908 2.146 ( 2.178 -4.135 -1.010) 4.782 2.263 ( 2.393 -1.698 3.170) 4.319 2.283 ( -3.241 0.531 1.346) 3.549 2.335 ( 4.703 0.612 -0.510) 4.770 2.359 ( -1.162 0.091 -5.190) 5.320 2.379 ( -1.007 2.833 -1.716) 3.462 2.460 ( -0.199 0.094 2.454) 2.464 2.641 ( 2.488 0.891 -1.493) 3.035 3.193 ( 1.776 -1.128 -5.203) 5.612 3.310 ( -3.661 -2.217 -8.698) 9.694 3.442 ( -1.247 0.969 -2.830) 3.241 3.480 ( -1.450 1.526 -1.385) 2.520 3.689 ( 6.443 -1.100 -0.608) 6.565 3.727 ( -1.418 2.060 -2.555) 3.575 3.849 ( -0.360 -0.619 3.631) 3.701 3.932 ( -1.868 1.149 0.607) 2.275 4.381 ( -2.338 21.322 6.524) 22.420 4.533 ( -1.680 17.439 -0.330) 17.523 5.656 ( 2.788 7.240 4.733) 9.088 5.752 ( 4.711 8.828 -0.849) 10.042 6.131 ( 0.122 -0.831 4.918) 4.989 6.271 ( -0.193 5.391 -0.709) 5.441 6.402 ( -0.867 -5.732 7.898) 9.797 6.631 ( -0.041 -8.621 -3.743) 9.399 6.770 ( -1.618 -3.705 -10.746) 11.481 6.918 ( 1.754 -2.343 -13.610) 13.921 7.035 ( -4.797 -2.185 4.865) 7.173 7.213 ( 4.629 -3.476 -0.886) 5.856 7.581 ( 2.951 4.544 1.470) 5.614 7.722 ( -1.801 1.059 -4.907) 5.333 7.902 ( 5.305 4.573 1.479) 7.158 7.993 ( -3.462 2.915 -3.820) 5.922 8.273 ( -0.075 0.388 4.928) 4.944 8.377 ( -6.078 -1.923 1.650) 6.585 8.481 ( 1.196 2.980 3.285) 4.593 8.561 ( -3.630 -1.628 5.880) 7.099 8.631 ( 5.906 0.876 3.095) 6.725 8.811 ( -1.685 -2.475 -1.680) 3.434 9.162 ( 1.002 -6.082 0.176) 6.167 9.173 ( -3.252 -5.241 -2.420) 6.626 10.670 ( -1.647 1.213 4.823) 5.238 10.821 ( 1.940 -4.174 4.152) 6.199 10.927 ( 1.258 -2.225 -1.568) 2.999 11.109 ( -1.230 -6.845 -4.377) 8.217 13.220 ( 3.308 -2.467 -4.532) 6.129 13.253 ( -5.447 -4.315 -5.043) 8.587 14.610 ( -0.990 35.911 12.093) 37.906 14.629 ( 4.995 38.368 11.150) 40.266 15.833 ( -0.979 4.851 3.171) 5.877 15.927 ( -5.049 3.089 2.163) 6.302 15.945 ( -5.576 8.473 5.091) 11.349 16.098 ( 7.156 8.807 2.639) 11.651 18.861 ( -0.527 -27.747 -12.432) 30.410 18.868 ( 3.146 -26.975 -11.971) 29.679 21.450 ( -2.487 -1.339 1.271) 3.097 21.463 ( 2.573 -1.283 0.561) 2.930 ======================= Grid point 215 (107/160) ======================= q-point: (-0.40 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -9.985 7.875 0.772) 12.741 1.806 ( -13.950 6.733 -0.925) 15.518 1.909 ( 8.108 1.113 -2.618) 8.593 2.055 ( 1.725 -0.588 3.877) 4.284 2.192 ( -0.461 -6.614 2.594) 7.119 2.220 ( -5.240 0.975 -0.512) 5.354 2.286 ( -0.389 -0.715 2.495) 2.624 2.308 ( 5.001 -0.508 -6.141) 7.936 2.391 ( 2.221 -0.544 1.295) 2.628 2.448 ( 8.747 0.570 -3.899) 9.594 2.550 ( 2.551 7.441 5.473) 9.583 2.661 ( 3.959 -0.203 -4.560) 6.042 3.157 ( -1.924 -0.119 -5.772) 6.086 3.178 ( 2.069 -2.510 -3.197) 4.561 3.311 ( -9.174 -3.874 0.556) 9.974 3.412 ( -5.482 2.144 -1.012) 5.973 3.645 ( -1.715 7.876 -1.288) 8.163 3.817 ( -0.318 7.985 1.406) 8.114 3.866 ( 6.847 -7.526 -1.349) 10.264 4.037 ( 7.742 2.299 2.343) 8.410 4.370 ( -7.329 14.706 6.089) 17.523 4.408 ( -11.859 19.569 0.428) 22.886 5.746 ( 4.278 9.092 -0.235) 10.051 5.819 ( 5.900 9.316 -3.560) 11.588 6.153 ( -2.250 -1.639 0.872) 2.917 6.353 ( 8.381 5.286 3.559) 10.528 6.519 ( -2.262 -9.851 -0.787) 10.138 6.557 ( 3.216 -5.315 7.085) 9.423 6.729 ( 2.925 -4.055 -5.858) 7.702 6.789 ( 3.655 -1.950 -11.305) 12.040 7.019 ( -3.273 -1.485 3.961) 5.349 7.280 ( 5.718 -0.337 -2.684) 6.326 7.575 ( -5.301 2.423 -2.362) 6.289 7.671 ( 1.247 0.824 0.871) 1.730 7.908 ( -1.468 0.919 -3.864) 4.235 7.991 ( 3.208 2.516 1.315) 4.284 8.262 ( -6.597 0.861 2.423) 7.081 8.330 ( -2.809 -1.364 4.628) 5.583 8.492 ( -0.392 4.261 1.442) 4.516 8.612 ( -3.030 -3.334 1.124) 4.643 8.732 ( 0.448 1.339 1.298) 1.917 8.774 ( 6.360 -2.672 -0.256) 6.904 9.158 ( 2.972 -5.837 0.404) 6.562 9.229 ( 5.663 -5.509 0.695) 7.931 10.671 ( -5.537 -0.282 4.814) 7.343 10.812 ( -2.295 -7.271 -4.938) 9.084 10.939 ( -3.198 0.824 6.026) 6.872 10.973 ( -8.016 -2.548 -5.144) 9.859 13.135 ( -3.044 -2.137 -2.568) 4.519 13.277 ( 5.623 -3.898 0.606) 6.869 14.567 ( -13.116 39.351 4.441) 41.716 14.723 ( -5.197 31.393 1.665) 31.864 15.828 ( -1.507 8.533 0.099) 8.665 15.902 ( -1.779 1.346 6.129) 6.523 16.021 ( 4.261 2.811 6.082) 7.940 16.205 ( 3.662 7.776 0.009) 8.596 18.659 ( -4.407 -23.930 -8.527) 25.784 18.896 ( 9.141 -26.364 -6.682) 28.692 21.422 ( -2.042 -0.788 0.408) 2.226 21.515 ( 2.931 -1.899 0.314) 3.507 ======================= Grid point 216 (108/160) ======================= q-point: (-0.30 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.459 ( -11.178 12.945 5.802) 18.060 1.578 ( -13.627 10.832 1.542) 17.476 1.967 ( 2.314 1.989 -3.830) 4.897 2.117 ( -4.888 2.873 2.829) 6.336 2.139 ( -3.670 -5.776 3.298) 7.597 2.210 ( 4.662 -0.361 0.922) 4.766 2.293 ( 2.540 -3.448 -1.074) 4.415 2.377 ( 4.891 -0.882 -3.413) 6.029 2.469 ( -5.707 3.491 -1.198) 6.797 2.473 ( 2.704 -2.346 4.137) 5.471 2.603 ( 6.030 5.323 0.402) 8.054 2.672 ( 5.425 -1.578 -5.891) 8.163 3.096 ( -1.858 2.203 0.385) 2.908 3.226 ( 0.621 -2.042 5.165) 5.589 3.255 ( 1.359 0.268 1.466) 2.017 3.339 ( -1.159 4.355 -1.035) 4.624 3.586 ( -3.706 10.827 -0.470) 11.453 3.821 ( -3.481 9.550 -3.093) 10.625 3.895 ( 2.453 0.033 -1.776) 3.029 4.116 ( -1.755 6.316 -0.705) 6.593 4.243 ( -5.291 12.203 1.479) 13.382 4.376 ( -1.403 2.639 6.933) 7.550 5.740 ( 1.714 3.475 -5.707) 6.898 5.892 ( 7.931 5.834 -7.031) 12.098 6.124 ( -0.871 2.923 1.419) 3.364 6.468 ( 4.564 5.616 -5.123) 8.867 6.560 ( 1.398 -5.523 7.767) 9.633 6.646 ( 5.424 -1.693 -4.243) 7.091 6.749 ( 0.728 -4.898 8.805) 10.102 6.819 ( 6.327 -2.520 -2.253) 7.174 7.024 ( 0.963 -3.822 0.951) 4.054 7.325 ( 3.356 1.464 -3.748) 5.239 7.470 ( -3.326 5.858 -1.563) 6.916 7.656 ( -4.568 0.250 -0.696) 4.627 7.841 ( -1.151 -3.460 -4.392) 5.708 8.079 ( 2.766 -1.241 7.839) 8.405 8.233 ( -1.386 2.117 0.430) 2.567 8.294 ( -3.033 0.692 1.809) 3.598 8.430 ( -6.639 -3.132 -7.105) 10.216 8.555 ( -0.074 1.691 1.781) 2.457 8.799 ( 3.722 4.785 4.120) 7.329 8.920 ( 9.772 -3.517 -0.911) 10.426 9.238 ( 4.764 -4.868 0.684) 6.846 9.362 ( 7.524 -5.097 4.032) 9.942 10.583 ( -11.556 -3.966 3.187) 12.626 10.637 ( -12.138 -0.150 -4.748) 13.034 10.779 ( -9.109 1.538 -2.583) 9.592 10.939 ( -2.823 -4.759 2.569) 6.101 13.108 ( 0.267 -0.222 1.884) 1.916 13.384 ( 3.816 -1.234 3.107) 5.073 14.317 ( -19.279 31.868 -1.286) 37.268 14.574 ( -6.017 12.103 -6.409) 14.958 15.827 ( -1.095 5.084 -1.082) 5.312 15.894 ( -2.364 3.919 1.375) 4.779 16.181 ( 4.477 6.592 1.113) 8.046 16.225 ( 2.364 -2.037 -1.433) 3.433 18.548 ( -3.239 -9.305 1.268) 9.934 19.016 ( 10.234 -19.106 0.665) 21.685 21.399 ( -1.067 -0.706 0.107) 1.284 21.559 ( 2.620 -2.655 -0.600) 3.778 ======================= Grid point 217 (109/160) ======================= q-point: (-0.20 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 244 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( -11.915 16.115 7.919) 21.549 1.412 ( -11.752 13.816 5.817) 19.048 1.883 ( -8.060 5.107 -1.318) 9.632 2.052 ( -5.736 -2.356 0.663) 6.236 2.125 ( -1.108 0.508 4.313) 4.482 2.249 ( -9.510 17.014 2.721) 19.681 2.294 ( 2.816 -3.631 -4.065) 6.135 2.379 ( 7.947 -3.375 -1.840) 8.828 2.469 ( 3.029 -3.377 -0.891) 4.623 2.533 ( 1.786 -4.394 -0.308) 4.753 2.715 ( 6.680 -0.137 -1.243) 6.796 2.749 ( 5.861 0.529 0.634) 5.919 3.099 ( -0.365 2.000 4.546) 4.979 3.249 ( -0.774 7.008 -0.587) 7.075 3.319 ( 5.777 4.800 -0.666) 7.540 3.404 ( 2.833 5.216 8.643) 10.485 3.533 ( -2.789 11.807 1.171) 12.188 3.707 ( -4.103 5.996 2.814) 7.791 3.898 ( -1.364 1.590 -3.760) 4.304 4.062 ( -2.281 8.953 -0.465) 9.251 4.157 ( -5.899 5.439 -3.024) 8.574 4.438 ( 1.958 -4.649 -0.864) 5.118 5.742 ( 5.414 -0.863 -3.363) 6.432 5.858 ( 1.850 -0.280 -8.823) 9.019 6.224 ( 7.477 9.762 3.583) 12.808 6.428 ( 0.881 6.344 -4.638) 7.907 6.642 ( -3.248 0.020 8.222) 8.840 6.747 ( 7.843 -5.150 -1.910) 9.575 6.823 ( -1.723 0.964 5.239) 5.599 6.904 ( 5.443 -3.326 0.228) 6.383 7.097 ( 5.687 -4.905 1.593) 7.677 7.290 ( -1.732 1.833 -2.400) 3.481 7.419 ( -2.857 7.115 -2.027) 7.931 7.534 ( -6.200 1.514 -2.277) 6.776 7.776 ( 0.539 -6.594 -5.722) 8.747 8.137 ( -5.953 -3.576 0.991) 7.014 8.206 ( -7.424 -4.779 -5.312) 10.304 8.273 ( -0.370 -8.139 7.835) 11.303 8.353 ( 9.908 11.033 -2.969) 15.123 8.608 ( 5.284 3.751 1.898) 6.752 8.897 ( 4.803 6.756 -1.206) 8.377 9.071 ( 8.040 -4.663 2.482) 9.620 9.303 ( 3.846 -4.069 -1.792) 5.879 9.538 ( 5.618 -6.611 4.219) 9.647 10.363 ( -14.617 5.433 -0.459) 15.600 10.393 ( -17.228 -4.061 5.624) 18.573 10.603 ( -10.293 2.796 -0.626) 10.685 10.914 ( -0.034 -6.281 -2.654) 6.819 13.177 ( 1.997 0.585 6.026) 6.376 13.444 ( -1.380 6.406 3.385) 7.376 13.939 ( -20.771 19.759 -5.595) 29.209 14.448 ( 3.562 -8.471 -11.675) 14.858 15.742 ( -3.250 2.901 -4.964) 6.605 15.871 ( -2.240 3.137 -0.170) 3.859 16.123 ( -7.186 1.642 -0.194) 7.374 16.258 ( 5.363 -9.314 -11.191) 15.516 18.607 ( -0.060 9.748 13.739) 16.846 19.242 ( 11.313 -8.437 6.890) 15.705 21.393 ( 0.003 -1.053 0.476) 1.155 21.583 ( 1.910 -3.217 -1.728) 4.122 ======================= Grid point 218 (110/160) ======================= q-point: (-0.10 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.242 ( -10.821 16.853 6.289) 20.992 1.343 ( -8.028 13.874 10.287) 19.046 1.750 ( -7.668 9.706 2.577) 12.635 1.961 ( -4.020 0.192 -3.185) 5.132 2.118 ( -3.552 8.516 2.080) 9.459 2.224 ( -1.993 -7.293 -8.429) 11.323 2.258 ( -0.488 9.236 9.728) 13.423 2.438 ( 3.431 -1.982 -4.355) 5.888 2.481 ( 3.184 -4.737 -3.482) 6.686 2.559 ( 1.946 -0.896 -1.624) 2.688 2.755 ( 1.253 -1.238 -2.650) 3.182 2.798 ( -0.134 3.296 0.476) 3.333 3.167 ( 2.854 9.399 2.030) 10.030 3.336 ( 6.082 4.456 8.182) 11.126 3.427 ( 7.521 7.383 -0.225) 10.542 3.535 ( -0.198 9.437 4.255) 10.354 3.580 ( 5.752 5.077 8.112) 11.166 3.742 ( -3.982 3.413 6.843) 8.622 3.813 ( -0.935 -0.800 -1.145) 1.680 3.939 ( -7.152 5.393 -5.935) 10.745 4.061 ( -3.058 7.475 -0.178) 8.078 4.377 ( -2.059 -5.415 -9.314) 10.969 5.794 ( 3.844 -0.629 -5.917) 7.084 5.831 ( 4.654 -3.719 -0.663) 5.994 6.376 ( 4.900 7.761 0.749) 9.209 6.441 ( 3.279 11.544 2.959) 12.360 6.661 ( -3.693 0.743 6.091) 7.161 6.764 ( -5.349 0.065 0.419) 5.366 6.850 ( 6.021 -4.543 -3.935) 8.507 7.001 ( 4.360 -1.272 -0.466) 4.565 7.188 ( 1.685 0.370 1.693) 2.417 7.270 ( 0.645 -0.551 0.237) 0.881 7.314 ( -6.094 -1.776 1.101) 6.442 7.449 ( -0.629 8.773 -1.859) 8.990 7.714 ( 0.380 -5.554 -7.381) 9.244 8.021 ( -5.591 -5.613 -4.380) 9.052 8.077 ( -1.585 -5.141 -1.033) 5.478 8.247 ( -2.589 -1.463 -5.910) 6.616 8.538 ( 6.077 0.807 7.164) 9.429 8.776 ( 8.906 4.030 2.451) 10.078 8.941 ( 3.860 5.078 -2.536) 6.864 9.168 ( 4.011 -1.188 -6.336) 7.593 9.352 ( 2.444 -4.061 3.972) 6.184 9.607 ( 1.282 -8.476 3.222) 9.157 10.086 ( -19.643 -1.711 2.772) 19.911 10.272 ( -11.228 2.197 7.028) 13.427 10.496 ( -1.186 8.641 3.685) 9.468 10.878 ( 1.218 -3.347 -5.554) 6.598 13.285 ( 0.031 0.964 7.951) 8.010 13.434 ( -2.786 10.342 2.855) 11.085 13.579 ( -14.150 11.362 -4.082) 18.601 14.388 ( 8.196 -22.762 -17.637) 29.939 15.653 ( -0.827 1.780 -3.402) 3.927 15.823 ( -2.192 -0.518 -0.817) 2.396 15.985 ( -9.270 -4.216 0.782) 10.213 16.142 ( 1.335 -8.330 -16.093) 18.170 18.838 ( 2.949 19.738 20.354) 28.506 19.482 ( 7.496 0.450 4.910) 8.973 21.408 ( 0.451 -1.544 1.279) 2.055 21.581 ( 1.013 -3.429 -2.720) 4.492 ======================= Grid point 219 (111/160) ======================= q-point: ( 0.00 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.494 ( -1.590 10.774 3.510) 11.443 1.604 ( -2.683 9.122 7.026) 11.823 1.815 ( -2.177 3.131 -7.197) 8.145 1.941 ( -2.073 4.459 -8.148) 9.517 1.982 ( -0.666 -2.830 2.681) 3.955 2.110 ( -1.696 -0.709 -2.889) 3.424 2.346 ( 1.660 -5.281 -3.162) 6.375 2.353 ( 0.643 -4.577 -3.471) 5.781 2.462 ( 2.915 0.699 0.808) 3.105 2.557 ( 0.913 -0.383 -0.926) 1.356 2.734 ( 1.226 -0.608 -2.128) 2.530 2.831 ( -2.135 -1.519 -1.882) 3.226 3.499 ( 1.998 2.021 11.258) 11.612 3.544 ( 2.932 9.375 8.132) 12.751 3.667 ( 4.216 3.936 -1.477) 5.953 3.712 ( -2.123 1.555 7.232) 7.696 3.766 ( -0.591 6.389 1.827) 6.671 3.815 ( -1.769 3.785 -0.160) 4.181 3.918 ( 0.899 7.965 1.934) 8.245 3.995 ( -0.325 5.676 -1.050) 5.782 4.133 ( -1.089 4.457 -0.310) 4.598 4.198 ( -3.485 1.638 -2.920) 4.833 5.770 ( 2.593 -1.479 -2.410) 3.836 5.804 ( 0.642 -2.704 -1.697) 3.257 6.529 ( -8.376 7.042 2.851) 11.308 6.641 ( 4.113 -0.734 0.946) 4.284 6.680 ( -1.797 6.119 -1.179) 6.485 6.757 ( 2.535 -2.608 -3.203) 4.847 6.892 ( 2.302 3.393 3.878) 5.644 7.046 ( 2.007 -1.953 -2.462) 3.729 7.146 ( -0.057 -1.610 -2.243) 2.762 7.200 ( 0.121 0.521 -3.135) 3.180 7.356 ( 4.100 1.323 2.945) 5.219 7.500 ( -0.523 -4.353 -4.515) 6.294 7.687 ( 0.603 5.387 2.507) 5.972 7.802 ( -2.688 -3.672 -1.717) 4.864 7.964 ( 0.793 -2.937 0.388) 3.067 8.101 ( -1.082 -3.211 -4.132) 5.344 8.670 ( 0.058 2.444 6.370) 6.823 8.883 ( -6.788 1.187 1.762) 7.113 8.944 ( 1.826 -0.501 -1.169) 2.225 9.031 ( 0.790 -6.071 -7.775) 9.896 9.452 ( -0.385 0.614 3.812) 3.881 9.623 ( 6.965 -6.156 -3.366) 9.887 9.853 ( -7.956 4.646 6.291) 11.156 10.108 ( -0.771 -5.758 -3.711) 6.894 10.800 ( 1.290 7.720 6.568) 10.218 10.879 ( 0.583 2.784 1.300) 3.127 13.366 ( -2.149 2.629 2.536) 4.238 13.564 ( -7.744 4.544 -0.893) 9.023 13.639 ( 2.222 7.125 1.948) 7.713 13.847 ( 6.792 -14.676 -13.149) 20.842 15.634 ( -0.327 0.852 -3.283) 3.407 15.751 ( 1.280 -2.448 -1.972) 3.394 15.778 ( -3.078 -3.577 0.906) 4.805 15.846 ( 1.358 -7.449 -9.213) 11.925 19.464 ( 1.066 13.526 13.441) 19.098 19.664 ( 0.510 2.980 3.657) 4.744 21.401 ( 0.014 -0.681 0.946) 1.166 21.479 ( 0.098 -3.767 -2.559) 4.555 ======================= Grid point 220 (112/160) ======================= q-point: ( 0.10 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 7.376 5.219 8.077) 12.120 1.673 ( 0.572 6.949 7.726) 10.407 1.720 ( 3.677 3.399 -7.416) 8.948 1.880 ( 2.936 4.283 -3.814) 6.443 2.020 ( 0.308 0.043 3.014) 3.030 2.090 ( 1.820 -1.328 0.297) 2.273 2.310 ( -1.038 -4.388 -2.780) 5.298 2.349 ( 1.855 -5.321 -2.816) 6.300 2.488 ( -0.530 1.545 0.728) 1.788 2.522 ( -0.828 0.723 -3.871) 4.024 2.734 ( -3.231 -3.092 -0.625) 4.516 2.760 ( -1.416 -3.596 0.047) 3.865 3.536 ( -3.512 6.278 1.020) 7.265 3.659 ( 0.909 2.987 -2.605) 4.067 3.715 ( -5.227 4.444 2.227) 7.214 3.725 ( -2.757 3.999 0.185) 4.861 3.752 ( 2.460 5.256 5.023) 7.675 3.801 ( -0.273 4.408 1.542) 4.678 3.927 ( -2.239 6.017 0.249) 6.425 3.977 ( 0.001 5.174 -1.020) 5.273 4.137 ( 1.676 6.835 1.391) 7.174 4.211 ( 6.242 5.490 2.344) 8.637 5.757 ( -1.772 -1.623 -3.641) 4.363 5.774 ( -0.771 -2.792 -2.096) 3.575 6.453 ( -5.256 6.241 7.673) 11.201 6.576 ( -6.285 5.623 -1.452) 8.558 6.685 ( -4.629 -2.752 -0.410) 5.401 6.773 ( 4.553 -6.048 0.366) 7.579 6.922 ( -4.928 4.258 -3.902) 7.592 7.030 ( 4.533 1.392 -1.783) 5.066 7.152 ( 2.817 -0.473 -3.173) 4.269 7.223 ( 4.157 -1.104 2.175) 4.820 7.413 ( -1.271 -1.831 -6.569) 6.937 7.457 ( 3.671 -1.265 1.856) 4.303 7.740 ( 2.254 0.393 4.192) 4.776 7.788 ( 0.868 2.139 -1.637) 2.830 8.028 ( 5.320 -2.371 1.092) 5.926 8.055 ( 3.116 0.994 -3.342) 4.677 8.690 ( -6.980 -1.058 6.561) 9.638 8.809 ( -7.134 -2.499 0.089) 7.560 8.884 ( -0.444 5.201 0.125) 5.221 9.036 ( 2.354 -1.640 -4.283) 5.155 9.359 ( -10.397 -2.514 1.967) 10.875 9.489 ( -11.934 -5.979 -0.042) 13.348 10.075 ( 16.685 -1.619 3.980) 17.230 10.186 ( 12.856 -6.326 -1.742) 14.433 10.839 ( -2.742 6.926 2.433) 7.836 10.861 ( -3.034 5.551 -1.091) 6.419 13.401 ( -1.105 -1.646 7.489) 7.747 13.480 ( -2.011 -2.646 0.860) 3.433 13.756 ( 12.152 9.423 -1.349) 15.436 13.872 ( 12.439 -1.024 -11.371) 16.884 15.614 ( 0.106 -0.565 0.132) 0.590 15.695 ( 0.186 -0.898 -5.006) 5.090 15.819 ( 5.385 -3.777 -0.080) 6.579 15.880 ( 7.831 -6.158 0.091) 9.962 19.530 ( -8.718 8.001 7.563) 14.043 19.604 ( -8.879 4.762 -0.852) 10.111 21.411 ( -0.638 -1.447 1.402) 2.113 21.447 ( -0.312 -2.854 -2.331) 3.698 ======================= Grid point 221 (113/160) ======================= q-point: ( 0.20 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.767 ( 9.141 7.187 -2.573) 11.909 1.786 ( 4.967 4.172 3.580) 7.409 1.820 ( 4.588 5.011 3.265) 7.538 1.985 ( 8.750 1.953 5.973) 10.773 2.044 ( -0.579 0.898 1.692) 2.001 2.167 ( 3.467 -2.724 3.940) 5.913 2.255 ( -2.946 0.160 -0.289) 2.964 2.338 ( 1.652 -5.481 -4.126) 7.056 2.455 ( -3.398 -0.810 -1.976) 4.014 2.488 ( 1.167 -2.847 -1.375) 3.370 2.644 ( -3.820 -2.225 -2.590) 5.124 2.735 ( -4.798 -6.905 1.708) 8.580 3.441 ( -7.153 10.191 -0.004) 12.450 3.546 ( -8.487 10.852 -4.202) 