----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 23:30:34]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 16 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.639391590153657 0.000000000000000 0.000000000000000 b 0.000000000000000 5.762111170000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): *1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 2 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 *3 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 *4 Cd 0.25606070659306 0.54332807006576 0.25537319104264 112.411 5 Cd 0.74393929340694 0.04332807006576 0.24462680895736 112.411 6 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 7 Cd 0.25606070659306 0.95667192993424 0.75537319104264 112.411 8 Cd 0.74393929340694 0.45667192993424 0.74462680895736 112.411 *9 O 0.64292814298799 0.08429915901941 0.76157305937707 15.999 *10 O 0.91944529437296 0.30329045649909 0.07651300385691 15.999 *11 O 0.25595575814534 0.33145792360029 0.44433267307554 15.999 12 O 0.74404424185466 0.83145792360029 0.05566732692446 15.999 13 O 0.08055470562703 0.80329045649909 0.42348699614309 15.999 14 O 0.35707185701201 0.58429915901941 0.73842694062293 15.999 15 O 0.64292814298799 0.41570084098059 0.26157305937707 15.999 16 O 0.91944529437296 0.19670954350091 0.57651300385691 15.999 17 O 0.25595575814534 0.16854207639971 0.94433267307554 15.999 18 O 0.74404424185466 0.66854207639971 0.55566732692446 15.999 19 O 0.08055470562703 0.69670954350091 0.92348699614309 15.999 20 O 0.35707185701201 0.91570084098059 0.23842694062293 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.639391590153657 0.000000000000000 0.000000000000000 b 0.000000000000000 5.762111170000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): *1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 > 1 2 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 > 2 *3 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 > 3 *4 Cd 0.25606070659306 0.54332807006576 0.25537319104264 112.411 > 4 5 Cd 0.74393929340694 0.04332807006576 0.24462680895736 112.411 > 5 6 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 > 6 7 Cd 0.25606070659306 0.95667192993424 0.75537319104264 112.411 > 7 8 Cd 0.74393929340694 0.45667192993424 0.74462680895736 112.411 > 8 *9 O 0.64292814298799 0.08429915901941 0.76157305937707 15.999 > 9 *10 O 0.91944529437296 0.30329045649909 0.07651300385691 15.999 > 10 *11 O 0.25595575814534 0.33145792360029 0.44433267307554 15.999 > 11 12 O 0.74404424185466 0.83145792360029 0.05566732692446 15.999 > 12 13 O 0.08055470562703 0.80329045649909 0.42348699614309 15.999 > 13 14 O 0.35707185701201 0.58429915901941 0.73842694062293 15.999 > 14 15 O 0.64292814298799 0.41570084098059 0.26157305937707 15.999 > 15 16 O 0.91944529437296 0.19670954350091 0.57651300385691 15.999 > 16 17 O 0.25595575814534 0.16854207639971 0.94433267307554 15.999 > 17 18 O 0.74404424185466 0.66854207639971 0.55566732692446 15.999 > 18 19 O 0.08055470562703 0.69670954350091 0.92348699614309 15.999 > 19 20 O 0.35707185701201 0.91570084098059 0.23842694062293 15.999 > 20 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.278783180307315 0.000000000000000 0.000000000000000 b 0.000000000000000 11.524222340000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): *1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 > 1 2 U 0.50000000000000 0.00000000000000 0.00000000000000 238.029 > 1 3 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 > 1 4 U 0.50000000000000 0.50000000000000 0.00000000000000 238.029 > 1 5 U 0.00000000000000 0.25000000000000 0.50000000000000 238.029 > 2 6 U 0.50000000000000 0.25000000000000 0.50000000000000 238.029 > 2 7 U 0.00000000000000 0.75000000000000 0.50000000000000 238.029 > 2 8 U 0.50000000000000 0.75000000000000 0.50000000000000 238.029 > 2 *9 Cd 0.25000000000000 0.00000000000000 0.50000000000000 112.411 > 3 10 Cd 0.75000000000000 0.00000000000000 0.50000000000000 112.411 > 3 11 Cd 0.25000000000000 0.50000000000000 0.50000000000000 112.411 > 3 12 Cd 0.75000000000000 0.50000000000000 0.50000000000000 112.411 > 3 *13 Cd 0.12803035329653 0.27166403503288 0.25537319104264 112.411 > 4 14 Cd 0.62803035329653 0.27166403503288 0.25537319104264 112.411 > 4 15 Cd 0.12803035329653 0.77166403503288 0.25537319104264 112.411 > 4 16 Cd 0.62803035329653 0.77166403503288 0.25537319104264 112.411 > 4 17 Cd 0.37196964670347 0.02166403503288 0.24462680895736 112.411 > 5 18 Cd 0.87196964670347 0.02166403503288 0.24462680895736 112.411 > 5 19 Cd 0.37196964670347 0.52166403503288 0.24462680895736 112.411 > 5 20 Cd 0.87196964670347 0.52166403503288 0.24462680895736 112.411 > 5 21 Cd 0.25000000000000 0.25000000000000 0.00000000000000 112.411 > 6 22 Cd 0.75000000000000 0.25000000000000 0.00000000000000 112.411 > 6 23 Cd 0.25000000000000 0.75000000000000 0.00000000000000 112.411 > 6 24 Cd 0.75000000000000 0.75000000000000 0.00000000000000 112.411 > 6 25 Cd 0.12803035329653 0.47833596496712 0.75537319104264 112.411 > 7 26 Cd 0.62803035329653 0.47833596496712 0.75537319104264 112.411 > 7 27 Cd 0.12803035329653 0.97833596496712 0.75537319104264 112.411 > 7 28 Cd 0.62803035329653 0.97833596496712 0.75537319104264 112.411 > 7 29 Cd 0.37196964670347 0.22833596496712 0.74462680895736 112.411 > 8 30 Cd 0.87196964670347 0.22833596496712 0.74462680895736 112.411 > 8 31 Cd 0.37196964670347 0.72833596496712 0.74462680895736 112.411 > 8 32 Cd 0.87196964670347 0.72833596496712 0.74462680895736 112.411 > 8 *33 O 0.32146407149399 0.04214957950971 0.76157305937707 15.999 > 9 34 O 0.82146407149399 0.04214957950971 0.76157305937707 15.999 > 9 35 O 0.32146407149399 0.54214957950971 0.76157305937707 15.999 > 9 36 O 0.82146407149399 0.54214957950971 0.76157305937707 15.999 > 9 *37 O 0.45972264718648 0.15164522824954 0.07651300385691 15.999 > 10 38 O 0.95972264718648 0.15164522824954 0.07651300385691 15.999 > 10 39 O 0.45972264718648 0.65164522824954 0.07651300385691 15.999 > 10 40 O 0.95972264718648 0.65164522824954 0.07651300385691 15.999 > 10 *41 O 0.12797787907267 0.16572896180014 0.44433267307554 15.999 > 11 42 O 0.62797787907267 0.16572896180014 0.44433267307554 15.999 > 11 43 O 0.12797787907267 0.66572896180014 0.44433267307554 15.999 > 11 44 O 0.62797787907267 0.66572896180014 0.44433267307554 15.999 > 11 45 O 0.37202212092733 0.41572896180014 0.05566732692446 15.999 > 12 46 O 0.87202212092733 0.41572896180014 0.05566732692446 15.999 > 12 47 O 0.37202212092733 0.91572896180014 0.05566732692446 15.999 > 12 48 O 0.87202212092733 0.91572896180014 0.05566732692446 15.999 > 12 49 O 0.04027735281352 0.40164522824955 0.42348699614309 15.999 > 13 50 O 0.54027735281352 0.40164522824955 0.42348699614309 15.999 > 13 51 O 0.04027735281352 0.90164522824955 0.42348699614309 15.999 > 13 52 O 0.54027735281352 0.90164522824955 0.42348699614309 15.999 > 13 53 O 0.17853592850600 0.29214957950971 0.73842694062293 15.999 > 14 54 O 0.67853592850600 0.29214957950971 0.73842694062293 15.999 > 14 55 O 0.17853592850600 0.79214957950971 0.73842694062293 15.999 > 14 56 O 0.67853592850600 0.79214957950971 0.73842694062293 15.999 > 14 57 O 0.32146407149399 0.20785042049029 0.26157305937707 15.999 > 15 58 O 0.82146407149399 0.20785042049029 0.26157305937707 15.999 > 15 59 O 0.32146407149399 0.70785042049029 0.26157305937707 15.999 > 15 60 O 0.82146407149399 0.70785042049029 0.26157305937707 15.999 > 15 61 O 0.45972264718648 0.09835477175045 0.57651300385691 15.999 > 16 62 O 0.95972264718648 0.09835477175045 0.57651300385691 15.999 > 16 63 O 0.45972264718648 0.59835477175046 0.57651300385691 15.999 > 16 64 O 0.95972264718648 0.59835477175046 0.57651300385691 15.999 > 16 65 O 0.12797787907267 0.08427103819986 0.94433267307554 15.999 > 17 66 O 0.62797787907267 0.08427103819986 0.94433267307554 15.999 > 17 67 O 0.12797787907267 0.58427103819986 0.94433267307554 15.999 > 17 68 O 0.62797787907267 0.58427103819986 0.94433267307554 15.999 > 17 69 O 0.37202212092733 0.33427103819986 0.55566732692446 15.999 > 18 70 O 0.87202212092733 0.33427103819986 0.55566732692446 15.999 > 18 71 O 0.37202212092733 0.83427103819986 0.55566732692446 15.999 > 18 72 O 0.87202212092733 0.83427103819986 0.55566732692446 15.999 > 18 73 O 0.04027735281352 0.34835477175045 0.92348699614309 15.999 > 19 74 O 0.54027735281352 0.34835477175045 0.92348699614309 15.999 > 19 75 O 0.04027735281352 0.84835477175045 0.92348699614309 15.999 > 19 76 O 0.54027735281352 0.84835477175045 0.92348699614309 15.999 > 19 77 O 0.17853592850600 0.45785042049029 0.23842694062293 15.999 > 20 78 O 0.67853592850600 0.45785042049029 0.23842694062293 15.999 > 20 79 O 0.17853592850600 0.95785042049029 0.23842694062293 15.999 > 20 80 O 0.67853592850600 0.95785042049029 0.23842694062293 15.999 > 20 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.4345445 0.0000000 -0.0791181 0.0000000 5.5624190 0.0000000 -0.0791203 0.0000000 5.2866722 -------------------------- Born effective charges -------------------------- 1 U 6.0153976 -0.2444089 -0.2319165 -0.1933514 5.9944937 -0.5470228 -0.3318791 0.0489776 5.5462315 2 U 6.0153976 0.2444089 -0.2319165 0.1933514 5.9944937 0.5470228 -0.3318791 -0.0489776 5.5462315 3 Cd 2.7099109 -0.3323719 0.3204715 0.2119988 2.7881294 0.1755981 -0.2408450 0.2593148 2.6961328 4 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 5 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 6 Cd 2.7099109 0.3323719 0.3204715 -0.2119988 2.7881294 -0.1755981 -0.2408450 -0.2593148 2.6961328 7 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 8 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 9 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 10 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 11 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 12 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 13 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 14 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 15 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 16 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 17 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 18 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 19 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 20 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 ---------------------------------------------------------------------------- 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: 2.219 Solver_block: 200 / 640 - Time: 2.227 Solver_block: 300 / 640 - Time: 2.219 Solver_block: 400 / 640 - Time: 2.218 Solver_block: 500 / 640 - Time: 2.219 Solver_block: 600 / 640 - Time: 2.219 Solver_block: 640 / 640 - Time: 0.955 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.324 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 240/240 Permutation basis: 7440/7440 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1908 Number of blocks in projector: 1908 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 404 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 232 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 232 Use standard eigh solver. Tree of FC basis block matrices: - (1908, 1855), data: False |-- (232, 226), data: True |-- (232, 226), data: True |-- (232, 226), data: True |-- (404, 393), data: True |-- (404, 392), data: True |-- (404, 392), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 23:31:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:31:08]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.639391590153657 0.000000000000000 0.000000000000000 b 0.000000000000000 5.762111170000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): 1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 2 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 3 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 4 Cd 0.25606070659306 0.54332807006576 0.25537319104264 112.411 5 Cd 0.74393929340694 0.04332807006576 0.24462680895736 112.411 6 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 7 Cd 0.25606070659306 0.95667192993424 0.75537319104264 112.411 8 Cd 0.74393929340694 0.45667192993424 0.74462680895736 112.411 9 O 0.64292814298799 0.08429915901941 0.76157305937707 15.999 10 O 0.91944529437296 0.30329045649909 0.07651300385691 15.999 11 O 0.25595575814534 0.33145792360029 0.44433267307554 15.999 12 O 0.74404424185466 0.83145792360029 0.05566732692446 15.999 13 O 0.08055470562703 0.80329045649909 0.42348699614309 15.999 14 O 0.35707185701201 0.58429915901941 0.73842694062293 15.999 15 O 0.64292814298799 0.41570084098059 0.26157305937707 15.999 16 O 0.91944529437296 0.19670954350091 0.57651300385691 15.999 17 O 0.25595575814534 0.16854207639971 0.94433267307554 15.999 18 O 0.74404424185466 0.66854207639971 0.55566732692446 15.999 19 O 0.08055470562703 0.69670954350091 0.92348699614309 15.999 20 O 0.35707185701201 0.91570084098059 0.23842694062293 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.278783180307315 0.000000000000000 0.000000000000000 b 0.000000000000000 11.524222340000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): 1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 > 1 2 U 0.50000000000000 0.00000000000000 0.00000000000000 238.029 > 1 3 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 > 1 4 U 0.50000000000000 0.50000000000000 0.00000000000000 238.029 > 1 5 U 0.00000000000000 0.25000000000000 0.50000000000000 238.029 > 5 6 U 0.50000000000000 0.25000000000000 0.50000000000000 238.029 > 5 7 U 0.00000000000000 0.75000000000000 0.50000000000000 238.029 > 5 8 U 0.50000000000000 0.75000000000000 0.50000000000000 238.029 > 5 9 Cd 0.25000000000000 0.00000000000000 0.50000000000000 112.411 > 9 10 Cd 0.75000000000000 0.00000000000000 0.50000000000000 112.411 > 9 11 Cd 0.25000000000000 0.50000000000000 0.50000000000000 112.411 > 9 12 Cd 0.75000000000000 0.50000000000000 0.50000000000000 112.411 > 9 13 Cd 0.12803035329653 0.27166403503288 0.25537319104264 112.411 > 13 14 Cd 0.62803035329653 0.27166403503288 0.25537319104264 112.411 > 13 15 Cd 0.12803035329653 0.77166403503288 0.25537319104264 112.411 > 13 16 Cd 0.62803035329653 0.77166403503288 0.25537319104264 112.411 > 13 17 Cd 0.37196964670347 0.02166403503288 0.24462680895736 112.411 > 17 18 Cd 0.87196964670347 0.02166403503288 0.24462680895736 112.411 > 17 19 Cd 0.37196964670347 0.52166403503288 0.24462680895736 112.411 > 17 20 Cd 0.87196964670347 0.52166403503288 0.24462680895736 112.411 > 17 21 Cd 0.25000000000000 0.25000000000000 0.00000000000000 112.411 > 21 22 Cd 0.75000000000000 0.25000000000000 0.00000000000000 112.411 > 21 23 Cd 0.25000000000000 0.75000000000000 0.00000000000000 112.411 > 21 24 Cd 0.75000000000000 0.75000000000000 0.00000000000000 112.411 > 21 25 Cd 0.12803035329653 0.47833596496712 0.75537319104264 112.411 > 25 26 Cd 0.62803035329653 0.47833596496712 0.75537319104264 112.411 > 25 27 Cd 0.12803035329653 0.97833596496712 0.75537319104264 112.411 > 25 28 Cd 0.62803035329653 0.97833596496712 0.75537319104264 112.411 > 25 29 Cd 0.37196964670347 0.22833596496712 0.74462680895736 112.411 > 29 30 Cd 0.87196964670347 0.22833596496712 0.74462680895736 112.411 > 29 31 Cd 0.37196964670347 0.72833596496712 0.74462680895736 112.411 > 29 32 Cd 0.87196964670347 0.72833596496712 0.74462680895736 112.411 > 29 33 O 0.32146407149399 0.04214957950971 0.76157305937707 15.999 > 33 34 O 0.82146407149399 0.04214957950971 0.76157305937707 15.999 > 33 35 O 0.32146407149399 0.54214957950971 0.76157305937707 15.999 > 33 36 O 0.82146407149399 0.54214957950971 0.76157305937707 15.999 > 33 37 O 0.45972264718648 0.15164522824954 0.07651300385691 15.999 > 37 38 O 0.95972264718648 0.15164522824954 0.07651300385691 15.999 > 37 39 O 0.45972264718648 0.65164522824954 0.07651300385691 15.999 > 37 40 O 0.95972264718648 0.65164522824954 0.07651300385691 15.999 > 37 41 O 0.12797787907267 0.16572896180014 0.44433267307554 15.999 > 41 42 O 0.62797787907267 0.16572896180014 0.44433267307554 15.999 > 41 43 O 0.12797787907267 0.66572896180014 0.44433267307554 15.999 > 41 44 O 0.62797787907267 0.66572896180014 0.44433267307554 15.999 > 41 45 O 0.37202212092733 0.41572896180014 0.05566732692446 15.999 > 45 46 O 0.87202212092733 0.41572896180014 0.05566732692446 15.999 > 45 47 O 0.37202212092733 0.91572896180014 0.05566732692446 15.999 > 45 48 O 0.87202212092733 0.91572896180014 0.05566732692446 15.999 > 45 49 O 0.04027735281352 0.40164522824955 0.42348699614309 15.999 > 49 50 O 0.54027735281352 0.40164522824955 0.42348699614309 15.999 > 49 51 O 0.04027735281352 0.90164522824955 0.42348699614309 15.999 > 49 52 O 0.54027735281352 0.90164522824955 0.42348699614309 15.999 > 49 53 O 0.17853592850600 0.29214957950971 0.73842694062293 15.999 > 53 54 O 0.67853592850600 0.29214957950971 0.73842694062293 15.999 > 53 55 O 0.17853592850600 0.79214957950971 0.73842694062293 15.999 > 53 56 O 0.67853592850600 0.79214957950971 0.73842694062293 15.999 > 53 57 O 0.32146407149399 0.20785042049029 0.26157305937707 15.999 > 57 58 O 0.82146407149399 0.20785042049029 0.26157305937707 15.999 > 57 59 O 0.32146407149399 0.70785042049029 0.26157305937707 15.999 > 57 60 O 0.82146407149399 0.70785042049029 0.26157305937707 15.999 > 57 61 O 0.45972264718648 0.09835477175045 0.57651300385691 15.999 > 61 62 O 0.95972264718648 0.09835477175045 0.57651300385691 15.999 > 61 63 O 0.45972264718648 0.59835477175046 0.57651300385691 15.999 > 61 64 O 0.95972264718648 0.59835477175046 0.57651300385691 15.999 > 61 65 O 0.12797787907267 0.08427103819986 0.94433267307554 15.999 > 65 66 O 0.62797787907267 0.08427103819986 0.94433267307554 15.999 > 65 67 O 0.12797787907267 0.58427103819986 0.94433267307554 15.999 > 65 68 O 0.62797787907267 0.58427103819986 0.94433267307554 15.999 > 65 69 O 0.37202212092733 0.33427103819986 0.55566732692446 15.999 > 69 70 O 0.87202212092733 0.33427103819986 0.55566732692446 15.999 > 69 71 O 0.37202212092733 0.83427103819986 0.55566732692446 15.999 > 69 72 O 0.87202212092733 0.83427103819986 0.55566732692446 15.999 > 69 73 O 0.04027735281352 0.34835477175045 0.92348699614309 15.999 > 73 74 O 0.54027735281352 0.34835477175045 0.92348699614309 15.999 > 73 75 O 0.04027735281352 0.84835477175045 0.92348699614309 15.999 > 73 76 O 0.54027735281352 0.84835477175045 0.92348699614309 15.999 > 73 77 O 0.17853592850600 0.45785042049029 0.23842694062293 15.999 > 77 78 O 0.67853592850600 0.45785042049029 0.23842694062293 15.999 > 77 79 O 0.17853592850600 0.95785042049029 0.23842694062293 15.999 > 77 80 O 0.67853592850600 0.95785042049029 0.23842694062293 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.4345445 0.0000000 -0.0791181 0.0000000 5.5624190 0.0000000 -0.0791203 0.0000000 5.2866722 -------------------------- Born effective charges -------------------------- 1 U 6.0153976 -0.2444089 -0.2319165 -0.1933514 5.9944937 -0.5470228 -0.3318791 0.0489776 5.5462315 2 U 6.0153976 0.2444089 -0.2319165 0.1933514 5.9944937 0.5470228 -0.3318791 -0.0489776 5.5462315 3 Cd 2.7099109 -0.3323719 0.3204715 0.2119988 2.7881294 0.1755981 -0.2408450 0.2593148 2.6961328 4 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 5 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 6 Cd 2.7099109 0.3323719 0.3204715 -0.2119988 2.7881294 -0.1755981 -0.2408450 -0.2593148 2.6961328 7 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 8 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 9 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 10 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 11 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 12 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 13 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 14 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 15 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 16 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 17 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 18 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 19 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 20 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Computing fc3[ 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] 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] [-0.0056 0.0000 0.0083] [ 0.0056 0.0000 -0.0083] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000002 (yyy) -0.00000002 (yyy) -0.00000002 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000017 (zx) 0.00000017 (zx) 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 23:31:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 23:31:24]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 5.639391590153657 0.000000000000000 0.000000000000000 b 0.000000000000000 5.762111170000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): 1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 2 U 0.00000000000000 0.50000000000000 0.50000000000000 238.029 3 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 4 Cd 0.25606070659306 0.54332807006576 0.25537319104264 112.411 5 Cd 0.74393929340694 0.04332807006576 0.24462680895736 112.411 6 Cd 0.50000000000000 0.50000000000000 0.00000000000000 112.411 7 Cd 0.25606070659306 0.95667192993424 0.75537319104264 112.411 8 Cd 0.74393929340694 0.45667192993424 0.74462680895736 112.411 9 O 0.64292814298799 0.08429915901941 0.76157305937707 15.999 10 O 0.91944529437296 0.30329045649909 0.07651300385691 15.999 11 O 0.25595575814534 0.33145792360029 0.44433267307554 15.999 12 O 0.74404424185466 0.83145792360029 0.05566732692446 15.999 13 O 0.08055470562703 0.80329045649909 0.42348699614309 15.999 14 O 0.35707185701201 0.58429915901941 0.73842694062293 15.999 15 O 0.64292814298799 0.41570084098059 0.26157305937707 15.999 16 O 0.91944529437296 0.19670954350091 0.57651300385691 15.999 17 O 0.25595575814534 0.16854207639971 0.94433267307554 15.999 18 O 0.74404424185466 0.66854207639971 0.55566732692446 15.999 19 O 0.08055470562703 0.69670954350091 0.92348699614309 15.999 20 O 0.35707185701201 0.91570084098059 0.23842694062293 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.278783180307315 0.000000000000000 0.000000000000000 b 0.000000000000000 11.524222340000001 0.000000000000000 c -5.567364582070731 0.000000000000000 8.303720448522736 Atomic positions (fractional): 1 U 0.00000000000000 0.00000000000000 0.00000000000000 238.029 > 1 2 U 0.50000000000000 0.00000000000000 0.00000000000000 238.029 > 1 3 U 0.00000000000000 0.50000000000000 0.00000000000000 238.029 > 1 4 U 0.50000000000000 0.50000000000000 0.00000000000000 238.029 > 1 5 U 0.00000000000000 0.25000000000000 0.50000000000000 238.029 > 5 6 U 0.50000000000000 0.25000000000000 0.50000000000000 238.029 > 5 7 U 0.00000000000000 0.75000000000000 0.50000000000000 238.029 > 5 8 U 0.50000000000000 0.75000000000000 0.50000000000000 238.029 > 5 9 Cd 0.25000000000000 0.00000000000000 0.50000000000000 112.411 > 9 10 Cd 0.75000000000000 0.00000000000000 0.50000000000000 112.411 > 9 11 Cd 0.25000000000000 0.50000000000000 0.50000000000000 112.411 > 9 12 Cd 0.75000000000000 0.50000000000000 0.50000000000000 112.411 > 9 13 Cd 0.12803035329653 0.27166403503288 0.25537319104264 112.411 > 13 14 Cd 0.62803035329653 0.27166403503288 0.25537319104264 112.411 > 13 15 Cd 0.12803035329653 0.77166403503288 0.25537319104264 112.411 > 13 16 Cd 0.62803035329653 0.77166403503288 0.25537319104264 112.411 > 13 17 Cd 0.37196964670347 0.02166403503288 0.24462680895736 112.411 > 17 18 Cd 0.87196964670347 0.02166403503288 0.24462680895736 112.411 > 17 19 Cd 0.37196964670347 0.52166403503288 0.24462680895736 112.411 > 17 20 Cd 0.87196964670347 0.52166403503288 0.24462680895736 112.411 > 17 21 Cd 0.25000000000000 0.25000000000000 0.00000000000000 112.411 > 21 22 Cd 0.75000000000000 0.25000000000000 0.00000000000000 112.411 > 21 23 Cd 0.25000000000000 0.75000000000000 0.00000000000000 112.411 > 21 24 Cd 0.75000000000000 0.75000000000000 0.00000000000000 112.411 > 21 25 Cd 0.12803035329653 0.47833596496712 0.75537319104264 112.411 > 25 26 Cd 0.62803035329653 0.47833596496712 0.75537319104264 112.411 > 25 27 Cd 0.12803035329653 0.97833596496712 0.75537319104264 112.411 > 25 28 Cd 0.62803035329653 0.97833596496712 0.75537319104264 112.411 > 25 29 Cd 0.37196964670347 0.22833596496712 0.74462680895736 112.411 > 29 30 Cd 0.87196964670347 0.22833596496712 0.74462680895736 112.411 > 29 31 Cd 0.37196964670347 0.72833596496712 0.74462680895736 112.411 > 29 32 Cd 0.87196964670347 0.72833596496712 0.74462680895736 112.411 > 29 33 O 0.32146407149399 0.04214957950971 0.76157305937707 15.999 > 33 34 O 0.82146407149399 0.04214957950971 0.76157305937707 15.999 > 33 35 O 0.32146407149399 0.54214957950971 0.76157305937707 15.999 > 33 36 O 0.82146407149399 0.54214957950971 0.76157305937707 15.999 > 33 37 O 0.45972264718648 0.15164522824954 0.07651300385691 15.999 > 37 38 O 0.95972264718648 0.15164522824954 0.07651300385691 15.999 > 37 39 O 0.45972264718648 0.65164522824954 0.07651300385691 15.999 > 37 40 O 0.95972264718648 0.65164522824954 0.07651300385691 15.999 > 37 41 O 0.12797787907267 0.16572896180014 0.44433267307554 15.999 > 41 42 O 0.62797787907267 0.16572896180014 0.44433267307554 15.999 > 41 43 O 0.12797787907267 0.66572896180014 0.44433267307554 15.999 > 41 44 O 0.62797787907267 0.66572896180014 0.44433267307554 15.999 > 41 45 O 0.37202212092733 0.41572896180014 0.05566732692446 15.999 > 45 46 O 0.87202212092733 0.41572896180014 0.05566732692446 15.999 > 45 47 O 0.37202212092733 0.91572896180014 0.05566732692446 15.999 > 45 48 O 0.87202212092733 0.91572896180014 0.05566732692446 15.999 > 45 49 O 0.04027735281352 0.40164522824955 0.42348699614309 15.999 > 49 50 O 0.54027735281352 0.40164522824955 0.42348699614309 15.999 > 49 51 O 0.04027735281352 0.90164522824955 0.42348699614309 15.999 > 49 52 O 0.54027735281352 0.90164522824955 0.42348699614309 15.999 > 49 53 O 0.17853592850600 0.29214957950971 0.73842694062293 15.999 > 53 54 O 0.67853592850600 0.29214957950971 0.73842694062293 15.999 > 53 55 O 0.17853592850600 0.79214957950971 0.73842694062293 15.999 > 53 56 O 0.67853592850600 0.79214957950971 0.73842694062293 15.999 > 53 57 O 0.32146407149399 0.20785042049029 0.26157305937707 15.999 > 57 58 O 0.82146407149399 0.20785042049029 0.26157305937707 15.999 > 57 59 O 0.32146407149399 0.70785042049029 0.26157305937707 15.999 > 57 60 O 0.82146407149399 0.70785042049029 0.26157305937707 15.999 > 57 61 O 0.45972264718648 0.09835477175045 0.57651300385691 15.999 > 61 62 O 0.95972264718648 0.09835477175045 0.57651300385691 15.999 > 61 63 O 0.45972264718648 0.59835477175046 0.57651300385691 15.999 > 61 64 O 0.95972264718648 0.59835477175046 0.57651300385691 15.999 > 61 65 O 0.12797787907267 0.08427103819986 0.94433267307554 15.999 > 65 66 O 0.62797787907267 0.08427103819986 0.94433267307554 15.999 > 65 67 O 0.12797787907267 0.58427103819986 0.94433267307554 15.999 > 65 68 O 0.62797787907267 0.58427103819986 0.94433267307554 15.999 > 65 69 O 0.37202212092733 0.33427103819986 0.55566732692446 15.999 > 69 70 O 0.87202212092733 0.33427103819986 0.55566732692446 15.999 > 69 71 O 0.37202212092733 0.83427103819986 0.55566732692446 15.999 > 69 72 O 0.87202212092733 0.83427103819986 0.55566732692446 15.999 > 69 73 O 0.04027735281352 0.34835477175045 0.92348699614309 15.999 > 73 74 O 0.54027735281352 0.34835477175045 0.92348699614309 15.999 > 73 75 O 0.04027735281352 0.84835477175045 0.92348699614309 15.999 > 73 76 O 0.54027735281352 0.84835477175045 0.92348699614309 15.999 > 73 77 O 0.17853592850600 0.45785042049029 0.23842694062293 15.999 > 77 78 O 0.67853592850600 0.45785042049029 0.23842694062293 15.999 > 77 79 O 0.17853592850600 0.95785042049029 0.23842694062293 15.999 > 77 80 O 0.67853592850600 0.95785042049029 0.23842694062293 15.999 > 77 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.4345445 0.0000000 -0.0791181 0.0000000 5.5624190 0.0000000 -0.0791203 0.0000000 5.2866722 -------------------------- Born effective charges -------------------------- 1 U 6.0153976 -0.2444089 -0.2319165 -0.1933514 5.9944937 -0.5470228 -0.3318791 0.0489776 5.5462315 2 U 6.0153976 0.2444089 -0.2319165 0.1933514 5.9944937 0.5470228 -0.3318791 -0.0489776 5.5462315 3 Cd 2.7099109 -0.3323719 0.3204715 0.2119988 2.7881294 0.1755981 -0.2408450 0.2593148 2.6961328 4 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 5 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 6 Cd 2.7099109 0.3323719 0.3204715 -0.2119988 2.7881294 -0.1755981 -0.2408450 -0.2593148 2.6961328 7 Cd 2.5102178 -0.1166985 -0.1953309 -0.1917455 2.5237014 -0.1213796 0.0724976 0.2181479 2.4786405 8 Cd 2.5102178 0.1166985 -0.1953309 0.1917455 2.5237014 0.1213796 0.0724976 -0.2181479 2.4786405 9 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 10 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 11 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 12 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 13 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 14 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 15 O -1.7536978 -0.0482575 -0.6364581 0.0961180 -1.6717465 -0.6511587 -0.6259521 -0.4492986 -3.3239495 16 O -1.8805523 -0.9541948 0.3491778 -0.8931078 -3.3024423 0.7736869 0.3237504 0.8871794 -1.6876215 17 O -3.2386219 -0.9411219 0.4383338 -1.0601904 -1.9408242 0.3159411 0.5160662 0.1082171 -1.5882516 18 O -3.2386219 0.9411219 0.4383338 1.0601904 -1.9408242 -0.3159411 0.5160662 -0.1082171 -1.5882516 19 O -1.8805523 0.9541948 0.3491778 0.8931078 -3.3024423 -0.7736869 0.3237504 -0.8871794 -1.6876215 20 O -1.7536978 0.0482575 -0.6364581 -0.0961180 -1.6717465 0.6511587 -0.6259521 0.4492986 -3.3239495 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000002 (yyy) -0.00000002 (yyy) -0.00000002 (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 ... [ 11 9 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: 0.64, Number of G-points: 309, Lambda: 0.16 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/170) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 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 0.751 ( 0.000 0.000 0.000) 0.000 1.404 ( 0.000 0.000 0.000) 0.000 1.925 ( 0.000 0.000 0.000) 0.000 2.131 ( 0.000 0.000 0.000) 0.000 2.311 ( 0.000 0.000 0.000) 0.000 2.551 ( 0.000 0.000 0.000) 0.000 2.585 ( 0.000 0.000 0.000) 0.000 2.657 ( 0.000 0.000 0.000) 0.000 2.735 ( 0.000 0.000 0.000) 0.000 2.857 ( 0.000 0.000 0.000) 0.000 3.113 ( 0.000 0.000 0.000) 0.000 3.309 ( 0.000 0.000 0.000) 0.000 3.467 ( 0.000 0.000 0.000) 0.000 3.540 ( 0.000 0.000 0.000) 0.000 4.073 ( 0.000 0.000 0.000) 0.000 4.095 ( 0.000 0.000 0.000) 0.000 4.156 ( 0.000 0.000 0.000) 0.000 4.363 ( 0.000 0.000 0.000) 0.000 4.414 ( 0.000 0.000 0.000) 0.000 5.032 ( 0.000 0.000 0.000) 0.000 5.373 ( 0.000 0.000 0.000) 0.000 5.407 ( 0.000 0.000 0.000) 0.000 5.682 ( 0.000 0.000 0.000) 0.000 5.855 ( 0.000 0.000 0.000) 0.000 5.923 ( 0.000 0.000 0.000) 0.000 6.257 ( 0.000 0.000 0.000) 0.000 6.442 ( 0.000 0.000 0.000) 0.000 6.471 ( 0.000 0.000 0.000) 0.000 6.589 ( 0.000 0.000 0.000) 0.000 7.570 ( 0.000 0.000 0.000) 0.000 8.465 ( 0.000 0.000 0.000) 0.000 8.730 ( 0.000 0.000 0.000) 0.000 9.178 ( 0.000 0.000 0.000) 0.000 9.582 ( 0.000 0.000 0.000) 0.000 9.584 ( 0.000 0.000 0.000) 0.000 9.993 ( 0.000 0.000 0.000) 0.000 10.177 ( 0.000 0.000 0.000) 0.000 10.681 ( 0.000 0.000 0.000) 0.000 10.723 ( 0.000 0.000 0.000) 0.000 11.284 ( 0.000 0.000 0.000) 0.000 11.324 ( 0.000 0.000 0.000) 0.000 11.640 ( 0.000 0.000 0.000) 0.000 11.720 ( 0.000 0.000 0.000) 0.000 11.853 ( 0.000 0.000 0.000) 0.000 12.643 ( 0.000 0.000 0.000) 0.000 12.657 ( 0.000 0.000 0.000) 0.000 12.671 ( 0.000 0.000 0.000) 0.000 13.656 ( 0.000 0.000 0.000) 0.000 14.207 ( 0.000 0.000 0.000) 0.000 14.488 ( 0.000 0.000 0.000) 0.000 15.795 ( 0.000 0.000 0.000) 0.000 15.881 ( 0.000 0.000 0.000) 0.000 15.917 ( 0.000 0.000 0.000) 0.000 16.531 ( 0.000 0.000 0.000) 0.000 17.365 ( 0.000 0.000 0.000) 0.000 20.533 ( 0.000 0.000 0.000) 0.000 20.770 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/170) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.379 ( 15.923 0.000 10.809) 19.245 0.385 ( 11.875 0.000 17.864) 21.451 0.868 ( 36.780 0.000 21.640) 42.674 1.194 ( -18.920 0.000 30.974) 36.295 1.470 ( 5.510 0.000 3.407) 6.479 1.897 ( -0.672 0.000 -2.725) 2.807 1.967 ( -8.659 0.000 -11.940) 14.749 2.268 ( -4.482 0.000 0.056) 4.483 2.488 ( -4.581 0.000 -3.120) 5.542 2.685 ( -0.957 0.000 4.814) 4.909 2.727 ( 1.085 0.000 6.903) 6.988 2.770 ( -3.723 0.000 8.445) 9.229 3.048 ( -4.892 0.000 9.267) 10.479 3.163 ( 5.936 0.000 -0.489) 5.956 3.326 ( -7.652 0.000 -2.229) 7.970 3.537 ( 9.956 0.000 -15.819) 18.691 3.546 ( 8.117 0.000 1.797) 8.314 4.018 ( -5.871 0.000 -3.423) 6.796 4.138 ( -1.257 0.000 -3.064) 3.312 4.213 ( -7.841 0.000 12.923) 15.115 4.379 ( -0.198 0.000 -5.459) 5.463 4.900 ( 14.365 0.000 -20.100) 24.706 5.017 ( -5.055 0.000 5.036) 7.135 5.360 ( -0.503 0.000 -0.987) 1.108 5.433 ( -10.535 0.000 9.687) 14.312 5.636 ( -16.055 0.000 -1.563) 16.131 5.708 ( 0.344 0.000 -4.375) 4.389 5.879 ( -4.917 0.000 -0.567) 4.949 6.462 ( -0.242 0.000 0.243) 0.343 6.515 ( 5.068 0.000 -0.091) 5.069 6.535 ( 8.159 0.000 2.342) 8.489 6.642 ( 6.443 0.000 0.363) 6.453 7.620 ( 3.838 0.000 3.476) 5.178 8.489 ( 2.977 0.000 -0.185) 2.983 8.723 ( -0.224 0.000 -0.898) 0.926 9.373 ( 6.931 0.000 -25.651) 26.571 9.585 ( -0.297 0.000 1.649) 1.676 9.685 ( 1.157 0.000 8.023) 8.106 10.049 ( 4.195 0.000 3.012) 5.165 10.582 ( -23.545 0.000 28.138) 36.690 10.727 ( 2.549 0.000 4.426) 5.108 10.966 ( -0.427 0.000 18.698) 18.703 11.303 ( 2.098 0.000 0.489) 2.154 11.398 ( 13.514 0.000 -34.516) 37.067 11.660 ( -2.042 0.000 5.705) 6.059 11.710 ( -1.267 0.000 0.223) 1.286 11.873 ( 3.626 0.000 -1.063) 3.778 12.321 ( -10.294 0.000 -12.246) 15.998 12.635 ( -0.201 0.000 -1.069) 1.087 13.105 ( 16.989 0.000 15.121) 22.743 14.040 ( -7.547 0.000 -12.847) 14.900 14.572 ( 8.259 0.000 -3.507) 8.973 15.029 ( -61.247 0.000 89.384) 108.354 15.467 ( -28.367 0.000 -8.480) 29.607 15.816 ( -2.297 0.000 -7.617) 7.956 16.155 ( -3.919 0.000 0.823) 4.004 17.677 ( 19.608 0.000 18.159) 26.725 18.642 ( 59.521 0.000 -91.193) 108.898 20.554 ( 0.804 0.000 2.549) 2.672 20.766 ( -0.674 0.000 0.254) 0.720 ======================= Grid point 2 (3/170) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.734 ( 13.581 0.000 9.640) 16.654 0.766 ( 11.996 0.000 16.525) 20.420 1.236 ( -2.345 0.000 7.987) 8.324 1.533 ( 16.017 0.000 11.179) 19.533 1.630 ( 8.521 0.000 1.921) 8.735 1.701 ( -6.704 0.000 -8.896) 11.139 1.926 ( 6.956 0.000 1.773) 7.179 2.237 ( 3.388 0.000 5.549) 6.502 2.337 ( -9.125 0.000 -4.490) 10.170 2.656 ( -7.259 0.000 1.820) 7.484 2.808 ( -1.896 0.000 6.624) 6.890 2.841 ( -1.280 0.000 13.081) 13.143 3.080 ( -6.255 0.000 6.796) 9.236 3.162 ( -4.097 0.000 -0.918) 4.199 3.259 ( 7.447 0.000 -2.668) 7.911 3.520 ( 9.671 0.000 -16.240) 18.902 3.727 ( 10.585 0.000 1.040) 10.636 3.851 ( -6.686 0.000 -8.316) 10.671 4.065 ( -3.962 0.000 -0.020) 3.962 4.214 ( -4.359 0.000 4.496) 6.262 4.303 ( -0.439 0.000 -7.306) 7.320 4.912 ( 6.321 0.000 -9.584) 11.481 4.987 ( -6.423 0.000 6.848) 9.389 5.265 ( -20.230 0.000 -6.455) 21.235 5.344 ( 0.606 0.000 -2.166) 2.250 5.348 ( -8.346 0.000 2.400) 8.684 5.716 ( 0.401 0.000 0.863) 0.951 5.758 ( -9.245 0.000 -0.303) 9.250 6.454 ( -0.349 0.000 -0.709) 0.790 6.543 ( -0.124 0.000 0.446) 0.463 6.735 ( 11.212 0.000 4.314) 12.013 6.783 ( 7.986 0.000 0.238) 7.990 7.763 ( 6.977 0.000 6.500) 9.536 8.550 ( 4.766 0.000 -0.628) 4.807 8.708 ( 0.140 0.000 -1.547) 1.554 9.202 ( 1.442 0.000 -18.072) 18.129 9.625 ( 1.800 0.000 4.303) 4.664 9.754 ( -6.129 0.000 12.206) 13.658 10.164 ( 4.685 0.000 3.688) 5.962 10.601 ( -4.312 0.000 16.195) 16.759 10.838 ( 2.493 0.000 7.126) 7.550 10.996 ( -1.065 0.000 -12.317) 12.363 11.258 ( -1.280 0.000 -9.461) 9.547 11.359 ( 3.033 0.000 1.299) 3.299 11.697 ( -1.004 0.000 2.378) 2.582 11.713 ( -3.454 0.000 10.785) 11.325 11.957 ( 3.661 0.000 0.632) 3.715 12.130 ( 3.978 0.000 -4.701) 6.158 12.612 ( -0.755 0.000 -1.794) 1.946 13.534 ( 17.128 0.000 12.613) 21.271 13.753 ( -4.313 0.000 -21.507) 21.935 14.600 ( 3.911 0.000 -13.039) 13.613 14.893 ( -25.616 0.000 -9.376) 27.278 14.983 ( -30.212 0.000 37.565) 48.206 15.653 ( -9.362 0.000 -4.431) 10.358 16.081 ( -5.420 0.000 0.061) 5.421 18.221 ( 18.490 0.000 21.720) 28.524 18.607 ( 25.804 0.000 -42.217) 49.479 20.610 ( 1.545 0.000 4.204) 4.479 20.753 ( -1.266 0.000 0.278) 1.296 ======================= Grid point 3 (4/170) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.980 ( 6.541 0.000 3.257) 7.307 1.108 ( 10.280 0.000 11.205) 15.206 1.273 ( 2.515 0.000 -0.864) 2.659 1.543 ( -0.021 0.000 -4.622) 4.622 1.737 ( 6.777 0.000 7.585) 10.172 1.831 ( 9.146 0.000 3.724) 9.875 1.929 ( -6.868 0.000 1.009) 6.942 2.108 ( -12.115 0.000 -4.596) 12.957 2.535 ( -8.645 0.000 0.975) 8.699 2.554 ( 4.964 0.000 4.095) 6.435 2.801 ( 1.377 0.000 2.107) 2.518 2.976 ( -0.337 0.000 12.494) 12.499 3.016 ( 2.534 0.000 9.512) 9.844 3.282 ( 8.422 0.000 6.191) 10.453 3.350 ( 8.486 0.000 -3.530) 9.191 3.507 ( 6.952 0.000 -10.640) 12.710 3.645 ( -4.751 0.000 -10.936) 11.923 3.851 ( 4.857 0.000 -2.450) 5.440 4.065 ( 1.812 0.000 3.301) 3.766 4.153 ( -4.641 0.000 -2.908) 5.477 4.215 ( -1.927 0.000 -4.194) 4.616 4.816 ( -15.047 0.000 -5.471) 16.011 4.932 ( -3.001 0.000 -9.531) 9.992 4.954 ( -6.334 0.000 5.555) 8.424 5.239 ( -8.793 0.000 3.356) 9.412 5.321 ( 0.160 0.000 -4.487) 4.490 5.592 ( -10.813 0.000 1.175) 10.876 5.731 ( 0.392 0.000 0.660) 0.768 6.440 ( -0.249 0.000 -0.846) 0.882 6.541 ( 0.087 0.000 -0.711) 0.716 6.877 ( 3.374 0.000 0.319) 3.389 6.966 ( 10.575 0.000 4.968) 11.684 7.969 ( 8.157 0.000 7.910) 11.363 8.616 ( 4.258 0.000 -1.220) 4.430 8.698 ( 0.983 0.000 -1.903) 2.142 9.039 ( -0.254 0.000 -13.436) 13.439 9.742 ( 4.653 0.000 7.576) 8.891 9.777 ( -7.978 0.000 14.581) 16.621 10.260 ( 2.808 0.000 2.334) 3.651 10.675 ( -1.302 0.000 -8.614) 8.712 10.866 ( 4.651 0.000 -0.855) 4.729 10.929 ( 0.391 0.000 4.488) 4.505 11.106 ( -8.375 0.000 -3.347) 9.019 11.385 ( -4.418 0.000 4.120) 6.041 11.726 ( -6.087 0.000 6.094) 8.613 11.789 ( 7.123 0.000 7.183) 10.116 11.896 ( -1.278 0.000 -6.472) 6.597 12.458 ( 21.537 0.000 14.317) 25.862 12.570 ( -1.867 0.000 -2.205) 2.889 13.445 ( 0.209 0.000 -29.235) 29.236 13.914 ( 15.159 0.000 8.849) 17.553 14.300 ( -19.971 0.000 -6.643) 21.047 14.624 ( 4.456 0.000 -18.148) 18.687 14.848 ( -23.059 0.000 16.178) 28.169 15.437 ( -13.973 0.000 0.032) 13.973 15.994 ( -5.453 0.000 0.566) 5.483 18.567 ( 13.521 0.000 -23.678) 27.266 18.695 ( 11.814 0.000 19.617) 22.900 20.687 ( 1.844 0.000 4.514) 4.876 20.731 ( -1.578 0.000 0.082) 1.580 ======================= Grid point 4 (5/170) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( -0.559 0.000 -4.305) 4.342 1.225 ( 4.614 0.000 -6.398) 7.888 1.409 ( 5.302 0.000 10.054) 11.367 1.562 ( 3.156 0.000 -0.096) 3.158 1.816 ( -8.560 0.000 2.664) 8.965 1.843 ( -10.655 0.000 -2.008) 10.842 1.998 ( 12.586 0.000 9.020) 15.484 2.055 ( 8.313 0.000 4.338) 9.376 2.385 ( -10.120 0.000 -6.913) 12.256 2.426 ( -5.153 0.000 0.742) 5.206 2.804 ( -3.892 0.000 1.338) 4.116 3.047 ( -3.891 0.000 3.826) 5.457 3.388 ( 13.785 0.000 5.616) 14.885 3.448 ( 5.237 0.000 -1.391) 5.419 3.512 ( 4.214 0.000 1.020) 4.336 3.536 ( 5.541 0.000 -4.676) 7.251 3.565 ( 16.869 0.000 9.556) 19.388 3.853 ( -0.867 0.000 -2.580) 2.722 4.001 ( -5.703 0.000 -7.908) 9.750 4.080 ( -0.520 0.000 -3.953) 3.987 4.235 ( 4.563 0.000 4.168) 6.181 4.485 ( -14.254 0.000 -6.240) 15.560 4.804 ( -4.418 0.000 -7.882) 9.035 4.887 ( -8.181 0.000 2.757) 8.633 5.142 ( -7.780 0.000 3.514) 8.537 5.228 ( -4.207 0.000 -5.578) 6.987 5.482 ( -4.804 0.000 2.382) 5.362 5.746 ( 0.791 0.000 0.324) 0.855 6.430 ( -0.007 0.000 -0.503) 0.503 6.531 ( 0.152 0.000 -1.374) 1.383 6.909 ( 0.512 0.000 0.419) 0.661 7.166 ( 7.465 0.000 4.403) 8.667 8.170 ( 6.310 0.000 6.519) 9.073 8.652 ( 1.941 0.000 -1.430) 2.410 8.700 ( 1.723 0.000 -1.733) 2.443 8.914 ( -0.332 0.000 -8.393) 8.400 9.834 ( -4.646 0.000 15.103) 15.802 9.928 ( 6.115 0.000 9.675) 11.445 10.296 ( 0.165 0.000 -0.373) 0.408 10.467 ( -1.209 0.000 -18.715) 18.754 10.883 ( -10.629 0.000 2.081) 10.831 10.950 ( -0.282 0.000 -0.137) 0.314 11.102 ( 11.482 0.000 2.311) 11.712 11.336 ( -8.069 0.000 7.697) 11.151 11.665 ( -8.693 0.000 4.873) 9.966 11.821 ( 0.543 0.000 -6.400) 6.423 12.034 ( 9.654 0.000 8.906) 13.134 12.504 ( -3.138 0.000 -2.362) 3.927 13.013 ( 24.613 0.000 17.174) 30.012 13.155 ( 3.316 0.000 -26.838) 27.042 13.968 ( -14.585 0.000 -4.032) 15.132 14.193 ( 10.234 0.000 3.002) 10.665 14.526 ( 8.274 0.000 -17.774) 19.606 14.586 ( -22.133 0.000 4.003) 22.492 15.218 ( -14.743 0.000 3.097) 15.065 15.926 ( -3.918 0.000 1.012) 4.046 18.535 ( 6.827 0.000 -12.409) 14.163 19.015 ( 5.574 0.000 13.609) 14.707 20.707 ( -1.356 0.000 -0.100) 1.359 20.758 ( 1.358 0.000 3.410) 3.670 ======================= Grid point 5 (6/170) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( -1.028 0.000 -2.764) 2.949 1.232 ( 2.638 0.000 -2.927) 3.940 1.544 ( 1.614 0.000 2.979) 3.388 1.605 ( 3.630 0.000 -1.776) 4.041 1.687 ( -7.125 0.000 0.899) 7.182 1.744 ( -3.923 0.000 3.819) 5.475 2.116 ( -2.966 0.000 -3.489) 4.580 2.195 ( 2.079 0.000 2.545) 3.286 2.349 ( 7.543 0.000 3.379) 8.265 2.416 ( 1.958 0.000 1.663) 2.569 2.756 ( -2.490 0.000 0.407) 2.523 2.950 ( -4.719 0.000 -3.010) 5.597 3.462 ( -3.731 0.000 3.228) 4.933 3.525 ( 3.530 0.000 1.894) 4.006 3.559 ( 3.170 0.000 -5.045) 5.959 3.651 ( 6.438 0.000 2.340) 6.850 3.772 ( -3.499 0.000 -5.054) 6.146 3.892 ( 3.237 0.000 0.726) 3.317 4.012 ( 13.225 0.000 7.944) 15.427 4.037 ( -1.037 0.000 -0.778) 1.296 4.249 ( -7.047 0.000 -4.049) 8.128 4.362 ( 5.057 0.000 1.963) 5.425 4.616 ( -7.323 0.000 -6.390) 9.719 4.759 ( -7.238 0.000 -0.070) 7.239 5.076 ( -3.375 0.000 1.534) 3.707 5.128 ( -1.958 0.000 -1.918) 2.741 5.460 ( -0.939 0.000 0.858) 1.271 5.760 ( 0.466 0.000 0.142) 0.487 6.427 ( 0.045 0.000 -0.145) 0.152 6.520 ( 0.029 0.000 -0.741) 0.741 6.914 ( -0.111 0.000 0.243) 0.267 7.285 ( 2.682 0.000 1.845) 3.256 8.291 ( 2.197 0.000 2.466) 3.303 8.655 ( 0.316 0.000 -0.712) 0.779 8.712 ( 1.076 0.000 -0.681) 1.273 8.850 ( -0.066 0.000 -2.785) 2.785 9.938 ( -1.135 0.000 10.373) 10.435 10.115 ( 4.426 0.000 7.351) 8.580 10.259 ( -1.903 0.000 -3.309) 3.817 10.278 ( -0.167 0.000 -12.026) 12.028 10.759 ( -4.874 0.000 0.615) 4.912 10.936 ( -0.210 0.000 -0.823) 0.850 11.312 ( 9.778 0.000 1.320) 9.866 11.312 ( -3.463 0.000 4.739) 5.869 11.557 ( -8.390 0.000 1.934) 8.610 11.779 ( 0.437 0.000 -2.620) 2.657 12.208 ( 3.717 0.000 1.424) 3.980 12.437 ( -2.523 0.000 0.078) 2.525 13.028 ( 4.590 0.000 -9.222) 10.301 13.587 ( 24.069 0.000 14.848) 28.281 13.738 ( -7.111 0.000 -3.539) 7.943 14.107 ( -18.774 0.000 -9.994) 21.268 14.420 ( -0.352 0.000 3.229) 3.248 14.514 ( 5.648 0.000 -6.950) 8.956 15.054 ( -7.778 0.000 2.172) 8.076 15.891 ( -1.441 0.000 0.491) 1.522 18.519 ( 2.114 0.000 -3.867) 4.407 19.171 ( 1.509 0.000 4.869) 5.097 20.690 ( -0.541 0.000 -0.075) 0.546 20.799 ( 0.455 0.000 1.254) 1.334 ======================= Grid point 11 (7/170) ======================= q-point: ( 0.00 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.377 ( 0.000 18.736 0.000) 18.736 0.443 ( 0.000 22.402 0.000) 22.402 0.996 ( 0.000 50.546 0.000) 50.546 1.081 ( 0.000 27.997 0.000) 27.997 1.583 ( 0.000 -1.526 0.000) 1.526 1.853 ( 0.000 -7.200 0.000) 7.200 2.186 ( 0.000 -3.690 0.000) 3.690 2.258 ( 0.000 -0.752 0.000) 0.752 2.385 ( 0.000 -10.292 0.000) 10.292 2.559 ( 0.000 -14.460 0.000) 14.460 2.658 ( 0.000 -1.405 0.000) 1.405 2.796 ( 0.000 3.956 0.000) 3.956 2.824 ( 0.000 8.883 0.000) 8.883 3.206 ( 0.000 4.866 0.000) 4.866 3.382 ( 0.000 -11.850 0.000) 11.850 3.385 ( 0.000 7.397 0.000) 7.397 3.418 ( 0.000 -6.033 0.000) 6.033 3.897 ( 0.000 -10.260 0.000) 10.260 4.223 ( 0.000 4.876 0.000) 4.876 4.315 ( 0.000 12.407 0.000) 12.407 4.354 ( 0.000 -0.040 0.000) 0.040 4.505 ( 0.000 -4.508 0.000) 4.508 5.123 ( 0.000 -12.856 0.000) 12.856 5.213 ( 0.000 -2.679 0.000) 2.679 5.567 ( 0.000 -10.214 0.000) 10.214 5.575 ( 0.000 5.160 0.000) 5.160 5.851 ( 0.000 -2.999 0.000) 2.999 5.940 ( 0.000 3.412 0.000) 3.412 6.208 ( 0.000 -4.397 0.000) 4.397 6.431 ( 0.000 -4.148 0.000) 4.148 6.590 ( 0.000 9.271 0.000) 9.271 6.728 ( 0.000 12.909 0.000) 12.909 7.605 ( 0.000 3.598 0.000) 3.598 8.550 ( 0.000 7.526 0.000) 7.526 8.933 ( 0.000 -4.863 0.000) 4.863 9.158 ( 0.000 -1.917 0.000) 1.917 9.601 ( 0.000 1.771 0.000) 1.771 9.625 ( 0.000 4.081 0.000) 4.081 10.052 ( 0.000 -8.438 0.000) 8.438 10.346 ( 0.000 -0.838 0.000) 0.838 10.670 ( 0.000 -5.608 0.000) 5.608 10.856 ( 0.000 11.838 0.000) 11.838 11.350 ( 0.000 4.142 0.000) 4.142 11.442 ( 0.000 6.119 0.000) 6.119 11.613 ( 0.000 -1.883 0.000) 1.883 11.878 ( 0.000 3.062 0.000) 3.062 12.126 ( 0.000 6.301 0.000) 6.301 12.517 ( 0.000 -8.384 0.000) 8.384 12.671 ( 0.000 -3.095 0.000) 3.095 12.771 ( 0.000 10.259 0.000) 10.259 13.660 ( 0.000 -0.218 0.000) 0.218 14.229 ( 0.000 2.437 0.000) 2.437 14.838 ( 0.000 -2.302 0.000) 2.302 15.298 ( 0.000 -32.167 0.000) 32.167 16.003 ( 0.000 -5.036 0.000) 5.036 17.000 ( 0.000 35.148 0.000) 35.148 17.190 ( 0.000 -8.218 0.000) 8.218 19.592 ( 0.000 -5.088 0.000) 5.088 20.542 ( 0.000 0.955 0.000) 0.955 20.770 ( 0.000 -0.044 0.000) 0.044 ======================= Grid point 12 (8/170) ======================= q-point: ( 0.09 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.515 ( 7.915 16.308 3.674) 18.495 0.607 ( 11.475 12.491 13.538) 21.702 1.200 ( 4.971 18.562 19.134) 27.118 1.335 ( 12.455 26.999 13.725) 32.748 1.528 ( -1.551 4.534 2.637) 5.469 1.737 ( -3.637 -9.343 -0.630) 10.046 2.058 ( -9.025 3.525 -9.934) 13.876 2.160 ( -3.123 -8.849 -0.965) 9.433 2.482 ( -2.348 -1.564 -0.701) 2.907 2.561 ( 0.968 -11.371 1.927) 11.574 2.721 ( -3.288 -1.156 6.494) 7.370 2.830 ( -1.852 4.363 7.071) 8.513 2.890 ( 1.338 -7.217 10.771) 13.034 3.222 ( -0.643 -0.047 -4.090) 4.141 3.323 ( -2.515 0.430 2.706) 3.720 3.403 ( 7.021 -7.155 -8.336) 13.037 3.570 ( 11.444 1.113 1.199) 11.560 3.892 ( -3.226 -10.802 -1.328) 11.352 4.201 ( -2.691 3.697 -1.591) 4.842 4.303 ( -2.010 10.323 1.817) 10.673 4.366 ( 1.270 -1.108 -5.811) 6.050 4.661 ( 17.299 -10.282 -4.105) 20.538 5.068 ( -6.692 -6.949 1.393) 9.748 5.169 ( -4.070 -5.560 0.786) 6.935 5.435 ( -7.807 -6.067 -0.977) 9.936 5.666 ( -1.217 -2.721 4.499) 5.397 5.694 ( -12.537 4.005 -5.611) 14.307 5.892 ( 0.464 0.062 -2.080) 2.133 6.362 ( 0.882 -6.580 1.810) 6.881 6.417 ( 4.743 -3.250 5.601) 8.027 6.678 ( 7.303 9.498 -2.797) 12.303 6.781 ( 6.634 11.533 1.739) 13.418 7.646 ( 2.801 2.753 3.374) 5.177 8.549 ( 1.802 6.420 -1.706) 6.883 8.756 ( -5.075 0.309 -4.332) 6.679 9.203 ( 5.053 -10.089 -12.356) 16.732 9.607 ( -0.747 2.158 2.228) 3.190 9.716 ( 1.912 2.769 6.658) 7.460 10.155 ( 5.316 1.546 4.984) 7.449 10.365 ( -7.686 -8.130 16.213) 19.698 10.720 ( 2.471 -4.730 5.817) 7.894 10.987 ( 6.356 0.691 2.206) 6.763 11.278 ( -5.584 2.977 0.120) 6.330 11.460 ( 4.372 5.192 -8.347) 10.758 11.591 ( -3.619 -1.751 2.768) 4.881 11.898 ( 1.177 9.242 2.341) 9.606 11.990 ( -2.087 9.732 -5.355) 11.302 12.349 ( -10.259 2.210 -12.248) 16.129 12.578 ( -0.270 -5.747 1.599) 5.972 13.057 ( 16.286 -1.706 9.878) 19.124 13.967 ( 1.663 -7.011 5.275) 8.930 14.249 ( 2.491 -7.086 15.265) 17.013 14.823 ( -1.462 -5.476 -2.246) 6.097 15.100 ( -14.768 -26.850 -11.150) 32.609 16.033 ( 0.344 1.439 2.337) 2.767 16.664 ( -18.878 29.866 -2.800) 35.443 17.622 ( 19.013 -1.793 20.435) 27.970 19.070 ( -4.182 18.465 -47.687) 51.308 20.562 ( 0.591 0.784 2.498) 2.684 20.764 ( -0.583 -0.178 -0.010) 0.609 ======================= Grid point 13 (9/170) ======================= q-point: ( 0.18 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.755 ( 11.851 6.680 8.666) 16.129 0.933 ( 10.243 10.264 13.051) 19.509 1.387 ( -4.224 13.645 8.347) 16.544 1.473 ( 4.619 -5.943 6.382) 9.869 1.648 ( 0.698 -4.119 -0.974) 4.290 1.755 ( -2.712 6.698 -5.992) 9.388 1.946 ( 7.398 5.342 2.607) 9.490 2.195 ( 10.299 -1.915 7.134) 12.674 2.365 ( -7.008 2.724 -2.892) 8.056 2.635 ( 1.943 -10.217 6.374) 12.198 2.663 ( -6.903 -1.968 1.275) 7.290 2.894 ( -3.683 2.276 9.723) 10.644 2.996 ( 0.858 -7.908 6.588) 10.328 3.088 ( -9.578 -3.165 -0.776) 10.117 3.391 ( 8.584 8.367 -2.594) 12.264 3.411 ( 7.014 -8.254 -9.402) 14.343 3.748 ( -2.436 -7.969 -4.163) 9.315 3.800 ( 7.898 2.874 -0.153) 8.406 4.108 ( -3.076 4.562 -6.182) 8.275 4.245 ( -5.941 1.559 0.704) 6.183 4.341 ( 0.852 5.350 -1.897) 5.740 4.827 ( 9.452 -6.542 -5.680) 12.822 4.960 ( -10.728 -7.714 3.027) 13.556 5.107 ( -4.710 -5.083 -0.054) 6.930 5.281 ( -7.387 -4.453 -4.088) 9.545 5.453 ( -9.175 3.604 -2.507) 10.171 5.621 ( -8.238 -6.396 1.896) 10.600 5.898 ( 1.113 9.023 -0.044) 9.091 6.308 ( -2.629 -9.471 -2.774) 10.213 6.633 ( 7.953 -3.027 8.866) 12.289 6.732 ( 3.249 12.433 -0.885) 12.881 6.935 ( 9.686 9.615 -0.589) 13.660 7.766 ( 5.651 0.612 6.024) 8.282 8.580 ( 3.379 3.105 -1.035) 4.705 8.683 ( -0.943 -2.572 -2.074) 3.436 9.101 ( 1.251 -8.221 -13.853) 16.157 9.632 ( -0.079 1.127 3.968) 4.126 9.794 ( -3.729 3.008 11.161) 12.146 10.254 ( 3.012 6.357 0.906) 7.093 10.484 ( -0.030 -8.749 16.009) 18.244 10.848 ( 2.674 -2.583 6.653) 7.621 10.982 ( -0.292 -2.293 -8.647) 8.951 11.207 ( -1.996 -0.790 -2.285) 3.135 11.400 ( -2.198 3.005 -3.322) 4.990 11.573 ( -4.993 -3.976 6.860) 9.370 11.889 ( -3.521 8.382 1.643) 9.239 12.068 ( 1.247 9.543 -4.185) 10.495 12.145 ( 6.217 1.977 0.025) 6.524 12.595 ( 1.066 -1.038 1.278) 1.962 13.417 ( 14.144 -9.463 8.715) 19.120 13.830 ( -0.319 6.917 -18.696) 19.937 14.450 ( -5.544 -11.436 9.593) 15.923 14.673 ( -11.646 -14.443 -4.969) 19.208 14.768 ( -3.291 -10.224 -11.598) 15.807 16.022 ( -8.624 16.745 7.186) 20.160 16.391 ( -12.957 27.260 -1.179) 30.206 18.142 ( 15.942 -6.698 21.785) 27.813 18.682 ( 8.216 5.456 -33.917) 35.322 20.612 ( 1.056 0.123 4.024) 4.162 20.751 ( -1.127 -0.250 0.184) 1.169 ======================= Grid point 14 (10/170) ======================= q-point: ( 0.27 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.020 ( 8.221 5.062 5.745) 11.234 1.185 ( 5.029 6.279 8.941) 12.027 1.348 ( -1.902 5.550 -0.933) 5.940 1.554 ( 2.061 -0.701 -4.536) 5.031 1.702 ( 6.377 -2.946 8.825) 11.279 1.755 ( 0.207 -3.272 6.258) 7.065 1.978 ( 2.076 3.854 -1.520) 4.634 2.141 ( -8.927 2.348 -5.707) 10.852 2.489 ( -0.818 -5.913 1.117) 6.073 2.544 ( -6.760 -0.242 1.360) 6.899 2.793 ( -7.971 -8.519 4.176) 12.391 2.882 ( 10.556 4.125 6.976) 13.308 3.070 ( 6.353 -1.896 5.946) 8.906 3.115 ( 5.686 -5.517 8.770) 11.818 3.401 ( 3.622 -7.084 -8.333) 11.521 3.526 ( 6.540 5.787 -1.545) 8.868 3.594 ( -0.110 -2.983 -6.973) 7.585 3.953 ( 4.241 2.341 0.959) 4.938 3.999 ( -3.047 1.346 -4.124) 5.301 4.159 ( -0.963 1.666 -4.457) 4.855 4.336 ( -0.982 9.367 1.181) 9.492 4.724 ( -17.344 -8.426 -1.701) 19.357 4.859 ( 0.642 -3.887 -4.606) 6.061 5.026 ( -2.926 2.833 -2.042) 4.556 5.184 ( -1.407 -5.120 -1.224) 5.449 5.328 ( -5.983 1.282 -0.469) 6.137 5.474 ( -10.982 -6.947 1.125) 13.043 5.915 ( 0.724 12.198 0.220) 12.222 6.231 ( -2.958 -12.153 -3.047) 12.874 6.775 ( 2.135 13.821 1.294) 14.045 6.833 ( 6.686 -0.949 4.383) 8.051 7.070 ( 7.420 8.132 1.049) 11.058 7.946 ( 7.346 -1.834 7.038) 10.338 8.601 ( -0.546 -2.163 -0.870) 2.394 8.680 ( 3.780 -1.089 -2.115) 4.467 8.971 ( 0.058 -6.012 -11.323) 12.820 9.691 ( -0.368 -1.822 7.331) 7.563 9.863 ( -3.195 4.930 13.207) 14.455 10.292 ( 0.613 1.784 0.699) 2.011 10.600 ( -0.127 -6.068 -3.134) 6.831 10.836 ( 1.206 -3.572 -0.441) 3.796 10.987 ( -0.733 3.588 4.149) 5.534 11.120 ( -4.403 2.447 -3.190) 5.963 11.380 ( -1.609 0.103 3.393) 3.756 11.609 ( -1.472 -8.082 11.474) 14.112 11.847 ( -1.350 2.860 -1.091) 3.345 11.940 ( -2.218 3.584 -6.882) 8.070 12.364 ( 4.793 -6.008 4.732) 9.025 12.709 ( 10.992 10.315 6.067) 16.249 13.537 ( 3.796 7.059 -20.854) 22.341 13.742 ( 6.757 -13.770 -1.079) 15.376 14.222 ( -13.723 -7.424 -2.513) 15.804 14.587 ( 7.315 -1.572 -20.234) 21.573 14.662 ( -6.258 -5.403 7.507) 11.168 15.902 ( -17.024 30.973 9.196) 36.520 16.213 ( -7.303 20.153 -1.734) 21.505 18.490 ( 7.062 -6.654 -11.533) 15.072 18.614 ( 11.156 -8.742 9.383) 16.997 20.674 ( 1.008 -1.108 3.835) 4.117 20.734 ( -1.189 -0.017 0.496) 1.288 ======================= Grid point 15 (11/170) ======================= q-point: ( 0.36 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( -4.803 5.836 -3.567) 8.358 1.284 ( 3.879 2.838 -3.251) 5.802 1.401 ( 3.137 -0.068 7.993) 8.587 1.593 ( 4.675 2.400 -1.107) 5.370 1.729 ( -6.339 -5.140 6.784) 10.612 1.909 ( -4.953 3.048 -2.165) 6.206 2.025 ( 10.891 3.171 6.391) 13.020 2.092 ( 6.703 3.633 2.878) 8.149 2.362 ( -8.458 -2.667 -4.058) 9.753 2.418 ( -5.383 -0.481 -1.541) 5.619 2.715 ( -4.275 -7.905 2.521) 9.334 3.010 ( -1.582 -3.239 2.061) 4.152 3.243 ( 7.228 -11.377 5.106) 14.414 3.301 ( 1.036 -14.153 -9.411) 17.028 3.477 ( 13.778 -0.766 0.964) 13.833 3.575 ( 7.278 5.197 9.369) 12.952 3.688 ( 6.004 7.021 2.558) 9.586 3.882 ( -4.230 -8.274 -6.463) 11.319 3.954 ( -2.941 5.079 1.670) 6.102 4.140 ( 2.860 5.803 -4.476) 7.867 4.316 ( -2.904 4.670 -5.325) 7.655 4.480 ( -6.815 1.726 2.824) 7.576 4.767 ( -5.772 -1.256 -4.377) 7.352 4.959 ( -3.564 5.019 -2.019) 6.479 5.162 ( -2.442 -1.724 1.363) 3.285 5.215 ( -5.055 -0.443 -4.282) 6.639 5.339 ( -7.091 -7.410 2.952) 10.673 5.930 ( 1.120 12.223 -0.039) 12.274 6.151 ( -2.996 -14.551 -2.589) 15.080 6.822 ( 1.933 15.466 1.112) 15.626 6.930 ( 2.438 3.151 0.573) 4.025 7.208 ( 5.781 4.475 3.718) 8.202 8.134 ( 6.677 -3.344 5.837) 9.478 8.557 ( -2.378 -6.727 -2.050) 7.424 8.731 ( 3.896 0.486 -1.102) 4.078 8.871 ( 0.123 -4.028 -7.160) 8.216 9.780 ( -0.538 -3.449 10.678) 11.234 9.982 ( 0.543 3.291 11.686) 12.153 10.279 ( -2.029 -2.343 -1.277) 3.352 10.449 ( -1.007 -1.525 -15.521) 15.629 10.901 ( -5.223 1.293 5.214) 7.493 10.950 ( -0.942 -0.270 1.218) 1.563 11.113 ( 3.890 1.639 2.190) 4.755 11.378 ( -3.985 4.854 6.296) 8.893 11.644 ( -6.619 -3.403 1.578) 7.608 11.846 ( 0.944 1.274 -5.793) 6.006 11.950 ( 7.342 -6.544 8.482) 12.987 12.393 ( -1.641 -9.355 0.210) 9.500 12.946 ( 8.808 0.309 -2.976) 9.302 13.438 ( 11.860 17.269 -10.516) 23.441 13.732 ( -5.112 -15.388 -4.349) 16.788 14.080 ( -3.449 -17.163 0.677) 17.519 14.548 ( 10.262 7.338 -11.853) 17.310 14.606 ( -5.760 11.140 -1.469) 12.627 15.708 ( -16.445 35.871 7.108) 40.097 16.102 ( -5.343 16.632 -0.518) 17.477 18.437 ( 4.960 -9.617 -11.145) 15.534 18.895 ( 5.105 -12.271 12.624) 18.330 20.696 ( -0.899 -1.162 0.251) 1.490 20.749 ( 0.590 -0.918 2.840) 3.043 ======================= Grid point 16 (12/170) ======================= q-point: ( 0.45 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( -3.736 0.044 -2.771) 4.652 1.313 ( 3.282 5.562 -2.050) 6.776 1.481 ( -0.961 -2.955 2.277) 3.853 1.645 ( 3.120 2.882 -0.719) 4.308 1.739 ( -1.595 0.994 6.310) 6.584 1.793 ( -4.238 6.861 -1.380) 8.182 2.101 ( -2.999 -1.424 -4.052) 5.238 2.199 ( 1.440 -0.173 1.961) 2.439 2.376 ( 6.238 0.776 1.542) 6.473 2.397 ( 3.311 0.844 3.088) 4.606 2.682 ( -2.242 -6.403 1.190) 6.887 2.929 ( -3.903 -1.832 -2.914) 5.204 3.269 ( 1.196 -18.199 -1.329) 18.286 3.383 ( 1.620 -7.597 2.117) 8.051 3.554 ( 2.157 -8.826 -1.178) 9.162 3.664 ( 1.203 6.261 1.496) 6.549 3.771 ( -0.943 -8.630 -5.123) 10.081 3.921 ( 4.977 2.465 4.007) 6.848 3.933 ( -1.063 2.127 2.452) 3.416 4.140 ( -3.199 -0.901 -0.854) 3.431 4.217 ( 5.167 10.006 -0.088) 11.261 4.517 ( 1.102 -0.436 -3.429) 3.628 4.631 ( -3.158 10.988 2.067) 11.619 4.849 ( -5.780 8.568 -3.077) 10.784 5.116 ( -1.855 -1.337 -1.979) 3.025 5.131 ( -2.424 2.354 1.321) 3.628 5.302 ( -1.148 -9.860 0.886) 9.966 5.949 ( 1.016 13.539 0.084) 13.577 6.088 ( -1.726 -18.115 -1.197) 18.236 6.854 ( 0.764 16.194 0.516) 16.221 6.951 ( 0.528 5.658 -0.201) 5.686 7.308 ( 2.156 2.569 1.871) 3.840 8.266 ( 3.257 -2.541 2.652) 4.909 8.497 ( -1.778 -10.319 -1.570) 10.588 8.770 ( 1.393 0.916 0.064) 1.668 8.821 ( 0.263 -2.868 -2.730) 3.968 9.893 ( 0.538 -4.075 8.276) 9.240 10.093 ( 0.916 -2.230 4.878) 5.441 10.199 ( -2.846 -4.247 -4.497) 6.809 10.315 ( 0.531 2.477 -6.506) 6.981 10.839 ( -3.014 6.913 0.897) 7.594 10.966 ( 0.520 3.096 -0.621) 3.200 11.235 ( 1.218 -4.671 9.718) 10.851 11.404 ( 3.407 5.510 -0.956) 6.549 11.505 ( -7.480 -4.222 -3.071) 9.122 11.810 ( -0.165 2.443 -1.531) 2.888 12.133 ( 4.089 -7.715 3.254) 9.318 12.359 ( -1.704 -7.436 -0.218) 7.632 13.007 ( 6.321 -0.835 -0.751) 6.420 13.394 ( -5.478 -14.652 -11.134) 19.200 13.808 ( 12.875 5.596 6.516) 15.477 14.040 ( -6.191 -20.511 1.758) 21.497 14.464 ( -3.830 24.387 -6.070) 25.422 14.607 ( 4.883 13.353 -3.113) 14.554 15.568 ( -6.885 37.231 3.143) 37.993 16.033 ( -2.396 13.915 -0.093) 14.120 18.414 ( 1.793 -10.755 -3.613) 11.486 19.039 ( 1.332 -13.356 4.600) 14.188 20.683 ( -0.451 -0.766 -0.065) 0.892 20.780 ( 0.272 -1.852 1.160) 2.202 ======================= Grid point 22 (13/170) ======================= q-point: ( 0.00 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.715 ( 0.000 16.152 0.000) 16.152 0.847 ( 0.000 18.693 0.000) 18.693 1.492 ( 0.000 -9.346 0.000) 9.346 1.641 ( 0.000 26.606 0.000) 26.606 1.669 ( 0.000 -7.804 0.000) 7.804 1.925 ( 0.000 39.037 0.000) 39.037 2.067 ( 0.000 -4.397 0.000) 4.397 2.106 ( 0.000 -19.741 0.000) 19.741 2.294 ( 0.000 -7.372 0.000) 7.372 2.320 ( 0.000 6.384 0.000) 6.384 2.613 ( 0.000 -2.751 0.000) 2.751 2.891 ( 0.000 3.880 0.000) 3.880 3.018 ( 0.000 5.961 0.000) 5.961 3.167 ( 0.000 -4.061 0.000) 4.061 3.242 ( 0.000 -1.657 0.000) 1.657 3.292 ( 0.000 -6.393 0.000) 6.393 3.549 ( 0.000 6.327 0.000) 6.327 3.732 ( 0.000 -2.721 0.000) 2.721 4.266 ( 0.000 1.067 0.000) 1.067 4.390 ( 0.000 2.642 0.000) 2.642 4.398 ( 0.000 -5.970 0.000) 5.970 4.550 ( 0.000 10.310 0.000) 10.310 4.919 ( 0.000 -8.499 0.000) 8.499 5.145 ( 0.000 -4.301 0.000) 4.301 5.355 ( 0.000 -10.738 0.000) 10.738 5.586 ( 0.000 -3.881 0.000) 3.881 5.732 ( 0.000 -7.630 0.000) 7.630 6.046 ( 0.000 6.179 0.000) 6.179 6.091 ( 0.000 -7.925 0.000) 7.925 6.342 ( 0.000 -4.166 0.000) 4.166 6.813 ( 0.000 13.108 0.000) 13.108 7.009 ( 0.000 14.516 0.000) 14.516 7.705 ( 0.000 6.744 0.000) 6.744 8.662 ( 0.000 0.102 0.000) 0.102 8.843 ( 0.000 -1.359 0.000) 1.359 9.111 ( 0.000 -2.863 0.000) 2.863 9.633 ( 0.000 1.108 0.000) 1.108 9.727 ( 0.000 5.830 0.000) 5.830 9.948 ( 0.000 -1.527 0.000) 1.527 10.328 ( 0.000 -0.747 0.000) 0.747 10.518 ( 0.000 -9.376 0.000) 9.376 10.955 ( 0.000 -2.039 0.000) 2.039 11.528 ( 0.000 0.942 0.000) 0.942 11.541 ( 0.000 14.057 0.000) 14.057 11.634 ( 0.000 4.771 0.000) 4.771 12.003 ( 0.000 10.834 0.000) 10.834 12.267 ( 0.000 7.503 0.000) 7.503 12.349 ( 0.000 -8.502 0.000) 8.502 12.526 ( 0.000 -11.236 0.000) 11.236 13.062 ( 0.000 19.759 0.000) 19.759 13.598 ( 0.000 -7.808 0.000) 7.808 14.310 ( 0.000 6.072 0.000) 6.072 14.776 ( 0.000 -3.984 0.000) 3.984 14.817 ( 0.000 -15.583 0.000) 15.583 15.831 ( 0.000 -11.647 0.000) 11.647 16.954 ( 0.000 -16.150 0.000) 16.150 17.666 ( 0.000 32.507 0.000) 32.507 19.455 ( 0.000 -8.843 0.000) 8.843 20.569 ( 0.000 1.797 0.000) 1.797 20.764 ( 0.000 -0.627 0.000) 0.627 ======================= Grid point 23 (14/170) ======================= q-point: ( 0.09 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.839 ( 6.819 12.475 5.786) 15.349 0.850 ( 2.803 14.640 2.232) 15.072 1.432 ( -8.103 -5.040 -2.744) 9.930 1.520 ( -5.234 1.462 0.261) 5.440 1.694 ( -7.450 12.612 13.849) 20.158 1.907 ( 3.621 -8.789 -8.094) 12.485 2.059 ( 10.867 26.476 5.039) 29.060 2.122 ( -9.831 -3.042 -2.246) 10.533 2.340 ( 3.410 -2.477 4.066) 5.856 2.440 ( 2.817 -0.635 5.295) 6.031 2.620 ( 0.631 -5.634 0.042) 5.670 2.914 ( -5.485 4.838 3.795) 8.240 2.918 ( -3.427 2.524 3.436) 5.470 3.128 ( -1.580 -6.709 -4.507) 8.235 3.230 ( 1.467 -3.048 -2.358) 4.124 3.400 ( 3.644 -1.672 6.235) 7.413 3.614 ( 6.100 1.377 -2.093) 6.594 3.749 ( 3.730 1.193 -1.221) 4.103 4.259 ( -1.164 2.728 0.614) 3.029 4.340 ( 0.602 -1.895 -5.748) 6.082 4.504 ( -0.424 5.613 -0.115) 5.631 4.541 ( 8.420 -0.017 -0.284) 8.425 4.879 ( -2.915 -8.628 -3.279) 9.679 5.117 ( -4.127 -3.091 1.906) 5.498 5.276 ( -5.992 -8.829 -0.872) 10.706 5.540 ( -5.752 -9.478 1.586) 11.200 5.763 ( -13.436 0.825 -7.090) 15.215 5.862 ( 9.515 -2.897 2.625) 10.287 6.234 ( -1.382 -5.577 -0.579) 5.775 6.408 ( 6.987 0.988 7.846) 10.553 6.873 ( 8.509 11.193 -3.773) 14.558 7.043 ( 3.330 13.924 1.702) 14.418 7.728 ( 0.867 5.778 2.976) 6.556 8.646 ( -2.691 -2.155 0.721) 3.521 8.749 ( -2.720 3.775 -7.449) 8.783 9.055 ( 0.061 -5.629 -8.553) 10.239 9.656 ( -0.405 2.367 4.019) 4.682 9.776 ( 1.716 3.578 1.586) 4.273 10.078 ( 4.628 -4.612 15.115) 16.467 10.337 ( 0.071 0.470 0.448) 0.653 10.569 ( 1.640 -9.598 7.609) 12.357 10.941 ( 0.117 -5.366 -4.007) 6.699 11.430 ( -9.620 9.111 1.939) 13.391 11.547 ( 0.436 3.848 -3.274) 5.071 11.602 ( -6.319 3.994 4.381) 8.664 12.112 ( 7.727 9.893 1.495) 12.641 12.142 ( -5.908 6.827 -3.694) 9.755 12.340 ( -5.357 -4.488 -6.028) 9.229 12.482 ( 2.231 -1.680 1.734) 3.287 13.088 ( 8.677 4.800 -3.192) 10.417 13.868 ( 10.097 -3.643 18.033) 20.986 14.273 ( 1.458 5.638 -6.357) 8.621 14.648 ( -15.296 -10.581 2.019) 18.708 14.778 ( 9.419 -5.929 -21.664) 24.356 15.925 ( 9.660 -10.241 1.568) 14.165 16.953 ( 1.690 -2.831 -4.393) 5.492 17.760 ( 0.713 18.513 16.234) 24.633 19.204 ( -15.395 -1.112 -16.486) 22.584 20.583 ( 0.125 1.419 2.206) 2.626 20.756 ( -0.729 -0.685 -0.152) 1.012 ======================= Grid point 24 (15/170) ======================= q-point: ( 0.18 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.941 ( 8.338 9.794 2.655) 13.134 1.073 ( 7.232 3.229 9.848) 12.637 1.331 ( -1.641 -6.366 2.640) 7.084 1.513 ( -2.141 -4.590 6.832) 8.505 1.708 ( -9.922 11.848 12.382) 19.802 1.866 ( -4.005 4.400 -7.723) 9.749 1.968 ( 4.711 -1.000 -4.971) 6.921 2.233 ( 3.120 -2.916 0.785) 4.342 2.409 ( -3.676 -0.310 -1.313) 3.916 2.549 ( 