14.403 3.629 ( 0.507 3.103 -8.414) 8.983 3.669 ( -2.443 1.608 -0.913) 3.064 3.782 ( -3.174 -0.736 -1.343) 3.524 3.816 ( -0.804 3.627 3.060) 4.813 3.921 ( 1.769 4.657 -1.115) 5.105 3.976 ( -0.607 1.229 3.623) 3.873 4.274 ( 8.115 9.309 5.586) 13.554 4.383 ( 10.859 8.974 2.030) 14.232 5.677 ( -4.338 -1.203 -2.361) 5.083 5.704 ( -1.727 0.088 -2.306) 2.883 6.453 ( -5.870 1.645 -1.088) 6.192 6.490 ( -3.675 -1.044 -0.731) 3.890 6.612 ( -2.566 0.623 9.880) 10.227 6.690 ( -11.247 3.545 -4.531) 12.633 6.924 ( 6.415 -0.763 1.106) 6.554 6.992 ( -3.963 -3.405 -6.370) 8.239 7.169 ( 0.191 -0.685 -3.586) 3.656 7.272 ( -1.288 -1.532 0.374) 2.036 7.405 ( 8.334 -1.008 -2.387) 8.728 7.519 ( 5.003 -2.815 -1.083) 5.842 7.767 ( 2.018 10.420 -2.753) 10.965 7.882 ( 6.145 -0.420 6.943) 9.282 8.114 ( 7.474 -0.928 -1.864) 7.759 8.169 ( 6.973 0.028 3.473) 7.789 8.618 ( -6.766 -0.644 -3.735) 7.755 8.680 ( -7.964 -4.516 5.769) 10.822 8.802 ( -11.489 6.614 -1.122) 13.304 9.037 ( 1.105 4.770 2.586) 5.538 9.202 ( -11.624 -7.586 -0.477) 13.888 9.372 ( -3.691 -8.306 2.273) 9.370 10.348 ( 14.774 -3.787 -0.039) 15.252 10.449 ( 15.843 -7.527 2.824) 17.766 10.769 ( -3.579 6.202 -3.284) 7.878 10.792 ( -4.050 4.801 -0.057) 6.281 13.454 ( -0.470 -2.693 2.021) 3.399 13.468 ( -2.192 -5.042 0.356) 5.509 14.007 ( 15.313 10.853 -2.291) 18.909 14.044 ( 21.265 11.949 4.257) 24.761 15.642 ( 0.784 -0.910 3.348) 3.557 15.701 ( 5.276 1.838 -0.862) 5.654 15.923 ( 7.015 -1.777 -0.264) 7.241 16.050 ( 10.685 -5.260 1.588) 12.015 19.321 ( -16.150 3.451 -5.803) 17.505 19.405 ( -15.196 -0.752 -1.258) 15.267 21.406 ( -0.718 -1.432 -0.383) 1.648 21.427 ( -0.728 -2.215 0.710) 2.437 ======================= Grid point 222 (114/160) ======================= q-point: ( 0.30 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.861 ( 5.225 4.984 -4.566) 8.543 1.897 ( 8.023 6.454 -1.091) 10.354 1.936 ( 4.611 4.741 3.205) 7.349 2.044 ( -1.428 0.585 2.121) 2.623 2.170 ( 4.695 2.146 4.511) 6.856 2.212 ( -3.015 1.731 0.248) 3.485 2.258 ( 2.001 -3.961 1.370) 4.644 2.308 ( -0.272 -0.890 -4.823) 4.912 2.375 ( -2.479 -3.295 1.302) 4.324 2.496 ( 0.906 -4.843 -1.212) 5.074 2.547 ( -5.812 -0.974 -0.889) 5.960 2.671 ( -2.538 -6.817 -0.083) 7.274 3.338 ( -7.922 9.770 -2.296) 12.786 3.375 ( -4.438 9.153 1.672) 10.309 3.545 ( 2.758 1.608 -10.444) 10.921 3.615 ( -3.004 -1.300 -2.591) 4.175 3.690 ( -3.620 -0.260 -2.860) 4.620 3.813 ( -1.576 -0.638 -0.893) 1.920 3.932 ( 0.910 4.721 -0.746) 4.865 4.024 ( -1.157 0.040 4.885) 5.021 4.483 ( 8.379 10.919 6.940) 15.414 4.588 ( 12.304 11.217 0.094) 16.649 5.601 ( -2.795 2.442 2.042) 4.235 5.707 ( 3.096 1.748 0.721) 3.627 6.353 ( -6.321 -0.657 0.726) 6.396 6.377 ( -2.946 -4.001 -5.779) 7.621 6.458 ( -10.579 6.890 -2.545) 12.879 6.747 ( 1.047 -7.045 5.070) 8.743 6.807 ( -7.141 1.552 -3.173) 7.967 7.006 ( 2.211 -0.366 0.101) 2.244 7.072 ( -2.625 -1.041 -7.488) 8.003 7.202 ( -5.930 -5.383 -1.199) 8.098 7.547 ( 9.889 1.911 -1.213) 10.145 7.631 ( 9.475 -0.541 -1.467) 9.603 7.809 ( 4.273 10.840 0.288) 11.655 8.070 ( 5.902 -1.852 7.241) 9.523 8.229 ( 7.796 -1.331 0.049) 7.909 8.304 ( 5.141 -0.630 0.506) 5.205 8.420 ( -9.089 1.483 -5.319) 10.635 8.615 ( -7.698 7.888 0.081) 11.022 8.647 ( -7.261 -5.188 6.661) 11.136 8.988 ( -9.114 0.188 -0.155) 9.117 9.085 ( -3.192 -4.059 1.777) 5.461 9.320 ( -6.092 -8.115 0.408) 10.155 10.578 ( 11.723 -3.975 0.989) 12.418 10.643 ( 3.683 -0.327 -2.542) 4.487 10.736 ( -0.110 3.406 1.057) 3.568 10.774 ( 6.894 -4.036 2.749) 8.449 13.386 ( -0.727 -2.091 -8.891) 9.162 13.422 ( -3.703 -4.276 -2.187) 6.065 14.344 ( 16.324 18.912 14.947) 29.113 14.506 ( 21.907 15.620 12.768) 29.781 15.711 ( 1.203 -0.553 5.348) 5.510 15.841 ( 11.090 3.114 0.617) 11.536 16.023 ( 5.209 3.413 -0.061) 6.228 16.233 ( 8.127 -1.279 2.121) 8.496 18.933 ( -16.944 -4.038 -12.972) 21.718 19.061 ( -18.838 -10.217 -9.291) 23.357 21.395 ( 0.152 -0.659 -0.242) 0.718 21.429 ( -1.243 -2.138 2.088) 3.237 ======================= Grid point 223 (115/160) ======================= q-point: ( 0.40 0.38 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 0.573 4.530 -4.808) 6.631 1.976 ( 3.347 5.746 -2.364) 7.057 2.004 ( 3.089 2.104 -0.532) 3.775 2.086 ( 2.569 1.808 1.370) 3.427 2.100 ( -5.917 -0.834 -4.218) 7.315 2.238 ( 0.301 -0.482 -3.118) 3.169 2.262 ( 0.142 0.431 3.959) 3.985 2.299 ( 2.383 -0.830 -0.272) 2.538 2.390 ( -0.080 -0.154 0.205) 0.269 2.453 ( -2.257 -3.466 -1.193) 4.305 2.487 ( -2.338 2.384 2.101) 3.946 2.668 ( -0.225 -2.163 2.612) 3.399 3.202 ( -2.585 3.608 -3.420) 5.604 3.383 ( -3.033 2.749 2.683) 4.895 3.455 ( 0.499 -2.894 -6.993) 7.585 3.517 ( 4.115 -1.615 -13.958) 14.641 3.627 ( -4.470 -0.895 2.993) 5.454 3.722 ( -4.983 -5.507 -5.688) 9.355 3.933 ( -0.721 5.239 0.857) 5.357 4.026 ( -3.848 0.559 2.738) 4.756 4.699 ( 5.982 15.627 8.971) 18.986 4.782 ( 10.230 13.481 1.621) 17.000 5.665 ( 3.125 7.477 8.086) 11.448 5.814 ( 6.964 5.307 2.483) 9.101 6.190 ( -9.566 -0.370 -2.997) 10.031 6.313 ( 0.106 1.329 -1.517) 2.019 6.347 ( -3.575 -2.569 0.733) 4.463 6.562 ( -8.023 -10.087 -6.682) 14.518 6.869 ( 0.025 -1.950 -1.158) 2.268 6.934 ( 0.014 1.362 -7.621) 7.742 7.016 ( 0.831 0.528 -1.520) 1.811 7.095 ( -5.901 -6.528 0.943) 8.850 7.660 ( 6.577 5.351 -3.158) 9.048 7.745 ( 6.152 -0.040 -2.864) 6.786 7.901 ( 5.657 6.810 1.535) 8.985 8.156 ( -3.669 -4.931 -4.548) 7.646 8.258 ( -1.994 4.121 5.273) 6.983 8.337 ( 0.311 2.876 1.383) 3.206 8.396 ( 8.388 -1.090 1.870) 8.662 8.523 ( -9.769 -4.164 3.785) 11.274 8.632 ( 0.847 3.324 2.731) 4.385 8.885 ( -3.836 2.682 0.072) 4.681 9.022 ( -4.271 -7.649 -0.609) 8.781 9.185 ( -8.603 -6.787 -1.591) 11.072 10.646 ( 1.859 -1.204 -1.363) 2.601 10.688 ( 2.290 -2.636 -0.591) 3.542 10.834 ( 5.564 2.231 5.828) 8.361 10.938 ( 5.873 -5.621 2.975) 8.657 13.263 ( -0.463 -0.596 -9.266) 9.297 13.310 ( -4.007 -3.524 -5.301) 7.521 14.830 ( 12.594 22.729 25.578) 36.461 15.010 ( 16.630 22.396 18.497) 33.470 15.791 ( 0.356 -0.301 5.588) 5.607 15.995 ( 4.928 1.875 -2.318) 5.760 16.128 ( 9.579 11.969 1.415) 15.396 16.322 ( -1.593 6.825 1.966) 7.279 18.522 ( -9.496 -16.893 -18.039) 26.475 18.621 ( -15.419 -21.025 -16.094) 30.640 21.408 ( 1.009 -0.461 0.637) 1.280 21.432 ( -1.405 -1.603 2.061) 2.965 ======================= Grid point 224 (116/160) ======================= q-point: (-0.50 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( -1.814 2.985 -1.910) 3.981 1.906 ( -2.748 0.429 -6.440) 7.015 2.032 ( 1.029 3.259 -0.083) 3.419 2.045 ( 0.144 0.684 1.490) 1.645 2.103 ( -1.333 0.504 -2.487) 2.866 2.207 ( 0.579 -3.317 -4.353) 5.503 2.293 ( -0.417 1.231 3.335) 3.579 2.342 ( 2.849 0.185 -0.314) 2.873 2.375 ( -1.744 0.635 -0.241) 1.872 2.395 ( -0.261 -1.386 -2.078) 2.512 2.570 ( 4.585 7.998 7.570) 11.929 2.697 ( -1.163 3.962 3.838) 5.638 3.159 ( 2.340 -1.273 -6.446) 6.975 3.267 ( -4.925 -1.928 -4.376) 6.864 3.390 ( -4.477 -5.047 -11.016) 12.918 3.449 ( 5.588 -4.800 -8.233) 11.048 3.599 ( -1.997 -3.602 2.073) 4.610 3.640 ( 3.385 -5.174 0.041) 6.182 3.939 ( -1.176 4.867 2.332) 5.523 3.990 ( -1.378 2.272 1.154) 2.897 4.831 ( -3.780 19.792 8.165) 21.741 4.915 ( 0.247 17.152 2.901) 17.397 5.831 ( 2.006 9.353 9.777) 13.678 5.957 ( 8.798 10.202 -0.774) 13.494 6.074 ( -1.764 -3.219 1.610) 4.008 6.294 ( -3.640 -2.762 1.984) 4.982 6.352 ( 0.669 -3.727 2.115) 4.338 6.414 ( 0.973 -9.526 -4.903) 10.758 6.741 ( 1.289 0.086 -12.552) 12.618 6.851 ( -0.567 -3.343 -11.593) 12.078 7.016 ( -3.795 0.058 4.175) 5.642 7.099 ( 4.299 -5.723 1.698) 7.357 7.696 ( 2.067 5.233 -2.408) 6.120 7.737 ( -0.906 0.962 -4.537) 4.725 8.005 ( 4.321 4.633 -0.086) 6.336 8.035 ( -3.668 1.585 -2.574) 4.753 8.285 ( -0.684 0.615 3.289) 3.415 8.333 ( -6.483 -2.021 2.575) 7.263 8.480 ( 0.924 -2.618 5.713) 6.352 8.541 ( 3.753 -1.633 2.512) 4.802 8.699 ( 4.208 5.429 1.630) 7.059 8.789 ( -6.211 1.868 -2.300) 6.882 9.010 ( 2.224 -8.398 0.491) 8.702 9.043 ( -4.154 -7.081 -2.090) 8.471 10.660 ( -0.256 -1.899 1.023) 2.173 10.704 ( 0.459 -4.222 -0.783) 4.318 10.955 ( 0.994 2.085 4.748) 5.280 11.011 ( -0.494 -2.424 1.786) 3.052 13.184 ( 1.522 -1.160 -5.221) 5.561 13.190 ( -2.988 -1.852 -4.827) 5.972 15.260 ( 1.052 25.615 23.743) 34.942 15.430 ( 6.607 32.935 18.743) 38.467 15.837 ( -2.209 -0.928 5.487) 5.987 15.985 ( -1.320 4.821 -0.493) 5.023 16.188 ( -14.885 11.355 -0.762) 18.738 16.314 ( 8.809 10.899 0.460) 14.021 18.249 ( -2.778 -28.883 -17.855) 34.070 18.283 ( 6.087 -27.902 -17.727) 33.613 21.429 ( -1.455 -0.657 1.410) 2.130 21.439 ( 1.558 -0.993 0.875) 2.044 ======================= Grid point 225 (117/160) ======================= q-point: (-0.40 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -4.542 5.413 0.822) 7.114 1.895 ( 4.531 -1.791 -0.518) 4.899 1.952 ( -7.571 6.770 -0.537) 10.170 2.042 ( -0.677 -0.055 -0.020) 0.679 2.091 ( -0.505 -2.863 1.139) 3.122 2.176 ( -0.273 -3.981 -1.616) 4.305 2.309 ( 0.589 1.739 0.803) 2.004 2.333 ( -1.513 1.096 -1.097) 2.166 2.366 ( 1.203 -1.154 0.758) 1.831 2.437 ( 5.058 -1.950 -1.779) 5.706 2.689 ( -0.675 5.266 1.115) 5.425 2.763 ( 3.138 7.996 5.112) 9.996 3.119 ( 1.938 -2.737 -4.157) 5.341 3.151 ( -0.958 -1.243 -11.515) 11.622 3.212 ( -0.856 -1.729 0.786) 2.084 3.461 ( 0.888 1.299 -1.257) 2.014 3.664 ( 8.832 -8.244 -0.484) 12.091 3.723 ( 4.657 -2.353 -1.226) 5.360 3.935 ( -0.932 4.489 2.674) 5.308 4.053 ( 4.942 -0.775 2.026) 5.397 4.748 ( -14.277 18.774 4.548) 24.020 4.812 ( -15.007 17.513 2.117) 23.160 5.955 ( 4.839 7.393 1.847) 9.027 6.004 ( -6.886 6.930 -2.398) 10.059 6.090 ( 4.418 -0.829 -0.665) 4.544 6.308 ( 0.732 -6.827 1.136) 6.959 6.378 ( 10.216 -2.630 2.439) 10.827 6.545 ( 6.405 -0.413 6.292) 8.987 6.663 ( 3.399 -1.546 -10.556) 11.197 6.723 ( 4.166 -5.211 -9.795) 11.852 7.000 ( -2.575 1.402 2.024) 3.563 7.204 ( 6.534 -6.197 0.297) 9.011 7.631 ( -4.508 3.459 -2.028) 6.033 7.711 ( 0.323 1.811 -1.420) 2.324 7.942 ( -4.756 2.210 -1.539) 5.465 8.009 ( -3.643 -0.456 0.811) 3.760 8.296 ( -3.375 1.211 2.035) 4.123 8.320 ( 1.023 1.742 3.725) 4.237 8.512 ( -3.624 -3.551 -1.688) 5.347 8.611 ( 3.323 -0.114 2.700) 4.283 8.659 ( -2.000 -0.217 -0.810) 2.169 8.842 ( 6.822 5.953 2.011) 9.275 8.992 ( 2.176 -9.448 -0.053) 9.695 9.111 ( 6.496 -6.151 1.184) 9.024 10.642 ( -3.781 -1.812 0.217) 4.199 10.681 ( -2.033 -4.762 -0.409) 5.194 10.957 ( -6.170 1.181 0.910) 6.348 10.973 ( -4.841 0.959 1.409) 5.133 13.117 ( -0.767 0.303 -1.886) 2.059 13.199 ( 4.354 -3.406 -0.668) 5.568 15.276 ( -18.556 28.893 5.447) 34.768 15.492 ( -23.368 39.577 4.543) 46.185 15.881 ( -4.051 -2.005 7.336) 8.617 15.955 ( -0.033 2.806 2.253) 3.598 16.029 ( -0.186 -1.002 3.445) 3.592 16.379 ( -2.849 4.572 1.258) 5.532 18.158 ( 13.323 -21.534 -10.801) 27.529 18.345 ( 19.902 -25.412 -9.879) 33.756 21.417 ( -1.345 0.365 0.538) 1.493 21.473 ( 1.684 -2.014 0.369) 2.652 ======================= Grid point 226 (118/160) ======================= q-point: (-0.30 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( -5.643 8.647 4.128) 11.120 1.801 ( -8.760 10.621 1.537) 13.853 1.989 ( 2.205 -2.692 1.051) 3.635 2.027 ( -1.696 -0.749 0.394) 1.895 2.132 ( -3.568 -2.030 2.695) 4.910 2.153 ( 5.318 -3.173 2.382) 6.635 2.298 ( -0.671 1.861 -1.595) 2.542 2.367 ( 4.503 0.105 -1.417) 4.722 2.402 ( 2.497 -3.499 -0.063) 4.299 2.478 ( 1.850 -3.396 -0.655) 3.922 2.671 ( 3.622 2.822 -5.436) 7.116 2.757 ( -2.247 4.129 -1.954) 5.091 3.100 ( 0.015 -0.474 2.067) 2.121 3.161 ( 0.747 -3.438 6.253) 7.175 3.309 ( 8.911 7.282 0.337) 11.513 3.477 ( 3.610 7.947 -0.774) 8.763 3.743 ( 0.930 3.659 -1.664) 4.126 3.806 ( 7.654 -6.901 -1.570) 10.424 3.962 ( 0.130 3.581 0.582) 3.630 4.148 ( 3.936 -3.497 0.231) 5.270 4.530 ( -16.105 13.621 2.872) 21.288 4.564 ( -16.722 13.000 3.603) 21.485 5.828 ( -4.371 3.871 -6.866) 9.013 5.931 ( -3.027 -1.799 -5.109) 6.205 6.221 ( 10.090 7.017 0.574) 12.303 6.406 ( 6.557 -4.289 1.033) 7.903 6.497 ( 4.219 -2.834 -5.669) 7.614 6.673 ( 8.076 -3.605 4.573) 9.956 6.735 ( 5.215 2.869 4.735) 7.606 6.758 ( 6.936 -2.459 -2.537) 7.784 6.983 ( -0.420 3.448 0.107) 3.475 7.304 ( 5.882 -5.100 -1.720) 7.973 7.540 ( -4.936 2.355 -0.699) 5.514 7.664 ( -3.242 -0.263 -2.503) 4.104 7.838 ( -5.735 3.111 -1.418) 6.676 8.000 ( -2.014 -4.719 7.335) 8.951 8.203 ( -9.088 -0.573 1.495) 9.228 8.335 ( -8.637 -4.690 -3.443) 10.414 8.434 ( 6.310 7.280 -1.404) 9.736 8.646 ( 1.551 6.395 0.759) 6.624 8.766 ( 8.917 -6.840 2.306) 11.473 8.946 ( 5.401 3.534 -0.213) 6.458 9.083 ( 6.196 -7.334 0.733) 9.628 9.256 ( 7.621 -5.514 3.766) 10.133 10.540 ( -7.938 0.055 -0.162) 7.940 10.621 ( -6.728 -2.126 0.469) 7.072 10.817 ( -8.987 2.051 -1.365) 9.319 10.876 ( -6.939 -1.491 -0.910) 7.156 13.127 ( 1.993 2.135 1.821) 3.442 13.300 ( 6.568 -5.508 2.261) 8.865 14.912 ( -24.360 21.454 -4.189) 32.730 14.956 ( -34.997 24.007 -5.179) 42.755 15.858 ( -3.012 -0.380 -0.276) 3.048 15.985 ( -3.591 3.943 2.086) 5.727 16.085 ( 3.571 -6.754 -2.649) 8.086 16.265 ( -12.016 -3.347 2.115) 12.652 18.405 ( 20.783 -3.194 2.408) 21.164 18.666 ( 24.377 -14.454 1.014) 28.358 21.401 ( -0.919 0.997 -0.052) 1.357 21.499 ( 1.484 -3.126 -0.568) 3.507 ======================= Grid point 227 (119/160) ======================= q-point: (-0.20 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -7.213 10.444 4.545) 13.481 1.699 ( -7.741 13.463 2.945) 15.806 1.982 ( -3.631 4.158 -0.514) 5.544 1.991 ( -3.578 -4.148 2.824) 6.163 2.139 ( -0.503 1.088 3.669) 3.860 2.240 ( 0.621 -2.174 -4.409) 4.955 2.299 ( 5.885 -2.013 -1.216) 6.337 2.386 ( 2.195 -1.745 -5.888) 6.522 2.410 ( 2.017 -3.968 0.321) 4.462 2.495 ( -1.208 -2.126 0.001) 2.445 2.714 ( 7.424 2.104 -3.261) 8.378 2.780 ( 5.931 0.113 -0.997) 6.015 3.131 ( -2.125 2.779 7.815) 8.562 3.274 ( 0.404 -3.387 11.157) 11.667 3.451 ( 7.475 9.676 0.678) 12.246 3.560 ( 6.199 9.994 0.399) 11.767 3.725 ( -1.100 6.010 -0.193) 6.113 3.847 ( 0.832 -0.144 -2.431) 2.573 3.938 ( -2.124 5.018 -0.821) 5.511 4.156 ( -1.166 -0.490 -3.356) 3.587 4.325 ( -12.345 7.581 2.756) 14.746 4.403 ( -8.515 3.531 2.811) 9.637 5.749 ( 2.422 1.325 -4.194) 5.022 5.831 ( -0.374 -2.272 -6.129) 6.547 6.357 ( 7.890 2.943 -2.299) 8.730 6.499 ( 4.939 -3.819 -0.530) 6.265 6.569 ( 7.222 3.013 3.141) 8.433 6.802 ( 1.577 3.572 1.953) 4.366 6.817 ( 3.036 -3.301 -2.456) 5.114 6.891 ( 5.005 1.750 5.714) 7.795 7.030 ( 6.441 2.325 0.841) 6.900 7.328 ( 0.014 -0.884 -2.468) 2.622 7.426 ( -7.596 -1.176 -1.967) 7.934 7.592 ( 0.361 -3.213 -5.008) 5.961 7.737 ( -5.123 6.633 -0.036) 8.381 8.062 ( -6.177 -6.251 2.660) 9.182 8.091 ( -3.535 -4.524 5.120) 7.692 8.129 ( -8.895 -4.183 -2.472) 10.136 8.520 ( 5.531 6.914 -2.422) 9.180 8.726 ( 6.559 6.200 2.192) 9.288 8.908 ( 6.370 -6.988 -1.878) 9.640 9.071 ( 9.163 5.538 3.042) 11.130 9.162 ( 3.072 -7.369 -0.372) 7.993 9.402 ( 5.506 -6.456 0.585) 8.505 10.386 ( -13.796 2.339 -0.236) 13.995 10.453 ( -12.444 2.330 2.807) 12.968 10.664 ( -7.230 3.074 -0.173) 7.858 10.799 ( 0.115 -4.593 -0.966) 4.695 13.214 ( 3.902 3.299 4.252) 6.647 13.448 ( 7.197 -5.192 3.014) 9.372 14.320 ( -32.156 15.921 -7.143) 36.585 14.453 ( -21.387 6.318 -9.647) 24.298 15.787 ( -2.559 0.933 -3.691) 4.587 15.893 ( -6.648 0.493 -1.518) 6.837 16.028 ( -5.343 -9.417 -5.478) 12.134 16.103 ( -5.333 -4.856 -3.327) 7.943 18.815 ( 17.617 9.778 11.780) 23.339 19.107 ( 21.592 -5.485 7.976) 23.662 21.390 ( -0.237 0.922 -0.093) 0.956 21.508 ( 1.114 -3.938 -1.505) 4.360 ======================= Grid point 228 (120/160) ======================= q-point: (-0.10 0.38 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( -7.502 13.179 2.519) 15.372 1.606 ( -6.089 11.824 3.680) 13.799 1.910 ( -3.711 4.868 -1.590) 6.324 1.971 ( -3.309 -0.519 3.920) 5.156 2.114 ( -3.161 -0.235 -9.405) 9.925 2.164 ( -1.321 -0.814 -0.456) 1.617 2.353 ( 3.326 -5.522 -4.653) 7.950 2.383 ( 4.079 -0.391 -2.889) 5.014 2.417 ( -1.247 -2.530 -1.934) 3.420 2.509 ( 3.900 -4.283 1.322) 5.942 2.750 ( 3.129 1.598 -5.347) 6.398 2.845 ( 1.651 -0.703 -0.149) 1.801 3.274 ( 3.278 4.614 14.603) 15.662 3.421 ( 2.520 0.666 8.851) 9.227 3.573 ( 5.395 8.321 2.522) 10.233 3.659 ( 2.676 6.774 2.747) 7.784 3.732 ( 0.183 5.131 2.800) 5.848 3.829 ( -0.530 4.308 0.083) 4.341 3.900 ( -0.980 6.486 -0.055) 6.560 4.056 ( -4.070 3.750 -3.602) 6.603 4.197 ( -6.116 4.215 0.376) 7.437 4.303 ( -5.629 -0.518 -1.154) 5.769 5.778 ( 2.376 -0.949 -4.918) 5.544 5.779 ( 3.468 -1.462 -2.022) 4.272 