4.785 2.952 2.737) 6.254 2.613 ( 1.811 3.663 7.081) 8.175 2.873 ( -1.188 -4.766 2.474) 5.500 2.967 ( -1.482 5.013 8.247) 9.764 3.012 ( -3.604 -4.114 -6.064) 8.166 3.261 ( 2.212 -4.357 1.493) 5.109 3.477 ( -0.418 -6.010 1.412) 6.188 3.616 ( 3.888 1.138 -7.962) 8.934 3.858 ( 5.135 4.465 3.809) 7.798 4.242 ( 0.664 3.594 -3.149) 4.824 4.262 ( -3.229 5.891 -4.003) 7.820 4.472 ( -0.767 5.503 1.702) 5.811 4.705 ( 8.743 -5.678 -1.195) 10.493 4.751 ( -8.432 -9.626 -3.504) 13.268 5.076 ( -2.008 -1.382 0.079) 2.439 5.183 ( -5.135 -5.164 -0.247) 7.287 5.443 ( -6.588 -10.177 -0.686) 12.142 5.501 ( -10.304 -0.415 -4.590) 11.288 6.031 ( 5.774 -1.162 3.546) 6.875 6.144 ( -3.429 -1.540 -4.892) 6.170 6.628 ( 6.666 1.373 10.411) 12.438 6.963 ( 7.985 11.185 -4.687) 14.520 7.145 ( 6.267 11.689 1.579) 13.357 7.800 ( 2.620 3.126 5.211) 6.617 8.589 ( -4.445 -5.646 0.348) 7.194 8.675 ( 2.161 4.586 -5.798) 7.702 8.952 ( -0.212 -6.399 -9.542) 11.491 9.677 ( -1.995 3.470 3.292) 5.183 9.835 ( -0.308 1.121 8.230) 8.312 10.323 ( 0.610 0.138 -0.275) 0.683 10.329 ( 2.946 -7.377 13.230) 15.431 10.726 ( 2.740 -8.104 11.584) 14.400 10.868 ( -0.947 -8.038 -5.001) 9.514 11.303 ( -6.317 7.680 -0.552) 9.959 11.462 ( -7.166 3.478 -1.060) 8.035 11.562 ( -5.185 3.300 5.196) 8.048 11.993 ( -5.284 1.872 -2.990) 6.354 12.109 ( -5.701 -2.224 -7.740) 9.867 12.291 ( 3.090 5.749 -0.258) 6.532 12.643 ( 10.772 8.366 7.492) 15.561 13.240 ( 10.012 -7.764 0.781) 12.694 13.980 ( 0.402 6.685 -15.718) 17.086 14.340 ( -0.062 -0.033 -1.655) 1.657 14.442 ( -1.508 -5.669 5.862) 8.293 14.680 ( 8.609 0.306 -20.118) 21.885 16.129 ( 9.521 -3.323 5.298) 11.391 16.881 ( -5.891 18.009 -3.081) 19.197 18.018 ( 5.207 -3.958 20.479) 21.498 18.758 ( -13.498 1.897 -18.590) 23.052 20.616 ( 0.002 0.370 3.459) 3.479 20.740 ( -1.175 -0.906 0.112) 1.488 ======================= Grid point 25 (16/170) ======================= q-point: ( 0.27 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( 10.172 6.451 5.475) 13.231 1.240 ( 3.167 -3.073 3.682) 5.747 1.424 ( 5.204 -1.121 5.235) 7.466 1.539 ( -9.766 -0.870 7.537) 12.367 1.605 ( -2.686 4.853 2.195) 5.965 1.858 ( 3.336 6.284 5.261) 8.848 2.038 ( 8.166 2.970 -4.556) 9.812 2.166 ( -5.055 -0.850 -4.547) 6.852 2.357 ( -2.401 -5.386 0.085) 5.897 2.497 ( -3.737 -4.808 -0.688) 6.128 2.688 ( -8.375 -0.438 0.669) 8.414 2.889 ( 1.059 -8.566 1.866) 8.831 2.934 ( 1.291 -3.365 -0.703) 3.672 3.141 ( 8.394 -2.000 -0.127) 8.630 3.342 ( 3.802 5.578 4.975) 8.386 3.425 ( 0.388 -7.134 1.809) 7.370 3.658 ( 4.217 0.550 0.554) 4.289 3.897 ( -2.589 1.311 -1.293) 3.178 4.152 ( -6.653 5.388 1.038) 8.624 4.259 ( 6.164 9.852 -6.344) 13.240 4.524 ( 1.720 5.818 4.912) 7.806 4.537 ( -10.860 -6.272 -5.139) 13.553 4.776 ( 1.371 -4.501 -0.219) 4.710 5.048 ( -0.349 -0.850 -2.143) 2.331 5.102 ( -1.881 -2.866 -3.573) 4.952 5.312 ( -7.651 -8.010 -1.764) 11.216 5.356 ( -5.256 -0.842 0.193) 5.327 5.991 ( -4.982 -10.528 -5.434) 12.852 6.163 ( 3.324 11.338 2.443) 12.065 6.828 ( 4.989 0.823 7.824) 9.316 7.042 ( 7.833 12.393 -3.415) 15.053 7.256 ( 4.579 10.494 2.250) 11.669 7.921 ( 4.806 -0.311 5.679) 7.446 8.515 ( -5.182 -6.552 -0.202) 8.356 8.675 ( 4.509 0.166 -4.706) 6.519 8.854 ( -0.367 -5.023 -7.176) 8.767 9.684 ( -1.432 1.097 4.113) 4.491 9.934 ( -1.444 2.314 11.834) 12.144 10.272 ( -3.352 -4.246 -1.238) 5.549 10.483 ( 1.040 -6.008 1.819) 6.363 10.745 ( -1.281 -4.963 2.424) 5.670 10.975 ( 1.590 -5.085 11.458) 12.636 11.222 ( -2.340 6.646 -1.232) 7.153 11.365 ( -2.971 -1.268 2.855) 4.311 11.540 ( -4.912 2.383 6.103) 8.189 11.890 ( -4.255 1.621 -4.147) 6.159 11.944 ( -3.687 -4.033 -6.163) 8.237 12.292 ( -2.106 -1.999 0.475) 2.942 12.912 ( 11.364 10.240 3.549) 15.703 13.394 ( 6.941 -12.034 1.442) 13.966 13.751 ( 0.351 5.464 -19.320) 20.081 14.095 ( -6.710 -5.336 -19.629) 21.419 14.678 ( 10.250 8.861 1.584) 13.642 14.699 ( 13.553 12.778 -2.863) 18.845 16.304 ( 1.659 9.278 8.804) 12.897 16.707 ( -11.550 27.716 -1.991) 30.092 18.319 ( 4.031 -14.901 18.288) 23.933 18.409 ( -5.556 -6.860 -15.745) 18.051 20.651 ( -0.245 -1.190 2.988) 3.226 20.723 ( -1.316 -1.148 0.685) 1.876 ======================= Grid point 26 (17/170) ======================= q-point: ( 0.36 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.198 ( -11.092 4.378 -1.867) 12.070 1.332 ( 6.293 7.385 1.139) 9.770 1.427 ( 1.094 2.263 4.187) 4.884 1.612 ( 3.963 0.225 0.197) 3.975 1.661 ( 0.430 -1.552 11.402) 11.515 1.952 ( 1.270 0.871 -2.430) 2.877 2.093 ( 4.952 2.303 1.131) 5.578 2.138 ( 1.068 -1.161 -0.668) 1.713 2.331 ( 2.550 1.961 1.324) 3.478 2.419 ( -3.773 0.698 -4.283) 5.751 2.564 ( -5.366 -6.014 3.811) 8.915 2.917 ( 1.333 -7.542 -1.313) 7.771 2.992 ( 5.120 -14.164 -0.362) 15.065 3.074 ( -4.514 -6.360 -5.222) 9.386 3.413 ( 2.922 -7.949 1.302) 8.569 3.591 ( -1.115 -6.459 -2.690) 7.085 3.757 ( 5.010 4.274 13.401) 14.931 3.838 ( 1.271 3.803 -1.261) 4.204 4.067 ( -6.547 6.471 1.720) 9.365 4.209 ( -7.034 -0.412 -2.052) 7.339 4.388 ( 2.768 6.644 -6.601) 9.766 4.602 ( 3.097 6.752 -1.782) 7.639 4.780 ( -1.098 3.449 3.931) 5.344 5.020 ( -0.010 -0.688 -1.795) 1.922 5.056 ( 0.145 -5.837 -2.202) 6.241 5.187 ( -4.141 -1.652 -4.106) 6.061 5.284 ( -5.809 -0.901 2.278) 6.304 5.854 ( -4.248 -11.580 -5.300) 13.425 6.221 ( 1.060 13.473 1.764) 13.629 6.937 ( 1.756 1.508 2.683) 3.544 7.148 ( 8.055 13.481 -1.693) 15.795 7.341 ( 1.659 8.924 4.221) 10.010 8.064 ( 5.904 -3.329 4.229) 7.989 8.417 ( -5.756 -7.647 -1.148) 9.640 8.707 ( 4.711 -2.837 -3.662) 6.607 8.789 ( -0.638 -3.510 -3.401) 4.929 9.729 ( 0.291 -1.655 5.854) 6.091 10.022 ( -2.539 0.858 9.182) 9.565 10.197 ( -3.506 -5.753 -2.232) 7.097 10.419 ( -1.088 -1.639 -7.351) 7.610 10.852 ( 1.780 -4.706 12.917) 13.862 11.002 ( -4.584 4.231 2.618) 6.765 11.192 ( -1.879 6.198 0.218) 6.481 11.451 ( 2.127 -2.461 6.508) 7.275 11.538 ( -4.207 -3.859 4.474) 7.253 11.780 ( 1.456 -3.299 -6.367) 7.317 11.878 ( -1.992 -4.960 1.942) 5.687 12.261 ( -1.741 -3.349 0.089) 3.776 12.980 ( 1.509 1.907 -8.146) 8.501 13.468 ( 1.834 -7.552 -6.161) 9.918 13.651 ( 5.635 -0.193 -15.438) 16.435 13.824 ( -2.956 -7.311 -2.811) 8.372 14.834 ( 15.195 23.954 -6.615) 29.128 14.939 ( 10.678 21.716 3.984) 24.525 16.348 ( -9.517 25.110 10.392) 28.794 16.502 ( -8.695 25.441 -3.473) 27.109 18.200 ( -2.079 -13.858 -9.337) 16.839 18.556 ( 3.442 -22.259 11.306) 25.202 20.664 ( -0.628 -2.042 0.645) 2.232 20.720 ( -0.780 -2.114 1.918) 2.959 ======================= Grid point 27 (18/170) ======================= q-point: ( 0.45 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -7.090 7.794 -2.291) 10.782 1.413 ( 5.288 5.688 -1.018) 7.832 1.483 ( -2.282 2.807 2.311) 4.293 1.646 ( 0.412 -1.896 2.153) 2.898 1.799 ( 3.077 4.371 5.690) 7.806 1.912 ( -1.350 3.656 -2.020) 4.389 2.061 ( -2.874 -2.398 -4.285) 5.690 2.172 ( 1.321 -2.198 1.225) 2.842 2.347 ( 0.093 -0.960 -1.957) 2.182 2.501 ( 9.447 5.210 1.747) 10.929 2.561 ( -2.947 -3.822 4.928) 6.898 2.895 ( -2.263 -1.580 -2.308) 3.598 2.937 ( 0.945 -14.904 -3.512) 15.342 3.163 ( 6.922 -13.740 4.468) 16.021 3.410 ( -5.829 -8.324 1.452) 10.265 3.423 ( -5.627 -16.025 -6.264) 18.102 3.893 ( 4.840 8.837 -2.644) 10.417 3.900 ( 0.039 -5.410 2.520) 5.968 3.992 ( -5.152 3.714 3.380) 7.194 4.160 ( -0.165 2.919 3.903) 4.876 4.410 ( 5.946 9.876 -2.348) 11.764 4.537 ( -5.092 3.786 -4.136) 7.575 4.873 ( 4.938 11.294 4.264) 13.043 5.015 ( 0.983 3.661 -2.102) 4.334 5.048 ( -1.642 -7.594 2.145) 8.060 5.079 ( -2.498 1.192 -4.832) 5.569 5.224 ( -3.252 -1.106 1.187) 3.634 5.759 ( -1.770 -13.781 -2.357) 14.093 6.242 ( 0.148 14.916 0.589) 14.928 6.966 ( 0.388 2.047 0.448) 2.131 7.233 ( 3.620 15.820 -0.959) 16.257 7.393 ( -0.006 6.277 2.572) 6.784 8.193 ( 5.502 -4.941 2.109) 7.690 8.313 ( -5.367 -8.300 -1.224) 9.960 8.737 ( 2.844 -3.879 -2.414) 5.382 8.757 ( -1.182 -3.097 0.090) 3.316 9.804 ( 1.136 -4.607 4.046) 6.236 10.047 ( -2.711 -2.015 4.971) 6.010 10.110 ( -1.167 -4.728 -5.796) 7.571 10.364 ( 0.019 1.986 -1.310) 2.379 10.942 ( -1.418 2.081 0.735) 2.623 11.055 ( 4.366 4.782 6.894) 9.458 11.174 ( -3.934 0.760 7.221) 8.258 11.416 ( -3.187 -2.300 -10.218) 10.947 11.509 ( -0.241 2.736 1.978) 3.385 11.778 ( 0.085 -8.048 -0.610) 8.071 11.950 ( 2.834 -9.666 4.734) 11.130 12.242 ( -0.636 -2.739 -0.069) 2.813 12.961 ( 2.991 -4.473 4.199) 6.826 13.212 ( -6.344 -3.963 -20.804) 22.108 13.656 ( 2.744 -11.427 -0.892) 11.786 13.884 ( 2.000 -3.922 3.641) 5.713 14.994 ( 9.138 32.037 -2.457) 33.405 15.084 ( 3.258 31.955 0.565) 32.125 16.271 ( -6.690 33.668 4.418) 34.610 16.378 ( -3.622 20.295 -1.378) 20.661 18.121 ( 0.153 -19.021 -3.319) 19.309 18.674 ( 0.897 -23.992 4.079) 24.353 20.656 ( -0.329 -2.002 -0.049) 2.029 20.730 ( -0.246 -3.295 0.939) 3.435 ======================= Grid point 33 (19/170) ======================= q-point: ( 0.00 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.995 ( 0.000 12.770 0.000) 12.770 1.085 ( 0.000 2.297 0.000) 2.297 1.209 ( 0.000 -17.214 0.000) 17.214 1.537 ( 0.000 -6.484 0.000) 6.484 1.784 ( 0.000 -6.441 0.000) 6.441 1.963 ( 0.000 3.366 0.000) 3.366 1.969 ( 0.000 -2.734 0.000) 2.734 2.269 ( 0.000 -1.267 0.000) 1.267 2.327 ( 0.000 10.943 0.000) 10.943 2.561 ( 0.000 -0.065 0.000) 0.065 2.699 ( 0.000 13.308 0.000) 13.308 2.908 ( 0.000 -2.833 0.000) 2.833 2.978 ( 0.000 4.542 0.000) 4.542 3.155 ( 0.000 -5.750 0.000) 5.750 3.233 ( 0.000 6.647 0.000) 6.647 3.383 ( 0.000 15.630 0.000) 15.630 3.552 ( 0.000 0.018 0.000) 0.018 3.899 ( 0.000 13.168 0.000) 13.168 4.289 ( 0.000 -4.823 0.000) 4.823 4.303 ( 0.000 2.808 0.000) 2.808 4.417 ( 0.000 0.168 0.000) 0.168 4.673 ( 0.000 1.784 0.000) 1.784 4.776 ( 0.000 -6.789 0.000) 6.789 5.042 ( 0.000 -7.372 0.000) 7.372 5.172 ( 0.000 -7.443 0.000) 7.443 5.436 ( 0.000 -10.978 0.000) 10.978 5.618 ( 0.000 -2.782 0.000) 2.782 5.919 ( 0.000 -9.095 0.000) 9.095 6.152 ( 0.000 4.529 0.000) 4.529 6.284 ( 0.000 -1.944 0.000) 1.944 7.069 ( 0.000 12.716 0.000) 12.716 7.244 ( 0.000 9.125 0.000) 9.125 7.864 ( 0.000 9.628 0.000) 9.628 8.530 ( 0.000 -10.579 0.000) 10.579 8.892 ( 0.000 3.437 0.000) 3.437 9.053 ( 0.000 -3.084 0.000) 3.084 9.649 ( 0.000 1.159 0.000) 1.159 9.809 ( 0.000 1.391 0.000) 1.391 9.986 ( 0.000 4.564 0.000) 4.564 10.336 ( 0.000 2.350 0.000) 2.350 10.344 ( 0.000 -7.883 0.000) 7.883 10.836 ( 0.000 -9.121 0.000) 9.121 11.548 ( 0.000 2.182 0.000) 2.182 11.719 ( 0.000 3.912 0.000) 3.912 11.754 ( 0.000 5.048 0.000) 5.048 12.184 ( 0.000 -10.703 0.000) 10.703 12.275 ( 0.000 14.720 0.000) 14.720 12.328 ( 0.000 -4.457 0.000) 4.457 12.400 ( 0.000 7.230 0.000) 7.230 13.353 ( 0.000 -16.166 0.000) 16.166 13.520 ( 0.000 27.079 0.000) 27.079 14.435 ( 0.000 5.481 0.000) 5.481 14.687 ( 0.000 -1.525 0.000) 1.525 14.691 ( 0.000 -4.694 0.000) 4.694 15.616 ( 0.000 -7.555 0.000) 7.555 16.576 ( 0.000 -22.603 0.000) 22.603 18.231 ( 0.000 25.968 0.000) 25.968 19.257 ( 0.000 -11.677 0.000) 11.677 20.610 ( 0.000 2.388 0.000) 2.388 20.744 ( 0.000 -1.531 0.000) 1.531 ======================= Grid point 34 (20/170) ======================= q-point: ( 0.09 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.962 ( -2.840 -5.305 -3.774) 7.103 1.034 ( -1.977 4.665 2.679) 5.732 1.294 ( 1.801 -3.491 7.724) 8.666 1.548 ( -3.886 -2.005 3.860) 5.833 1.644 ( -6.630 -1.468 -3.587) 7.680 1.958 ( -2.711 -5.860 4.001) 7.595 1.999 ( 4.043 2.555 0.124) 4.784 2.205 ( -2.748 0.520 -6.012) 6.631 2.422 ( 2.162 4.006 5.391) 7.056 2.539 ( 1.336 -1.403 -5.953) 6.260 2.725 ( 2.456 8.679 2.963) 9.494 2.888 ( -0.989 -3.904 -6.865) 7.959 2.935 ( -3.695 2.168 2.196) 4.814 3.145 ( -1.839 6.619 1.050) 6.949 3.271 ( -1.655 4.660 6.226) 7.951 3.376 ( -3.736 8.807 7.158) 11.948 3.600 ( 5.809 -0.094 -3.998) 7.053 3.949 ( 4.735 13.970 1.909) 14.873 4.265 ( -0.778 -3.091 -2.241) 3.896 4.347 ( 2.753 4.093 3.388) 5.984 4.470 ( 3.533 -2.871 1.859) 4.917 4.619 ( -2.821 0.121 -2.888) 4.039 4.765 ( -0.310 -3.269 -4.322) 5.428 5.027 ( -0.241 -6.882 -1.292) 7.007 5.129 ( -3.133 -5.675 -0.446) 6.498 5.326 ( -7.697 -11.580 -0.917) 13.935 5.725 ( -8.781 -3.552 -4.466) 10.472 5.763 ( 4.458 -7.039 2.342) 8.655 6.206 ( 2.136 2.554 0.397) 3.353 6.412 ( 9.809 -1.014 5.545) 11.313 7.102 ( 5.513 11.838 -2.616) 13.318 7.270 ( 2.638 8.773 0.826) 9.198 7.869 ( -0.821 8.845 2.372) 9.194 8.502 ( -3.482 -10.109 0.438) 10.701 8.853 ( -0.930 4.492 -5.438) 7.115 8.974 ( -2.049 -2.943 -8.058) 8.820 9.690 ( 1.775 1.738 4.573) 5.204 9.863 ( 1.654 4.417 -0.234) 4.723 10.007 ( 1.513 -2.733 7.285) 7.926 10.322 ( -1.611 -4.199 -1.182) 4.650 10.420 ( 0.305 -2.514 12.788) 13.036 10.799 ( -2.990 -8.891 -1.929) 9.576 11.527 ( -5.376 3.334 1.143) 6.428 11.617 ( -3.263 2.808 -2.771) 5.120 11.753 ( -6.843 8.029 3.981) 11.275 12.101 ( -6.492 -9.757 3.266) 12.166 12.192 ( -7.895 -0.343 -6.989) 10.550 12.333 ( 1.437 3.814 -1.564) 4.366 12.577 ( 14.227 10.646 4.657) 18.369 13.160 ( 0.131 -1.131 -11.648) 11.704 13.892 ( 15.271 9.853 19.144) 26.396 14.370 ( -0.776 3.500 -11.137) 11.700 14.585 ( -5.144 -0.779 -6.419) 8.262 14.723 ( 9.830 0.962 -10.304) 14.273 15.722 ( 11.637 -7.735 1.488) 14.053 16.687 ( 12.625 -21.011 0.068) 24.512 18.195 ( -9.234 23.132 7.298) 25.954 19.106 ( -14.266 -8.195 -4.880) 17.161 20.616 ( -0.471 1.955 1.672) 2.615 20.735 ( -0.983 -1.516 0.032) 1.807 ======================= Grid point 35 (21/170) ======================= q-point: ( 0.18 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.951 ( 2.883 -9.554 3.971) 10.740 1.054 ( 0.695 -3.863 4.598) 6.045 1.367 ( -0.724 9.973 4.001) 10.770 1.512 ( -0.846 3.886 5.134) 6.494 1.669 ( 0.843 -7.325 8.855) 11.523 1.908 ( -4.559 -0.937 -1.016) 4.764 2.085 ( 1.326 -4.032 3.937) 5.789 2.108 ( 1.938 2.757 -8.004) 8.685 2.439 ( -0.639 1.110 -3.132) 3.384 2.491 ( -2.069 -0.596 -1.906) 2.876 2.761 ( -2.708 -1.457 -6.776) 7.441 2.811 ( 3.191 -1.894 -2.407) 4.423 2.907 ( -4.160 0.419 3.081) 5.194 3.099 ( -4.434 3.858 3.443) 6.812 3.308 ( -2.661 -1.730 2.884) 4.288 3.422 ( 0.778 15.854 8.818) 18.158 3.613 ( -1.130 -2.337 0.155) 2.601 4.053 ( 4.003 13.603 -0.726) 14.198 4.230 ( -1.916 -1.377 2.561) 3.482 4.426 ( 1.444 3.919 -1.807) 4.551 4.466 ( -3.939 -4.134 1.990) 6.047 4.628 ( 5.358 -2.029 -1.694) 5.974 4.674 ( -1.738 1.757 -3.091) 3.958 5.033 ( 1.367 -2.697 -2.311) 3.806 5.085 ( -1.076 -5.286 -0.904) 5.470 5.200 ( -5.497 -13.008 -1.487) 14.199 5.501 ( -8.348 0.199 -5.230) 9.853 5.842 ( -0.152 -11.995 0.092) 11.996 6.272 ( 5.836 8.776 0.945) 10.582 6.634 ( 8.261 -1.457 7.438) 11.211 7.176 ( 8.093 10.812 -4.493) 14.233 7.342 ( 4.272 7.680 1.761) 8.963 7.893 ( -0.589 6.540 4.304) 7.851 8.440 ( -4.850 -9.337 0.866) 10.557 8.759 ( -0.120 3.295 -9.333) 9.898 8.867 ( -1.118 -2.459 -6.450) 6.993 9.761 ( -2.197 4.943 4.550) 7.068 9.863 ( 1.380 2.861 3.001) 4.370 10.176 ( 4.441 -8.656 8.667) 13.030 10.266 ( -2.466 -5.532 -0.943) 6.130 10.595 ( 0.012 -4.752 18.071) 18.685 10.715 ( -4.652 -7.528 -0.597) 8.869 11.411 ( -6.329 4.104 -1.498) 7.690 11.552 ( -8.254 4.940 2.874) 10.039 11.676 ( -4.915 6.736 2.414) 8.681 11.975 ( -7.567 -1.367 -7.221) 10.548 12.043 ( -4.225 -5.450 -0.437) 6.910 12.273 ( -6.051 -4.906 -0.732) 7.824 12.880 ( 15.778 12.667 3.930) 20.611 13.153 ( 7.964 -1.445 -3.848) 8.962 14.060 ( -4.231 2.953 -15.521) 16.357 14.329 ( 1.812 -3.249 -22.617) 22.921 14.473 ( 12.311 8.235 11.789) 18.930 14.851 ( 16.604 15.106 -4.932) 22.983 15.995 ( 17.292 -7.142 4.183) 19.171 16.927 ( 16.218 -13.241 -1.916) 21.025 18.103 ( -14.863 12.777 12.501) 23.247 18.748 ( -20.943 -3.102 -6.203) 22.062 20.627 ( -1.107 0.826 2.594) 2.939 