6.477 ( 8.051 2.360 1.373) 8.502 6.577 ( 3.152 -0.905 1.424) 3.575 6.709 ( 0.043 6.040 4.624) 7.607 6.779 ( 0.058 0.453 -3.322) 3.354 6.826 ( 1.461 2.794 -0.974) 3.299 7.004 ( 4.119 1.244 0.573) 4.341 7.153 ( 4.377 -2.701 1.285) 5.301 7.267 ( -5.313 -2.458 -3.446) 6.793 7.299 ( -0.476 3.312 -0.585) 3.397 7.545 ( 1.123 -6.605 -5.172) 8.464 7.680 ( -2.640 8.506 1.163) 8.982 7.919 ( -7.363 -3.874 -3.395) 8.986 7.990 ( -3.732 -2.996 -0.116) 4.787 8.140 ( -1.877 -7.733 2.532) 8.351 8.586 ( 3.617 4.631 1.859) 6.164 8.854 ( 5.854 1.650 0.563) 6.108 8.956 ( 0.691 -3.160 -0.396) 3.259 9.133 ( -0.983 -1.654 -4.707) 5.085 9.298 ( 10.513 -0.387 2.938) 10.923 9.475 ( 7.095 -4.784 -0.796) 8.594 10.094 ( -18.265 2.911 -0.891) 18.517 10.268 ( -13.167 -2.659 -0.056) 13.433 10.673 ( 2.159 7.593 7.300) 10.752 10.831 ( 2.567 -1.521 1.249) 3.235 13.329 ( 3.449 4.119 3.561) 6.445 13.580 ( 4.460 0.417 2.226) 5.002 13.804 ( -21.228 9.818 -3.894) 23.710 14.040 ( -11.478 -9.259 -13.161) 19.766 15.699 ( -1.324 2.212 -5.384) 5.970 15.783 ( -4.150 -1.986 -0.797) 4.669 15.868 ( -8.097 -5.890 -0.488) 10.024 15.975 ( -0.443 -7.350 -11.438) 13.603 19.204 ( 10.086 14.840 14.981) 23.375 19.490 ( 12.466 -0.588 7.921) 14.781 21.391 ( 0.215 0.231 0.332) 0.458 21.501 ( 0.646 -4.178 -2.192) 4.762 ======================= Grid point 229 (121/160) ======================= q-point: ( 0.00 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.665 ( -3.240 -4.619 0.039) 5.642 1.665 ( -3.240 4.619 0.039) 5.642 1.874 ( -0.468 -3.482 -3.622) 5.046 1.874 ( -0.468 3.482 -3.622) 5.046 2.084 ( -1.789 -3.915 -2.092) 4.786 2.084 ( -1.789 3.915 -2.092) 4.786 2.263 ( 1.946 -1.219 -4.609) 5.149 2.263 ( 1.946 1.219 -4.609) 5.149 2.513 ( 1.341 -3.310 3.984) 5.350 2.513 ( 1.341 3.310 3.984) 5.350 2.765 ( -0.517 -3.389 -4.552) 5.699 2.765 ( -0.517 3.389 -4.552) 5.699 3.557 ( 2.580 -3.365 10.421) 11.251 3.557 ( 2.580 3.365 10.421) 11.251 3.740 ( -1.063 -1.088 -1.156) 1.910 3.740 ( -1.063 1.088 -1.156) 1.910 3.866 ( 1.116 -2.352 2.617) 3.692 3.866 ( 1.116 2.352 2.617) 3.692 4.022 ( -0.146 -2.185 2.420) 3.264 4.022 ( -0.146 2.185 2.420) 3.264 4.205 ( -2.283 -1.932 -0.483) 3.029 4.205 ( -2.283 1.932 -0.483) 3.029 5.764 ( 1.086 -1.004 -2.106) 2.573 5.764 ( 1.086 1.004 -2.106) 2.573 6.621 ( 0.594 -2.194 0.750) 2.394 6.621 ( 0.594 2.194 0.750) 2.394 6.742 ( -3.033 -1.359 -0.556) 3.369 6.742 ( -3.033 1.359 -0.556) 3.369 6.962 ( 0.429 -4.122 1.936) 4.574 6.962 ( 0.429 4.122 1.936) 4.574 7.173 ( 4.163 -2.840 -6.579) 8.287 7.173 ( 4.163 2.840 -6.579) 8.287 7.406 ( 1.686 -3.671 0.230) 4.046 7.406 ( 1.686 3.671 0.230) 4.046 7.757 ( -2.473 -1.522 -0.409) 2.932 7.757 ( -2.473 1.522 -0.409) 2.932 7.998 ( 0.044 -5.430 1.712) 5.694 7.998 ( 0.044 5.430 1.712) 5.694 8.787 ( -0.229 -7.981 2.805) 8.463 8.787 ( -0.229 7.981 2.805) 8.463 8.960 ( -1.799 -2.575 -3.414) 4.639 8.960 ( -1.799 2.575 -3.414) 4.639 9.506 ( 2.335 -4.661 -0.570) 5.244 9.506 ( 2.335 4.661 -0.570) 5.244 9.979 ( -3.385 -6.640 -0.818) 7.498 9.979 ( -3.385 6.640 -0.818) 7.498 10.896 ( 1.059 -1.679 5.157) 5.526 10.896 ( 1.059 1.679 5.157) 5.526 13.481 ( -3.351 -8.246 -5.414) 10.418 13.481 ( -3.351 8.246 -5.414) 10.418 13.730 ( 2.759 -1.627 0.809) 3.303 13.730 ( 2.759 1.627 0.809) 3.303 15.682 ( 1.332 -3.809 -5.926) 7.170 15.682 ( 1.332 3.809 -5.926) 7.170 15.752 ( -1.333 -1.136 -1.308) 2.186 15.752 ( -1.333 1.136 -1.308) 2.186 19.653 ( 0.605 -4.672 8.473) 9.695 19.653 ( 0.605 4.672 8.473) 9.695 21.415 ( 0.069 -2.084 -0.919) 2.278 21.415 ( 0.069 2.084 -0.919) 2.278 ======================= Grid point 231 (122/160) ======================= q-point: ( 0.10 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 3.790 -1.848 4.971) 6.518 1.693 ( 3.790 1.848 4.971) 6.518 1.852 ( 3.889 -5.390 -4.337) 7.936 1.852 ( 3.889 5.390 -4.337) 7.936 2.069 ( -0.408 -1.891 2.178) 2.914 2.069 ( -0.408 1.891 2.178) 2.914 2.254 ( 2.532 -1.720 -3.391) 4.568 2.254 ( 2.532 1.720 -3.391) 4.568 2.535 ( -3.010 -1.774 1.498) 3.802 2.535 ( -3.010 1.774 1.498) 3.802 2.693 ( -2.484 -1.702 -2.868) 4.159 2.693 ( -2.484 1.702 -2.868) 4.159 3.647 ( -0.020 -4.423 0.760) 4.487 3.647 ( -0.020 4.423 0.760) 4.487 3.724 ( -0.886 -1.946 1.007) 2.363 3.724 ( -0.886 1.946 1.007) 2.363 3.883 ( -1.911 -1.626 1.258) 2.806 3.883 ( -1.911 1.626 1.258) 2.806 4.004 ( -4.895 -2.356 0.689) 5.476 4.004 ( -4.895 2.356 0.689) 5.476 4.248 ( 6.928 -2.426 2.241) 7.675 4.248 ( 6.928 2.426 2.241) 7.675 5.742 ( -0.963 -0.648 -2.336) 2.609 5.742 ( -0.963 0.648 -2.336) 2.609 6.592 ( -5.252 -6.171 0.102) 8.104 6.592 ( -5.252 6.171 0.102) 8.104 6.664 ( -4.787 -2.198 3.247) 6.188 6.664 ( -4.787 2.198 3.247) 6.188 7.009 ( 1.631 -3.528 -3.300) 5.099 7.009 ( 1.631 3.528 -3.300) 5.099 7.174 ( 4.857 -2.654 -2.480) 6.065 7.174 ( 4.857 2.654 -2.480) 6.065 7.417 ( 0.382 -1.919 -1.876) 2.711 7.417 ( 0.382 1.919 -1.876) 2.711 7.775 ( 3.508 -2.573 1.932) 4.760 7.775 ( 3.508 2.573 1.932) 4.760 8.044 ( 4.238 -2.233 0.443) 4.811 8.044 ( 4.238 2.233 0.443) 4.811 8.722 ( -8.189 -4.157 0.969) 9.235 8.722 ( -8.189 4.157 0.969) 9.235 8.983 ( 4.232 -3.968 0.479) 5.822 8.983 ( 4.232 3.968 0.479) 5.822 9.377 ( -12.895 -4.092 -0.988) 13.565 9.377 ( -12.895 4.092 -0.988) 13.565 10.092 ( 12.872 -2.854 1.253) 13.244 10.092 ( 12.872 2.854 1.253) 13.244 10.916 ( -3.058 -0.452 1.069) 3.271 10.916 ( -3.058 0.452 1.069) 3.271 13.409 ( -1.243 -2.718 1.193) 3.218 13.409 ( -1.243 2.718 1.193) 3.218 13.873 ( 14.712 -1.721 -3.219) 15.158 13.873 ( 14.712 1.721 -3.219) 15.158 15.644 ( 2.289 -3.377 -4.146) 5.817 15.644 ( 2.289 3.377 -4.146) 5.817 15.793 ( 5.602 -2.066 1.246) 6.099 15.793 ( 5.602 2.066 1.246) 6.099 19.636 ( -11.092 -1.890 3.506) 11.786 19.636 ( -11.092 1.890 3.506) 11.786 21.405 ( -0.250 -1.007 -0.533) 1.166 21.405 ( -0.250 1.007 -0.533) 1.166 ======================= Grid point 233 (123/160) ======================= q-point: ( 0.20 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( 5.301 -1.532 3.512) 6.541 1.845 ( 5.301 1.532 3.512) 6.541 1.923 ( 7.896 -4.365 0.953) 9.073 1.923 ( 7.896 4.365 0.953) 9.073 2.107 ( 0.748 -3.064 3.494) 4.707 2.107 ( 0.748 3.064 3.494) 4.707 2.268 ( 2.822 -0.983 -1.483) 3.336 2.268 ( 2.822 0.983 -1.483) 3.336 2.456 ( -4.424 -1.574 -3.034) 5.591 2.456 ( -4.424 1.574 -3.034) 5.591 2.628 ( -4.203 -1.991 0.475) 4.675 2.628 ( -4.203 1.991 0.475) 4.675 3.603 ( -2.704 -4.422 -3.286) 6.137 3.603 ( -2.704 4.422 -3.286) 6.137 3.683 ( -5.426 -2.105 -0.736) 5.866 3.683 ( -5.426 2.105 -0.736) 5.866 3.825 ( -3.607 -4.472 -2.478) 6.257 3.825 ( -3.607 4.472 -2.478) 6.257 3.962 ( -1.381 -1.457 2.957) 3.574 3.962 ( -1.381 1.457 2.957) 3.574 4.436 ( 11.535 -4.054 2.559) 12.491 4.436 ( 11.535 4.054 2.559) 12.491 5.688 ( -1.992 -1.551 -1.438) 2.906 5.688 ( -1.992 1.551 -1.438) 2.906 6.456 ( -6.787 -1.347 -2.882) 7.496 6.456 ( -6.787 1.347 -2.882) 7.496 6.682 ( -4.173 -3.846 5.525) 7.920 6.682 ( -4.173 3.846 5.525) 7.920 6.942 ( -1.524 -1.979 -2.852) 3.791 6.942 ( -1.524 1.979 -2.852) 3.791 7.203 ( -0.807 -3.765 -3.883) 5.468 7.203 ( -0.807 3.765 -3.883) 5.468 7.443 ( 7.567 -3.808 -1.178) 8.552 7.443 ( 7.567 3.808 -1.178) 8.552 7.887 ( 5.032 -1.070 3.997) 6.515 7.887 ( 5.032 1.070 3.997) 6.515 8.136 ( 7.697 -3.081 -2.181) 8.573 8.136 ( 7.697 3.081 -2.181) 8.573 8.605 ( -7.729 -1.474 2.053) 8.132 8.605 ( -7.729 1.474 2.053) 8.132 8.983 ( -7.484 -9.089 -0.330) 11.778 8.983 ( -7.484 9.089 -0.330) 11.778 9.207 ( -5.238 -7.129 1.675) 9.004 9.207 ( -5.238 7.129 1.675) 9.004 10.340 ( 13.959 -2.764 2.403) 14.431 10.340 ( 13.959 2.764 2.403) 14.431 10.839 ( -4.493 -0.482 -2.118) 4.991 10.839 ( -4.493 0.482 -2.118) 4.991 13.418 ( -0.569 -0.278 0.274) 0.691 13.418 ( -0.569 0.278 0.274) 0.691 14.155 ( 21.192 -1.777 2.604) 21.425 14.155 ( 21.192 1.777 2.604) 21.425 15.677 ( 5.312 -3.623 -0.926) 6.496 15.677 ( 5.312 3.623 -0.926) 6.496 15.941 ( 9.717 -4.260 1.901) 10.778 15.941 ( 9.717 4.260 1.901) 10.778 19.380 ( -20.160 -2.027 -3.331) 20.533 19.380 ( -20.160 2.027 -3.331) 20.533 21.397 ( -0.436 -0.573 0.179) 0.742 21.397 ( -0.436 0.573 0.179) 0.742 ======================= Grid point 235 (124/160) ======================= q-point: ( 0.30 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 5.366 -1.871 -2.010) 6.028 1.938 ( 5.366 1.871 -2.010) 6.028 2.035 ( 2.340 -3.360 1.359) 4.314 2.035 ( 2.340 3.360 1.359) 4.314 2.175 ( 2.742 -2.755 2.187) 4.460 2.175 ( 2.742 2.755 2.187) 4.460 2.302 ( -1.048 -4.084 1.386) 4.438 2.302 ( -1.048 4.084 1.386) 4.438 2.370 ( 0.908 -6.121 -3.005) 6.879 2.370 ( 0.908 6.121 -3.005) 6.879 2.562 ( -4.173 -2.851 1.066) 5.165 2.562 ( -4.173 2.851 1.066) 5.165 3.510 ( -4.393 -5.038 -4.266) 7.930 3.510 ( -4.393 5.038 -4.266) 7.930 3.540 ( -8.067 -4.994 -0.669) 9.512 3.540 ( -8.067 4.994 -0.669) 9.512 3.742 ( -1.811 -4.998 -5.322) 7.522 3.742 ( -1.811 4.998 -5.322) 7.522 3.994 ( -0.347 -2.408 3.452) 4.223 3.994 ( -0.347 2.408 3.452) 4.223 4.661 ( 11.961 -4.117 3.108) 13.026 4.661 ( 11.961 4.117 3.108) 13.026 5.688 ( 2.377 -3.956 2.516) 5.256 5.688 ( 2.377 3.956 2.516) 5.256 6.333 ( -3.913 -1.994 -3.091) 5.371 6.333 ( -3.913 1.994 -3.091) 5.371 6.576 ( -8.979 -6.358 -3.937) 11.686 6.576 ( -8.979 6.358 -3.937) 11.686 6.939 ( -2.452 -6.709 5.516) 9.025 6.939 ( -2.452 6.709 5.516) 9.025 7.100 ( -2.481 -3.240 -6.602) 7.762 7.100 ( -2.481 3.240 -6.602) 7.762 7.594 ( 10.734 -2.531 -1.022) 11.076 7.594 ( 10.734 2.531 -1.022) 11.076 8.001 ( 3.321 -6.291 2.364) 7.497 8.001 ( 3.321 6.291 2.364) 7.497 8.230 ( 7.466 -2.564 -2.375) 8.244 8.230 ( 7.466 2.564 -2.375) 8.244 8.520 ( -7.319 -6.232 3.520) 10.237 8.520 ( -7.319 6.232 3.520) 10.237 8.821 ( -8.002 -10.912 -0.403) 13.538 8.821 ( -8.002 10.912 -0.403) 13.538 9.165 ( -5.098 -6.816 1.247) 8.603 9.165 ( -5.098 6.816 1.247) 8.603 10.570 ( 9.408 -3.041 1.727) 10.037 10.570 ( 9.408 3.041 1.727) 10.037 10.772 ( -0.045 -0.238 0.067) 0.251 10.772 ( -0.045 0.238 0.067) 0.251 13.370 ( -1.553 -0.795 -5.328) 5.607 13.370 ( -1.553 0.795 -5.328) 5.607 14.615 ( 20.607 -5.548 16.399) 26.914 14.615 ( 20.607 5.548 16.399) 26.914 15.785 ( 8.751 -6.488 -1.071) 10.946 15.785 ( 8.751 6.488 -1.071) 10.946 16.138 ( 10.931 -6.799 2.526) 13.118 16.138 ( 10.931 6.799 2.526) 13.118 18.921 ( -24.824 -3.122 -11.420) 27.503 18.921 ( -24.824 3.122 -11.420) 27.503 21.397 ( -0.324 -0.863 1.018) 1.373 21.397 ( -0.324 0.863 1.018) 1.373 ======================= Grid point 237 (125/160) ======================= q-point: ( 0.40 -0.50 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.949 ( -0.185 -4.471 -3.929) 5.955 1.949 ( -0.185 4.471 -3.929) 5.955 2.063 ( 0.715 -1.729 -0.626) 1.973 2.063 ( 0.715 1.729 -0.626) 1.973 2.188 ( 1.921 -4.426 -5.673) 7.447 2.188 ( 1.921 4.426 -5.673) 7.447 2.285 ( -1.141 -1.161 2.943) 3.363 2.285 ( -1.141 1.161 2.943) 3.363 2.397 ( 0.814 -1.454 -0.060) 1.667 2.397 ( 0.814 1.454 -0.060) 1.667 2.570 ( 1.980 -5.594 5.035) 7.782 2.570 ( 1.980 5.594 5.035) 7.782 3.330 ( -9.080 -6.551 -2.797) 11.540 3.330 ( -9.080 6.551 -2.797) 11.540 3.475 ( 0.602 -2.794 -5.421) 6.128 3.475 ( 0.602 2.794 -5.421) 6.128 3.623 ( -4.020 -2.617 -5.588) 7.364 3.623 ( -4.020 2.617 -5.588) 7.364 4.009 ( -1.589 -2.243 1.913) 3.349 4.009 ( -1.589 2.243 1.913) 3.349 4.902 ( 9.866 -2.814 7.297) 12.590 4.902 ( 9.866 2.814 7.297) 12.590 5.831 ( 7.819 -5.430 6.497) 11.525 5.831 ( 7.819 5.430 6.497) 11.525 6.244 ( -4.506 -6.526 -2.504) 8.316 6.244 ( -4.506 6.526 -2.504) 8.316 6.363 ( -7.030 -4.893 -6.007) 10.462 6.363 ( -7.030 4.893 -6.007) 10.462 6.931 ( -4.485 -5.196 -1.383) 7.002 6.931 ( -4.485 5.196 -1.383) 7.002 7.007 ( 0.165 -1.357 -2.622) 2.957 7.007 ( 0.165 1.357 -2.622) 2.957 7.729 ( 7.649 -1.927 -3.105) 8.477 7.729 ( 7.649 1.927 -3.105) 8.477 8.038 ( 1.682 -6.229 -0.845) 6.507 8.038 ( 1.682 6.229 -0.845) 6.507 8.344 ( 3.667 -3.615 4.644) 6.934 8.344 ( 3.667 3.615 4.644) 6.934 8.416 ( -6.980 -4.498 0.170) 8.306 8.416 ( -6.980 4.498 0.170) 8.306 8.772 ( 1.128 -9.272 0.994) 9.393 8.772 ( 1.128 9.272 0.994) 9.393 9.047 ( -8.723 -6.351 -1.156) 10.852 9.047 ( -8.723 6.351 -1.156) 10.852 10.642 ( 1.726 -1.681 -1.173) 2.679 10.642 ( 1.726 1.681 -1.173) 2.679 10.875 ( 5.210 -1.725 5.532) 7.792 10.875 ( 5.210 1.725 5.532) 7.792 13.265 ( -1.722 -0.995 -7.110) 7.383 13.265 ( -1.722 0.995 -7.110) 7.383 15.155 ( 12.635 -7.426 27.756) 31.388 15.155 ( 12.635 7.426 27.756) 31.388 15.913 ( 9.070 -8.972 -2.800) 13.061 15.913 ( 9.070 8.972 -2.800) 13.061 16.336 ( 8.653 -5.903 2.628) 10.799 16.336 ( 8.653 5.903 2.628) 10.799 18.352 ( -20.891 -2.682 -19.637) 28.797 18.352 ( -20.891 2.682 -19.637) 28.797 21.409 ( -0.088 -0.602 1.472) 1.593 21.409 ( -0.088 0.602 1.472) 1.593 ======================= Grid point 239 (126/160) ======================= q-point: (-0.50 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.864 ( -2.547 -3.358 -3.813) 5.683 1.864 ( -2.547 3.358 -3.813) 5.683 2.063 ( 1.071 -0.604 -1.185) 1.708 2.063 ( 1.071 0.604 -1.185) 1.708 2.144 ( -1.165 -2.811 -3.565) 4.687 2.144 ( -1.165 2.811 -3.565) 4.687 2.326 ( 2.503 -1.758 1.070) 3.241 2.326 ( 2.503 1.758 1.070) 3.241 2.376 ( -1.950 -0.420 -0.561) 2.073 2.376 ( -1.950 0.420 -0.561) 2.073 2.711 ( 2.762 -4.107 9.590) 10.792 2.711 ( 2.762 4.107 9.590) 10.792 3.192 ( -3.557 -4.727 -3.251) 6.750 3.192 ( -3.557 4.727 -3.251) 6.750 3.350 ( 1.834 -2.760 -15.862) 16.204 3.350 ( 1.834 2.760 -15.862) 16.204 3.575 ( 0.297 -1.050 2.177) 2.435 3.575 ( 0.297 1.050 2.177) 2.435 4.002 ( -1.188 -1.218 1.527) 2.286 4.002 ( -1.188 1.218 1.527) 2.286 5.089 ( -1.147 -2.846 8.205) 8.760 5.089 ( -1.147 2.846 8.205) 8.760 6.005 ( -0.013 -5.758 5.030) 7.646 6.005 ( -0.013 5.758 5.030) 7.646 6.139 ( 0.933 -9.337 -0.681) 9.408 6.139 ( 0.933 9.337 -0.681) 9.408 6.304 ( 4.187 -4.591 -1.220) 6.333 6.304 ( 4.187 4.591 -1.220) 6.333 6.780 ( -2.346 -3.430 -11.775) 12.487 6.780 ( -2.346 3.430 -11.775) 12.487 7.028 ( 1.091 -1.519 2.014) 2.749 7.028 ( 1.091 1.519 2.014) 2.749 7.753 ( 0.880 -0.252 -3.753) 3.864 7.753 ( 0.880 0.252 -3.753) 3.864 8.059 ( -0.110 -0.434 -0.789) 0.907 8.059 ( -0.110 0.434 -0.789) 0.907 8.299 ( -4.229 -1.077 3.089) 5.347 8.299 ( -4.229 1.077 3.089) 5.347 8.474 ( 3.000 -2.838 2.575) 4.867 8.474 ( 3.000 2.838 2.575) 4.867 8.831 ( 3.195 -6.417 -0.722) 7.205 8.831 ( 3.195 6.417 -0.722) 7.205 8.901 ( -4.929 -5.605 -0.165) 7.466 8.901 ( -4.929 5.605 -0.165) 7.466 10.647 ( -0.248 -1.242 0.003) 1.267 10.647 ( -0.248 1.242 0.003) 1.267 10.985 ( 0.518 -0.911 4.237) 4.365 10.985 ( 0.518 0.911 4.237) 4.365 13.172 ( -0.562 -0.072 -5.052) 5.084 13.172 ( -0.562 0.072 -5.052) 5.084 15.605 ( 0.834 -8.743 27.994) 29.339 15.605 ( 0.834 8.743 27.994) 29.339 15.999 ( 3.906 -6.710 -1.221) 7.859 15.999 ( 3.906 6.710 -1.221) 7.859 16.410 ( -6.798 -6.074 3.011) 9.601 16.410 ( -6.798 6.074 3.011) 9.601 17.907 ( 2.553 -2.133 -24.110) 24.338 17.907 ( 2.553 2.133 -24.110) 24.338 21.425 ( 0.055 -0.273 1.241) 1.272 21.425 ( 0.055 0.273 1.241) 1.272 ======================= Grid point 241 (127/160) ======================= q-point: (-0.40 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.830 ( 0.438 -4.165 0.561) 4.226 1.830 ( 0.438 4.165 0.561) 4.226 2.054 ( -1.089 -1.205 0.043) 1.625 2.054 ( -1.089 1.205 0.043) 1.625 2.081 ( -2.498 -5.168 -1.364) 5.899 2.081 ( -2.498 5.168 -1.364) 5.899 2.331 ( -0.549 -0.758 -0.417) 1.025 2.331 ( -0.549 0.758 -0.417) 1.025 2.385 ( 1.932 -2.551 -0.102) 3.202 2.385 ( 1.932 2.551 -0.102) 3.202 2.803 ( -4.151 -3.930 5.673) 8.053 2.803 ( -4.151 3.930 5.673) 8.053 3.093 ( 1.390 -1.073 -7.833) 8.027 3.093 ( 1.390 1.073 -7.833) 8.027 3.346 ( 11.055 -10.544 -3.279) 15.625 3.346 ( 11.055 10.544 -3.279) 15.625 3.634 ( 4.517 -4.591 0.465) 6.457 3.634 ( 4.517 4.591 0.465) 6.457 4.015 ( 0.270 -2.976 1.906) 3.544 4.015 ( 0.270 2.976 1.906) 3.544 4.997 ( -17.062 -2.278 3.646) 17.595 4.997 ( -17.062 2.278 3.646) 17.595 5.985 ( -5.162 -1.303 1.550) 5.545 5.985 ( -5.162 1.303 1.550) 5.545 6.248 ( 11.172 -4.323 -0.004) 11.979 6.248 ( 11.172 4.323 -0.004) 11.979 6.400 ( 3.169 -9.525 -0.321) 10.043 6.400 ( 3.169 9.525 -0.321) 10.043 6.666 ( 5.485 -1.116 -7.067) 9.015 6.666 ( 5.485 1.116 -7.067) 9.015 7.075 ( 2.840 -5.478 0.707) 6.210 7.075 ( 2.840 5.478 0.707) 6.210 7.702 ( -2.646 -2.669 -2.191) 4.350 7.702 ( -2.646 2.669 -2.191) 4.350 7.987 ( -6.472 -1.839 0.761) 6.771 7.987 ( -6.472 1.839 0.761) 6.771 8.333 ( -0.348 -2.085 2.064) 2.954 8.333 ( -0.348 2.085 2.064) 2.954 8.500 ( 1.262 -4.238 -0.145) 4.424 8.500 ( 1.262 4.238 -0.145) 4.424 8.801 ( -0.395 -8.820 -0.395) 8.838 8.801 ( -0.395 8.820 -0.395) 8.838 8.977 ( 7.435 -6.805 1.799) 10.238 8.977 ( 7.435 6.805 1.799) 10.238 10.626 ( -2.784 -0.680 0.396) 2.893 10.626 ( -2.784 0.680 0.396) 2.893 10.979 ( -5.186 -0.537 1.143) 5.337 10.979 ( -5.186 0.537 1.143) 5.337 13.142 ( 1.696 -2.053 -1.421) 3.019 13.142 ( 1.696 2.053 -1.421) 3.019 15.725 ( -19.852 -13.737 10.524) 26.336 15.725 ( -19.852 13.737 10.524) 26.336 15.979 ( -4.564 -2.199 -1.388) 5.253 15.979 ( -4.564 2.199 -1.388) 5.253 16.215 ( -14.223 -22.299 5.470) 27.009 16.215 ( -14.223 22.299 5.470) 27.009 17.975 ( 29.653 -6.684 -12.716) 32.950 17.975 ( 29.653 6.684 -12.716) 32.950 21.437 ( 0.068 -1.473 0.494) 1.555 21.437 ( 0.068 1.473 0.494) 1.555 ======================= Grid point 243 (128/160) ======================= q-point: (-0.30 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( -2.630 -6.476 2.340) 7.371 1.837 ( -2.630 6.476 2.340) 7.371 2.022 ( -4.974 -5.944 2.599) 8.174 2.022 ( -4.974 5.944 2.599) 8.174 2.093 ( 4.557 -1.760 1.025) 4.991 2.093 ( 4.557 1.760 1.025) 4.991 2.341 ( 1.537 -2.388 -0.348) 2.862 2.341 ( 1.537 2.388 -0.348) 2.862 2.398 ( 1.042 -3.205 -1.131) 3.555 2.398 ( 1.042 3.205 -1.131) 3.555 2.743 ( 0.134 -3.496 -5.271) 6.326 2.743 ( 0.134 3.496 -5.271) 6.326 3.108 ( 0.338 -1.493 5.421) 5.633 3.108 ( 0.338 1.493 5.421) 5.633 3.520 ( 10.658 -8.903 -0.353) 13.892 3.520 ( 10.658 8.903 -0.353) 13.892 3.721 ( 6.087 -3.181 -1.351) 7.000 3.721 ( 6.087 3.181 -1.351) 7.000 4.046 ( 0.660 -5.164 1.526) 5.425 4.046 ( 0.660 5.164 1.526) 5.425 4.709 ( -19.829 -1.157 1.963) 19.960 4.709 ( -19.829 1.157 1.963) 19.960 5.877 ( -5.460 -2.173 -3.126) 6.656 5.877 ( -5.460 2.173 -3.126) 6.656 6.380 ( 4.171 -2.988 -6.762) 8.488 6.380 ( 4.171 2.988 -6.762) 8.488 6.478 ( 12.984 -6.997 1.682) 14.845 6.478 ( 12.984 6.997 1.682) 14.845 6.769 ( 5.295 -0.773 3.816) 6.573 6.769 ( 5.295 0.773 3.816) 6.573 7.138 ( 4.772 -9.485 -0.725) 10.643 7.138 ( 4.772 9.485 -0.725) 10.643 7.611 ( -5.467 -3.949 -2.123) 7.071 7.611 ( -5.467 3.949 -2.123) 7.071 7.917 ( -4.723 -3.729 3.485) 6.954 7.917 ( -4.723 3.729 3.485) 6.954 8.240 ( -9.610 -3.871 -0.542) 10.374 8.240 ( -9.610 3.871 -0.542) 10.374 8.591 ( 7.291 -8.005 0.070) 10.828 8.591 ( 7.291 8.005 0.070) 10.828 8.828 ( 4.489 -9.421 -0.484) 10.447 8.828 ( 4.489 9.421 -0.484) 10.447 9.130 ( 7.585 -6.506 2.510) 10.303 9.130 ( 7.585 6.506 2.510) 10.303 10.569 ( -5.275 -2.399 1.160) 5.909 10.569 ( -5.275 2.399 1.160) 5.909 10.853 ( -8.818 -1.297 -1.940) 9.122 10.853 ( -8.818 1.297 -1.940) 9.122 13.195 ( 4.371 -4.400 1.733) 6.439 13.195 ( 4.371 4.400 1.733) 6.439 15.210 ( -38.276 -3.998 -4.571) 38.755 15.210 ( -38.276 3.998 -4.571) 38.755 15.909 ( -0.633 -7.362 -5.331) 9.111 15.909 ( -0.633 7.362 -5.331) 9.111 16.119 ( -9.850 -7.965 5.960) 14.000 16.119 ( -9.850 7.965 5.960) 14.000 18.443 ( 32.127 -6.791 1.947) 32.895 18.443 ( 32.127 6.791 1.947) 32.895 21.438 ( 0.061 -2.568 -0.340) 2.591 21.438 ( 0.061 2.568 -0.340) 2.591 ======================= Grid point 245 (129/160) ======================= q-point: (-0.20 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 152 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.806 ( -3.669 -5.851 1.171) 7.005 1.806 ( -3.669 5.851 1.171) 7.005 1.985 ( -4.610 -4.977 3.825) 7.788 1.985 ( -4.610 4.977 3.825) 7.788 2.168 ( 3.088 -2.794 -0.468) 4.191 2.168 ( 3.088 2.794 -0.468) 4.191 2.347 ( 1.125 -2.623 -0.493) 2.896 2.347 ( 1.125 2.623 -0.493) 2.896 2.386 ( 0.196 -4.940 -4.651) 6.788 2.386 ( 0.196 4.940 -4.651) 6.788 2.757 ( 6.898 -1.707 -3.603) 7.967 2.757 ( 6.898 1.707 -3.603) 7.967 3.197 ( -1.014 -3.474 11.537) 12.091 3.197 ( -1.014 3.474 11.537) 12.091 3.670 ( 7.408 -6.123 1.019) 9.665 3.670 ( 7.408 6.123 1.019) 9.665 3.770 ( 2.589 -0.605 -2.508) 3.655 3.770 ( 2.589 0.605 -2.508) 3.655 4.054 ( -1.052 -6.608 -0.183) 6.693 4.054 ( -1.052 6.608 -0.183) 6.693 4.449 ( -14.384 -2.418 2.170) 14.747 4.449 ( -14.384 2.418 2.170) 14.747 5.784 ( -0.358 -1.987 -3.901) 4.392 5.784 ( -0.358 1.987 -3.901) 4.392 6.409 ( 6.974 -3.409 -3.377) 8.465 6.409 ( 6.974 3.409 -3.377) 8.465 6.684 ( 9.482 -6.720 0.941) 11.660 6.684 ( 9.482 6.720 0.941) 11.660 6.877 ( 1.875 -2.317 4.670) 5.540 6.877 ( 1.875 2.317 4.670) 5.540 7.196 ( 3.973 -9.635 -2.646) 10.753 7.196 ( 3.973 9.635 -2.646) 10.753 7.486 ( -5.451 -5.184 -3.113) 8.141 7.486 ( -5.451 5.184 -3.113) 8.141 7.899 ( -4.218 -7.909 4.309) 9.945 7.899 ( -4.218 7.909 4.309) 9.945 8.073 ( -8.636 -1.195 -0.477) 8.732 8.073 ( -8.636 1.195 -0.477) 8.732 8.678 ( 4.134 -8.409 -0.912) 9.414 8.678 ( 4.134 8.409 -0.912) 9.414 8.942 ( 8.103 -8.845 0.932) 12.032 8.942 ( 8.103 8.845 0.932) 12.032 9.257 ( 5.894 -7.787 0.235) 9.769 9.257 ( 5.894 7.787 0.235) 9.769 10.446 ( -12.338 -2.525 -0.496) 12.604 10.446 ( -12.338 2.525 -0.496) 12.604 10.726 ( -2.683 -2.949 0.973) 4.104 10.726 ( -2.683 2.949 0.973) 4.104 13.315 ( 6.757 -6.345 2.789) 9.679 13.315 ( 6.757 6.345 2.789) 9.679 14.525 ( -34.799 -2.725 -8.028) 35.817 14.525 ( -34.799 2.725 -8.028) 35.817 15.823 ( -2.265 -4.619 -4.932) 7.127 15.823 ( -2.265 4.619 -4.932) 7.127 15.998 ( -7.872 -4.728 -1.352) 9.282 15.998 ( -7.872 4.728 -1.352) 9.282 18.987 ( 24.662 -6.871 9.625) 27.350 18.987 ( 24.662 6.871 9.625) 27.350 21.432 ( 0.144 -3.125 -0.886) 3.252 21.432 ( 0.144 3.125 -0.886) 3.252 ======================= Grid point 247 (130/160) ======================= q-point: (-0.10 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.743 ( -4.665 -2.581 -0.287) 5.339 1.743 ( -4.665 2.581 -0.287) 5.339 1.936 ( -4.579 -2.663 0.812) 5.359 1.936 ( -4.579 2.663 0.812) 5.359 2.158 ( -0.648 -1.974 -4.754) 5.188 2.158 ( -0.648 1.974 -4.754) 5.188 2.307 ( 0.273 -4.264 -6.640) 7.896 2.307 ( 0.273 4.264 -6.640) 7.896 2.417 ( 4.010 -3.319 3.707) 6.391 2.417 ( 4.010 3.319 3.707) 6.391 2.800 ( 2.892 -2.738 -4.158) 5.757 2.800 ( 2.892 2.738 -4.158) 5.757 3.362 ( 2.191 -4.056 14.555) 15.268 3.362 ( 2.191 4.056 14.555) 15.268 3.757 ( 0.927 -3.511 -0.472) 3.662 3.757 ( 0.927 3.511 -0.472) 3.662 3.797 ( 3.791 -5.815 1.435) 7.089 3.797 ( 3.791 5.815 1.435) 7.089 4.020 ( -1.446 -5.084 -0.577) 5.317 4.020 ( -1.446 5.084 -0.577) 5.317 4.288 ( -8.129 -3.382 1.150) 8.879 4.288 ( -8.129 3.382 1.150) 8.879 5.765 ( 2.118 -0.057 -2.957) 3.637 5.765 ( 2.118 0.057 -2.957) 3.637 6.522 ( 8.445 -2.797 0.080) 8.897 6.522 ( 8.445 2.797 0.080) 8.897 6.781 ( 0.134 -0.939 0.841) 1.268 6.781 ( 0.134 0.939 0.841) 1.268 6.939 ( 1.179 -6.848 2.122) 7.266 6.939 ( 1.179 6.848 2.122) 7.266 7.193 ( 1.753 -4.846 -5.325) 7.410 7.193 ( 1.753 4.846 -5.325) 7.410 7.398 ( -0.792 -6.367 -1.896) 6.690 7.398 ( -0.792 6.367 -1.896) 6.690 7.838 ( -6.416 -5.407 0.685) 8.418 7.838 ( -6.416 5.407 0.685) 8.418 7.994 ( -2.626 -4.455 2.175) 5.610 7.994 ( -2.626 4.455 2.175) 5.610 8.730 ( 3.348 -8.755 0.169) 9.375 8.730 ( 3.348 8.755 0.169) 9.375 9.028 ( -0.248 -6.726 -0.393) 6.742 9.028 ( -0.248 6.726 -0.393) 6.742 9.371 ( 10.370 -5.453 -1.132) 11.770 9.371 ( 10.370 5.453 -1.132) 11.770 10.184 ( -15.185 -4.973 -2.663) 16.199 10.184 ( -15.185 4.973 -2.663) 16.199 10.787 ( 2.830 -3.476 6.165) 7.623 10.787 ( 2.830 3.476 6.165) 7.623 13.460 ( 8.057 -8.249 0.092) 11.531 13.460 ( 8.057 8.249 0.092) 11.531 13.949 ( -24.134 -3.985 -5.730) 25.123 13.949 ( -24.134 3.985 -5.730) 25.123 15.736 ( -1.778 -2.602 -3.752) 4.900 15.736 ( -1.778 2.602 -3.752) 4.900 15.852 ( -4.853 -4.379 -5.134) 8.312 15.852 ( -4.853 4.379 -5.134) 8.312 19.424 ( 13.297 -6.591 11.046) 18.500 19.424 ( 13.297 6.591 11.046) 18.500 21.424 ( 0.216 -2.922 -1.046) 3.111 21.424 ( 0.216 2.922 -1.046) 3.111 ======================= Grid point 279 (131/160) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( -5.769 0.000 -5.915) 8.262 1.216 ( 5.769 0.000 5.915) 8.262 1.320 ( -7.946 0.000 -18.618) 20.242 1.320 ( 7.946 0.000 18.618) 20.242 2.281 ( 3.239 0.000 -11.828) 12.263 2.281 ( -3.239 0.000 11.828) 12.263 2.342 ( 3.000 0.000 -3.690) 4.755 2.342 ( -3.000 0.000 3.690) 4.755 2.589 ( -3.466 0.000 0.871) 3.574 2.589 ( 3.466 0.000 -0.871) 3.574 2.642 ( -2.287 0.000 -1.505) 2.738 2.642 ( 2.287 0.000 1.505) 2.738 2.861 ( -2.046 0.000 0.351) 2.076 2.861 ( 2.046 0.000 -0.351) 2.076 3.498 ( -3.647 0.000 -7.205) 8.076 3.498 ( 3.647 0.000 7.205) 8.076 3.719 ( -5.757 0.000 -15.013) 16.079 3.719 ( 5.757 0.000 15.013) 16.079 3.781 ( -1.947 0.000 -9.828) 10.019 3.781 ( 1.947 0.000 9.828) 10.019 4.113 ( -3.853 0.000 -0.368) 3.871 4.113 ( 3.853 0.000 0.368) 3.871 5.965 ( -5.849 0.000 -0.498) 5.870 5.965 ( 5.849 0.000 0.498) 5.870 6.277 ( -3.902 0.000 0.946) 4.015 6.277 ( 3.902 0.000 -0.946) 4.015 6.674 ( 5.365 0.000 -9.352) 10.782 6.674 ( -5.365 0.000 9.352) 10.782 6.852 ( -2.202 0.000 -6.029) 6.418 6.852 ( 2.202 0.000 6.029) 6.418 7.223 ( -0.861 0.000 -1.585) 1.804 7.223 ( 0.861 0.000 1.585) 1.804 7.451 ( -2.521 0.000 -4.630) 5.272 7.451 ( 2.521 0.000 4.630) 5.272 7.754 ( -4.219 0.000 -2.202) 4.759 7.754 ( 4.219 0.000 2.202) 4.759 8.111 ( 2.345 0.000 -3.633) 4.324 8.111 ( -2.345 0.000 3.633) 4.324 8.785 ( -5.852 0.000 0.609) 5.883 8.785 ( 5.852 0.000 -0.609) 5.883 9.008 ( 2.013 0.000 -8.575) 8.808 9.008 ( -2.013 0.000 8.575) 8.808 9.741 ( 9.476 0.000 -6.919) 11.733 9.741 ( -9.476 0.000 6.919) 11.733 10.131 ( 9.377 0.000 -3.447) 9.991 10.131 ( -9.377 0.000 3.447) 9.991 10.520 ( -1.958 0.000 -18.388) 18.492 10.520 ( 1.958 0.000 18.388) 18.492 13.167 ( -0.097 0.000 -2.777) 2.778 13.167 ( 0.097 0.000 2.777) 2.778 14.277 ( -2.684 0.000 -37.863) 37.958 14.277 ( 2.684 0.000 37.863) 37.958 15.663 ( -2.536 0.000 -0.239) 2.547 15.663 ( 2.536 0.000 0.239) 2.547 16.033 ( -5.693 0.000 -1.306) 5.841 16.033 ( 5.693 0.000 1.306) 5.841 19.060 ( -7.790 0.000 -17.337) 19.007 19.060 ( 7.790 0.000 17.337) 19.007 21.551 ( -0.065 0.000 -3.753) 3.753 21.551 ( 0.065 0.000 3.753) 3.753 ======================= Grid point 281 (132/160) ======================= q-point: ( 0.10 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 4.804 0.000 -16.480) 17.166 1.093 ( 4.601 0.000 -13.543) 14.303 1.412 ( 10.706 0.000 3.745) 11.342 1.641 ( 5.294 0.000 16.502) 17.330 2.199 ( 11.867 0.000 -20.510) 23.696 2.355 ( 4.196 0.000 2.547) 4.908 2.399 ( -2.760 0.000 6.308) 6.886 2.409 ( 5.401 0.000 -3.634) 6.510 2.516 ( -0.421 0.000 -6.907) 6.919 2.548 ( 1.091 0.000 1.557) 1.901 2.733 ( 6.216 0.000 2.982) 6.894 2.739 ( 3.087 0.000 4.496) 5.454 2.834 ( -4.051 0.000 3.391) 5.282 2.893 ( 1.639 0.000 0.883) 1.862 3.338 ( -4.433 0.000 -10.270) 11.186 3.458 ( -2.270 0.000 -11.631) 11.850 3.621 ( 1.743 0.000 5.833) 6.088 3.663 ( -2.153 0.000 -3.536) 4.140 3.750 ( -6.893 0.000 0.916) 6.954 3.976 ( -9.308 0.000 -2.235) 9.572 4.097 ( 3.075 0.000 23.578) 23.778 4.123 ( -1.474 0.000 -2.817) 3.180 5.840 ( -8.001 0.000 1.589) 8.157 5.978 ( -3.216 0.000 -1.321) 3.477 6.142 ( -7.356 0.000 -5.608) 9.250 6.215 ( -4.733 0.000 -5.891) 7.557 6.718 ( 8.896 0.000 -6.852) 11.229 6.790 ( 1.041 0.000 14.356) 14.394 6.828 ( 5.354 0.000 -3.130) 6.202 6.979 ( 3.990 0.000 3.290) 5.172 7.163 ( -2.186 0.000 -2.310) 3.180 7.233 ( -0.736 0.000 0.819) 1.101 7.443 ( 3.962 0.000 -0.746) 4.032 7.597 ( 4.457 0.000 7.991) 9.150 7.649 ( -4.548 0.000 -2.348) 5.119 7.796 ( -2.127 0.000 -0.012) 2.127 8.111 ( 1.105 0.000 -0.633) 1.274 8.127 ( -2.154 0.000 6.825) 7.157 8.631 ( -8.206 0.000 -1.576) 8.356 8.781 ( -4.093 0.000 -0.638) 4.142 8.891 ( -3.794 0.000 -9.787) 10.496 9.051 ( -3.348 0.000 6.244) 7.085 9.642 ( -8.116 0.000 -5.837) 9.997 9.701 ( -0.302 0.000 7.035) 7.042 10.213 ( -3.388 0.000 -12.952) 13.387 10.270 ( 14.522 0.000 2.496) 14.735 10.472 ( 24.122 0.000 -5.313) 24.701 10.770 ( 6.004 0.000 13.407) 14.690 13.155 ( 2.335 0.000 -2.402) 3.349 13.216 ( 1.935 0.000 2.455) 3.126 13.771 ( -7.966 0.000 -29.237) 30.303 14.632 ( -12.536 0.000 35.111) 37.282 15.623 ( -2.709 0.000 0.708) 2.800 15.705 ( 1.167 0.000 0.958) 1.510 15.902 ( -8.063 0.000 -2.025) 8.313 16.134 ( 1.189 0.000 6.922) 7.023 18.811 ( 7.116 0.000 -22.929) 24.008 19.406 ( 12.514 0.000 10.597) 16.398 21.503 ( -0.696 0.000 -3.123) 3.199 21.588 ( -0.936 0.000 3.760) 3.874 ======================= Grid point 282 (133/160) ======================= q-point: ( 0.20 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.061 ( 13.184 0.000 -16.112) 20.819 1.123 ( 18.199 0.000 -8.877) 20.249 1.616 ( 8.979 0.000 2.047) 9.209 1.888 ( 4.514 0.000 13.251) 13.999 2.232 ( 17.383 0.000 -14.851) 22.863 2.332 ( -4.216 0.000 -2.881) 5.106 2.389 ( 2.688 0.000 -7.076) 7.569 2.437 ( -0.224 0.000 -0.747) 0.780 2.464 ( -1.717 0.000 0.607) 1.821 2.639 ( 3.454 0.000 0.200) 3.459 2.761 ( -10.834 0.000 3.007) 11.244 2.821 ( 1.134 0.000 3.042) 3.246 2.870 ( 10.125 0.000 -0.823) 10.159 2.952 ( 4.504 0.000 1.992) 4.925 3.163 ( -2.958 0.000 -5.346) 6.110 3.373 ( 3.747 0.000 -6.652) 7.634 3.478 ( -16.721 0.000 -7.947) 18.513 3.695 ( -0.816 0.000 6.013) 6.068 3.743 ( 11.766 0.000 2.083) 11.949 3.853 ( -5.172 0.000 0.566) 5.203 3.991 ( -5.816 0.000 -8.180) 10.037 4.358 ( -2.588 0.000 18.090) 18.274 5.749 ( -7.842 0.000 2.819) 8.333 5.884 ( -6.317 0.000 -1.052) 6.404 5.966 ( -3.993 0.000 -5.046) 6.435 6.095 ( -4.358 0.000 1.946) 4.773 6.743 ( 6.499 0.000 -10.856) 12.652 6.902 ( 6.076 0.000 -2.271) 6.486 6.952 ( -0.141 0.000 9.288) 9.289 6.990 ( -5.147 0.000 -0.215) 5.151 7.156 ( 3.674 0.000 -0.247) 3.682 7.232 ( 0.248 0.000 -0.372) 0.447 7.469 ( -0.720 0.000 -3.576) 3.647 7.594 ( 0.682 0.000 0.529) 0.863 7.653 ( -3.271 0.000 -2.443) 4.082 7.798 ( 1.016 0.000 9.071) 9.127 8.159 ( 3.656 0.000 3.677) 5.186 8.215 ( 1.753 0.000 8.452) 8.632 8.580 ( 1.305 0.000 -1.907) 2.311 8.675 ( -7.767 0.000 0.131) 7.768 8.696 ( -4.720 0.000 -7.284) 8.680 9.034 ( -6.125 0.000 3.896) 7.259 9.452 ( -7.477 0.000 -3.806) 8.389 9.753 ( -7.575 0.000 -0.411) 7.586 10.108 ( 11.049 0.000 -1.733) 11.184 10.501 ( 8.829 0.000 3.427) 9.471 10.830 ( 20.915 0.000 -2.796) 21.101 11.011 ( 10.107 0.000 4.270) 10.972 13.184 ( 3.989 0.000 -2.169) 4.541 13.279 ( 2.764 0.000 1.533) 3.160 13.440 ( -0.880 0.000 -14.090) 14.117 14.676 ( -23.047 0.000 23.810) 33.138 15.594 ( -2.688 0.000 2.066) 3.390 15.710 ( -1.081 0.000 -0.100) 1.085 15.757 ( -4.761 0.000 -2.306) 5.290 16.216 ( -6.120 0.000 12.939) 14.314 18.781 ( 20.784 0.000 -21.983) 30.253 19.636 ( 5.620 0.000 1.870) 5.923 21.462 ( -0.599 0.000 -2.021) 2.108 21.604 ( -2.049 0.000 3.176) 3.780 ======================= Grid point 283 (134/160) ======================= q-point: ( 0.30 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( 17.794 0.000 -10.170) 20.495 1.344 ( 18.213 0.000 -6.256) 19.258 1.732 ( 4.712 0.000 -1.129) 4.845 2.095 ( 4.310 0.000 9.126) 10.092 2.249 ( -3.233 0.000 -0.549) 3.279 2.298 ( 0.171 0.000 -1.815) 1.823 2.325 ( -7.708 0.000 -0.961) 7.768 2.439 ( 8.656 0.000 -3.443) 9.315 2.441 ( -2.668 0.000 -1.549) 3.086 2.568 ( -3.818 0.000 -7.351) 8.284 2.629 ( -7.014 0.000 2.741) 7.530 2.843 ( -2.037 0.000 1.796) 2.715 2.997 ( 8.146 0.000 -6.179) 10.224 3.077 ( 6.197 0.000 1.149) 6.302 3.170 ( 4.682 0.000 3.043) 5.584 3.266 ( 2.472 0.000 -3.688) 4.440 3.417 ( 7.353 0.000 -2.535) 7.778 3.725 ( -3.010 0.000 -4.295) 5.245 3.745 ( -2.995 0.000 -10.607) 11.022 3.757 ( -4.022 0.000 4.337) 5.915 4.026 ( 9.434 0.000 5.503) 10.922 4.406 ( -8.471 0.000 6.511) 10.684 5.633 ( -7.661 0.000 0.623) 7.686 5.732 ( -8.613 0.000 -1.995) 8.841 5.961 ( 3.569 0.000 2.215) 4.201 6.127 ( -1.813 0.000 9.243) 9.419 6.704 ( 3.821 0.000 -8.833) 9.624 6.867 ( -7.126 0.000 -0.269) 7.132 6.950 ( 5.433 0.000 -5.815) 7.958 6.975 ( -4.374 0.000 2.033) 4.824 7.200 ( -2.811 0.000 -2.658) 3.869 7.254 ( 6.285 0.000 0.644) 6.318 7.355 ( -4.754 0.000 -5.417) 7.208 7.628 ( -0.262 0.000 3.261) 3.272 7.649 ( 3.934 0.000 1.339) 4.155 7.921 ( 1.390 0.000 7.807) 7.930 8.319 ( 7.227 0.000 6.319) 9.600 8.352 ( 2.883 0.000 6.701) 7.295 8.436 ( -4.745 0.000 -9.467) 10.589 8.558 ( -6.709 0.000 1.779) 6.941 8.713 ( 5.264 0.000 0.217) 5.268 8.939 ( -9.929 0.000 2.471) 10.232 9.322 ( -4.250 0.000 -2.234) 4.802 9.538 ( -9.770 0.000 -5.489) 11.206 10.420 ( 14.938 0.000 10.983) 18.541 10.645 ( 2.741 0.000 6.016) 6.611 11.027 ( 11.866 0.000 -9.258) 15.050 11.171 ( 8.884 0.000 -4.127) 9.796 13.218 ( 4.206 0.000 -2.844) 5.077 13.335 ( 2.601 0.000 0.515) 2.651 13.382 ( 4.685 0.000 -4.235) 6.316 14.461 ( -27.550 0.000 11.552) 29.874 15.578 ( -2.627 0.000 2.118) 3.375 15.676 ( -1.853 0.000 -1.289) 2.257 15.754 ( 2.921 0.000 4.976) 5.770 16.226 ( -9.493 0.000 11.243) 14.715 18.947 ( 23.914 0.000 -14.222) 27.824 19.649 ( -0.473 0.000 -4.748) 4.772 21.442 ( 0.412 0.000 -0.840) 0.936 21.593 ( -3.101 0.000 2.150) 3.774 ======================= Grid point 284 (135/160) ======================= q-point: ( 0.40 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( 16.360 0.000 -3.948) 16.829 1.560 ( 11.028 0.000 -0.010) 11.028 1.762 ( 4.568 0.000 -3.319) 5.647 2.151 ( -3.815 0.000 1.088) 3.967 2.180 ( -5.882 0.000 -1.990) 6.209 2.269 ( -2.950 0.000 -0.652) 3.021 2.279 ( -1.265 0.000 3.312) 3.546 2.345 ( -7.760 0.000 0.747) 7.796 2.436 ( 6.083 0.000 1.340) 6.229 2.564 ( 3.032 0.000 -3.376) 4.538 2.577 ( -4.790 0.000 4.607) 6.646 2.791 ( -6.327 0.000 0.794) 6.377 3.066 ( 9.520 0.000 -4.612) 10.578 3.139 ( 1.646 0.000 -0.591) 1.749 3.256 ( 2.872 0.000 -0.606) 2.936 3.354 ( 6.595 0.000 -2.486) 7.048 3.416 ( -0.487 0.000 -5.854) 5.874 3.536 ( -10.976 0.000 -2.949) 11.365 3.792 ( 10.439 0.000 6.492) 12.293 3.849 ( 11.612 0.000 -1.546) 11.714 4.153 ( -0.529 0.000 2.469) 2.525 4.278 ( -8.301 0.000 -2.992) 8.824 5.543 ( -4.222 0.000 0.881) 4.313 5.587 ( -6.294 0.000 -1.183) 6.404 6.070 ( 3.099 0.000 5.005) 5.887 6.181 ( -2.659 0.000 4.768) 5.460 6.701 ( 4.379 0.000 -2.158) 4.882 6.809 ( -0.488 0.000 2.274) 2.326 6.896 ( -4.043 0.000 -2.612) 4.814 6.951 ( 3.054 0.000 -5.413) 6.216 7.094 ( -6.877 0.000 -0.333) 6.885 7.147 ( -6.490 0.000 -8.087) 10.369 7.426 ( 9.601 0.000 0.886) 9.642 7.656 ( -3.630 0.000 4.315) 5.639 7.752 ( 6.463 0.000 1.668) 6.675 7.982 ( -3.863 0.000 3.279) 5.067 8.318 ( 0.613 0.000 -2.087) 2.175 8.402 ( -1.867 0.000 -0.423) 1.915 8.446 ( 4.689 0.000 -0.564) 4.723 8.588 ( 1.243 0.000 7.452) 7.555 8.790 ( 5.457 0.000 -2.887) 6.174 8.796 ( -9.579 0.000 3.602) 10.233 9.256 ( -1.021 0.000 -1.694) 1.978 9.355 ( -7.551 0.000 -1.493) 7.697 10.749 ( -0.549 0.000 9.430) 9.446 10.758 ( 10.108 0.000 8.959) 13.507 11.038 ( 5.342 0.000 -10.012) 11.348 11.197 ( 4.196 0.000 -9.568) 10.448 13.290 ( 6.584 0.000 0.004) 6.584 13.371 ( 1.371 0.000 -0.202) 1.386 13.452 ( 8.952 0.000 -1.990) 9.170 14.085 ( -27.262 0.000 2.501) 27.377 15.567 ( -1.245 0.000 1.994) 2.351 15.628 ( -1.573 0.000 -1.953) 2.507 15.914 ( 6.168 0.000 7.065) 9.379 16.177 ( -8.358 0.000 5.507) 10.010 19.185 ( 18.532 0.000 -5.899) 19.448 19.549 ( -4.725 0.000 -4.495) 6.522 21.457 ( 2.021 0.000 -0.095) 2.024 21.555 ( -3.712 0.000 0.979) 3.839 ======================= Grid point 285 (136/160) ======================= q-point: (-0.50 0.00 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( -9.812 0.000 1.864) 9.988 1.562 ( 9.812 0.000 -1.864) 9.988 1.943 ( -16.221 0.000 -0.823) 16.242 1.943 ( 16.221 0.000 0.823) 16.242 2.179 ( -5.669 0.000 1.606) 5.892 2.179 ( 5.669 0.000 -1.606) 5.892 2.303 ( -1.118 0.000 -0.225) 1.141 2.303 ( 1.118 0.000 0.225) 1.141 2.533 ( 0.420 0.000 -4.888) 4.906 2.533 ( -0.420 0.000 4.888) 4.906 2.655 ( -7.706 0.000 -3.378) 8.414 2.655 ( 7.706 0.000 3.378) 8.414 3.141 ( 2.723 0.000 -2.479) 3.682 3.141 ( -2.723 0.000 2.479) 3.682 3.328 ( -8.317 0.000 -1.286) 8.416 3.328 ( 8.317 0.000 1.286) 8.416 3.389 ( -0.523 0.000 -0.190) 0.557 3.389 ( 0.523 0.000 0.190) 0.557 4.010 ( 2.653 0.000 -5.016) 5.674 4.010 ( -2.653 0.000 5.016) 5.674 4.111 ( -0.176 0.000 -4.202) 4.205 4.111 ( 0.176 0.000 4.202) 4.205 5.519 ( -0.535 0.000 -0.663) 0.852 5.519 ( 0.535 0.000 0.663) 0.852 6.153 ( -1.932 0.000 -2.293) 2.998 6.153 ( 1.932 0.000 2.293) 2.998 6.787 ( -4.104 0.000 -3.607) 5.464 6.787 ( 4.104 0.000 3.607) 5.464 6.900 ( -6.124 0.000 -1.624) 6.335 6.900 ( 6.124 0.000 1.624) 6.335 7.018 ( 6.046 0.000 -8.408) 10.356 7.018 ( -6.046 0.000 8.408) 10.356 7.583 ( -8.635 0.000 0.891) 8.681 7.583 ( 8.635 0.000 -0.891) 8.681 7.886 ( -7.667 0.000 -0.769) 7.706 7.886 ( 7.667 0.000 0.769) 7.706 8.357 ( -1.831 0.000 -1.592) 2.426 8.357 ( 1.831 0.000 1.592) 2.426 8.543 ( -10.271 0.000 3.231) 10.767 8.543 ( 10.271 0.000 -3.231) 10.767 8.800 ( 1.633 0.000 -6.026) 6.243 8.800 ( -1.633 0.000 6.026) 6.243 9.259 ( -3.765 0.000 1.080) 3.917 9.259 ( 3.765 0.000 -1.080) 3.917 10.845 ( 3.443 0.000 -11.116) 11.637 10.845 ( -3.443 0.000 11.116) 11.637 11.097 ( -1.370 0.000 -10.084) 10.177 11.097 ( 1.370 0.000 10.084) 10.177 13.368 ( -1.556 0.000 -0.706) 1.708 13.368 ( 1.556 0.000 0.706) 1.708 13.688 ( -21.066 0.000 -0.305) 21.068 13.688 ( 21.066 0.000 0.305) 21.068 15.586 ( -0.457 0.000 -2.177) 2.225 15.586 ( 0.457 0.000 2.177) 2.225 16.076 ( -7.039 0.000 -1.558) 7.209 16.076 ( 7.039 0.000 1.558) 7.209 19.394 ( -10.892 0.000 -0.382) 10.899 19.394 ( 10.892 0.000 0.382) 10.899 21.502 ( -3.367 0.000 0.154) 3.370 21.502 ( 3.367 0.000 -0.154) 3.370 ======================= Grid point 291 (137/160) ======================= q-point: ( 0.00 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -3.700 6.013 -15.414) 16.954 1.367 ( 3.700 6.013 15.414) 16.954 1.382 ( -1.145 11.891 -11.447) 16.545 1.382 ( 1.145 11.891 11.447) 16.545 2.145 ( 1.599 -5.219 -6.696) 8.639 2.145 ( -1.599 -5.219 6.696) 8.639 2.436 ( -0.086 -0.176 -2.442) 2.450 2.436 ( 0.086 -0.176 2.442) 2.450 2.542 ( 3.226 -2.496 -3.499) 5.374 2.542 ( -3.226 -2.496 3.499) 5.374 2.711 ( 1.146 4.916 -2.631) 5.692 2.711 ( -1.146 4.916 2.631) 5.692 3.003 ( 1.112 14.393 -7.523) 16.279 3.003 ( -1.112 14.393 7.523) 16.279 3.549 ( -2.558 4.666 -6.930) 8.737 3.549 ( 2.558 4.666 6.930) 8.737 3.705 ( -2.308 0.177 -8.125) 8.448 3.705 ( 2.308 0.177 8.125) 8.448 3.843 ( -3.413 3.294 -4.363) 6.444 3.843 ( 3.413 3.294 4.363) 6.444 4.049 ( -1.422 -4.526 -3.200) 5.722 4.049 ( 1.422 -4.526 3.200) 5.722 5.918 ( -6.062 -3.887 -2.343) 7.572 5.918 ( 6.062 -3.887 2.343) 7.572 6.328 ( -2.446 4.563 -3.844) 6.448 6.328 ( 2.446 4.563 3.844) 6.448 6.733 ( 0.905 4.865 -8.362) 9.717 6.733 ( -0.905 4.865 8.362) 9.717 6.839 ( -2.012 -1.005 -5.395) 5.845 6.839 ( 2.012 -1.005 5.395) 5.845 7.207 ( -3.894 -1.171 -2.148) 4.599 7.207 ( 3.894 -1.171 2.148) 4.599 7.454 ( -2.428 -0.007 -4.768) 5.351 7.454 ( 2.428 -0.007 4.768) 5.351 7.737 ( -6.538 -0.863 -8.262) 10.571 7.737 ( 6.538 -0.863 8.262) 10.571 8.107 ( 1.930 -1.106 -2.518) 3.360 8.107 ( -1.930 -1.106 2.518) 3.360 8.795 ( -4.705 0.840 -1.594) 5.039 8.795 ( 4.705 0.840 1.594) 5.039 8.984 ( 3.562 -1.611 -8.526) 9.380 8.984 ( -3.562 -1.611 8.526) 9.380 9.712 ( 4.374 -2.930 -7.346) 9.037 9.712 ( -4.374 -2.930 7.346) 9.037 10.157 ( 7.915 -0.044 -5.332) 9.543 10.157 ( -7.915 -0.044 5.332) 9.543 10.540 ( -1.912 3.922 -14.744) 15.376 10.540 ( 1.912 3.922 14.744) 15.376 13.234 ( 0.048 6.292 -2.413) 6.739 13.234 ( -0.048 6.292 2.413) 6.739 14.101 ( -0.572 -14.543 -32.758) 35.846 14.101 ( 0.572 -14.543 32.758) 35.846 15.686 ( 0.562 1.250 -3.363) 3.632 15.686 ( -0.562 1.250 3.363) 3.632 16.002 ( -2.605 -3.201 -1.164) 4.288 16.002 ( 2.605 -3.201 1.164) 4.288 19.178 ( -5.517 10.462 -15.918) 19.830 19.178 ( 5.517 10.462 15.918) 19.830 21.533 ( -0.037 -1.650 -3.708) 4.058 21.533 ( 0.037 -1.650 3.708) 4.058 ======================= Grid point 293 (138/160) ======================= q-point: ( 0.10 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 6.140 9.245 -14.277) 18.084 1.291 ( 5.086 15.109 -12.345) 20.163 1.526 ( 7.726 9.623 3.900) 12.942 1.668 ( 4.899 3.291 16.417) 17.446 2.147 ( 8.215 -1.642 -8.464) 11.909 2.251 ( 2.454 -8.737 7.356) 11.682 2.416 ( 2.760 -0.006 -5.818) 6.440 2.458 ( -0.163 -0.066 -1.388) 1.399 2.487 ( -0.256 0.608 -3.094) 3.163 2.525 ( -0.338 -3.544 1.279) 3.782 2.741 ( 3.927 3.926 -1.627) 5.786 2.754 ( 2.136 0.122 1.697) 2.731 2.946 ( -0.389 10.697 -3.249) 11.186 3.077 ( -1.317 15.136 5.600) 16.192 3.406 ( -3.569 6.462 -9.683) 12.176 3.523 ( -1.838 5.577 -8.031) 9.948 3.650 ( -2.263 1.249 3.279) 4.175 3.683 ( -0.634 2.246 1.749) 2.916 3.764 ( -6.629 0.206 -3.604) 7.548 3.944 ( -1.658 0.036 -0.426) 1.712 4.044 ( 0.155 -5.377 0.203) 5.383 4.129 ( 1.557 1.413 16.426) 16.560 5.778 ( -6.964 -3.488 -0.260) 7.793 5.951 ( -3.704 -4.604 -1.574) 6.115 6.209 ( -5.719 7.198 -2.213) 9.456 6.310 ( -4.456 7.952 -4.309) 10.083 6.701 ( 2.475 0.269 0.869) 2.637 6.816 ( 5.187 -0.845 -4.308) 6.795 6.868 ( 5.226 4.137 5.687) 8.761 6.943 ( 1.815 -3.942 2.510) 5.013 7.151 ( 0.021 1.037 0.415) 1.118 7.279 ( 0.075 2.739 -0.025) 2.740 7.413 ( 3.347 -2.735 -1.278) 4.508 7.480 ( -3.505 -4.993 -7.450) 9.629 7.626 ( 0.611 -1.637 6.647) 6.873 7.924 ( 3.576 4.922 7.835) 9.920 8.107 ( -1.330 -0.709 2.932) 3.297 8.114 ( 0.338 -0.964 0.985) 1.419 8.629 ( -9.874 0.846 -2.449) 10.209 8.813 ( -3.556 2.580 0.440) 4.415 8.881 ( -3.968 -0.588 -8.963) 9.820 9.024 ( -2.353 -2.035 7.264) 7.902 9.584 ( -5.975 -4.677 -4.505) 8.825 9.701 ( -3.539 -1.559 4.581) 5.995 10.271 ( 9.131 1.420 -6.529) 11.314 10.356 ( 2.887 8.635 -6.163) 10.995 10.391 ( 21.944 -5.099 -3.694) 22.829 10.740 ( 3.504 -1.855 12.939) 13.533 13.233 ( 2.902 7.391 -1.491) 8.079 13.301 ( 4.551 7.841 2.523) 9.410 13.697 ( -4.850 -6.150 -25.590) 26.762 14.392 ( -10.668 -19.307 29.883) 37.142 15.653 ( -0.869 -0.871 -1.857) 2.228 15.711 ( -2.051 3.592 4.378) 6.024 15.959 ( -2.229 2.330 1.698) 3.644 16.089 ( 2.606 -4.056 4.759) 6.774 18.934 ( 3.334 11.117 -21.203) 24.172 19.431 ( 6.834 2.578 7.995) 10.829 21.487 ( -0.730 -1.563 -3.038) 3.494 21.570 ( -0.967 -1.749 3.725) 4.227 ======================= Grid point 294 (139/160) ======================= q-point: ( 0.20 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 15.744 11.460 -9.795) 21.797 1.271 ( 11.393 14.767 -11.338) 21.827 1.693 ( 6.884 6.859 2.997) 10.169 1.910 ( 4.375 2.479 12.677) 13.638 2.204 ( 9.054 -2.398 -6.373) 11.328 2.310 ( -0.642 -4.042 1.781) 4.464 2.323 ( 0.405 -1.862 -10.381) 10.554 2.430 ( 1.730 -0.576 -4.575) 4.925 2.511 ( -1.866 0.713 1.831) 2.710 2.576 ( 1.080 -4.487 3.066) 5.541 2.748 ( 0.589 -0.878 -4.681) 4.798 2.772 ( -5.276 -2.506 1.073) 5.939 2.970 ( 7.917 9.786 2.481) 12.829 3.060 ( -1.409 8.739 -1.025) 8.911 3.262 ( -1.193 8.890 -6.116) 10.857 3.421 ( -4.919 2.034 -7.387) 9.105 3.477 ( -5.695 1.676 -6.005) 8.444 3.732 ( 4.025 2.300 5.865) 7.476 3.813 ( 5.006 7.530 4.411) 10.061 3.933 ( -4.319 -1.994 -4.555) 6.586 3.945 ( -0.835 4.665 -1.827) 5.079 4.344 ( -1.436 -0.933 14.888) 14.987 5.703 ( -5.351 -2.021 3.019) 6.468 5.825 ( -7.197 -4.885 -0.877) 8.743 6.096 ( -4.960 10.020 -3.562) 11.734 6.189 ( -4.314 8.131 1.396) 9.309 6.747 ( 4.499 0.276 -7.000) 8.326 6.854 ( -0.005 -4.446 0.808) 4.519 6.951 ( 0.180 -4.494 0.210) 4.502 6.985 ( 2.018 1.484 1.639) 2.993 7.189 ( -2.016 4.449 -1.729) 5.182 7.217 ( 1.899 -1.338 -1.971) 3.046 7.341 ( -1.457 -6.010 -3.406) 7.060 7.514 ( 6.225 -0.822 -0.219) 6.283 7.743 ( 0.523 -3.155 8.667) 9.238 7.976 ( -5.543 15.319 3.906) 16.753 8.155 ( 3.907 -0.693 3.104) 5.037 8.181 ( 3.276 -2.913 6.423) 7.776 8.523 ( -0.075 -3.416 -1.450) 3.712 8.649 ( -8.479 -1.291 -7.668) 11.505 8.768 ( -4.070 4.409 0.234) 6.005 9.040 ( -5.619 0.412 5.249) 7.700 9.416 ( -6.902 -3.449 -3.674) 8.546 9.710 ( -5.984 -4.383 0.658) 7.447 10.212 ( 8.093 9.041 -3.730) 12.694 10.531 ( 8.773 2.688 2.030) 9.398 10.704 ( 20.161 -10.381 -4.458) 23.111 10.951 ( 8.733 -5.404 5.154) 11.490 13.284 ( 5.321 9.400 -2.301) 11.044 13.393 ( -1.276 2.838 -11.851) 12.253 13.461 ( 7.034 8.986 2.691) 11.724 14.447 ( -17.494 -17.349 20.815) 32.254 15.634 ( 0.510 0.215 0.292) 0.625 15.721 ( -2.125 7.049 3.548) 8.172 15.944 ( -2.917 9.630 1.764) 10.216 16.171 ( -4.429 -3.846 10.835) 12.322 18.826 ( 13.943 4.396 -21.229) 25.776 19.542 ( 1.941 -7.617 -1.539) 8.010 21.446 ( -0.570 -1.438 -1.945) 2.485 21.586 ( -2.046 -1.779 3.199) 4.194 ======================= Grid point 295 (140/160) ======================= q-point: ( 0.30 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( 14.237 13.322 -9.661) 21.760 1.445 ( 16.137 8.822 -5.638) 19.236 1.793 ( 2.252 5.598 1.026) 6.120 2.100 ( 2.863 0.441 9.140) 9.588 2.211 ( -0.328 -4.004 -3.637) 5.419 2.251 ( -2.790 -0.194 0.949) 2.953 2.319 ( -0.401 -3.012 -2.605) 4.002 2.431 ( -0.688 -1.351 -1.009) 1.821 2.452 ( 0.393 0.707 -2.201) 2.345 2.549 ( -5.506 -1.825 0.299) 5.808 2.640 ( -5.859 0.620 -3.182) 6.696 2.682 ( -3.566 -8.624 -1.964) 9.537 3.063 ( 5.012 5.248 -4.271) 8.420 3.189 ( 8.986 4.424 5.280) 11.323 3.252 ( 7.038 10.340 -3.387) 12.959 3.288 ( 2.179 2.899 -3.754) 5.220 3.470 ( 4.737 3.427 -4.136) 7.162 3.715 ( -4.381 0.281 -7.365) 8.574 3.788 ( -0.606 4.194 -0.675) 4.291 3.939 ( -2.571 12.567 5.019) 13.774 4.020 ( 7.122 1.104 3.241) 7.903 4.396 ( -5.519 -0.283 4.597) 7.189 5.632 ( -6.303 -0.009 2.247) 6.692 5.726 ( -6.853 -0.280 1.173) 6.958 6.027 ( 1.025 6.140 0.233) 6.230 6.205 ( -2.254 6.789 7.791) 10.577 6.693 ( -0.138 -1.533 -6.010) 6.204 6.770 ( -6.697 -6.371 -2.047) 9.467 6.960 ( -2.133 -2.216 -3.721) 4.828 7.006 ( 6.110 0.663 -2.721) 6.721 7.093 ( -2.564 -5.621 -5.004) 7.950 7.256 ( -3.056 -1.837 1.165) 3.751 7.334 ( 4.751 2.567 -0.129) 5.402 7.601 ( 3.762 1.516 1.771) 4.426 7.810 ( -1.426 1.717 3.489) 4.142 7.953 ( -1.209 8.456 4.895) 9.845 8.302 ( 7.141 -1.415 4.436) 8.525 8.328 ( 4.782 -2.242 5.379) 7.539 8.404 ( -5.263 -2.735 -7.643) 9.675 8.554 ( -2.200 -0.771 1.948) 3.038 8.733 ( 0.269 2.485 0.109) 2.502 8.951 ( -10.114 0.429 2.352) 10.393 9.303 ( -3.883 -1.924 -1.105) 4.472 9.522 ( -10.073 -1.963 -4.968) 11.401 10.456 ( 13.584 3.387 8.655) 16.459 10.664 ( 3.097 1.800 5.359) 6.446 10.900 ( 13.080 -10.584 -8.879) 19.025 11.110 ( 8.615 -5.634 -3.104) 10.752 13.235 ( 0.241 -1.167 -8.537) 8.620 13.360 ( 4.430 7.846 -2.129) 9.258 13.664 ( 8.620 21.106 5.511) 23.455 14.342 ( -17.954 -6.949 12.462) 22.933 15.659 ( 0.021 7.168 0.311) 7.175 15.767 ( 2.655 3.792 6.559) 8.028 15.889 ( -5.322 14.160 0.133) 15.128 16.187 ( -8.722 -3.637 10.909) 14.433 18.889 ( 18.383 -5.492 -14.799) 24.230 19.486 ( -1.599 -14.424 -6.816) 16.033 21.429 ( 0.543 -1.200 -0.790) 1.536 21.576 ( -3.002 -1.629 2.220) 4.074 ======================= Grid point 296 (141/160) ======================= q-point: ( 0.40 0.12 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 13.963 8.747 -5.148) 17.262 1.647 ( 10.789 7.446 0.803) 13.134 1.798 ( 0.803 3.421 -1.658) 3.885 2.154 ( -0.902 -0.684 1.207) 1.655 2.181 ( -7.326 0.931 -0.877) 7.437 2.233 ( 2.347 -1.313 0.638) 2.764 2.323 ( 1.347 -3.303 1.305) 3.798 2.333 ( -6.957 1.957 1.488) 7.379 2.382 ( -3.927 -1.638 -0.337) 4.268 2.520 ( -0.782 -4.675 -4.480) 6.522 2.565 ( -3.866 -1.487 4.953) 6.457 2.616 ( -1.582 -8.060 -1.049) 8.281 3.104 ( 4.927 3.026 -3.345) 6.679 3.259 ( 0.398 5.846 -6.266) 8.579 3.339 ( 4.072 3.117 0.986) 5.222 3.389 ( 10.531 2.685 -4.734) 11.854 3.442 ( 1.087 4.717 -1.169) 4.980 3.622 ( -4.782 7.544 -0.195) 8.934 3.874 ( 9.439 3.629 1.091) 10.171 3.949 ( 0.121 10.841 3.634) 11.435 4.111 ( 0.078 -1.295 2.201) 2.555 4.311 ( -4.569 3.928 -3.353) 6.895 5.580 ( -3.752 3.334 2.977) 5.836 5.624 ( -4.973 3.836 -0.512) 6.302 6.101 ( 2.618 2.639 4.215) 5.620 6.236 ( -3.686 4.861 4.177) 7.394 6.657 ( -0.748 -5.424 2.033) 5.840 6.679 ( -0.317 -6.411 -0.704) 6.457 6.858 ( -2.061 -3.120 -6.974) 7.914 6.957 ( -6.040 -8.478 -6.608) 12.331 7.061 ( 6.211 3.759 -5.014) 8.823 7.177 ( -6.588 1.658 1.810) 7.031 7.461 ( 7.867 2.593 2.279) 8.592 7.665 ( 0.324 1.570 1.817) 2.423 7.823 ( 0.558 3.919 1.611) 4.274 7.973 ( -3.450 0.503 1.109) 3.658 8.292 ( 1.788 -1.785 -1.345) 2.863 8.413 ( 0.700 0.343 -0.955) 1.232 8.450 ( 3.220 0.165 1.675) 3.633 8.577 ( 1.090 -0.517 5.737) 5.862 8.753 ( -1.671 -1.494 1.298) 2.590 8.817 ( -3.801 0.003 -0.902) 3.906 9.244 ( -1.784 -1.456 -1.177) 2.586 9.333 ( -7.691 -2.308 -1.809) 8.231 10.727 ( 3.096 -0.858 9.114) 9.664 10.802 ( 6.414 2.899 7.590) 10.352 10.942 ( 6.298 -8.243 -8.586) 13.466 11.148 ( 4.130 -4.497 -8.480) 10.449 13.202 ( 3.952 -4.537 -2.611) 6.559 13.369 ( -0.666 1.126 -2.628) 2.935 13.847 ( 8.847 28.819 1.957) 30.209 14.178 ( -14.815 12.435 6.105) 20.283 15.653 ( 0.495 7.910 -0.340) 7.932 15.784 ( -6.389 13.040 -0.746) 14.540 15.928 ( 6.020 1.592 6.290) 8.851 16.153 ( -7.567 -2.251 6.159) 10.013 19.048 ( 15.389 -13.183 -6.613) 21.316 19.363 ( -4.632 -17.327 -5.215) 18.679 21.446 ( 2.126 -0.974 -0.099) 2.340 21.541 ( -3.561 -1.305 1.067) 3.940 ======================= Grid point 297 (142/160) ======================= q-point: (-0.50 0.12 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -6.778 6.330 1.446) 9.386 1.641 ( 6.778 6.330 -1.446) 9.386 1.962 ( -14.415 1.716 -2.076) 14.665 1.962 ( 14.415 1.716 2.076) 14.665 2.201 ( -4.549 1.963 -0.712) 5.005 2.201 ( 4.549 1.963 0.712) 5.005 2.309 ( -2.378 0.743 -0.529) 2.547 2.309 ( 2.378 0.743 0.529) 2.547 2.431 ( -2.839 -9.374 -2.403) 10.085 2.431 ( 2.839 -9.374 2.403) 10.085 2.584 ( 1.852 -2.652 -5.128) 6.063 2.584 ( -1.852 -2.652 5.128) 6.063 3.162 ( -3.463 0.933 -2.620) 4.441 3.162 ( 3.463 0.933 2.620) 4.441 3.399 ( -1.061 3.515 -1.438) 3.943 3.399 ( 1.061 3.515 1.438) 3.943 3.534 ( -6.942 12.389 0.715) 14.220 3.534 ( 6.942 12.389 -0.715) 14.220 3.979 ( 2.247 -3.921 -1.545) 4.776 3.979 ( -2.247 -3.921 1.545) 4.776 4.182 ( -4.504 8.826 -5.794) 11.478 4.182 ( 4.504 8.826 5.794) 11.478 5.573 ( 0.251 5.164 -1.736) 5.453 5.573 ( -0.251 5.164 1.736) 5.453 6.184 ( -3.168 2.641 -2.131) 4.642 6.184 ( 3.168 2.641 2.131) 4.642 6.709 ( 0.373 -6.502 -4.341) 7.826 6.709 ( -0.373 -6.502 4.341) 7.826 6.793 ( -3.649 -6.371 -1.378) 7.470 6.793 ( 3.649 -6.371 1.378) 7.470 7.106 ( 6.519 4.231 -4.464) 8.962 7.106 ( -6.519 4.231 4.464) 8.962 7.611 ( -5.048 1.857 -2.592) 5.971 7.611 ( 5.048 1.857 2.592) 5.971 7.889 ( -3.969 0.770 -1.831) 4.438 7.889 ( 3.969 0.770 1.831) 4.438 8.360 ( -2.833 0.267 -2.824) 4.010 8.360 ( 2.833 0.267 2.824) 4.010 8.541 ( -0.132 0.090 -2.282) 2.287 8.541 ( 0.132 0.090 2.282) 2.287 8.783 ( 0.755 -1.593 -6.055) 6.306 8.783 ( -0.755 -1.593 6.055) 6.306 9.237 ( -1.590 -2.310 0.191) 2.811 9.237 ( 1.590 -2.310 -0.191) 2.811 10.836 ( 2.797 -1.244 -11.157) 11.569 10.836 ( -2.797 -1.244 11.157) 11.569 11.052 ( -1.787 -3.527 -10.821) 11.520 11.052 ( 1.787 -3.527 10.821) 11.520 13.284 ( -5.456 -5.299 -1.696) 7.792 13.284 ( 5.456 -5.299 1.696) 7.792 14.010 ( -10.793 27.946 1.369) 29.989 14.010 ( 10.793 27.946 -1.369) 29.989 15.688 ( -3.365 9.046 -0.774) 9.682 15.688 ( 3.365 9.046 0.774) 9.682 16.073 ( -6.227 -0.113 -0.726) 6.270 16.073 ( 6.227 -0.113 0.726) 6.270 19.216 ( -9.579 -16.998 -0.207) 19.512 19.216 ( 9.579 -16.998 0.207) 19.512 21.490 ( -3.311 -1.007 0.215) 3.468 21.490 ( 3.311 -1.007 -0.215) 3.468 ======================= Grid point 303 (143/160) ======================= q-point: ( 0.00 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( -3.360 6.245 -10.329) 12.529 1.483 ( 3.360 6.245 10.329) 12.529 1.646 ( 0.368 10.496 -5.206) 11.722 1.646 ( -0.368 10.496 5.206) 11.722 2.076 ( -2.069 -2.215 0.045) 3.032 2.076 ( 2.069 -2.215 -0.045) 3.032 2.399 ( 1.854 -2.504 -2.177) 3.801 2.399 ( -1.854 -2.504 2.177) 3.801 2.492 ( 2.173 -1.709 -3.242) 4.261 2.492 ( -2.173 -1.709 3.242) 4.261 2.779 ( -2.894 1.629 -1.316) 3.572 2.779 ( 2.894 1.629 1.316) 3.572 3.380 ( 0.564 18.995 -9.007) 21.030 3.380 ( -0.564 18.995 9.007) 21.030 3.631 ( 1.186 1.762 -5.374) 5.779 3.631 ( -1.186 1.762 5.374) 5.779 3.764 ( 0.206 5.684 -2.788) 6.335 3.764 ( -0.206 5.684 2.788) 6.335 3.838 ( -1.443 -1.247 -3.230) 3.751 3.838 ( 1.443 -1.247 3.230) 3.751 4.050 ( -1.016 4.375 -4.203) 6.151 4.050 ( 1.016 4.375 4.203) 6.151 5.832 ( -3.813 -4.038 -2.433) 6.064 5.832 ( 3.813 -4.038 2.433) 6.064 6.451 ( -2.110 7.247 -4.420) 8.747 6.451 ( 2.110 7.247 4.420) 8.747 6.764 ( 0.109 -2.810 -2.643) 3.859 6.764 ( -0.109 -2.810 2.643) 3.859 6.882 ( -0.473 5.264 -4.253) 6.784 6.882 ( 0.473 5.264 4.253) 6.784 7.186 ( -3.425 -0.966 -1.785) 3.981 7.186 ( 3.425 -0.966 1.785) 3.981 7.443 ( -3.193 -1.014 -5.743) 6.648 7.443 ( 3.193 -1.014 5.743) 6.648 7.740 ( -6.387 1.071 -9.574) 11.559 7.740 ( 6.387 1.071 9.574) 11.559 8.052 ( -1.863 -3.698 -0.402) 4.160 8.052 ( 1.863 -3.698 0.402) 4.160 8.811 ( -4.286 0.667 -4.974) 6.600 8.811 ( 4.286 0.667 4.974) 6.600 8.965 ( 4.773 -0.588 -8.035) 9.364 8.965 ( -4.773 -0.588 8.035) 9.364 9.628 ( 0.286 -4.758 -7.169) 8.609 9.628 ( -0.286 -4.758 7.169) 8.609 10.085 ( 3.206 -5.392 -9.878) 11.702 10.085 ( -3.206 -5.392 9.878) 11.702 10.701 ( -0.694 9.934 -5.669) 11.459 10.701 ( 0.694 9.934 5.669) 11.459 13.400 ( -1.115 8.713 -1.509) 8.913 13.400 ( 1.115 8.713 1.509) 8.913 13.795 ( 2.175 -13.078 -21.728) 25.453 13.795 ( -2.175 -13.078 21.728) 25.453 15.688 ( 0.019 -1.128 -5.236) 5.356 15.688 ( -0.019 -1.128 5.236) 5.356 15.903 ( 2.384 -5.943 -1.585) 6.596 15.903 ( -2.384 -5.943 1.585) 6.596 19.429 ( -2.132 12.684 -11.235) 17.078 19.429 ( 2.132 12.684 11.235) 17.078 21.487 ( 0.015 -2.740 -3.335) 4.317 21.487 ( -0.015 -2.740 3.335) 4.317 ======================= Grid point 305 (144/160) ======================= q-point: ( 0.10 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 7.357 11.288 -8.819) 16.103 1.546 ( 5.927 8.867 -9.570) 14.330 1.712 ( 3.135 7.032 5.931) 9.718 1.806 ( 5.236 8.853 12.609) 16.272 2.093 ( 1.352 -4.886 3.910) 6.402 2.146 ( 5.083 -0.334 -0.118) 5.095 2.362 ( -3.430 -4.420 0.193) 5.598 2.406 ( 1.147 -3.107 -1.601) 3.679 2.477 ( 1.415 -1.497 -3.800) 4.323 2.507 ( -0.532 0.334 3.406) 3.463 2.729 ( -2.312 -2.141 -0.046) 3.151 2.831 ( 1.862 3.592 -0.726) 4.110 3.257 ( -1.127 17.059 -8.878) 19.264 3.380 ( -7.866 11.967 1.674) 14.418 3.546 ( -1.987 2.187 -7.811) 8.351 3.643 ( -5.109 2.343 -6.091) 8.288 3.688 ( -3.118 9.201 -3.045) 10.181 3.694 ( 0.804 4.549 4.402) 6.381 3.859 ( 3.661 7.411 1.566) 8.413 3.910 ( 0.420 -5.944 -1.260) 6.090 4.047 ( 3.803 7.137 0.637) 8.113 4.172 ( 3.050 2.935 10.423) 11.249 5.730 ( -4.672 -1.326 -0.285) 4.865 5.838 ( -4.456 -5.180 -0.959) 6.900 6.383 ( -3.344 8.830 -0.298) 9.446 6.491 ( -3.364 8.412 0.722) 9.089 6.735 ( -3.649 2.238 1.159) 4.435 6.781 ( 7.647 -2.412 -4.918) 9.406 6.816 ( -3.569 -5.104 -0.203) 6.231 6.953 ( 3.340 2.494 1.434) 4.409 7.184 ( 1.327 0.640 1.805) 2.330 7.298 ( 2.182 -0.915 0.329) 2.389 7.348 ( 2.634 -3.354 -2.762) 5.081 7.502 ( -3.560 6.060 -6.528) 9.592 7.582 ( -0.042 -1.608 4.173) 4.473 7.922 ( 3.859 -3.870 6.790) 8.716 8.057 ( 2.441 -2.956 0.991) 3.959 8.117 ( 3.190 0.097 4.508) 5.523 8.666 ( -7.097 1.565 -4.366) 8.478 8.852 ( -5.520 0.794 -3.283) 6.471 8.903 ( -4.870 3.138 -0.818) 5.850 8.988 ( -0.698 -1.194 9.415) 9.516 9.466 ( -5.841 -6.410 -4.371) 9.712 9.622 ( -5.730 -5.909 1.370) 8.344 10.177 ( 17.054 -6.491 -4.845) 18.880 10.315 ( 16.920 -3.851 0.715) 17.368 10.598 ( -2.898 11.934 -5.771) 13.569 10.757 ( -1.591 3.936 6.298) 7.595 13.409 ( 3.805 6.689 -0.362) 7.704 13.509 ( 8.419 11.459 0.489) 14.228 13.584 ( 0.773 -2.058 -14.962) 15.122 13.991 ( -5.041 -17.338 21.626) 28.173 15.637 ( -0.493 -0.182 -1.528) 1.616 15.754 ( -0.201 -0.623 6.784) 6.815 15.925 ( 0.848 -5.053 4.414) 6.762 15.995 ( 8.076 -4.804 -0.155) 9.398 19.210 ( -3.990 14.308 -16.427) 22.146 19.510 ( -3.047 4.748 2.863) 6.326 21.445 ( -0.684 -2.238 -2.575) 3.480 21.519 ( -0.916 -3.051 3.424) 4.676 ======================= Grid point 306 (145/160) ======================= q-point: ( 0.20 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.493 ( 13.462 12.744 -5.253) 19.267 1.550 ( 8.181 10.855 -9.037) 16.323 1.830 ( 3.650 5.044 4.204) 7.513 2.002 ( 3.838 5.693 7.979) 10.526 2.156 ( 0.306 -2.734 2.755) 3.893 2.220 ( 3.243 -2.084 0.998) 3.982 2.304 ( -1.190 -1.406 -3.161) 3.659 2.380 ( -1.892 -4.196 -2.423) 5.202 2.479 ( 1.021 -1.770 -0.692) 2.158 2.532 ( -0.085 -1.335 0.241) 1.360 2.685 ( -4.767 -3.621 1.399) 6.148 2.800 ( -2.420 1.914 -4.031) 5.076 3.186 ( 0.965 9.705 -2.544) 10.079 3.238 ( -5.838 9.217 -1.127) 10.969 3.380 ( -3.834 1.465 -8.664) 9.587 3.554 ( -0.564 7.897 -1.689) 8.095 3.590 ( 1.650 12.769 -7.266) 14.784 3.787 ( -1.405 -0.608 2.592) 3.011 3.837 ( -0.053 -0.563 -3.767) 3.810 3.976 ( 4.062 6.920 5.655) 9.817 4.144 ( 6.851 11.799 -0.320) 13.647 4.337 ( 1.946 0.553 8.930) 9.156 5.691 ( -4.151 0.371 2.838) 5.042 5.730 ( -5.660 -3.543 1.964) 6.961 6.295 ( -5.465 7.801 -2.759) 9.916 6.390 ( -5.314 10.697 -0.723) 11.966 6.702 ( -8.993 -8.702 1.277) 12.579 6.760 ( 3.061 0.557 -0.460) 3.145 6.871 ( 5.791 -2.476 -1.763) 6.540 6.967 ( -1.076 -2.682 -4.635) 5.462 7.158 ( -4.590 -3.041 -4.507) 7.115 7.260 ( 0.671 1.290 0.090) 1.457 7.407 ( 1.817 8.136 -1.797) 8.527 7.493 ( 7.961 -0.188 1.798) 8.164 7.656 ( 0.265 -3.954 6.336) 7.473 8.075 ( 6.026 -3.771 7.165) 10.093 8.137 ( 6.287 -1.993 0.373) 6.606 8.231 ( 0.641 5.433 5.932) 8.069 8.482 ( -6.212 -0.225 -7.133) 9.462 8.646 ( -9.661 2.165 -4.268) 10.781 8.847 ( -5.003 2.509 3.717) 6.719 9.050 ( -4.872 0.946 4.942) 7.004 9.314 ( -6.129 -6.333 -2.830) 9.256 9.576 ( -3.800 -8.350 0.340) 9.180 10.389 ( 11.754 3.831 -3.329) 12.803 10.519 ( 11.834 -3.671 -5.878) 13.714 10.595 ( 8.915 3.263 0.051) 9.494 10.829 ( 2.848 -5.005 5.855) 8.212 13.357 ( -0.845 -1.857 -12.209) 12.379 13.508 ( 2.381 7.243 -2.813) 8.126 13.776 ( 15.203 17.703 8.828) 24.949 14.157 ( -1.210 -6.743 17.820) 19.091 15.663 ( 3.244 2.561 2.462) 4.811 15.836 ( 0.949 2.126 5.439) 5.916 15.999 ( -2.023 -4.475 8.937) 10.197 16.125 ( 6.153 -0.226 0.914) 6.225 18.951 ( -1.972 7.297 -18.706) 20.176 19.392 ( -8.328 -6.079 -6.254) 12.059 21.412 ( -0.357 -1.597 -1.515) 2.230 21.535 ( -1.828 -3.063 3.092) 4.721 ======================= Grid point 307 (146/160) ======================= q-point: ( 0.30 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 8.724 10.868 -7.359) 15.760 1.650 ( 12.317 10.391 -4.942) 16.855 1.904 ( -0.028 3.841 2.675) 4.681 2.125 ( 1.317 0.709 6.117) 6.297 2.176 ( -0.329 1.025 -0.260) 1.108 2.234 ( -1.127 -3.658 -2.751) 4.713 2.251 ( -1.544 -0.353 -0.530) 1.670 2.347 ( -0.178 -4.876 0.465) 4.901 2.437 ( -3.141 -2.242 0.236) 3.866 2.525 ( -1.984 0.622 0.154) 2.085 2.594 ( -6.507 -2.542 -0.194) 6.989 2.682 ( -3.729 3.088 -5.055) 6.999 3.156 ( 0.831 2.629 -3.321) 4.317 3.250 ( 3.459 4.534 1.036) 5.796 3.314 ( 4.766 1.976 -3.599) 6.291 3.487 ( -0.440 -0.379 -14.598) 14.610 3.573 ( 1.693 11.914 0.512) 12.045 3.758 ( 2.736 4.613 2.205) 5.799 3.858 ( -2.218 2.166 2.543) 4.010 4.070 ( -0.438 4.468 4.178) 6.133 4.253 ( 6.844 16.381 -0.285) 17.755 4.428 ( 2.304 4.108 1.806) 5.045 5.634 ( -3.679 0.728 3.984) 5.472 5.745 ( -3.095 2.099 6.848) 7.802 6.173 ( -2.843 6.695 -3.568) 8.101 6.353 ( -3.886 6.356 5.251) 9.115 6.568 ( -8.890 -9.126 2.297) 12.945 6.719 ( -4.121 0.951 -4.749) 6.360 6.878 ( 1.860 -4.885 -8.652) 10.109 6.928 ( 2.439 -4.244 -7.336) 8.819 7.021 ( -3.492 -3.865 0.388) 5.223 7.268 ( -3.061 1.559 1.486) 3.743 7.445 ( 3.314 6.901 0.716) 7.689 7.632 ( 6.554 0.515 1.024) 6.653 7.754 ( 3.173 -2.161 4.989) 6.295 8.192 ( -7.256 10.629 0.477) 12.879 8.266 ( 4.751 -3.900 4.690) 7.731 8.268 ( 7.627 -1.634 -1.524) 7.947 8.331 ( -0.017 -3.801 -3.272) 5.016 8.549 ( -1.080 1.355 2.122) 2.739 8.807 ( -5.049 3.443 3.192) 6.895 8.931 ( -9.720 -1.896 -1.178) 9.973 9.234 ( -3.787 -5.092 0.680) 6.382 9.443 ( -9.173 -5.676 -3.524) 11.348 10.543 ( 9.341 4.308 2.938) 10.698 10.679 ( 10.859 -7.510 -3.929) 13.775 10.720 ( 5.939 1.994 2.672) 6.811 10.965 ( 7.952 -7.678 -0.213) 11.055 13.212 ( -0.890 -0.664 -9.008) 9.076 13.456 ( -3.723 -1.367 -4.007) 5.637 14.174 ( 16.234 27.089 12.688) 34.035 14.386 ( 7.404 13.273 12.592) 19.737 15.784 ( 6.023 4.604 3.362) 8.292 15.887 ( 0.412 6.504 1.477) 6.682 16.060 ( -5.555 -4.840 12.385) 14.411 16.180 ( -1.333 8.497 0.634) 8.624 18.745 ( 2.305 -7.635 -16.194) 18.052 19.141 ( -9.222 -17.453 -10.238) 22.237 21.403 ( 0.822 -0.995 -0.483) 1.378 21.530 ( -2.524 -2.675 2.293) 4.334 ======================= Grid point 308 (147/160) ======================= q-point: ( 0.40 0.25 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 7.704 7.284 -4.579) 11.549 1.804 ( 10.763 7.188 -0.744) 12.964 1.883 ( -4.299 3.885 -0.285) 5.802 2.116 ( -1.413 -3.322 -0.837) 3.706 2.187 ( -4.036 -2.446 3.988) 6.179 2.230 ( -0.201 -0.976 -0.063) 0.998 2.241 ( 3.628 0.547 -2.065) 4.211 2.320 ( 0.213 -1.984 -0.782) 2.143 2.413 ( -3.337 -2.145 -0.193) 3.971 2.418 ( -8.002 3.092 -1.584) 8.724 2.533 ( -3.464 -0.820 5.812) 6.816 2.621 ( -0.704 5.585 -1.469) 5.818 3.134 ( 1.084 -0.582 -3.208) 3.436 3.279 ( -2.382 -1.901 -11.814) 12.200 3.362 ( 10.084 -4.394 -4.736) 11.976 3.388 ( 5.298 2.604 1.411) 6.070 3.620 ( 1.576 7.754 1.707) 8.095 3.803 ( -2.799 6.944 1.903) 7.725 3.846 ( -1.044 -5.153 1.120) 5.376 4.042 ( -6.919 2.506 1.584) 7.528 4.377 ( 7.381 21.195 2.135) 22.545 4.480 ( 4.924 13.230 -2.865) 14.404 5.679 ( 0.172 6.736 6.321) 9.239 5.742 ( -3.547 7.187 3.010) 8.561 6.146 ( 0.684 0.777 0.778) 1.295 6.333 ( -5.203 2.700 4.043) 7.121 6.517 ( -4.594 -5.313 5.983) 9.226 6.602 ( -1.061 -2.650 -2.431) 3.750 6.761 ( -5.474 -8.544 -9.740) 14.065 6.794 ( 0.425 -3.163 -10.235) 10.722 7.075 ( 4.892 -2.367 -0.087) 5.435 7.208 ( -6.101 0.435 2.702) 6.687 7.527 ( 4.786 4.184 1.862) 6.624 7.704 ( 1.199 0.919 -1.412) 2.068 7.848 ( 3.068 1.320 2.631) 4.252 8.040 ( -5.617 3.563 -3.880) 7.701 8.272 ( 2.644 0.408 0.530) 2.727 8.400 ( 4.521 -1.738 -1.697) 5.132 8.446 ( 3.484 -0.203 5.970) 6.915 8.583 ( 2.355 1.014 1.906) 3.195 8.736 ( -9.529 -1.679 3.682) 10.352 8.800 ( -0.906 0.220 -3.478) 3.601 9.175 ( -3.157 -5.968 -0.618) 6.779 9.258 ( -7.800 -4.741 -2.482) 9.459 10.704 ( 3.144 -2.111 5.181) 6.418 10.766 ( 5.461 -6.979 -3.207) 9.424 10.868 ( 6.608 3.254 4.453) 8.607 11.044 ( 4.469 -4.719 -4.365) 7.829 13.143 ( 1.887 -1.480 -3.687) 4.399 13.321 ( -6.460 -4.721 -3.659) 8.799 14.538 ( 12.902 36.303 7.624) 39.275 14.649 ( 7.325 31.421 8.666) 33.407 15.836 ( 0.304 8.401 -0.935) 8.458 15.960 ( 4.674 3.281 0.966) 5.792 16.077 ( -5.258 1.861 1.538) 5.786 16.119 ( -6.968 9.703 7.177) 13.935 18.668 ( 6.130 -22.885 -8.965) 25.332 18.895 ( -8.111 -26.747 -6.898) 28.788 21.426 ( 2.116 -0.797 0.002) 2.261 21.506 ( -2.938 -1.953 1.221) 3.733 ======================= Grid point 309 (148/160) ======================= q-point: (-0.50 0.25 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( -3.669 4.014 -2.082) 5.823 1.755 ( 3.669 4.014 2.082) 5.823 2.006 ( -9.493 2.397 -3.525) 10.406 2.006 ( 9.493 2.397 3.525) 10.406 2.198 ( -1.612 -4.765 -6.040) 7.860 2.198 ( 1.612 -4.765 6.040) 7.860 2.303 ( -5.222 0.844 0.922) 5.370 2.303 ( 5.222 0.844 -0.922) 5.370 2.351 ( -1.546 2.192 -1.030) 2.873 2.351 ( 1.546 2.192 1.030) 2.873 2.577 ( 0.848 2.626 -6.142) 6.733 2.577 ( -0.848 2.626 6.142) 6.733 3.148 ( -1.969 -2.022 -3.105) 4.196 3.148 ( 1.969 -2.022 3.105) 4.196 3.448 ( -0.151 -0.460 -0.689) 0.842 3.448 ( 0.151 -0.460 0.689) 0.842 3.699 ( -8.015 0.306 -0.639) 8.046 3.699 ( 8.015 0.306 0.639) 8.046 3.915 ( -5.896 1.096 -1.872) 6.283 3.915 ( 5.896 1.096 1.872) 6.283 4.490 ( -0.002 20.249 -4.226) 20.685 4.490 ( 0.002 20.249 4.226) 20.685 5.724 ( 0.997 9.308 -2.136) 9.602 5.724 ( -0.997 9.308 2.136) 9.602 6.232 ( -5.555 1.226 -3.920) 6.909 6.232 ( 5.555 1.226 3.920) 6.909 6.573 ( -4.358 -7.301 -6.882) 10.939 6.573 ( 4.358 -7.301 6.882) 10.939 6.671 ( -1.619 -4.167 -8.194) 9.334 6.671 ( 1.619 -4.167 8.194) 9.334 7.145 ( 4.468 -0.744 -5.183) 6.884 7.145 ( -4.468 -0.744 5.183) 6.884 7.637 ( -3.837 1.207 -3.821) 5.548 7.637 ( 3.837 1.207 3.821) 5.548 7.933 ( -4.021 3.297 -2.182) 5.639 7.933 ( 4.021 3.297 2.182) 5.639 8.358 ( -3.712 -0.652 -3.266) 4.987 8.358 ( 3.712 -0.652 3.266) 4.987 8.559 ( -2.956 1.593 -3.228) 4.657 8.559 ( 2.956 1.593 3.228) 4.657 8.739 ( -1.631 -2.376 -5.597) 6.295 8.739 ( 1.631 -2.376 5.597) 6.295 9.157 ( -2.273 -5.583 -0.031) 6.028 9.157 ( 2.273 -5.583 0.031) 6.028 10.774 ( 1.834 -4.619 -5.449) 7.375 10.774 ( -1.834 -4.619 5.449) 7.375 11.005 ( -1.569 -0.439 -6.129) 6.342 11.005 ( 1.569 -0.439 6.129) 6.342 13.190 ( -5.304 -3.633 -1.171) 6.535 13.190 ( 5.304 -3.633 1.171) 6.535 14.735 ( -4.576 40.491 0.665) 40.755 14.735 ( 4.576 40.491 -0.665) 40.755 15.889 ( -5.716 8.297 -2.629) 10.412 15.889 ( 5.716 8.297 2.629) 10.412 16.092 ( 5.760 3.254 -4.424) 7.959 16.092 ( -5.760 3.254 4.424) 7.959 18.728 ( -7.479 -29.635 0.364) 30.566 18.728 ( 7.479 -29.635 -0.364) 30.566 21.466 ( -2.868 -1.191 0.303) 3.120 21.466 ( 2.868 -1.191 -0.303) 3.120 ======================= Grid point 315 (149/160) ======================= q-point: ( 0.00 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -1.009 6.173 -8.698) 10.714 1.616 ( 1.009 6.173 8.698) 10.714 1.774 ( 2.920 2.322 -8.398) 9.190 1.774 ( -2.920 2.322 8.398) 9.190 2.059 ( 0.085 0.924 -3.322) 3.449 2.059 ( -0.085 0.924 3.322) 3.449 2.306 ( -0.090 -6.303 -0.086) 6.304 2.306 ( 0.090 -6.303 0.086) 6.304 2.508 ( -0.539 3.133 -3.409) 4.662 2.508 ( 0.539 3.133 3.409) 4.662 2.767 ( -2.292 -3.080 -3.949) 5.508 2.767 ( 2.292 -3.080 3.949) 5.508 3.597 ( 0.413 2.879 -4.110) 5.035 3.597 ( -0.413 2.879 4.110) 5.035 3.756 ( -3.500 4.967 -6.768) 9.095 3.756 ( 3.500 4.967 6.768) 9.095 3.792 ( -1.156 4.950 -1.933) 5.438 3.792 ( 1.156 4.950 1.933) 5.438 3.961 ( -0.898 7.934 -2.385) 8.334 3.961 ( 0.898 7.934 2.385) 8.334 4.148 ( -2.725 4.197 -1.891) 5.349 4.148 ( 2.725 4.197 1.891) 5.349 5.765 ( -1.404 -2.322 -1.625) 3.163 5.765 ( 1.404 -2.322 1.625) 3.163 6.606 ( -0.475 6.301 -3.325) 7.141 6.606 ( 0.475 6.301 3.325) 7.141 6.701 ( -2.476 -1.435 -2.082) 3.539 6.701 ( 2.476 -1.435 2.082) 3.539 6.962 ( 0.954 1.907 -3.638) 4.217 6.962 ( -0.954 1.907 3.638) 4.217 7.150 ( 0.342 -2.984 -1.009) 3.169 7.150 ( -0.342 -2.984 1.009) 3.169 7.421 ( -3.480 -0.791 -3.732) 5.164 7.421 ( 3.480 -0.791 3.732) 5.164 7.756 ( -1.155 -0.093 -3.527) 3.712 7.756 ( 1.155 -0.093 3.527) 3.712 8.003 ( -1.266 -0.242 -4.117) 4.314 8.003 ( 1.266 -0.242 4.117) 4.314 8.827 ( -2.915 0.845 -8.559) 9.081 8.827 ( 2.915 0.845 8.559) 9.081 8.935 ( -0.250 -2.242 -1.288) 2.597 8.935 ( 0.250 -2.242 1.288) 2.597 9.539 ( -0.995 -3.483 -4.325) 5.641 9.539 ( 0.995 -3.483 4.325) 5.641 9.997 ( 0.956 -2.612 -7.154) 7.676 9.997 ( -0.956 -2.612 7.154) 7.676 10.879 ( -0.200 6.525 -1.723) 6.752 10.879 ( 0.200 6.525 1.723) 6.752 13.476 ( -1.279 -3.451 -7.640) 8.480 13.476 ( 1.279 -3.451 7.640) 8.480 13.681 ( 0.306 3.405 -3.234) 4.705 13.681 ( -0.306 3.405 3.234) 4.705 15.645 ( 1.210 -2.780 -4.497) 5.423 15.645 ( -1.210 -2.780 4.497) 5.423 15.792 ( -2.274 -4.057 0.476) 4.675 15.792 ( 2.274 -4.057 -0.476) 4.675 19.652 ( -0.494 8.251 -5.304) 9.821 19.652 ( 0.494 8.251 5.304) 9.821 21.431 ( 0.032 -2.328 -2.132) 3.157 21.431 ( -0.032 -2.328 2.132) 3.157 ======================= Grid point 317 (150/160) ======================= q-point: ( 0.10 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 7.534 9.077 -3.418) 12.282 1.706 ( 3.972 7.463 -3.620) 9.197 1.817 ( 3.118 3.601 5.010) 6.913 1.905 ( 5.823 -1.264 11.077) 12.579 2.048 ( 2.186 1.293 -1.928) 3.189 2.131 ( 3.544 -0.949 3.213) 4.876 2.294 ( -1.544 -5.079 1.380) 5.485 2.312 ( -1.099 -3.980 1.114) 4.277 2.443 ( -1.271 0.060 -3.646) 3.862 2.523 ( -2.376 0.892 1.251) 2.829 2.689 ( -3.299 -1.368 -0.566) 3.616 2.820 ( -1.819 -4.650 2.911) 5.779 3.519 ( -3.262 5.192 -3.424) 7.022 3.561 ( -3.655 3.766 -10.388) 11.638 3.610 ( -3.159 11.496 -3.925) 12.552 3.720 ( -3.971 4.143 -1.633) 5.967 3.808 ( -0.674 -2.449 -1.872) 3.155 3.827 ( 1.002 5.647 -0.024) 5.735 3.910 ( -1.329 7.937 -1.177) 8.133 3.995 ( 1.063 4.456 2.411) 5.177 4.179 ( 6.186 5.966 2.144) 8.858 4.262 ( 6.673 4.664 2.685) 8.573 5.715 ( -2.581 -0.188 0.321) 2.608 5.759 ( -3.758 -2.572 0.389) 4.570 6.524 ( -6.092 3.523 -2.467) 7.457 6.587 ( -6.044 -0.496 1.875) 6.347 6.722 ( -1.956 1.168 4.220) 4.795 6.760 ( 9.246 1.351 -1.369) 9.444 6.840 ( -8.255 4.499 -3.477) 10.024 6.988 ( 1.000 0.777 -0.435) 1.339 7.154 ( -1.068 -3.236 1.764) 3.838 7.238 ( 7.155 -5.036 -0.421) 8.760 7.319 ( -2.587 1.596 -2.826) 4.150 7.487 ( 0.746 -4.328 1.570) 4.663 7.716 ( 1.389 9.118 -2.953) 9.684 7.844 ( 4.506 -2.387 4.395) 6.732 7.998 ( 4.339 -1.943 -1.161) 4.894 8.106 ( 4.141 -1.738 4.396) 6.285 8.677 ( -4.807 0.547 -5.978) 7.690 8.840 ( -7.250 -3.496 2.599) 8.459 8.952 ( -4.523 2.089 1.182) 5.120 9.002 ( 5.722 2.119 5.085) 7.943 9.357 ( -9.865 -3.222 -2.362) 10.643 9.482 ( -8.345 -7.062 -0.485) 10.943 10.100 ( 14.957 -0.745 -1.087) 15.015 10.216 ( 14.693 -4.916 4.099) 16.027 10.802 ( -3.807 7.403 -5.053) 9.738 10.854 ( -3.345 4.114 -0.659) 5.344 13.419 ( 0.848 -1.430 -4.996) 5.266 13.567 ( -4.756 -5.947 5.066) 9.146 13.749 ( 14.295 9.711 0.814) 17.301 13.812 ( 12.034 2.448 7.007) 14.139 15.640 ( 1.973 -0.005 0.044) 1.974 15.693 ( -1.182 -4.095 7.382) 8.524 15.823 ( 4.337 -3.647 0.800) 5.723 15.892 ( 9.155 -4.835 0.652) 10.373 19.470 ( -9.740 10.201 -10.899) 17.824 19.599 ( -9.633 3.097 -2.094) 10.333 21.407 ( -0.420 -1.210 -1.333) 1.849 21.453 ( -0.600 -3.082 2.433) 3.972 ======================= Grid point 318 (151/160) ======================= q-point: ( 0.20 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( 8.535 7.874 -3.876) 12.242 1.742 ( 7.438 9.366 -2.819) 12.288 1.917 ( 2.181 3.617 4.545) 6.205 2.064 ( 1.541 -0.968 -1.056) 2.104 2.116 ( 5.187 1.714 5.994) 8.110 2.208 ( 3.300 -2.827 -0.970) 4.452 2.282 ( -1.980 -4.431 -0.352) 4.866 2.294 ( -3.062 2.199 3.343) 5.039 2.421 ( -0.997 -3.992 0.424) 4.136 2.476 ( -0.430 -4.812 -0.637) 4.873 2.643 ( -5.196 0.087 3.012) 6.006 2.764 ( -6.934 -4.381 0.941) 8.256 3.380 ( 1.719 6.260 -15.145) 16.477 3.425 ( -3.283 6.562 -3.261) 8.029 3.481 ( -7.699 11.110 -1.863) 13.644 3.627 ( -3.496 1.801 -5.068) 6.414 3.740 ( -2.934 0.275 -2.040) 3.584 3.826 ( -0.412 2.105 -0.482) 2.199 3.915 ( 1.300 6.754 1.182) 6.979 4.067 ( 1.213 0.988 5.141) 5.374 4.349 ( 11.590 6.822 1.019) 13.487 4.412 ( 8.807 6.942 1.216) 11.280 5.686 ( -5.110 0.181 2.201) 5.567 5.712 ( -0.939 0.439 4.131) 4.259 6.378 ( -5.679 0.716 -3.999) 6.983 6.492 ( -6.642 -5.276 0.294) 8.488 6.621 ( -10.997 5.081 -2.521) 12.373 6.787 ( -0.753 -0.726 4.517) 4.637 6.851 ( 2.511 2.501 -3.578) 5.037 6.949 ( -1.859 1.802 -1.697) 3.095 7.084 ( -4.915 -2.736 -4.504) 7.206 7.280 ( -1.250 -2.680 1.592) 3.358 7.394 ( 8.948 -0.958 1.012) 9.056 7.522 ( 2.851 -2.883 1.759) 4.420 7.741 ( 3.881 11.378 -0.398) 12.028 8.009 ( 7.672 -2.379 5.960) 10.002 8.089 ( 7.808 -2.276 -0.838) 8.176 8.207 ( 4.860 -5.909 -1.198) 7.744 8.522 ( -6.923 4.104 -3.533) 8.790 8.747 ( -7.716 4.557 -0.277) 8.965 8.833 ( -9.363 -2.005 4.878) 10.747 9.109 ( -1.509 4.432 2.659) 5.385 9.162 ( -8.955 -7.896 -2.630) 12.225 9.397 ( -3.250 -8.358 0.637) 8.990 10.363 ( 15.656 -0.654 1.435) 15.735 10.490 ( 13.188 -3.915 0.511) 13.766 10.695 ( 0.112 5.856 -3.542) 6.845 10.789 ( -2.860 0.250 0.015) 2.871 13.334 ( -1.555 0.175 -7.834) 7.989 13.493 ( -6.233 -6.028 -1.072) 8.737 14.125 ( 23.215 14.941 11.078) 29.747 14.228 ( 22.030 8.914 12.484) 26.844 15.716 ( 5.134 1.526 2.609) 5.957 15.780 ( -0.537 -5.510 9.959) 11.394 15.924 ( 6.117 -1.208 0.987) 6.313 16.077 ( 11.628 -4.387 1.094) 12.476 19.102 ( -16.295 6.907 -15.174) 23.313 19.298 ( -18.474 -3.600 -9.357) 21.019 21.392 ( -0.068 -0.125 -0.426) 0.449 21.467 ( -1.137 -3.265 2.456) 4.241 ======================= Grid point 319 (152/160) ======================= q-point: ( 0.30 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( 5.073 6.893 -4.511) 9.674 1.853 ( 8.033 8.123 -3.154) 11.851 1.978 ( 0.507 3.671 1.170) 3.886 2.069 ( 1.161 -2.783 -1.090) 3.206 2.170 ( -2.892 -2.986 -1.470) 4.409 2.208 ( -1.223 -2.205 -4.184) 4.885 2.256 ( 1.630 3.017 2.373) 4.171 2.310 ( -1.068 0.403 4.704) 4.840 2.386 ( -0.693 -2.302 -0.658) 2.492 2.490 ( -2.262 -4.951 -0.376) 5.457 2.578 ( -5.593 1.450 3.705) 6.863 2.694 ( -1.401 -2.791 2.743) 4.157 3.263 ( -1.222 7.747 -9.595) 12.392 3.314 ( -1.451 2.199 -6.594) 7.101 3.384 ( 0.205 1.970 -6.086) 6.400 3.478 ( -5.626 4.061 -4.385) 8.208 3.705 ( -2.372 1.523 2.180) 3.563 3.789 ( -4.657 -3.692 -0.174) 5.945 3.948 ( 0.247 5.633 1.438) 5.819 4.111 ( -2.835 -1.141 3.721) 4.815 4.571 ( 14.866 11.457 -0.722) 18.783 4.588 ( 11.811 11.371 1.516) 16.465 5.688 ( 0.519 4.554 6.382) 7.857 5.790 ( 1.725 1.581 7.683) 8.032 6.250 ( -4.929 0.942 -4.213) 6.552 6.398 ( -7.487 -6.252 2.124) 9.983 6.442 ( -7.105 2.403 0.273) 7.506 6.689 ( -9.704 -8.382 -1.520) 12.913 6.841 ( -0.042 4.617 -5.578) 7.241 6.893 ( -2.179 0.577 -8.211) 8.515 6.974 ( -0.087 1.017 -0.220) 1.044 7.244 ( -6.855 -5.003 3.815) 9.305 7.534 ( 6.897 2.271 -0.095) 7.262 7.626 ( 6.617 -0.710 1.035) 6.735 7.821 ( 5.423 7.558 0.668) 9.326 8.143 ( 0.525 -7.419 -4.501) 8.693 8.228 ( 9.512 -1.080 -0.654) 9.596 8.252 ( 7.390 -2.105 2.070) 7.958 8.405 ( -6.010 7.857 1.499) 10.005 8.635 ( -4.476 7.056 1.457) 8.482 8.754 ( -8.924 -7.708 3.730) 12.368 8.961 ( -6.599 1.508 -1.786) 7.000 9.100 ( -4.849 -5.172 -0.449) 7.104 9.309 ( -7.515 -6.861 -1.519) 10.288 10.561 ( 6.826 -1.049 -2.119) 7.223 10.622 ( 6.837 0.176 0.248) 6.844 10.775 ( 5.618 2.246 2.588) 6.580 10.836 ( 7.908 -3.898 3.009) 9.316 13.215 ( -1.720 1.033 -7.184) 7.459 13.360 ( -6.227 -5.797 -3.586) 9.232 14.703 ( 24.408 22.498 18.223) 37.869 14.765 ( 25.837 19.045 11.894) 34.231 15.841 ( 5.998 -0.493 1.800) 6.282 15.894 ( -0.012 -6.141 10.073) 11.798 16.027 ( 5.041 4.915 0.493) 7.057 16.269 ( 9.205 -0.844 1.320) 9.337 18.622 ( -18.423 -3.251 -16.844) 25.173 18.823 ( -22.241 -12.752 -12.981) 28.736 21.396 ( 0.737 0.427 0.267) 0.893 21.472 ( -1.469 -2.822 2.026) 3.772 ======================= Grid point 320 (153/160) ======================= q-point: ( 0.40 0.38 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 240 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.779 ( 1.993 5.239 -3.220) 6.465 1.923 ( -0.280 1.842 -2.620) 3.215 1.962 ( 2.587 5.638 -2.928) 6.859 2.041 ( -0.693 -2.344 0.060) 2.445 2.121 ( 0.553 -3.123 -0.062) 3.173 2.170 ( -1.137 -3.129 -2.309) 4.051 2.293 ( 1.253 1.981 0.526) 2.402 2.328 ( -0.665 0.793 1.301) 1.662 2.381 ( 0.030 -0.828 -0.657) 1.057 2.429 ( -3.454 -1.983 -0.654) 4.036 2.586 ( 0.020 5.779 7.479) 9.451 2.765 ( 0.095 4.644 5.888) 7.500 3.119 ( -2.929 1.646 -5.836) 6.734 3.230 ( -0.526 -2.286 -13.139) 13.347 3.267 ( 3.053 -3.260 -6.580) 7.953 3.437 ( -1.227 1.173 1.419) 2.213 3.664 ( -7.443 -8.062 -0.488) 10.983 3.689 ( -3.909 -1.014 2.258) 4.626 3.954 ( -0.323 5.085 0.621) 5.133 4.064 ( -5.405 -0.480 0.835) 5.490 4.798 ( 13.432 17.423 -0.386) 22.003 4.818 ( 11.254 16.997 2.357) 20.521 5.850 ( 5.496 7.946 9.837) 13.788 5.901 ( 0.460 8.474 5.968) 10.375 6.117 ( -4.496 -2.197 -2.688) 5.681 6.311 ( -2.833 -2.805 0.038) 3.987 6.400 ( -3.256 -7.225 3.633) 8.718 6.533 ( -10.318 -8.671 4.038) 14.070 6.664 ( -3.782 2.071 -11.731) 12.498 6.770 ( -1.493 0.424 -10.526) 10.640 7.021 ( 3.888 -1.143 0.464) 4.079 7.166 ( -7.462 -4.480 3.680) 9.449 7.620 ( 4.741 4.294 -0.825) 6.449 7.707 ( 2.104 0.046 -0.999) 2.330 7.922 ( 5.529 4.822 0.790) 7.379 8.056 ( -1.115 -1.425 -4.173) 4.548 8.318 ( -0.661 3.381 0.156) 3.449 8.371 ( 2.839 0.004 -0.753) 2.937 8.430 ( 6.422 -1.752 4.552) 8.064 8.609 ( -4.737 -3.593 4.075) 7.208 8.656 ( -1.302 0.911 -0.753) 1.758 8.877 ( -4.828 5.692 -1.166) 7.554 9.000 ( -3.458 -10.051 -1.003) 10.677 9.148 ( -8.276 -5.994 -2.181) 10.449 10.637 ( 4.069 -2.363 0.252) 4.712 10.682 ( 1.696 -3.003 -0.202) 3.454 10.928 ( 6.296 2.349 3.481) 7.568 10.981 ( 5.320 -1.484 1.029) 5.618 13.134 ( 0.082 0.480 -3.751) 3.782 13.225 ( -5.032 -4.068 -3.144) 7.194 15.240 ( 20.441 30.241 9.936) 37.830 15.324 ( 18.664 29.919 16.728) 39.030 15.920 ( 0.826 -2.166 2.204) 3.199 15.994 ( 0.381 -1.261 4.504) 4.693 16.103 ( 8.711 8.226 -4.872) 12.934 16.363 ( -1.800 7.992 2.206) 8.484 18.186 ( -10.929 -21.036 -12.983) 27.028 18.338 ( -19.103 -25.422 -9.549) 33.202 21.419 ( 1.418 0.174 0.346) 1.470 21.465 ( -1.673 -1.874 1.181) 2.776 ======================= Grid point 321 (154/160) ======================= q-point: (-0.50 0.38 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 128 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.808 ( -2.280 1.486 -2.768) 3.882 1.808 ( 2.280 1.486 2.768) 3.882 2.047 ( -2.843 1.430 -2.467) 4.027 2.047 ( 2.843 1.430 2.467) 4.027 2.116 ( 1.588 -2.369 -4.481) 5.311 2.116 ( -1.588 -2.369 4.481) 5.311 2.329 ( 1.017 1.036 -0.828) 1.671 2.329 ( -1.017 1.036 0.828) 1.671 2.374 ( 0.217 -0.259 -0.635) 0.720 2.374 ( -0.217 -0.259 0.635) 0.720 2.722 ( -5.138 10.545 -4.937) 12.727 2.722 ( 5.138 10.545 4.937) 12.727 3.097 ( -1.039 -2.670 -4.693) 5.498 3.097 ( 1.039 -2.670 4.693) 5.498 3.344 ( -8.168 -8.652 0.629) 11.915 3.344 ( 8.168 -8.652 -0.629) 11.915 3.635 ( -2.451 -3.305 -0.219) 4.121 3.635 ( 2.451 -3.305 0.219) 4.121 3.985 ( -2.227 3.224 -1.371) 4.151 3.985 ( 2.227 3.224 1.371) 4.151 4.931 ( 2.210 20.189 -1.913) 20.399 4.931 ( -2.210 20.189 1.913) 20.399 5.930 ( 0.797 9.412 -1.124) 9.512 5.930 ( -0.797 9.412 1.124) 9.512 6.204 ( -5.646 -4.010 -8.662) 11.090 6.204 ( 5.646 -4.010 8.662) 11.090 6.423 ( 3.180 -5.644 -4.628) 7.962 6.423 ( -3.180 -5.644 4.628) 7.962 6.622 ( -1.170 -2.053 -7.775) 8.126 6.622 ( 1.170 -2.053 7.775) 8.126 7.092 ( 1.159 -3.248 -1.758) 3.871 7.092 ( -1.159 -3.248 1.758) 3.871 7.681 ( -2.520 2.710 -1.001) 3.834 7.681 ( 2.520 2.710 1.001) 3.834 8.005 ( -3.377 3.413 -0.502) 4.828 8.005 ( 3.377 3.413 0.502) 4.828 8.338 ( -2.557 -0.991 -1.724) 3.239 8.338 ( 2.557 -0.991 1.724) 3.239 8.557 ( -3.902 -2.954 -2.052) 5.307 8.557 ( 3.902 -2.954 2.052) 5.307 8.736 ( -7.425 3.222 -2.765) 8.553 8.736 ( 7.425 3.222 2.765) 8.553 9.020 ( -4.861 -7.182 -0.683) 8.699 9.020 ( 4.861 -7.182 0.683) 8.699 10.685 ( -0.300 -3.332 -1.182) 3.548 10.685 ( 0.300 -3.332 1.182) 3.548 11.017 ( -0.700 0.931 -1.409) 1.829 11.017 ( 0.700 0.931 1.409) 1.829 13.138 ( -2.793 -1.548 -0.352) 3.213 13.138 ( 2.793 -1.548 0.352) 3.213 15.548 ( 2.868 34.256 -4.147) 34.625 15.548 ( -2.868 34.256 4.147) 34.625 15.976 ( -2.006 1.891 -4.028) 4.881 15.976 ( 2.006 1.891 4.028) 4.881 16.246 ( 8.023 10.999 -5.302) 14.610 16.246 ( -8.023 10.999 5.302) 14.610 18.060 ( -5.534 -33.295 0.812) 33.762 18.060 ( 5.534 -33.295 -0.812) 33.762 21.446 ( -1.706 -0.731 0.240) 1.872 21.446 ( 1.706 -0.731 -0.240) 1.872 ======================= Grid point 327 (155/160) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( -0.000 -0.000 -0.000) 0.000 1.690 ( -0.000 0.000 0.000) 0.000 1.790 ( 0.000 0.000 -0.000) 0.000 1.790 ( 0.000 -0.000 0.000) 0.000 2.086 ( 0.000 0.000 0.000) 0.000 2.086 ( -0.000 0.000 0.000) 0.000 2.212 ( 0.000 -0.000 0.000) 0.000 2.212 ( 0.000 0.000 0.000) 0.000 2.570 ( -0.000 0.000 0.000) 0.000 2.570 ( 0.000 0.000 0.000) 0.000 2.702 ( -0.000 0.000 0.000) 0.000 2.702 ( 0.000 0.000 0.000) 0.000 3.636 ( -0.000 0.000 0.000) 0.000 3.636 ( 0.000 0.000 0.000) 0.000 3.747 ( 0.000 0.000 0.000) 0.000 3.747 ( 0.000 0.000 -0.000) 0.000 3.905 ( -0.000 0.000 0.000) 0.000 3.905 ( 0.000 0.000 0.000) 0.000 4.054 ( -0.000 -0.000 0.000) 0.000 4.054 ( 0.000 0.000 0.000) 0.000 4.194 ( -0.000 0.000 0.000) 0.000 4.194 ( 0.000 0.000 0.000) 0.000 5.741 ( -0.000 0.000 -0.000) 0.000 5.741 ( 0.000 0.000 0.000) 0.000 6.632 ( -0.000 0.000 0.000) 0.000 6.632 ( -0.000 0.000 0.000) 0.000 6.747 ( -0.000 0.000 0.000) 0.000 6.747 ( -0.000 0.000 0.000) 0.000 6.969 ( 0.000 0.000 0.000) 0.000 6.969 ( 0.000 0.000 0.000) 0.000 7.101 ( 0.000 0.000 0.000) 0.000 7.101 ( 0.000 0.000 0.000) 0.000 7.414 ( -0.000 0.000 0.000) 0.000 7.414 ( 0.000 0.000 0.000) 0.000 7.749 ( -0.000 0.000 0.000) 0.000 7.749 ( -0.000 0.000 0.000) 0.000 8.014 ( -0.000 0.000 0.000) 0.000 8.014 ( -0.000 0.000 0.000) 0.000 8.835 ( -0.000 0.000 0.000) 0.000 8.835 ( 0.000 0.000 0.000) 0.000 8.906 ( -0.000 -0.000 -0.000) 0.000 8.906 ( 0.000 0.000 0.000) 0.000 9.500 ( -0.000 0.000 0.000) 0.000 9.500 ( 0.000 0.000 0.000) 0.000 9.973 ( 0.000 0.000 0.000) 0.000 9.973 ( -0.000 0.000 0.000) 0.000 10.948 ( -0.000 0.000 0.000) 0.000 10.948 ( 0.000 0.000 0.000) 0.000 13.420 ( 0.000 0.000 0.000) 0.000 13.420 ( 0.000 0.000 0.000) 0.000 13.742 ( -0.000 0.000 0.000) 0.000 13.742 ( -0.000 0.000 0.000) 0.000 15.607 ( 0.000 0.000 0.000) 0.000 15.607 ( 0.000 0.000 0.000) 0.000 15.751 ( -0.000 0.000 0.000) 0.000 15.751 ( -0.000 0.000 0.000) 0.000 19.741 ( 0.000 0.000 0.000) 0.000 19.741 ( -0.000 0.000 0.000) 0.000 21.405 ( -0.000 0.000 0.000) 0.000 21.405 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 331 (156/160) ======================= q-point: ( 0.10 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( 6.490 -5.707 -1.526) 8.776 1.757 ( 6.490 5.707 -1.526) 8.776 1.857 ( 3.607 -1.320 7.238) 8.194 1.857 ( 3.607 1.320 7.238) 8.194 2.107 ( 1.621 -2.752 1.152) 3.395 2.107 ( 1.621 2.752 1.152) 3.395 2.225 ( 0.985 -1.516 1.200) 2.170 2.225 ( 0.985 1.516 1.200) 2.170 2.502 ( -4.026 -3.393 -4.270) 6.779 2.502 ( -4.026 3.393 -4.270) 6.779 2.711 ( -2.917 -4.146 4.152) 6.553 2.711 ( -2.917 4.146 4.152) 6.553 3.582 ( -1.663 -1.670 -6.771) 7.169 3.582 ( -1.663 1.670 -6.771) 7.169 3.747 ( -0.968 -3.385 0.493) 3.555 3.747 ( -0.968 3.385 0.493) 3.555 3.856 ( -3.194 -4.692 -3.758) 6.807 3.856 ( -3.194 4.692 -3.758) 6.807 4.009 ( -2.235 -2.433 0.377) 3.325 4.009 ( -2.235 2.433 0.377) 3.325 4.287 ( 8.236 -2.836 1.249) 8.800 4.287 ( 8.236 2.836 1.249) 8.800 5.724 ( -2.311 -1.044 0.778) 2.653 5.724 ( -2.311 1.044 0.778) 2.653 6.551 ( -7.497 -1.141 -2.568) 8.006 6.551 ( -7.497 1.141 -2.568) 8.006 6.778 ( 0.709 -1.407 4.001) 4.300 6.778 ( 0.709 1.407 4.001) 4.300 6.941 ( -3.410 -5.168 -1.019) 6.275 6.941 ( -3.410 5.168 -1.019) 6.275 7.141 ( 4.457 -3.262 -0.621) 5.558 7.141 ( 4.457 3.262 -0.621) 5.558 7.390 ( -0.632 -4.703 -0.721) 4.799 7.390 ( -0.632 4.703 -0.721) 4.799 7.819 ( 5.770 -1.420 2.173) 6.328 7.819 ( 5.770 1.420 2.173) 6.328 8.033 ( 3.157 -4.695 -1.470) 5.846 8.033 ( 3.157 4.695 -1.470) 5.846 8.733 ( -6.607 -5.059 0.039) 8.321 8.733 ( -6.607 5.059 0.039) 8.321 9.006 ( 3.882 -2.067 1.606) 4.682 9.006 ( 3.882 2.067 1.606) 4.682 9.362 ( -11.743 -3.762 -0.280) 12.334 9.362 ( -11.743 3.762 -0.280) 12.334 10.131 ( 13.645 -3.181 2.536) 14.238 10.131 ( 13.645 3.181 2.536) 14.238 10.889 ( -3.867 -1.073 -3.705) 5.462 10.889 ( -3.867 1.073 -3.705) 5.462 13.440 ( -1.678 -4.005 1.799) 4.700 13.440 ( -1.678 4.005 1.799) 4.700 13.865 ( 15.968 -0.896 2.311) 16.159 13.865 ( 15.968 0.896 2.311) 16.159 15.637 ( 1.020 -0.883 3.476) 3.729 15.637 ( 1.020 0.883 3.476) 3.729 15.813 ( 6.715 -2.414 0.792) 7.180 15.813 ( 6.715 2.414 0.792) 7.180 19.606 ( -11.834 -2.917 -6.346) 13.741 19.606 ( -11.834 2.917 -6.346) 13.741 21.406 ( -0.293 -1.245 0.622) 1.422 21.406 ( -0.293 1.245 0.622) 1.422 ======================= Grid point 333 (157/160) ======================= q-point: ( 0.20 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 5.453 -2.271 -1.760) 6.163 1.834 ( 5.453 2.271 -1.760) 6.163 2.001 ( 4.091 -5.604 2.867) 7.507 2.001 ( 4.091 5.604 2.867) 7.507 2.151 ( 1.405 -1.985 1.098) 2.668 2.151 ( 1.405 1.985 1.098) 2.668 2.286 ( 2.976 -5.206 3.887) 7.146 2.286 ( 2.976 5.206 3.887) 7.146 2.381 ( -3.833 -3.411 -3.659) 6.302 2.381 ( -3.833 3.411 -3.659) 6.302 2.681 ( -6.822 -3.225 4.058) 8.568 2.681 ( -6.822 3.225 4.058) 8.568 3.452 ( 0.118 -2.283 -12.012) 12.227 3.452 ( 0.118 2.283 -12.012) 12.227 3.689 ( -7.831 -0.318 -0.087) 7.838 3.689 ( -7.831 0.318 -0.087) 7.838 3.755 ( -2.594 -5.578 -2.213) 6.538 3.755 ( -2.594 5.578 -2.213) 6.538 4.022 ( 0.360 -4.091 2.804) 4.973 4.022 ( 0.360 4.091 2.804) 4.973 4.467 ( 12.645 -2.736 0.402) 12.944 4.467 ( 12.645 2.736 0.402) 12.944 5.707 ( -1.499 -1.025 3.154) 3.639 5.707 ( -1.499 1.025 3.154) 3.639 6.396 ( -7.049 -2.663 -2.059) 7.812 6.396 ( -7.049 2.663 -2.059) 7.812 6.717 ( -9.159 -4.224 -1.656) 10.221 6.717 ( -9.159 4.224 -1.656) 10.221 6.941 ( 2.065 -3.641 -0.138) 4.188 6.941 ( 2.065 3.641 -0.138) 4.188 7.145 ( -3.543 -7.656 0.249) 8.440 7.145 ( -3.543 7.656 0.249) 8.440 7.445 ( 6.941 -3.952 1.131) 8.067 7.445 ( 6.941 3.952 1.131) 8.067 7.941 ( 5.552 -6.348 0.739) 8.466 7.941 ( 5.552 6.348 0.739) 8.466 8.085 ( 6.782 -3.430 -2.210) 7.915 8.085 ( 6.782 3.430 -2.210) 7.915 8.648 ( -5.570 -7.768 2.079) 9.782 8.648 ( -5.570 7.768 2.079) 9.782 8.965 ( -8.614 -9.607 -1.273) 12.967 8.965 ( -8.614 9.607 -1.273) 12.967 9.242 ( -4.127 -6.919 1.626) 8.219 9.242 ( -4.127 6.919 1.626) 8.219 10.400 ( 13.740 -3.786 3.412) 14.655 10.400 ( 13.740 3.786 3.412) 14.655 10.779 ( -2.490 -2.036 -3.664) 4.875 10.779 ( -2.490 2.036 -3.664) 4.875 13.377 ( -3.995 -4.153 -3.392) 6.687 13.377 ( -3.995 4.153 -3.392) 6.687 14.319 ( 27.896 -2.493 11.806) 30.394 14.319 ( 27.896 2.493 11.806) 30.394 15.713 ( 2.180 -0.375 4.674) 5.171 15.713 ( 2.180 0.375 4.674) 5.171 15.972 ( 10.664 -4.995 1.354) 11.854 15.972 ( 10.664 4.995 1.354) 11.854 19.220 ( -22.051 -4.525 -12.033) 25.525 19.220 ( -22.051 4.525 -12.033) 25.525 21.411 ( -0.312 -2.001 1.132) 2.320 21.411 ( -0.312 2.001 1.132) 2.320 ======================= Grid point 335 (158/160) ======================= q-point: ( 0.30 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( 3.893 -4.094 -2.722) 6.271 1.886 ( 3.893 4.094 -2.722) 6.271 2.054 ( 1.807 -2.846 -0.173) 3.376 2.054 ( 1.807 2.847 -0.173) 3.376 2.140 ( -1.555 -2.599 -3.704) 4.785 2.140 ( -1.555 2.599 -3.704) 4.785 2.324 ( -1.431 -1.536 0.951) 2.305 2.324 ( -1.431 1.536 0.951) 2.305 2.374 ( 1.923 -4.235 1.812) 4.992 2.374 ( 1.923 4.235 1.812) 4.992 2.623 ( -3.927 -2.987 5.187) 7.159 2.623 ( -3.927 2.987 5.187) 7.159 3.324 ( 1.669 -1.558 -13.255) 13.451 3.324 ( 1.669 1.558 -13.255) 13.451 3.528 ( -10.134 -6.512 -1.010) 12.089 3.528 ( -10.134 6.512 -1.010) 12.089 3.693 ( -5.027 -2.407 0.722) 5.620 3.693 ( -5.027 2.407 0.722) 5.620 4.046 ( -0.971 -4.264 1.516) 4.629 4.046 ( -0.971 4.264 1.516) 4.629 4.714 ( 16.315 -1.041 1.627) 16.429 4.714 ( 16.315 1.041 1.627) 16.429 5.779 ( 4.200 -3.017 6.079) 7.981 5.779 ( 4.200 3.017 6.079) 7.981 6.292 ( -4.671 -4.195 0.638) 6.310 6.292 ( -4.671 4.195 0.638) 6.310 6.514 ( -12.252 -5.986 -2.371) 13.841 6.514 ( -12.252 5.986 -2.371) 13.841 6.907 ( -0.837 -0.737 -7.991) 8.069 6.907 ( -0.837 0.737 -7.991) 8.069 7.089 ( -5.495 -8.675 4.040) 11.035 7.089 ( -5.495 8.675 4.040) 11.035 7.587 ( 8.070 -2.766 0.389) 8.540 7.587 ( 8.070 2.766 0.389) 8.540 7.987 ( 2.870 -7.839 -3.145) 8.921 7.987 ( 2.870 7.839 -3.145) 8.921 8.223 ( 9.922 -0.602 1.013) 9.992 8.223 ( 9.922 0.602 1.013) 9.992 8.573 ( -7.645 -8.931 1.858) 11.902 8.573 ( -7.645 8.931 1.858) 11.902 8.819 ( -5.968 -10.164 0.278) 11.789 8.819 ( -5.968 10.164 0.278) 11.789 9.167 ( -6.715 -6.866 -1.010) 9.657 9.167 ( -6.715 6.866 -1.010) 9.657 10.584 ( 5.147 -2.640 -0.234) 5.789 10.584 ( 5.147 2.640 -0.234) 5.789 10.803 ( 6.919 -0.651 2.730) 7.466 10.803 ( 6.919 0.651 2.730) 7.466 13.261 ( -3.707 -3.576 -4.949) 7.143 13.261 ( -3.707 3.576 -4.949) 7.143 14.983 ( 30.649 -1.626 17.936) 35.549 14.983 ( 30.649 1.626 17.936) 35.549 15.805 ( 2.914 -1.195 3.680) 4.844 15.805 ( 2.914 1.195 3.680) 4.844 16.169 ( 11.777 -7.510 0.227) 13.970 16.169 ( 11.777 7.510 0.227) 13.970 18.638 ( -28.712 -5.004 -15.409) 32.968 18.638 ( -28.712 5.004 -15.409) 32.968 21.422 ( -0.142 -1.975 1.261) 2.348 21.422 ( -0.142 1.975 1.261) 2.348 ======================= Grid point 337 (159/160) ======================= q-point: ( 0.40 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 150 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( -1.388 -4.369 -3.623) 5.842 1.878 ( -1.388 4.369 -3.623) 5.842 2.044 ( -0.715 -0.869 -0.322) 1.171 2.044 ( -0.715 0.869 -0.322) 1.171 2.101 ( 2.377 -2.997 -2.804) 4.743 2.101 ( 2.377 2.997 -2.804) 4.743 2.319 ( -0.147 -1.048 0.946) 1.420 2.319 ( -0.147 1.048 0.946) 1.420 2.390 ( -0.427 -1.331 -0.518) 1.491 2.390 ( -0.427 1.331 -0.518) 1.491 2.722 ( 4.333 -6.407 9.692) 12.400 2.722 ( 4.333 6.407 9.692) 12.400 3.188 ( 0.384 -1.916 -13.120) 13.265 3.188 ( 0.384 1.916 -13.120) 13.265 3.335 ( -11.251 -9.588 -1.840) 14.897 3.335 ( -11.251 9.588 -1.840) 14.897 3.623 ( -4.183 -3.537 1.429) 5.661 3.623 ( -4.183 3.537 1.429) 5.661 4.032 ( -1.469 -2.625 0.223) 3.016 4.032 ( -1.469 2.625 0.223) 3.016 5.011 ( 15.235 -0.867 2.703) 15.497 5.011 ( 15.235 0.867 2.703) 15.497 5.953 ( 6.998 -3.323 4.501) 8.960 5.953 ( 6.998 3.323 4.501) 8.960 6.234 ( -7.780 -11.158 2.181) 13.777 6.234 ( -7.780 11.158 2.181) 13.777 6.320 ( -5.644 -6.039 2.012) 8.507 6.320 ( -5.644 6.039 2.012) 8.507 6.746 ( -4.660 -3.566 -10.895) 12.374 6.746 ( -4.660 3.566 -10.895) 12.374 7.061 ( -2.671 -4.600 2.440) 5.852 7.061 ( -2.671 4.600 2.440) 5.852 7.689 ( 4.326 -2.226 -0.864) 4.941 7.689 ( 4.326 2.226 -0.864) 4.941 8.009 ( 3.938 -3.242 -1.561) 5.334 8.009 ( 3.938 3.242 -1.561) 5.334 8.370 ( 3.880 -2.269 -1.470) 4.729 8.370 ( 3.880 2.269 -1.470) 4.729 8.462 ( -4.817 -6.852 3.512) 9.082 8.462 ( -4.817 6.852 3.512) 9.082 8.789 ( 0.395 -8.959 0.721) 8.996 8.789 ( 0.395 8.959 0.721) 8.996 9.016 ( -8.467 -6.700 -1.948) 10.971 9.016 ( -8.467 6.700 -1.948) 10.971 10.631 ( 2.187 -1.529 -0.190) 2.675 10.631 ( 2.187 1.529 -0.190) 2.675 10.961 ( 5.855 -0.980 2.915) 6.614 10.961 ( 5.855 0.980 2.915) 6.614 13.161 ( -2.201 -2.188 -3.305) 4.534 13.161 ( -2.201 2.188 -3.305) 4.534 15.656 ( 21.638 -5.275 19.137) 29.364 15.656 ( 21.638 5.275 19.137) 29.364 15.887 ( 3.952 -6.238 1.460) 7.528 15.887 ( 3.952 6.238 1.460) 7.528 16.346 ( 11.859 -10.350 -2.981) 16.020 16.346 ( 11.859 10.350 -2.981) 16.020 17.985 ( -27.957 -4.962 -13.778) 31.560 17.985 ( -27.957 4.962 -13.778) 31.560 21.433 ( -0.020 -1.205 0.831) 1.464 21.433 ( -0.020 1.205 0.831) 1.464 ======================= Grid point 339 (160/160) ======================= q-point: (-0.50 -0.50 0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 6.24e-05 6.24e-05 6.24e-05 6.24e-05 2.98e-04 2.98e-04 1.16e-06 1.16e-06 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 80 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( 0.000 0.000 -0.000) 0.000 1.823 ( 0.000 0.000 0.000) 0.000 2.064 ( 0.000 0.000 -0.000) 0.000 2.064 ( 0.000 0.000 -0.000) 0.000 2.093 ( 0.000 0.000 -0.000) 0.000 2.093 ( 0.000 0.000 0.000) 0.000 2.342 ( -0.000 0.000 -0.000) 0.000 2.342 ( 0.000 0.000 -0.000) 0.000 2.366 ( 0.000 0.000 0.000) 0.000 2.366 ( 0.000 0.000 0.000) 0.000 2.893 ( 0.000 -0.000 -0.000) 0.000 2.893 ( 0.000 0.000 0.000) 0.000 3.048 ( 0.000 0.000 -0.000) 0.000 3.048 ( 0.000 0.000 0.000) 0.000 3.212 ( 0.000 0.000 0.000) 0.000 3.212 ( 0.000 0.000 0.000) 0.000 3.598 ( -0.000 -0.000 -0.000) 0.000 3.598 ( 0.000 0.000 0.000) 0.000 4.019 ( 0.000 0.000 -0.000) 0.000 4.019 ( 0.000 0.000 0.000) 0.000 5.177 ( 0.000 0.000 -0.000) 0.000 5.177 ( 0.000 0.000 0.000) 0.000 6.016 ( -0.000 0.000 0.000) 0.000 6.016 ( 0.000 0.000 0.000) 0.000 6.165 ( 0.000 0.000 -0.000) 0.000 6.165 ( 0.000 0.000 -0.000) 0.000 6.362 ( 0.000 0.000 -0.000) 0.000 6.362 ( -0.000 0.000 0.000) 0.000 6.588 ( 0.000 0.000 -0.000) 0.000 6.588 ( 0.000 0.000 0.000) 0.000 7.054 ( 0.000 0.000 -0.000) 0.000 7.054 ( 0.000 0.000 -0.000) 0.000 7.715 ( 0.000 0.000 -0.000) 0.000 7.715 ( 0.000 0.000 0.000) 0.000 8.050 ( 0.000 0.000 -0.000) 0.000 8.050 ( 0.000 0.000 0.000) 0.000 8.327 ( 0.000 0.000 -0.000) 0.000 8.327 ( 0.000 0.000 0.000) 0.000 8.505 ( 0.000 0.000 -0.000) 0.000 8.505 ( 0.000 0.000 0.000) 0.000 8.811 ( 0.000 -0.000 -0.000) 0.000 8.811 ( 0.000 0.000 0.000) 0.000 8.910 ( 0.000 -0.000 -0.000) 0.000 8.910 ( 0.000 0.000 0.000) 0.000 10.650 ( 0.000 0.000 -0.000) 0.000 10.650 ( 0.000 0.000 0.000) 0.000 11.028 ( 0.000 0.000 0.000) 0.000 11.028 ( 0.000 0.000 0.000) 0.000 13.123 ( 0.000 0.000 0.000) 0.000 13.123 ( 0.000 0.000 -0.000) 0.000 15.883 ( 0.000 0.000 -0.000) 0.000 15.883 ( 0.000 0.000 0.000) 0.000 16.030 ( 0.000 0.000 0.000) 0.000 16.030 ( 0.000 0.000 -0.000) 0.000 16.459 ( 0.000 0.000 0.000) 0.000 16.459 ( 0.000 0.000 -0.000) 0.000 17.603 ( 0.000 0.000 0.000) 0.000 17.603 ( 0.000 0.000 0.000) 0.000 21.438 ( 0.000 0.000 -0.000) 0.000 21.438 ( 0.000 0.000 0.000) 0.000 =================== End of collection of collisions =================== ----------- Thermal conductivity (W/m-k) with tetrahedron method ----------- # T(K) xx yy zz yz xz xy #ipm 0.0 0.000 0.000 0.000 0.000 0.000 0.000 3/28800 10.0 391.734 347.901 326.772 0.000 -41.163 0.000 3/28800 20.0 78.751 68.706 51.512 0.000 -8.946 0.000 3/28800 30.0 31.217 27.325 20.670 0.000 -3.078 0.000 3/28800 40.0 17.891 15.736 12.163 0.000 -1.631 0.000 3/28800 50.0 12.208 10.790 8.452 0.000 -1.058 0.000 3/28800 60.0 9.159 8.121 6.410 0.000 -0.763 0.000 3/28800 70.0 7.296 6.479 5.136 0.000 -0.588 0.000 3/28800 80.0 6.056 5.380 4.277 0.000 -0.473 0.000 3/28800 90.0 5.183 4.601 3.666 0.000 -0.393 0.000 3/28800 100.0 4.538 4.024 3.211 0.000 -0.335 0.000 3/28800 110.0 4.044 3.582 2.862 0.000 -0.291 0.000 3/28800 120.0 3.656 3.233 2.585 0.000 -0.256 0.000 3/28800 130.0 3.341 2.951 2.362 0.000 -0.229 0.000 3/28800 140.0 3.082 2.720 2.178 0.000 -0.206 0.000 3/28800 150.0 2.865 2.525 2.023 0.000 -0.188 0.000 3/28800 160.0 2.679 2.360 1.891 0.000 -0.172 0.000 3/28800 170.0 2.518 2.217 1.777 0.000 -0.159 0.000 3/28800 180.0 2.378 2.093 1.677 0.000 -0.147 0.000 3/28800 190.0 2.254 1.983 1.590 0.000 -0.137 0.000 3/28800 200.0 2.143 1.885 1.512 0.000 -0.128 0.000 3/28800 210.0 2.044 1.798 1.442 0.000 -0.121 0.000 3/28800 220.0 1.954 1.719 1.378 0.000 -0.114 0.000 3/28800 230.0 1.872 1.647 1.321 0.000 -0.108 0.000 3/28800 240.0 1.797 1.581 1.268 0.000 -0.102 0.000 3/28800 250.0 1.729 1.521 1.220 0.000 -0.097 0.000 3/28800 260.0 1.665 1.465 1.175 0.000 -0.093 0.000 3/28800 270.0 1.607 1.414 1.134 0.000 -0.088 0.000 3/28800 280.0 1.552 1.366 1.096 0.000 -0.085 0.000 3/28800 290.0 1.501 1.321 1.060 0.000 -0.081 0.000 3/28800 300.0 1.454 1.280 1.027 0.000 -0.078 0.000 3/28800 310.0 1.409 1.241 0.995 0.000 -0.075 0.000 3/28800 320.0 1.367 1.204 0.966 0.000 -0.072 0.000 3/28800 330.0 1.328 1.170 0.938 0.000 -0.070 0.000 3/28800 340.0 1.290 1.137 0.912 0.000 -0.067 0.000 3/28800 350.0 1.255 1.106 0.888 0.000 -0.065 0.000 3/28800 360.0 1.222 1.077 0.864 0.000 -0.063 0.000 3/28800 370.0 1.191 1.049 0.842 0.000 -0.061 0.000 3/28800 380.0 1.161 1.023 0.821 0.000 -0.059 0.000 3/28800 390.0 1.132 0.998 0.801 0.000 -0.058 0.000 3/28800 400.0 1.105 0.974 0.782 0.000 -0.056 0.000 3/28800 410.0 1.079 0.952 0.764 0.000 -0.054 0.000 3/28800 420.0 1.055 0.930 0.746 0.000 -0.053 0.000 3/28800 430.0 1.031 0.909 0.730 0.000 -0.052 0.000 3/28800 440.0 1.008 0.890 0.714 0.000 -0.050 0.000 3/28800 450.0 0.987 0.871 0.699 0.000 -0.049 0.000 3/28800 460.0 0.966 0.853 0.684 0.000 -0.048 0.000 3/28800 470.0 0.946 0.835 0.670 0.000 -0.047 0.000 3/28800 480.0 0.927 0.818 0.657 0.000 -0.046 0.000 3/28800 490.0 0.909 0.802 0.644 0.000 -0.045 0.000 3/28800 500.0 0.891 0.787 0.632 0.000 -0.044 0.000 3/28800 510.0 0.874 0.772 0.620 0.000 -0.043 0.000 3/28800 520.0 0.858 0.758 0.608 0.000 -0.042 0.000 3/28800 530.0 0.842 0.744 0.597 0.000 -0.041 0.000 3/28800 540.0 0.827 0.731 0.586 0.000 -0.040 0.000 3/28800 550.0 0.813 0.718 0.576 0.000 -0.039 0.000 3/28800 560.0 0.799 0.705 0.566 0.000 -0.039 0.000 3/28800 570.0 0.785 0.693 0.557 0.000 -0.038 0.000 3/28800 580.0 0.772 0.682 0.547 0.000 -0.037 0.000 3/28800 590.0 0.759 0.670 0.538 0.000 -0.037 0.000 3/28800 600.0 0.747 0.660 0.530 0.000 -0.036 0.000 3/28800 610.0 0.735 0.649 0.521 0.000 -0.035 0.000 3/28800 620.0 0.723 0.639 0.513 0.000 -0.035 0.000 3/28800 630.0 0.712 0.629 0.505 0.000 -0.034 0.000 3/28800 640.0 0.701 0.619 0.497 0.000 -0.034 0.000 3/28800 650.0 0.691 0.610 0.490 0.000 -0.033 0.000 3/28800 660.0 0.680 0.601 0.483 0.000 -0.032 0.000 3/28800 670.0 0.670 0.592 0.476 0.000 -0.032 0.000 3/28800 680.0 0.661 0.584 0.469 0.000 -0.031 0.000 3/28800 690.0 0.651 0.576 0.462 0.000 -0.031 0.000 3/28800 700.0 0.642 0.568 0.456 0.000 -0.031 0.000 3/28800 710.0 0.633 0.560 0.449 0.000 -0.030 0.000 3/28800 720.0 0.625 0.552 0.443 0.000 -0.030 0.000 3/28800 730.0 0.616 0.545 0.437 0.000 -0.029 0.000 3/28800 740.0 0.608 0.538 0.432 0.000 -0.029 0.000 3/28800 750.0 0.600 0.530 0.426 0.000 -0.028 0.000 3/28800 760.0 0.592 0.524 0.420 0.000 -0.028 0.000 3/28800 770.0 0.585 0.517 0.415 0.000 -0.028 0.000 3/28800 780.0 0.577 0.510 0.410 0.000 -0.027 0.000 3/28800 790.0 0.570 0.504 0.405 0.000 -0.027 0.000 3/28800 800.0 0.563 0.498 0.400 0.000 -0.027 0.000 3/28800 810.0 0.556 0.492 0.395 0.000 -0.026 0.000 3/28800 820.0 0.550 0.486 0.390 0.000 -0.026 0.000 3/28800 830.0 0.543 0.480 0.386 0.000 -0.026 0.000 3/28800 840.0 0.537 0.475 0.381 0.000 -0.025 0.000 3/28800 850.0 0.531 0.469 0.377 0.000 -0.025 0.000 3/28800 860.0 0.525 0.464 0.372 0.000 -0.025 0.000 3/28800 870.0 0.519 0.459 0.368 0.000 -0.024 0.000 3/28800 880.0 0.513 0.453 0.364 0.000 -0.024 0.000 3/28800 890.0 0.507 0.448 0.360 0.000 -0.024 0.000 3/28800 900.0 0.502 0.443 0.356 0.000 -0.024 0.000 3/28800 910.0 0.496 0.439 0.352 0.000 -0.023 0.000 3/28800 920.0 0.491 0.434 0.348 0.000 -0.023 0.000 3/28800 930.0 0.486 0.429 0.345 0.000 -0.023 0.000 3/28800 940.0 0.480 0.425 0.341 0.000 -0.022 0.000 3/28800 950.0 0.475 0.420 0.338 0.000 -0.022 0.000 3/28800 960.0 0.471 0.416 0.334 0.000 -0.022 0.000 3/28800 970.0 0.466 0.412 0.331 0.000 -0.022 0.000 3/28800 980.0 0.461 0.408 0.327 0.000 -0.022 0.000 3/28800 990.0 0.456 0.404 0.324 0.000 -0.021 0.000 3/28800 1000.0 0.452 0.400 0.321 0.000 -0.021 0.000 3/28800 Thermal conductivity related properties were written into "kappa-m1086.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 13:35:00]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|