20.715 ( -1.628 -1.651 0.294) 2.337 ======================= Grid point 36 (22/170) ======================= q-point: ( 0.27 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( 4.282 -8.689 6.534) 11.684 1.212 ( 10.647 -2.921 6.110) 12.618 1.450 ( 5.266 7.059 6.095) 10.710 1.556 ( -2.313 3.971 5.660) 7.291 1.760 ( -3.345 4.038 5.707) 7.750 1.862 ( 1.538 -2.554 0.747) 3.074 2.059 ( -1.131 -6.632 -3.272) 7.482 2.124 ( 2.552 0.844 -1.925) 3.306 2.395 ( 0.482 2.593 -2.410) 3.572 2.418 ( -3.622 3.437 -1.175) 5.130 2.684 ( -0.309 -7.469 -4.496) 8.723 2.728 ( -4.080 -2.305 -6.495) 8.009 2.857 ( -2.795 -0.981 -1.907) 3.523 3.118 ( -3.107 -0.091 6.753) 7.434 3.234 ( -4.040 -6.551 -2.305) 8.035 3.520 ( -2.451 -2.334 1.467) 3.689 3.666 ( 2.755 10.331 14.148) 17.734 3.995 ( -4.753 4.544 -4.487) 7.961 4.247 ( -4.508 5.706 3.675) 8.148 4.355 ( -10.666 -5.417 -1.098) 12.013 4.437 ( 6.642 3.997 -0.705) 7.783 4.634 ( 2.710 -2.048 -3.449) 4.841 4.778 ( 6.697 8.645 3.788) 11.573 4.964 ( -1.860 -7.294 -4.383) 8.710 5.052 ( -3.410 -3.567 -1.889) 5.284 5.171 ( 4.295 -4.086 -3.192) 6.732 5.353 ( -4.827 0.451 -3.210) 5.815 5.781 ( -4.302 -11.077 -3.056) 12.269 6.388 ( 5.469 11.443 2.124) 12.859 6.824 ( 6.057 -1.831 5.646) 8.481 7.265 ( 8.834 10.672 -4.081) 14.443 7.432 ( 3.397 6.763 2.886) 8.100 7.946 ( 1.081 3.080 4.749) 5.762 8.363 ( -5.883 -8.802 0.656) 10.607 8.674 ( 2.262 0.008 -8.694) 8.984 8.794 ( -1.079 -1.826 -4.162) 4.671 9.734 ( -2.964 4.188 1.594) 5.373 9.970 ( 1.392 2.223 8.533) 8.927 10.151 ( -5.163 -7.506 -1.099) 9.176 10.351 ( 3.202 -8.013 2.528) 8.991 10.661 ( -3.035 -3.476 7.246) 8.590 10.832 ( 1.652 -8.194 20.993) 22.596 11.311 ( -4.941 3.375 -0.485) 6.004 11.426 ( -9.236 6.274 2.476) 11.437 11.627 ( -3.178 4.851 -0.863) 5.863 11.821 ( -4.734 -5.025 -3.314) 7.658 11.930 ( -5.796 0.740 -4.917) 7.637 12.188 ( -3.742 -9.505 1.554) 10.333 13.101 ( 8.651 9.370 -3.898) 13.336 13.286 ( 9.906 0.034 0.523) 9.920 13.790 ( -2.795 -0.209 -16.974) 17.204 13.979 ( -4.753 -6.875 -30.079) 31.219 14.907 ( 18.500 15.975 13.581) 27.962 15.136 ( 24.320 26.931 -4.589) 36.576 16.327 ( 15.097 -4.004 6.911) 17.080 17.093 ( 6.078 6.273 -3.898) 9.565 18.019 ( -10.916 -9.428 11.776) 18.620 18.343 ( -21.286 -2.454 -3.875) 21.774 20.632 ( -1.525 -0.640 2.172) 2.730 20.691 ( -1.997 -2.044 0.762) 2.957 ======================= Grid point 37 (23/170) ======================= q-point: ( 0.36 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 2.029 -0.470 2.495) 3.250 1.425 ( 6.003 -0.799 5.695) 8.313 1.560 ( 0.121 7.044 3.913) 8.058 1.660 ( -5.128 5.573 4.296) 8.707 1.687 ( 7.885 6.057 0.751) 9.971 1.896 ( -1.172 -5.903 0.822) 6.074 2.042 ( 0.919 -5.336 -0.167) 5.417 2.134 ( 2.432 -0.451 -2.287) 3.369 2.402 ( 1.685 -1.223 1.138) 2.372 2.432 ( 4.165 7.071 -1.118) 8.282 2.543 ( -4.266 1.461 -2.763) 5.288 2.719 ( 3.299 -11.920 0.262) 12.370 2.787 ( -0.210 -4.013 -6.033) 7.249 3.041 ( -8.378 0.949 0.668) 8.458 3.209 ( -1.759 -11.368 0.764) 11.529 3.425 ( -8.303 -8.790 -1.155) 12.147 3.833 ( -4.623 0.661 7.695) 9.001 3.910 ( -0.276 3.558 3.210) 4.800 4.184 ( -4.916 4.475 -1.639) 6.847 4.194 ( -4.997 0.778 2.575) 5.675 4.550 ( 6.940 8.872 -2.826) 11.613 4.632 ( -0.530 -1.857 0.013) 1.931 4.864 ( 3.809 -3.806 -2.643) 5.999 4.960 ( -2.171 -2.069 0.504) 3.041 4.996 ( 4.049 5.139 0.387) 6.554 5.199 ( 3.621 1.675 -4.230) 5.814 5.257 ( -3.868 -1.274 -2.241) 4.649 5.665 ( -5.223 -8.632 -3.265) 10.604 6.478 ( 2.928 12.880 1.738) 13.323 6.939 ( 3.256 -1.550 1.725) 3.998 7.375 ( 8.912 10.055 -2.557) 13.677 7.503 ( 0.396 6.507 4.250) 7.782 8.023 ( 2.963 -0.580 3.068) 4.305 8.267 ( -6.246 -7.699 0.189) 9.916 8.647 ( 3.546 -2.433 -5.446) 6.939 8.740 ( -1.353 -2.258 -2.174) 3.414 9.723 ( -0.848 1.370 2.108) 2.653 10.020 ( -5.157 -2.099 4.601) 7.223 10.092 ( 0.444 -3.063 -1.639) 3.503 10.364 ( -0.355 -4.622 -0.816) 4.707 10.781 ( 0.488 -1.762 16.498) 16.599 11.052 ( -1.186 -0.649 12.375) 12.449 11.278 ( -0.683 -6.399 7.605) 9.962 11.334 ( -4.667 6.415 1.065) 8.005 11.559 ( -1.635 1.143 -4.207) 4.656 11.706 ( -6.394 -5.546 -1.874) 8.669 11.816 ( -1.377 1.080 -3.251) 3.692 12.174 ( -0.787 -7.269 1.426) 7.450 13.039 ( -1.148 5.205 -14.005) 14.985 13.432 ( 5.438 2.659 -2.865) 6.697 13.534 ( -2.621 -8.754 -27.238) 28.730 13.736 ( 1.920 -4.265 -1.397) 4.881 15.329 ( 17.531 25.124 9.851) 32.181 15.498 ( 25.382 34.713 -4.919) 43.283 16.595 ( 7.330 2.878 7.847) 11.117 17.024 ( -9.231 23.690 -1.849) 25.492 17.916 ( -9.565 -17.992 -8.245) 21.981 18.103 ( -8.386 -20.054 11.416) 24.552 20.625 ( -1.259 -1.776 0.677) 2.280 20.671 ( -1.851 -2.833 1.321) 3.633 ======================= Grid point 38 (24/170) ======================= q-point: ( 0.45 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( -2.463 10.888 -1.018) 11.209 1.516 ( 1.207 2.434 2.244) 3.524 1.566 ( -1.699 5.762 -0.429) 6.023 1.643 ( 1.512 2.975 3.327) 4.712 1.851 ( -1.616 -8.517 -1.567) 8.810 1.886 ( 6.126 4.862 3.950) 8.761 2.019 ( -1.465 -3.621 -2.614) 4.700 2.180 ( 2.144 3.357 1.021) 4.112 2.357 ( -2.218 2.177 -3.825) 4.928 2.465 ( 1.370 -1.500 1.983) 2.839 2.638 ( 5.738 3.755 3.205) 7.570 2.728 ( 0.426 -6.243 -2.921) 6.905 2.822 ( 7.491 -8.792 -0.614) 11.567 2.953 ( -3.117 -4.537 3.466) 6.505 3.103 ( -8.221 -14.236 -3.814) 16.876 3.274 ( -6.677 -7.827 -1.161) 10.354 3.779 ( -4.360 -5.075 2.059) 7.000 3.942 ( 0.755 -2.776 0.830) 2.994 4.121 ( -2.362 7.351 -0.313) 7.727 4.220 ( 1.015 2.489 3.289) 4.248 4.592 ( 3.984 8.594 -3.974) 10.272 4.618 ( -2.511 4.127 2.050) 5.248 4.904 ( 3.485 -5.833 -2.039) 7.095 4.928 ( -1.081 -4.813 0.339) 4.944 5.078 ( 1.484 6.221 2.412) 6.835 5.179 ( -1.725 -1.637 -2.914) 3.761 5.214 ( 1.857 6.502 -0.777) 6.806 5.564 ( -3.067 -6.907 -1.535) 7.712 6.521 ( 0.836 13.767 0.646) 13.807 6.979 ( 0.956 -0.995 0.034) 1.381 7.477 ( 6.627 9.154 -2.846) 11.654 7.528 ( -3.109 6.589 4.136) 8.378 8.100 ( 4.048 -3.830 0.458) 5.591 8.177 ( -5.166 -5.906 0.549) 7.866 8.657 ( 2.353 -3.594 -2.145) 4.802 8.704 ( -1.335 -2.633 -0.323) 2.969 9.741 ( 0.199 -1.240 1.259) 1.778 9.983 ( -2.544 -5.508 1.889) 6.354 10.070 ( -0.006 1.618 -2.529) 3.002 10.360 ( -0.223 -2.980 0.539) 3.037 10.952 ( 0.492 0.814 7.763) 7.821 11.101 ( -0.094 2.342 6.970) 7.354 11.281 ( -2.744 6.035 -0.169) 6.632 11.383 ( -1.024 -3.182 5.330) 6.291 11.486 ( 1.107 -5.707 -6.448) 8.682 11.617 ( -2.428 -3.804 -0.363) 4.528 11.812 ( 0.879 -3.115 1.578) 3.601 12.176 ( -0.245 -6.251 0.231) 6.260 12.910 ( -0.284 0.449 -3.498) 3.538 13.153 ( -4.230 -3.777 -17.591) 18.482 13.536 ( 2.747 -1.242 -0.214) 3.022 13.785 ( 1.710 -5.675 1.107) 6.030 15.640 ( 9.083 33.435 4.346) 34.918 15.783 ( 12.733 39.649 -2.892) 41.744 16.719 ( 2.012 13.230 1.927) 13.520 16.841 ( -10.277 24.207 2.194) 26.389 17.708 ( -4.303 -22.845 -4.668) 23.711 18.137 ( -0.897 -30.943 4.188) 31.238 20.613 ( -0.467 -2.233 -0.004) 2.281 20.660 ( -0.788 -3.639 0.682) 3.785 ======================= Grid point 44 (25/170) ======================= q-point: ( 0.00 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.934 ( 0.000 -8.530 0.000) 8.530 0.948 ( 0.000 -8.869 0.000) 8.869 1.220 ( 0.000 10.219 0.000) 10.219 1.397 ( 0.000 -8.144 0.000) 8.144 1.887 ( 0.000 12.382 0.000) 12.382 1.945 ( 0.000 -0.075 0.000) 0.075 1.958 ( 0.000 -1.100 0.000) 1.100 2.134 ( 0.000 -11.291 0.000) 11.291 2.520 ( 0.000 6.215 0.000) 6.215 2.567 ( 0.000 0.167 0.000) 0.167 2.730 ( 0.000 0.434 0.000) 0.434 2.801 ( 0.000 -6.303 0.000) 6.303 3.041 ( 0.000 0.871 0.000) 0.871 3.073 ( 0.000 -2.732 0.000) 2.732 3.539 ( 0.000 10.760 0.000) 10.760 3.592 ( 0.000 2.354 0.000) 2.354 3.747 ( 0.000 22.590 0.000) 22.590 4.033 ( 0.000 -3.757 0.000) 3.757 4.246 ( 0.000 1.766 0.000) 1.766 4.338 ( 0.000 -2.735 0.000) 2.735 4.463 ( 0.000 7.933 0.000) 7.933 4.625 ( 0.000 -6.048 0.000) 6.048 4.677 ( 0.000 -0.588 0.000) 0.588 4.827 ( 0.000 -13.106 0.000) 13.106 5.116 ( 0.000 1.469 0.000) 1.469 5.221 ( 0.000 -9.361 0.000) 9.361 5.641 ( 0.000 4.447 0.000) 4.447 5.759 ( 0.000 -7.359 0.000) 7.359 6.219 ( 0.000 2.489 0.000) 2.489 6.255 ( 0.000 -1.439 0.000) 1.439 7.273 ( 0.000 7.644 0.000) 7.644 7.342 ( 0.000 0.796 0.000) 0.796 8.072 ( 0.000 11.744 0.000) 11.744 8.306 ( 0.000 -12.224 0.000) 12.224 8.946 ( 0.000 2.413 0.000) 2.413 8.995 ( 0.000 -2.775 0.000) 2.775 9.693 ( 0.000 3.447 0.000) 3.447 9.773 ( 0.000 -4.116 0.000) 4.116 10.094 ( 0.000 6.118 0.000) 6.118 10.212 ( 0.000 -6.164 0.000) 6.164 10.443 ( 0.000 8.355 0.000) 8.355 10.635 ( 0.000 -10.925 0.000) 10.925 11.620 ( 0.000 5.154 0.000) 5.154 11.730 ( 0.000 -5.289 0.000) 5.289 11.808 ( 0.000 5.840 0.000) 5.840 11.961 ( 0.000 -10.278 0.000) 10.278 12.358 ( 0.000 3.857 0.000) 3.857 12.400 ( 0.000 0.338 0.000) 0.338 12.669 ( 0.000 17.968 0.000) 17.968 13.019 ( 0.000 -18.014 0.000) 18.014 14.064 ( 0.000 27.942 0.000) 27.942 14.519 ( 0.000 3.559 0.000) 3.559 14.529 ( 0.000 -17.358 0.000) 17.358 14.601 ( 0.000 -4.512 0.000) 4.512 15.689 ( 0.000 15.736 0.000) 15.736 16.109 ( 0.000 -24.832 0.000) 24.832 18.670 ( 0.000 19.728 0.000) 19.728 19.002 ( 0.000 -14.974 0.000) 14.974 20.659 ( 0.000 2.580 0.000) 2.580 20.706 ( 0.000 -2.277 0.000) 2.277 ======================= Grid point 45 (26/170) ======================= q-point: ( 0.09 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( -6.088 -3.234 -1.141) 6.988 0.921 ( -4.127 -11.880 -0.405) 12.583 1.336 ( 4.563 6.974 10.510) 13.413 1.468 ( 0.767 -5.683 8.254) 10.051 1.802 ( -5.530 11.452 -4.334) 13.436 1.920 ( -2.958 1.718 1.164) 3.613 1.962 ( 0.329 -3.027 -0.568) 3.097 2.101 ( 0.250 -10.230 -4.805) 11.305 2.521 ( 1.173 3.641 -3.431) 5.139 2.542 ( 1.739 0.630 -7.517) 7.742 2.728 ( 1.415 -0.036 -0.480) 1.495 2.778 ( -0.102 -5.117 -2.837) 5.852 3.024 ( -3.175 3.662 2.685) 5.540 3.099 ( -1.358 -4.577 2.687) 5.479 3.484 ( -8.752 9.613 5.088) 13.960 3.591 ( -2.607 -1.235 1.058) 3.073 3.777 ( -0.594 23.962 6.381) 24.804 4.089 ( 3.674 -5.293 3.715) 7.437 4.246 ( -0.603 3.468 0.105) 3.521 4.373 ( 0.905 -5.867 2.742) 6.539 4.485 ( 1.423 7.717 -1.606) 8.009 4.577 ( 0.481 -0.626 -1.243) 1.472 4.723 ( 2.345 -1.240 -1.511) 3.052 4.831 ( 3.689 -12.082 -0.753) 12.655 5.076 ( -2.106 0.260 -3.283) 3.909 5.143 ( -5.027 -6.692 -4.507) 9.506 5.654 ( -0.660 -2.143 1.534) 2.717 5.667 ( -7.289 -2.767 -2.255) 8.116 6.285 ( 6.489 4.724 1.630) 8.190 6.367 ( 9.368 -3.483 3.209) 10.497 7.296 ( 3.542 7.377 -1.272) 8.281 7.363 ( 2.683 0.683 -0.168) 2.774 8.064 ( -1.980 11.152 1.685) 11.452 8.288 ( -2.795 -11.710 1.049) 12.084 8.909 ( -0.763 1.637 -5.444) 5.736 8.934 ( -1.709 -1.395 -7.086) 7.421 9.744 ( 3.226 4.065 4.096) 6.611 9.841 ( 4.767 -5.281 4.223) 8.273 10.059 ( -3.505 6.783 -0.501) 7.652 10.195 ( -2.714 -7.091 0.367) 7.601 10.469 ( -2.885 5.694 9.157) 11.162 10.618 ( -3.845 -9.252 2.891) 10.428 11.607 ( -3.901 4.673 0.194) 6.090 11.656 ( -3.378 0.556 -2.100) 4.016 11.822 ( -2.716 0.673 1.594) 3.220 11.895 ( -4.776 -8.518 2.187) 10.007 12.266 ( -9.972 5.958 -2.399) 11.861 12.351 ( -6.523 -1.994 -1.119) 6.912 12.805 ( 13.370 11.961 1.941) 18.044 13.027 ( 5.592 -10.565 -3.834) 12.554 14.231 ( 11.591 21.252 5.789) 24.890 14.437 ( 0.518 3.191 -13.001) 13.397 14.519 ( -0.941 -4.157 -11.300) 12.077 14.652 ( 11.743 -12.222 4.597) 17.562 15.789 ( 12.124 16.054 -0.232) 20.119 16.223 ( 13.510 -25.534 -0.011) 28.888 18.599 ( -11.057 18.350 3.445) 21.698 18.901 ( -12.350 -13.071 0.284) 17.984 20.657 ( -0.954 2.237 1.038) 2.644 20.699 ( -1.123 -2.112 0.450) 2.434 ======================= Grid point 46 (27/170) ======================= q-point: ( 0.18 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.805 ( 1.674 -1.749 7.168) 7.566 0.907 ( 1.584 -9.784 4.842) 11.031 1.526 ( 3.074 4.421 11.235) 12.459 1.563 ( 0.260 0.422 8.189) 8.204 1.696 ( -1.811 9.404 -2.008) 9.785 1.849 ( -5.244 -5.193 0.695) 7.413 1.989 ( 1.578 -1.427 0.274) 2.145 2.068 ( 2.307 -6.995 -4.888) 8.840 2.462 ( 1.114 1.767 -8.872) 9.115 2.491 ( 1.397 -1.049 -5.870) 6.125 2.735 ( 0.623 -0.252 -7.257) 7.288 2.748 ( 2.974 -1.684 -5.400) 6.390 2.993 ( -7.162 4.170 7.058) 10.886 3.064 ( -6.015 -3.966 3.720) 8.108 3.385 ( -10.431 8.084 5.439) 14.274 3.523 ( -8.545 -5.137 3.666) 10.623 3.847 ( -0.745 21.076 7.544) 22.398 4.136 ( -4.666 -6.868 0.463) 8.316 4.275 ( 4.056 1.993 3.548) 5.745 4.369 ( -3.920 -7.038 1.343) 8.167 4.442 ( -3.619 6.633 0.239) 7.560 4.585 ( 0.639 -4.086 -4.330) 5.987 4.796 ( 9.877 8.682 1.942) 13.293 4.953 ( 7.976 -8.168 -1.014) 11.461 4.983 ( -0.743 -1.422 -6.919) 7.103 5.022 ( -3.043 -4.924 -3.163) 6.596 5.525 ( -6.041 2.844 -3.218) 7.412 5.634 ( -2.424 -8.708 -0.853) 9.079 6.437 ( 8.587 7.915 2.569) 11.957 6.567 ( 9.442 -5.354 4.356) 11.695 7.354 ( 5.874 6.894 -2.163) 9.312 7.421 ( 4.375 0.297 0.025) 4.385 8.049 ( -2.940 9.437 3.086) 10.355 8.245 ( -4.329 -10.512 1.842) 11.516 8.803 ( -1.038 1.832 -9.846) 10.069 8.836 ( -0.931 -1.459 -6.899) 7.113 9.859 ( 2.081 5.614 6.140) 8.576 9.954 ( 2.502 2.666 -0.726) 3.728 10.023 ( -0.447 -3.364 6.211) 7.077 10.135 ( -3.372 -7.604 -0.529) 8.335 10.547 ( -4.032 -0.239 15.726) 16.237 10.591 ( -5.526 -4.795 7.303) 10.337 11.500 ( -6.205 5.176 -1.224) 8.173 11.587 ( -6.774 -2.394 1.304) 7.302 11.777 ( -2.297 5.128 1.407) 5.792 11.904 ( -1.046 -7.676 3.908) 8.677 12.029 ( -11.915 6.503 -5.282) 14.565 12.163 ( -11.999 -6.460 -3.893) 14.173 13.064 ( 14.546 6.329 1.896) 15.976 13.136 ( 10.634 -1.578 -1.590) 10.868 14.130 ( -4.906 4.529 -21.763) 22.764 14.232 ( -2.644 -5.725 -26.504) 27.243 14.734 ( 21.041 16.724 12.893) 29.810 14.993 ( 22.233 -5.408 6.465) 23.777 16.049 ( 19.369 16.307 -0.086) 25.320 16.509 ( 21.350 -26.458 -1.094) 34.016 18.394 ( -20.293 14.896 5.774) 25.827 18.631 ( -21.240 -9.242 0.952) 23.183 20.649 ( -1.890 1.412 1.637) 2.872 20.681 ( -2.038 -1.830 0.813) 2.857 ======================= Grid point 47 (28/170) ======================= q-point: ( 0.27 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.991 ( 8.570 0.606 9.321) 12.677 1.091 ( 10.570 -7.861 8.439) 15.644 1.620 ( 0.169 7.801 3.356) 8.494 1.676 ( 2.725 8.428 6.445) 10.954 1.726 ( 1.048 -3.800 5.832) 7.040 1.830 ( 1.672 -5.152 3.448) 6.421 1.972 ( -2.233 0.263 -3.111) 3.839 2.056 ( 1.722 -6.410 -4.133) 7.819 2.405 ( 2.057 2.478 -5.423) 6.308 2.472 ( 2.705 -3.856 -3.280) 5.740 2.629 ( -2.506 2.809 -7.587) 8.469 2.676 ( -0.482 -2.287 -10.796) 11.046 2.933 ( -8.055 5.647 4.586) 10.854 3.038 ( -4.755 -5.590 6.580) 9.857 3.261 ( -10.400 6.864 2.642) 12.738 3.407 ( -10.319 -7.026 3.358) 12.927 3.899 ( -3.162 10.210 6.439) 12.478 4.015 ( -8.430 -2.016 -0.224) 8.670 4.270 ( -7.392 -1.666 1.819) 7.793 4.305 ( -4.868 -2.385 0.608) 5.455 4.501 ( 6.140 4.006 5.253) 9.019 4.577 ( 3.281 -3.340 -1.423) 4.894 4.846 ( -0.607 1.297 -9.091) 9.203 4.947 ( -1.479 -6.693 -4.076) 7.975 5.004 ( 10.841 8.897 2.085) 14.179 5.120 ( 9.042 -3.142 -1.070) 9.632 5.402 ( -4.414 5.424 -4.084) 8.099 5.566 ( -3.364 -10.753 -2.399) 11.520 6.594 ( 7.003 9.580 2.458) 12.118 6.747 ( 7.292 -6.131 3.431) 10.126 7.435 ( 6.793 6.385 -1.987) 9.533 7.498 ( 4.417 0.004 0.734) 4.478 8.041 ( -2.431 6.606 3.575) 7.895 8.191 ( -4.832 -8.672 1.938) 10.115 8.695 ( 0.247 2.316 -8.407) 8.724 8.751 ( -0.742 -2.906 -6.119) 6.815 9.846 ( -4.399 7.264 0.270) 8.497 9.999 ( -4.885 -8.128 -0.439) 9.493 10.043 ( 3.347 5.651 5.168) 8.358 10.185 ( 4.248 -8.580 2.709) 9.950 10.630 ( -3.475 0.761 14.953) 15.370 10.695 ( -1.766 -5.643 20.994) 21.811 11.395 ( -6.083 5.214 -0.499) 8.027 11.484 ( -7.646 -2.301 2.222) 8.289 11.715 ( -6.844 6.243 -3.873) 10.041 11.797 ( -8.980 0.453 -0.601) 9.012 11.926 ( -3.746 -0.803 -2.556) 4.606 11.984 ( -1.231 -9.131 0.646) 9.236 13.256 ( 8.849 5.933 -4.500) 11.566 13.309 ( 10.976 0.314 0.070) 10.981 13.788 ( -4.920 0.957 -23.198) 23.733 13.851 ( -5.332 -5.575 -29.365) 30.361 15.256 ( 25.415 18.374 12.637) 33.812 15.480 ( 28.981 1.331 6.002) 29.626 16.372 ( 19.164 15.782 0.474) 24.831 16.846 ( 22.162 -25.885 -3.050) 34.212 18.077 ( -26.784 10.548 6.155) 29.437 18.260 ( -25.976 -6.945 1.925) 26.957 20.630 ( -2.451 0.501 1.462) 2.898 20.653 ( -2.587 -1.734 0.990) 3.268 ======================= Grid point 48 (29/170) ======================= q-point: ( 0.36 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.235 ( 10.030 4.747 6.080) 12.653 1.354 ( 9.628 -6.173 7.643) 13.756 1.637 ( -3.527 3.765 3.545) 6.259 1.716 ( -0.986 -3.724 -1.234) 4.045 1.825 ( -0.985 6.689 1.158) 6.860 1.892 ( 2.799 7.643 1.195) 8.226 1.938 ( 3.268 -4.951 1.152) 6.043 2.057 ( 4.282 -7.383 -0.462) 8.547 2.419 ( 3.633 2.986 -1.036) 4.815 2.501 ( 3.034 -4.878 -3.606) 6.783 2.546 ( 0.754 1.764 -2.779) 3.376 2.567 ( 0.886 -2.060 -3.690) 4.318 2.833 ( -6.955 7.022 -0.680) 9.907 2.996 ( -7.900 -9.130 2.470) 12.324 3.117 ( -8.283 6.057 -0.681) 10.284 3.267 ( -10.189 -8.025 1.306) 13.035 3.837 ( -9.838 1.458 3.940) 10.697 3.903 ( -7.636 -3.978 2.845) 9.068 4.221 ( -0.806 2.321 2.261) 3.339 4.244 ( -2.011 0.624 -0.854) 2.272 4.614 ( 2.954 1.944 3.338) 4.862 4.686 ( 6.226 -0.975 4.095) 7.516 4.767 ( 1.155 2.511 -6.328) 6.905 4.884 ( -1.226 -5.507 -3.174) 6.473 5.152 ( 5.848 5.291 -2.276) 8.208 5.203 ( 3.672 -1.222 -4.168) 5.687 5.308 ( -0.990 7.763 -2.069) 8.095 5.492 ( -2.827 -9.673 -1.129) 10.140 6.706 ( 4.115 10.397 1.534) 11.286 6.867 ( 4.293 -6.091 1.269) 7.559 7.525 ( 6.228 5.157 -1.296) 8.189 7.570 ( 2.638 0.451 1.604) 3.120 8.048 ( -0.916 3.016 2.573) 4.068 8.134 ( -4.380 -5.819 1.533) 7.443 8.635 ( 1.298 1.333 -5.034) 5.366 8.686 ( -0.572 -3.261 -3.829) 5.062 9.790 ( -2.525 5.430 0.133) 5.990 9.915 ( -4.061 -6.893 -0.392) 8.009 10.125 ( 1.559 4.794 1.596) 5.288 10.245 ( 1.097 -6.990 1.092) 7.160 10.806 ( 0.456 4.428 20.431) 20.910 10.938 ( 1.432 -8.436 22.727) 24.285 11.282 ( -6.432 5.282 -1.171) 8.405 11.396 ( -6.048 -3.923 1.571) 7.378 11.562 ( -3.348 3.886 -5.942) 7.849 11.649 ( -7.688 -2.863 0.265) 8.208 11.875 ( 0.157 5.022 -2.570) 5.644 12.008 ( 0.735 -8.541 0.822) 8.611 13.176 ( -1.961 8.483 -19.094) 20.986 13.352 ( -1.692 -9.472 -22.402) 24.381 13.526 ( 3.138 5.861 -5.943) 8.917 13.640 ( 2.719 -5.614 -3.973) 7.395 15.800 ( 25.621 22.331 10.483) 35.567 16.029 ( 32.081 8.447 3.241) 33.332 16.640 ( 11.774 13.703 1.430) 18.123 17.126 ( 17.867 -22.010 -6.007) 28.978 17.671 ( -30.166 5.533 4.087) 30.941 17.860 ( -26.392 -9.748 3.796) 28.389 20.604 ( -2.099 -0.150 0.706) 2.220 20.622 ( -2.367 -1.935 0.941) 3.199 ======================= Grid point 49 (30/170) ======================= q-point: ( 0.45 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( 4.505 10.945 -0.248) 11.838 1.540 ( 5.006 -0.678 3.863) 6.359 1.600 ( -4.577 -0.582 5.255) 6.993 1.660 ( -2.800 -8.711 -0.410) 9.159 1.770 ( 0.098 7.498 -4.069) 8.532 1.900 ( -0.520 -5.665 -3.810) 6.846 2.035 ( 3.446 7.507 3.191) 8.855 2.171 ( 4.150 -5.094 2.102) 6.898 2.447 ( 1.766 6.002 -1.764) 6.500 2.519 ( 2.894 6.737 1.252) 7.438 2.591 ( 4.540 -8.066 -0.211) 9.258 2.646 ( 4.787 -3.516 1.383) 6.098 2.726 ( -1.442 1.531 -1.720) 2.717 2.841 ( -10.952 -8.936 -0.752) 14.155 2.995 ( -4.198 3.839 -1.491) 5.881 3.120 ( -7.036 -7.827 -0.378) 10.531 3.744 ( -4.740 1.701 2.047) 5.436 3.835 ( -3.058 -6.771 1.504) 7.580 4.221 ( -0.067 2.904 -0.691) 2.986 4.245 ( 0.547 0.084 0.723) 0.911 4.699 ( 1.276 4.555 4.663) 6.642 4.736 ( 1.237 5.887 -3.256) 6.840 4.798 ( 2.762 -4.430 1.209) 5.359 4.849 ( -0.356 -4.508 -0.684) 4.573 5.141 ( -1.699 1.215 -1.262) 2.440 5.157 ( 0.441 -0.316 -5.493) 5.520 5.346 ( 2.786 6.399 0.497) 6.997 5.456 ( -1.258 -5.198 0.108) 5.349 6.760 ( 1.296 10.634 0.494) 10.725 6.918 ( 1.352 -5.594 0.100) 5.756 7.593 ( 3.736 3.180 -1.493) 5.129 7.609 ( -0.376 1.541 1.898) 2.474 8.063 ( 0.704 -0.040 0.398) 0.810 8.091 ( -2.595 -2.903 1.139) 4.057 8.620 ( 0.934 -0.007 -1.648) 1.894 8.651 ( -0.391 -2.678 -1.165) 2.946 9.768 ( -0.649 3.776 0.159) 3.835 9.867 ( -1.346 -6.032 -0.197) 6.183 10.141 ( 0.066 5.316 -0.014) 5.316 10.260 ( 0.022 -6.467 0.444) 6.483 11.016 ( 0.854 6.167 11.794) 13.337 11.171 ( 0.132 -2.539 12.752) 13.003 11.197 ( -1.197 -1.787 1.098) 2.415 11.315 ( -2.891 -6.442 -3.322) 7.804 11.490 ( -0.132 5.635 -2.742) 6.268 11.576 ( -2.335 -2.691 0.636) 3.619 11.851 ( 0.043 6.258 -1.752) 6.498 12.012 ( 0.008 -9.513 -0.834) 9.550 12.963 ( -1.776 4.259 -8.964) 10.082 13.059 ( -3.006 -5.431 -13.769) 15.104 13.576 ( 2.352 4.390 -0.035) 4.981 13.676 ( 1.849 -5.571 0.125) 5.872 16.258 ( 16.641 29.540 6.250) 34.476 16.527 ( 23.033 29.102 -2.536) 37.200 16.776 ( 5.768 -2.730 3.738) 7.396 17.208 ( -28.457 6.665 1.402) 29.261 17.274 ( 8.809 -17.003 -8.285) 20.865 17.556 ( -14.684 -24.517 5.546) 29.111 20.584 ( -0.819 -0.454 0.147) 0.948 20.601 ( -0.996 -2.196 0.407) 2.445 ======================= Grid point 99 (31/170) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.402 ( -0.436 0.000 19.795) 19.800 0.492 ( 9.281 0.000 24.163) 25.885 0.861 ( -4.896 0.000 40.710) 41.004 1.424 ( 3.389 0.000 1.972) 3.921 1.632 ( -3.843 0.000 -4.998) 6.305 1.914 ( -3.268 0.000 -0.293) 3.281 2.008 ( -9.069 0.000 -10.353) 13.764 2.249 ( 0.812 0.000 -5.220) 5.283 2.468 ( 0.862 0.000 -4.604) 4.685 2.722 ( 5.028 0.000 6.234) 8.009 2.723 ( 4.403 0.000 1.727) 4.730 2.888 ( 0.263 0.000 12.921) 12.924 3.006 ( 7.831 0.000 3.476) 8.568 3.088 ( 1.317 0.000 -1.840) 2.263 3.343 ( -5.465 0.000 0.275) 5.472 3.464 ( 2.068 0.000 -0.526) 2.134 3.584 ( 1.948 0.000 4.014) 4.462 3.963 ( 4.987 0.000 -9.935) 11.117 4.095 ( -1.450 0.000 -6.263) 6.429 4.252 ( 20.470 0.000 -5.993) 21.329 4.429 ( -7.064 0.000 -0.090) 7.065 4.581 ( -15.789 0.000 -4.572) 16.437 5.061 ( 4.172 0.000 2.626) 4.929 5.413 ( -3.196 0.000 4.369) 5.414 5.611 ( 0.155 0.000 -7.763) 7.765 5.715 ( -3.296 0.000 1.848) 3.779 5.853 ( -9.792 0.000 -0.335) 9.798 5.914 ( -0.219 0.000 -0.900) 0.926 6.326 ( 12.039 0.000 5.007) 13.039 6.439 ( 4.416 0.000 -0.064) 4.417 6.495 ( -2.692 0.000 1.928) 3.311 6.608 ( -1.693 0.000 -3.491) 3.880 7.641 ( -0.519 0.000 6.942) 6.961 8.449 ( 0.548 0.000 -2.136) 2.205 8.730 ( -1.068 0.000 -0.024) 1.068 9.024 ( 4.033 0.000 -12.031) 12.689 9.650 ( -3.103 0.000 6.402) 7.115 9.707 ( 3.663 0.000 8.174) 8.958 10.029 ( 1.834 0.000 3.356) 3.825 10.698 ( 17.246 0.000 -5.369) 18.062 10.710 ( 4.012 0.000 3.250) 5.164 10.847 ( 5.245 0.000 7.764) 9.370 11.304 ( -0.928 0.000 1.809) 2.033 11.584 ( -13.500 0.000 -5.276) 14.494 11.698 ( 1.525 0.000 -1.967) 2.489 11.796 ( -6.897 0.000 -0.654) 6.928 12.009 ( -21.046 0.000 12.037) 24.245 12.392 ( -13.219 0.000 -13.441) 18.853 12.600 ( 1.549 0.000 -4.189) 4.466 12.996 ( 12.798 0.000 15.181) 19.856 14.035 ( -8.780 0.000 -16.701) 18.868 14.319 ( 10.685 0.000 -15.601) 18.909 15.537 ( 102.154 0.000 4.285) 102.244 15.814 ( 0.356 0.000 2.848) 2.870 15.911 ( -30.445 0.000 1.661) 30.490 16.312 ( 26.230 0.000 -2.409) 26.341 17.435 ( 25.152 0.000 6.595) 26.002 18.065 (-126.823 0.000 -3.837) 126.881 20.582 ( -0.155 0.000 4.487) 4.490 20.780 ( -0.257 0.000 0.889) 0.925 ======================= Grid point 100 (32/170) ======================= q-point: ( 0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( 7.698 0.000 16.986) 18.649 0.871 ( 3.256 0.000 25.059) 25.270 1.319 ( 6.342 0.000 8.590) 10.677 1.463 ( -0.776 0.000 13.535) 13.557 1.533 ( 5.258 0.000 1.064) 5.364 1.732 ( -7.598 0.000 -9.230) 11.955 1.888 ( 0.992 0.000 3.974) 4.096 2.214 ( 1.755 0.000 -4.573) 4.898 2.387 ( -3.543 0.000 -6.159) 7.105 2.781 ( -3.413 0.000 3.841) 5.139 2.842 ( 2.731 0.000 3.352) 4.323 2.963 ( 0.358 0.000 6.452) 6.462 3.084 ( 3.516 0.000 0.268) 3.526 3.140 ( 2.860 0.000 0.343) 2.881 3.299 ( -5.743 0.000 2.825) 6.400 3.478 ( -11.516 0.000 3.696) 12.095 3.552 ( 9.464 0.000 -2.608) 9.817 3.857 ( -4.625 0.000 -10.120) 11.127 4.053 ( 4.310 0.000 -4.465) 6.206 4.294 ( -6.481 0.000 -2.990) 7.137 4.351 ( -9.118 0.000 -1.644) 9.265 4.551 ( 22.455 0.000 -11.905) 25.416 5.121 ( -1.761 0.000 4.683) 5.003 5.393 ( -5.262 0.000 4.836) 7.147 5.406 ( -10.650 0.000 -9.828) 14.492 5.610 ( -15.161 0.000 2.888) 15.434 5.751 ( -1.143 0.000 2.704) 2.936 5.867 ( -4.486 0.000 -0.568) 4.522 6.466 ( -1.989 0.000 -0.037) 1.989 6.537 ( -0.008 0.000 -1.160) 1.160 6.579 ( 10.921 0.000 1.640) 11.044 6.613 ( 12.815 0.000 0.097) 12.815 7.755 ( 3.345 0.000 9.619) 10.184 8.459 ( 4.284 0.000 -4.001) 5.862 8.708 ( -1.160 0.000 -0.438) 1.239 8.971 ( 5.442 0.000 -14.642) 15.621 9.674 ( -1.845 0.000 6.447) 6.706 9.871 ( 3.921 0.000 8.362) 9.235 10.131 ( 4.245 0.000 4.839) 6.437 10.718 ( 2.359 0.000 -14.385) 14.577 10.862 ( 5.271 0.000 9.331) 10.717 10.922 ( -6.272 0.000 4.771) 7.880 11.307 ( -6.722 0.000 0.117) 6.723 11.314 ( 1.368 0.000 0.107) 1.372 11.708 ( 1.366 0.000 0.106) 1.370 11.792 ( 0.414 0.000 0.736) 0.844 12.048 ( -5.947 0.000 15.557) 16.655 12.118 ( -4.985 0.000 -0.399) 5.001 12.577 ( 1.549 0.000 -4.538) 4.795 13.382 ( 15.517 0.000 12.646) 20.017 13.651 ( -9.334 0.000 -25.308) 26.974 14.300 ( 10.500 0.000 -20.725) 23.233 15.310 ( -35.196 0.000 -7.673) 36.023 15.795 ( -7.252 0.000 4.104) 8.332 15.989 ( -13.843 0.000 11.639) 18.086 16.311 ( -46.063 0.000 16.397) 48.894 17.499 ( 50.585 0.000 -30.381) 59.007 18.037 ( 28.312 0.000 17.505) 33.287 20.639 ( 0.464 0.000 5.280) 5.300 20.778 ( -1.081 0.000 0.623) 1.248 ======================= Grid point 101 (33/170) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.947 ( 4.733 0.000 9.829) 10.909 1.118 ( 0.238 0.000 8.299) 8.303 1.295 ( 0.016 0.000 8.433) 8.434 1.470 ( 0.878 0.000 -8.822) 8.865 1.679 ( 5.904 0.000 2.012) 6.237 1.754 ( 5.716 0.000 5.613) 8.011 2.027 ( -1.776 0.000 5.769) 6.037 2.227 ( -7.730 0.000 -5.987) 9.777 2.361 ( 17.626 0.000 7.026) 18.975 2.691 ( -9.624 0.000 1.152) 9.693 2.855 ( -1.867 0.000 -0.092) 1.869 3.077 ( 2.096 0.000 8.093) 8.360 3.131 ( -11.109 0.000 -0.561) 11.123 3.167 ( 5.857 0.000 -5.619) 8.116 3.202 ( 6.935 0.000 5.222) 8.681 3.461 ( -1.339 0.000 8.799) 8.901 3.630 ( -6.376 0.000 -12.283) 13.839 3.658 ( 9.696 0.000 -9.156) 13.336 4.120 ( 3.545 0.000 3.774) 5.178 4.190 ( -3.554 0.000 -0.263) 3.564 4.194 ( -4.864 0.000 -7.128) 8.629 4.719 ( 11.438 0.000 -7.789) 13.838 5.059 ( -17.300 0.000 -10.406) 20.188 5.111 ( -5.536 0.000 4.875) 7.377 5.348 ( -5.856 0.000 2.782) 6.484 5.438 ( -11.329 0.000 4.416) 12.159 5.759 ( -1.370 0.000 1.903) 2.345 5.763 ( -8.236 0.000 1.010) 8.298 6.436 ( -0.721 0.000 -1.279) 1.468 6.513 ( 0.994 0.000 -3.107) 3.262 6.789 ( 7.693 0.000 0.225) 7.696 6.801 ( 13.463 0.000 2.047) 13.617 7.946 ( 5.814 0.000 11.267) 12.679 8.490 ( 6.636 0.000 -6.927) 9.593 8.688 ( -0.765 0.000 -0.083) 0.770 8.895 ( 2.663 0.000 -10.563) 10.894 9.751 ( 2.572 0.000 7.332) 7.770 9.988 ( -1.591 0.000 9.605) 9.736 10.241 ( 2.965 0.000 3.823) 4.838 10.547 ( -0.789 0.000 -18.784) 18.801 10.848 ( -2.758 0.000 2.508) 3.728 10.999 ( -1.853 0.000 7.181) 7.416 11.247 ( -6.499 0.000 1.564) 6.685 11.396 ( 6.791 0.000 3.718) 7.742 11.759 ( 3.268 0.000 3.987) 5.155 11.772 ( 0.479 0.000 -6.269) 6.288 11.952 ( -6.698 0.000 4.088) 7.847 12.399 ( 8.648 0.000 26.880) 28.237 12.554 ( 1.009 0.000 -3.677) 3.813 13.215 ( -6.425 0.000 -30.201) 30.877 13.750 ( 15.032 0.000 9.125) 17.585 14.221 ( 9.769 0.000 -22.613) 24.633 14.679 ( -28.695 0.000 -11.945) 31.082 15.610 ( -46.557 0.000 24.601) 52.657 15.689 ( -12.292 0.000 5.868) 13.621 16.065 ( -3.902 0.000 -1.739) 4.272 17.906 ( 37.431 0.000 -27.681) 46.555 18.636 ( 19.495 0.000 19.547) 27.607 20.707 ( 1.067 0.000 4.771) 4.889 20.759 ( -1.638 0.000 -0.035) 1.638 ======================= Grid point 102 (34/170) ======================= q-point: ( 0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( -1.964 0.000 -2.262) 2.995 1.107 ( 2.293 0.000 -5.764) 6.203 1.481 ( 1.030 0.000 15.175) 15.209 1.493 ( 5.307 0.000 -1.239) 5.450 1.832 ( 11.415 0.000 0.492) 11.426 1.918 ( 6.468 0.000 4.877) 8.101 2.005 ( -5.919 0.000 7.691) 9.705 2.038 ( -7.973 0.000 -2.158) 8.260 2.452 ( -6.026 0.000 -10.294) 11.928 2.528 ( -9.015 0.000 -1.872) 9.208 2.831 ( -4.202 0.000 -0.557) 4.238 3.133 ( -3.711 0.000 2.916) 4.719 3.208 ( 15.811 0.000 9.858) 18.633 3.267 ( 12.644 0.000 -5.671) 13.857 3.400 ( 9.797 0.000 4.792) 10.906 3.417 ( -0.066 0.000 -10.627) 10.627 3.573 ( 0.486 0.000 14.154) 14.162 3.693 ( 9.161 0.000 -13.750) 16.522 4.028 ( -5.215 0.000 -8.478) 9.954 4.171 ( -5.274 0.000 9.397) 10.776 4.224 ( 3.109 0.000 4.621) 5.569 4.660 ( -14.658 0.000 -11.013) 18.334 4.757 ( -0.277 0.000 -4.753) 4.761 5.056 ( -7.380 0.000 4.235) 8.509 5.241 ( -7.086 0.000 -3.741) 8.013 5.321 ( -9.465 0.000 4.091) 10.311 5.651 ( -8.721 0.000 4.818) 9.963 5.752 ( -0.886 0.000 0.652) 1.100 6.418 ( 0.274 0.000 -1.359) 1.386 6.504 ( 1.302 0.000 -2.162) 2.524 6.870 ( 3.591 0.000 -1.566) 3.918 7.035 ( 12.293 0.000 1.840) 12.430 8.161 ( 5.075 0.000 10.787) 11.922 8.515 ( 7.655 0.000 -9.992) 12.588 8.688 ( -0.082 0.000 1.516) 1.518 8.842 ( 1.196 0.000 -4.595) 4.749 9.912 ( 6.264 0.000 8.424) 10.498 10.037 ( -4.312 0.000 8.671) 9.684 10.292 ( 0.121 0.000 0.541) 0.555 10.324 ( -1.887 0.000 -15.832) 15.944 10.922 ( 9.149 0.000 -0.194) 9.151 10.976 ( -3.433 0.000 -0.630) 3.490 11.106 ( -12.157 0.000 1.568) 12.258 11.504 ( -3.385 0.000 6.780) 7.578 11.689 ( -0.236 0.000 -8.622) 8.625 11.924 ( -6.989 0.000 9.709) 11.963 11.946 ( 10.629 0.000 7.982) 13.293 12.527 ( -1.304 0.000 -1.190) 1.765 12.847 ( 2.148 0.000 -27.021) 27.106 12.893 ( 15.071 0.000 26.916) 30.848 14.048 ( 11.946 0.000 4.885) 12.907 14.131 ( -5.105 0.000 -26.424) 26.913 14.184 ( -1.440 0.000 -7.367) 7.506 15.134 ( -36.944 0.000 11.330) 38.643 15.531 ( -15.775 0.000 7.148) 17.319 15.995 ( -3.946 0.000 -0.203) 3.951 18.145 ( 23.930 0.000 -17.897) 29.882 19.051 ( 7.844 0.000 15.682) 17.534 20.728 ( -1.609 0.000 -0.735) 1.769 20.770 ( 1.077 0.000 3.272) 3.445 ======================= Grid point 103 (35/170) ======================= q-point: ( 0.36 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.925 ( -0.673 0.000 -3.523) 3.586 1.121 ( 5.821 0.000 -3.400) 6.741 1.536 ( 2.624 0.000 -2.067) 3.341 1.603 ( -1.423 0.000 7.956) 8.082 1.858 ( -9.957 0.000 2.874) 10.364 1.885 ( -6.928 0.000 2.739) 7.449 2.121 ( 7.569 0.000 -0.264) 7.573 2.138 ( 4.840 0.000 5.119) 7.045 2.226 ( 0.590 0.000 -7.200) 7.224 2.412 ( -1.733 0.000 -0.426) 1.785 2.747 ( -2.164 0.000 -4.482) 4.977 3.000 ( -6.503 0.000 -6.676) 9.319 3.382 ( 9.504 0.000 -6.559) 11.548 3.442 ( 1.037 0.000 -1.177) 1.569 3.496 ( 12.510 0.000 0.568) 12.523 3.578 ( 6.111 0.000 5.772) 8.406 3.665 ( 6.067 0.000 -12.791) 14.157 3.859 ( 13.483 0.000 11.550) 17.754 3.902 ( -1.604 0.000 3.623) 3.962 4.185 ( -7.662 0.000 11.208) 13.577 4.330 ( 2.744 0.000 6.076) 6.667 4.340 ( -11.177 0.000 -7.886) 13.679 4.658 ( -5.003 0.000 -5.313) 7.297 4.935 ( -12.607 0.000 1.211) 12.665 5.091 ( -1.522 0.000 -6.946) 7.110 5.206 ( -9.304 0.000 2.394) 9.607 5.591 ( -7.398 0.000 7.472) 10.515 5.751 ( 0.453 0.000 -0.072) 0.459 6.413 ( 0.779 0.000 -1.223) 1.450 6.508 ( 0.923 0.000 -0.270) 0.962 6.886 ( 1.884 0.000 -2.990) 3.535 7.211 ( 7.633 0.000 -0.056) 7.633 8.311 ( 0.964 0.000 6.908) 6.975 8.527 ( 7.739 0.000 -10.226) 12.824 8.723 ( 0.048 0.000 4.891) 4.891 8.835 ( 0.933 0.000 -0.067) 0.935 9.993 ( -2.974 0.000 -7.870) 8.413 10.103 ( 5.787 0.000 7.032) 9.106 10.235 ( 0.436 0.000 4.426) 4.448 10.253 ( -2.195 0.000 -4.509) 5.015 10.916 ( -0.574 0.000 -3.338) 3.387 10.918 ( -12.156 0.000 2.013) 12.322 11.101 ( 13.597 0.000 -2.806) 13.883 11.437 ( -8.355 0.000 -0.365) 8.363 11.578 ( -2.250 0.000 -8.601) 8.891 11.925 ( -7.509 0.000 11.916) 14.085 12.148 ( 6.157 0.000 2.763) 6.748 12.462 ( -2.880 0.000 -4.498) 5.341 12.837 ( 13.591 0.000 1.808) 13.710 13.430 ( 17.092 0.000 23.312) 28.907 13.737 ( -6.093 0.000 -20.438) 21.327 14.199 ( 1.272 0.000 -1.537) 1.995 14.247 ( 13.151 0.000 -6.809) 14.809 14.675 ( -27.555 0.000 3.734) 27.807 15.346 ( -16.927 0.000 8.175) 18.798 15.931 ( -3.449 0.000 -0.393) 3.472 18.313 ( 15.657 0.000 -9.359) 18.241 19.228 ( -1.028 0.000 7.327) 7.399 20.697 ( -0.893 0.000 -1.046) 1.376 20.804 ( 0.191 0.000 1.010) 1.028 ======================= Grid point 104 (36/170) ======================= q-point: ( 0.45 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( 2.893 0.000 2.502) 3.825 1.213 ( 6.432 0.000 0.974) 6.506 1.564 ( 3.576 0.000 -1.509) 3.882 1.620 ( -4.985 0.000 4.841) 6.949 1.730 ( -7.482 0.000 -4.798) 8.888 1.756 ( -7.468 0.000 4.771) 8.862 2.136 ( -0.427 0.000 5.006) 5.024 2.140 ( 2.613 0.000 -7.103) 7.568 2.360 ( 5.090 0.000 -2.388) 5.622 2.426 ( -0.767 0.000 -1.058) 1.307 2.647 ( 0.322 0.000 -10.605) 10.610 2.892 ( 2.391 0.000 -4.837) 5.395 3.388 ( 0.398 0.000 -0.384) 0.553 3.433 ( 6.232 0.000 -7.164) 9.496 3.629 ( 3.995 0.000 -5.396) 6.714 3.695 ( -1.142 0.000 6.755) 6.851 3.722 ( 8.782 0.000 3.624) 9.500 3.942 ( 0.432 0.000 1.535) 1.594 4.109 ( -5.147 0.000 2.657) 5.793 4.161 ( -8.064 0.000 8.265) 11.547 4.190 ( 3.451 0.000 0.347) 3.469 4.408 ( -1.329 0.000 2.890) 3.181 4.567 ( 2.034 0.000 1.645) 2.616 4.751 ( -6.132 0.000 -0.866) 6.192 5.049 ( 3.363 0.000 -4.423) 5.556 5.087 ( -5.809 0.000 -0.569) 5.836 5.562 ( -6.677 0.000 7.750) 10.230 5.761 ( 0.436 0.000 0.218) 0.488 6.415 ( 0.978 0.000 -1.018) 1.412 6.525 ( 0.419 0.000 1.074) 1.153 6.879 ( 1.905 0.000 -3.296) 3.807 7.268 ( 1.713 0.000 -3.444) 3.847 8.336 ( -3.531 0.000 1.944) 4.031 8.553 ( 7.619 0.000 -7.780) 10.889 8.773 ( -2.351 0.000 6.458) 6.872 8.871 ( 1.628 0.000 2.977) 3.394 9.833 ( -2.092 0.000 -12.286) 12.463 10.114 ( -4.396 0.000 -8.467) 9.540 10.244 ( 3.561 0.000 2.590) 4.404 10.372 ( 3.833 0.000 12.057) 12.651 10.780 ( -6.880 0.000 1.904) 7.138 10.900 ( 2.911 0.000 -2.848) 4.072 11.274 ( -5.438 0.000 -6.610) 8.560 11.282 ( 12.631 0.000 -3.792) 13.188 11.430 ( -4.684 0.000 -7.944) 9.223 11.939 ( -6.986 0.000 12.355) 14.193 12.242 ( -0.615 0.000 0.910) 1.099 12.385 ( 2.000 0.000 -2.907) 3.528 13.133 ( 5.893 0.000 15.374) 16.465 13.570 ( 9.583 0.000 -10.967) 14.564 13.891 ( -12.589 0.000 3.365) 13.031 13.946 ( 2.769 0.000 5.279) 5.961 14.425 ( 13.314 0.000 -1.500) 13.398 14.458 ( -6.053 0.000 0.464) 6.071 15.188 ( -13.661 0.000 9.876) 16.857 15.880 ( -1.406 0.000 -1.558) 2.099 18.459 ( 10.258 0.000 -1.992) 10.450 19.195 ( -5.700 0.000 -2.443) 6.202 20.680 ( 0.226 0.000 -0.829) 0.859 20.797 ( -0.822 0.000 -1.369) 1.596 ======================= Grid point 105 (37/170) ======================= q-point: (-0.45 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( 2.067 0.000 7.144) 7.437 1.319 ( 1.857 0.000 5.378) 5.690 1.478 ( -10.700 0.000 -3.742) 11.335 1.585 ( 0.241 0.000 -2.678) 2.689 1.697 ( 3.540 0.000 1.275) 3.763 1.760 ( 2.107 0.000 6.435) 6.771 2.098 ( -0.500 0.000 -4.866) 4.891 2.111 ( -11.310 0.000 -7.853) 13.769 2.311 ( 3.320 0.000 1.902) 3.827 2.356 ( -0.706 0.000 -4.427) 4.483 2.625 ( 9.915 0.000 -10.493) 14.436 2.899 ( 6.141 0.000 -11.846) 13.343 3.466 ( 0.642 0.000 4.660) 4.704 3.475 ( 2.848 0.000 2.507) 3.794 3.627 ( -0.921 0.000 0.313) 0.972 3.666 ( -5.845 0.000 3.234) 6.680 3.756 ( -18.411 0.000 -11.247) 21.575 3.851 ( 1.939 0.000 3.888) 4.345 4.057 ( -2.965 0.000 10.565) 10.974 4.129 ( -2.863 0.000 3.786) 4.746 4.317 ( -7.921 0.000 -2.525) 8.314 4.334 ( 10.226 0.000 4.580) 11.205 4.741 ( 9.783 0.000 4.138) 10.622 4.770 ( 4.861 0.000 1.225) 5.013 5.031 ( 1.609 0.000 -2.783) 3.215 5.107 ( 9.137 0.000 -2.846) 9.570 5.540 ( -6.073 0.000 7.376) 9.554 5.767 ( -0.787 0.000 1.529) 1.720 6.423 ( 0.978 0.000 -0.459) 1.080 6.537 ( 0.126 0.000 -0.077) 0.147 6.884 ( 2.018 0.000 -1.580) 2.563 7.200 ( -3.169 0.000 -6.237) 6.996 8.244 ( -7.616 0.000 -2.026) 7.881 8.600 ( 6.229 0.000 -4.712) 7.810 8.779 ( -4.235 0.000 5.056) 6.595 8.955 ( 3.223 0.000 5.598) 6.460 9.677 ( -1.253 0.000 -11.031) 11.102 9.928 ( -5.117 0.000 -10.302) 11.502 10.299 ( 0.758 0.000 0.927) 1.197 10.578 ( 4.902 0.000 10.513) 11.600 10.752 ( 1.774 0.000 0.647) 1.888 10.941 ( 3.025 0.000 -0.149) 3.028 11.160 ( 1.911 0.000 -7.386) 7.629 11.250 ( -8.811 0.000 -1.091) 8.879 11.439 ( 11.713 0.000 -5.880) 13.106 11.964 ( -5.761 0.000 11.233) 12.625 12.090 ( -8.170 0.000 -9.830) 12.782 12.471 ( 4.057 0.000 2.805) 4.933 13.337 ( -30.190 0.000 -10.061) 31.823 13.378 ( 5.762 0.000 19.250) 20.094 13.755 ( 13.593 0.000 1.833) 13.716 14.302 ( 4.584 0.000 6.713) 8.129 14.339 ( 0.097 0.000 -2.697) 2.698 14.612 ( 9.381 0.000 1.152) 9.451 15.159 ( -3.905 0.000 12.472) 13.069 15.859 ( 1.890 0.000 -2.676) 3.276 18.610 ( 6.704 0.000 5.216) 8.494 19.007 ( -8.205 0.000 -10.977) 13.705 20.686 ( 1.167 0.000 -0.310) 1.208 20.752 ( -1.637 0.000 -3.103) 3.508 ======================= Grid point 106 (38/170) ======================= q-point: (-0.36 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( -5.961 0.000 2.669) 6.531 1.236 ( -13.545 0.000 -4.358) 14.228 1.377 ( -4.435 0.000 6.492) 7.862 1.562 ( 0.861 0.000 1.179) 1.460 1.768 ( -7.982 0.000 -13.073) 15.317 1.812 ( 4.871 0.000 1.981) 5.258 1.919 ( 2.954 0.000 3.455) 4.546 2.006 ( -1.608 0.000 0.627) 1.726 2.380 ( 8.267 0.000 -2.984) 8.789 2.452 ( 8.094 0.000 -1.301) 8.198 2.690 ( 10.255 0.000 -6.672) 12.235 2.815 ( 3.621 0.000 -16.373) 16.768 3.216 ( -27.918 0.000 -9.490) 29.487 3.384 ( -9.963 0.000 -3.916) 10.705 3.495 ( -5.554 0.000 2.902) 6.266 3.674 ( 2.333 0.000 7.513) 7.867 3.730 ( -1.876 0.000 13.779) 13.906 3.891 ( -0.343 0.000 2.355) 2.380 4.145 ( 0.050 0.000 6.302) 6.302 4.146 ( -7.512 0.000 -4.220) 8.616 4.177 ( 3.576 0.000 3.283) 4.855 4.594 ( 15.808 0.000 4.468) 16.428 4.838 ( 3.500 0.000 -2.243) 4.157 4.898 ( 6.960 0.000 -0.057) 6.961 5.084 ( 7.613 0.000 -1.844) 7.833 5.276 ( 12.355 0.000 -0.418) 12.362 5.530 ( -3.834 0.000 6.327) 7.398 5.771 ( -2.114 0.000 3.535) 4.118 6.438 ( 0.861 0.000 0.459) 0.976 6.527 ( 0.636 0.000 -2.677) 2.751 6.901 ( 0.085 0.000 0.759) 0.764 7.046 ( -6.535 0.000 -7.273) 9.778 8.062 ( -10.171 0.000 -3.926) 10.902 8.635 ( 2.249 0.000 -2.127) 3.095 8.759 ( -3.604 0.000 3.486) 5.014 9.096 ( 5.334 0.000 7.621) 9.302 9.570 ( 1.639 0.000 -8.448) 8.606 9.752 ( -4.564 0.000 -7.048) 8.397 10.287 ( -2.297 0.000 -0.733) 2.411 10.662 ( 0.181 0.000 -7.533) 7.536 10.832 ( 6.652 0.000 0.590) 6.678 10.934 ( -3.179 0.000 -1.114) 3.368 11.206 ( -4.246 0.000 17.397) 17.907 11.208 ( 10.694 0.000 -4.542) 11.618 11.540 ( 8.645 0.000 -6.334) 10.717 11.837 ( -8.157 0.000 -10.093) 12.978 11.997 ( -4.021 0.000 9.756) 10.552 12.544 ( 3.000 0.000 0.745) 3.091 12.761 ( -27.674 0.000 -8.281) 28.886 13.723 ( 0.732 0.000 27.211) 27.221 14.003 ( 19.605 0.000 1.014) 19.632 14.066 ( -14.002 0.000 -9.042) 16.668 14.528 ( 8.299 0.000 -2.603) 8.698 14.734 ( 4.397 0.000 0.344) 4.411 15.330 ( 5.602 0.000 14.849) 15.871 15.888 ( 5.406 0.000 -2.856) 6.114 18.700 ( -11.074 0.000 -17.040) 20.322 18.798 ( 4.432 0.000 13.369) 14.084 20.682 ( -2.222 0.000 -3.659) 4.281 20.708 ( 1.500 0.000 0.227) 1.517 ======================= Grid point 107 (39/170) ======================= q-point: (-0.27 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.905 ( -13.961 0.000 -3.148) 14.311 0.945 ( -17.761 0.000 -1.843) 17.856 1.232 ( -11.792 0.000 -8.133) 14.325 1.604 ( -1.861 0.000 -3.874) 4.298 1.675 ( 5.547 0.000 6.946) 8.890 1.769 ( -10.168 0.000 -1.619) 10.297 1.957 ( 6.014 0.000 4.205) 7.338 2.199 ( 11.200 0.000 3.613) 11.768 2.343 ( -16.015 0.000 -11.823) 19.906 2.510 ( 9.471 0.000 -1.469) 9.585 2.700 ( 2.174 0.000 -12.137) 12.330 2.765 ( -7.328 0.000 -2.559) 7.762 2.851 ( 10.901 0.000 -6.320) 12.600 3.208 ( -7.342 0.000 -1.033) 7.415 3.408 ( -8.159 0.000 2.137) 8.434 3.799 ( 5.486 0.000 2.845) 6.179 3.819 ( -5.120 0.000 11.720) 12.790 3.863 ( -7.212 0.000 -1.448) 7.356 4.023 ( -0.199 0.000 -0.419) 0.464 4.178 ( -2.330 0.000 4.458) 5.031 4.318 ( 5.915 0.000 6.359) 8.685 4.845 ( 3.329 0.000 -5.490) 6.421 4.909 ( 14.456 0.000 3.290) 14.825 4.982 ( 9.706 0.000 -5.716) 11.264 5.216 ( 9.516 0.000 0.559) 9.532 5.403 ( 0.341 0.000 2.493) 2.516 5.606 ( 7.870 0.000 2.883) 8.381 5.780 ( -3.100 0.000 6.323) 7.042 6.459 ( 0.425 0.000 1.298) 1.366 6.507 ( 1.775 0.000 -4.208) 4.567 6.845 ( -8.567 0.000 -6.723) 10.890 6.883 ( -4.428 0.000 1.343) 4.628 7.858 ( -9.997 0.000 -2.727) 10.362 8.618 ( -2.476 0.000 -0.569) 2.540 8.744 ( -2.151 0.000 2.382) 3.210 9.289 ( 7.278 0.000 8.976) 11.555 9.556 ( 4.672 0.000 -4.096) 6.213 9.638 ( -3.062 0.000 -2.427) 3.907 10.214 ( -4.792 0.000 -1.734) 5.096 10.459 ( -5.176 0.000 -17.522) 18.271 10.843 ( -4.617 0.000 -3.331) 5.693 10.952 ( 6.679 0.000 -1.734) 6.900 11.323 ( 6.156 0.000 -2.783) 6.755 11.427 ( 2.312 0.000 17.892) 18.041 11.583 ( 2.576 0.000 2.255) 3.423 11.661 ( -1.774 0.000 -5.636) 5.908 12.053 ( -2.376 0.000 9.370) 9.667 12.320 ( -17.386 0.000 -2.341) 17.542 12.590 ( 2.620 0.000 -0.682) 2.708 13.692 ( -17.224 0.000 -12.801) 21.460 13.911 ( -2.279 0.000 15.002) 15.174 14.487 ( 26.618 0.000 12.909) 29.583 14.510 ( 2.253 0.000 -17.261) 17.408 14.759 ( 1.744 0.000 -3.509) 3.919 15.609 ( 7.409 0.000 15.289) 16.990 15.967 ( 7.447 0.000 -2.108) 7.740 18.284 ( -15.235 0.000 -20.471) 25.518 19.056 ( 3.573 0.000 23.172) 23.446 20.610 ( -2.223 0.000 -2.685) 3.486 20.736 ( 1.219 0.000 0.732) 1.422 ======================= Grid point 108 (40/170) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( -17.583 0.000 -0.927) 17.607 0.652 ( -19.611 0.000 4.377) 20.093 0.919 ( -9.853 0.000 -13.583) 16.781 1.339 ( -29.834 0.000 -4.944) 30.241 1.546 ( -8.622 0.000 -4.198) 9.590 1.939 ( 9.117 0.000 11.734) 14.860 1.964 ( -7.277 0.000 3.543) 8.094 2.160 ( 7.058 0.000 -0.252) 7.062 2.370 ( 8.644 0.000 -2.097) 8.895 2.603 ( 6.886 0.000 -7.947) 10.516 2.665 ( 1.645 0.000 2.136) 2.696 2.677 ( -0.969 0.000 -4.132) 4.244 2.926 ( 4.039 0.000 -7.505) 8.523 3.182 ( 4.548 0.000 0.844) 4.626 3.281 ( -8.650 0.000 -0.140) 8.651 3.672 ( -10.170 0.000 -3.495) 10.753 3.791 ( -5.258 0.000 -2.114) 5.667 3.902 ( 7.244 0.000 -3.520) 8.054 4.095 ( 5.103 0.000 1.850) 5.428 4.193 ( -6.135 0.000 11.042) 12.632 4.462 ( 0.578 0.000 8.549) 8.568 4.857 ( 6.832 0.000 -6.041) 9.120 4.976 ( 4.404 0.000 -7.105) 8.359 5.199 ( 13.970 0.000 -1.895) 14.098 5.401 ( -2.339 0.000 2.618) 3.511 5.413 ( 13.381 0.000 1.304) 13.444 5.774 ( 8.529 0.000 1.275) 8.624 5.817 ( -2.852 0.000 10.064) 10.460 6.473 ( -0.670 0.000 1.249) 1.417 6.498 ( 2.740 0.000 -4.263) 5.068 6.641 ( -8.460 0.000 -4.487) 9.576 6.775 ( -9.690 0.000 -0.192) 9.691 7.699 ( -7.752 0.000 0.356) 7.761 8.558 ( -4.268 0.000 0.434) 4.290 8.741 ( -1.035 0.000 1.580) 1.889 9.508 ( 7.740 0.000 6.104) 9.858 9.600 ( -1.434 0.000 1.877) 2.362 9.606 ( 2.944 0.000 0.568) 2.998 10.108 ( -5.733 0.000 -1.401) 5.902 10.184 ( -3.289 0.000 -17.748) 18.050 10.733 ( -3.701 0.000 -3.483) 5.082 10.921 ( -3.700 0.000 -9.330) 10.037 11.330 ( -0.806 0.000 -1.398) 1.614 11.512 ( 5.695 0.000 -2.978) 6.426 11.653 ( 3.989 0.000 -2.240) 4.575 11.860 ( 0.019 0.000 33.611) 33.611 12.025 ( -6.773 0.000 8.143) 10.592 12.286 ( 5.842 0.000 8.478) 10.296 12.613 ( 2.053 0.000 -1.952) 2.833 13.251 ( -18.365 0.000 -14.817) 23.597 14.038 ( 3.689 0.000 6.805) 7.741 14.205 ( -6.518 0.000 -34.368) 34.980 14.631 ( -3.070 0.000 -9.368) 9.859 15.138 ( 27.225 0.000 15.656) 31.406 15.874 ( 4.843 0.000 15.096) 15.854 16.068 ( 6.889 0.000 -1.241) 6.999 17.781 ( -18.119 0.000 -21.431) 28.064 19.435 ( 7.418 0.000 31.034) 31.908 20.561 ( -1.611 0.000 -0.389) 1.658 20.761 ( 0.581 0.000 1.233) 1.363 ======================= Grid point 109 (41/170) ======================= q-point: (-0.09 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.371 ( -16.333 0.000 9.948) 19.124 0.413 ( -18.031 0.000 8.401) 19.892 0.781 ( -29.759 0.000 19.933) 35.818 1.023 ( 17.068 0.000 46.668) 49.692 1.416 ( -2.803 0.000 -1.820) 3.342 1.945 ( -1.654 0.000 1.818) 2.458 2.137 ( 1.349 0.000 2.597) 2.927 2.274 ( 4.403 0.000 0.388) 4.420 2.451 ( 6.378 0.000 -3.887) 7.469 2.624 ( -2.424 0.000 0.560) 2.487 2.640 ( 7.410 0.000 -4.709) 8.780 2.736 ( -0.149 0.000 9.408) 9.409 2.877 ( -1.014 0.000 -1.257) 1.615 3.149 ( -5.449 0.000 -1.828) 5.748 3.306 ( 10.935 0.000 -1.679) 11.063 3.508 ( -5.788 0.000 -1.749) 6.047 3.605 ( -7.644 0.000 -11.195) 13.556 3.956 ( 7.383 0.000 -8.096) 10.957 4.155 ( 1.031 0.000 -1.784) 2.060 4.192 ( -7.434 0.000 7.947) 10.882 4.500 ( -4.632 0.000 4.880) 6.728 4.900 ( -2.582 0.000 -15.255) 15.472 4.946 ( 8.478 0.000 -1.490) 8.608 5.404 ( -1.172 0.000 3.088) 3.303 5.436 ( 15.992 0.000 6.300) 17.188 5.619 ( 10.240 0.000 0.733) 10.267 5.887 ( 4.319 0.000 0.076) 4.319 5.898 ( -0.956 0.000 7.381) 7.443 6.429 ( -8.544 0.000 -10.279) 13.366 6.443 ( -2.257 0.000 -2.024) 3.032 6.520 ( -3.870 0.000 1.648) 4.207 6.632 ( -2.896 0.000 1.491) 3.257 7.623 ( -4.401 0.000 3.793) 5.810 8.499 ( -3.541 0.000 -0.134) 3.543 8.740 ( -0.767 0.000 0.788) 1.099 9.378 ( -13.217 0.000 -32.601) 35.179 9.621 ( -1.282 0.000 5.202) 5.358 9.628 ( -2.396 0.000 5.279) 5.797 10.022 ( -3.485 0.000 0.495) 3.520 10.237 ( 15.340 0.000 20.912) 25.935 10.671 ( -0.252 0.000 -1.325) 1.349 10.764 ( -3.923 0.000 0.006) 3.923 11.307 ( -1.428 0.000 0.944) 1.712 11.597 ( 4.954 0.000 0.304) 4.964 11.688 ( 2.689 0.000 -2.001) 3.352 11.890 ( -4.423 0.000 0.775) 4.491 12.429 ( 5.111 0.000 3.593) 6.247 12.606 ( 16.478 0.000 29.721) 33.983 12.615 ( 1.655 0.000 -3.186) 3.590 12.806 ( -16.180 0.000 -13.173) 20.864 13.717 ( 0.595 0.000 11.237) 11.253 14.157 ( 5.335 0.000 -0.866) 5.405 14.430 ( -3.199 0.000 -16.305) 16.615 15.644 ( 15.089 0.000 9.082) 17.611 16.083 ( -3.167 0.000 16.867) 17.162 16.157 ( 5.238 0.000 -0.133) 5.239 17.324 ( -6.901 0.000 -16.444) 17.834 19.766 ( -3.841 0.000 -16.786) 17.220 20.552 ( -0.822 0.000 2.368) 2.506 20.776 ( -0.333 0.000 0.724) 0.797 ======================= Grid point 110 (42/170) ======================= q-point: ( 0.00 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.593 ( -3.187 13.755 14.592) 20.305 0.617 ( 5.725 11.825 17.399) 21.802 1.275 ( 0.242 33.897 20.125) 39.422 1.336 ( 3.075 2.371 10.263) 10.973 1.668 ( -4.931 0.955 2.678) 5.692 1.833 ( -5.343 -3.268 0.175) 6.266 2.086 ( -4.541 2.141 -8.947) 10.260 2.180 ( -1.991 -4.542 -3.946) 6.338 2.435 ( 3.954 -4.117 -1.893) 6.014 2.554 ( 1.362 -9.522 1.421) 9.724 2.810 ( 11.284 -11.467 12.118) 20.141 2.835 ( 1.989 7.538 1.943) 8.034 2.994 ( -0.263 3.537 9.875) 10.493 3.152 ( -3.864 -3.620 -2.864) 6.020 3.310 ( 1.446 -6.034 -1.037) 6.291 3.419 ( 1.939 1.302 0.310) 2.356 3.455 ( 1.494 -1.277 3.538) 4.047 3.862 ( 2.363 -11.773 -5.666) 13.278 4.191 ( 5.566 1.123 -4.960) 7.540 4.252 ( -3.337 9.993 -6.815) 12.547 4.386 ( -1.756 -1.240 3.207) 3.861 4.541 ( -8.588 -2.139 0.987) 8.905 5.131 ( 5.390 -8.386 -2.700) 10.327 5.160 ( -2.104 -5.554 1.771) 6.197 5.560 ( -3.691 -10.753 2.076) 11.557 5.667 ( 2.920 1.211 0.668) 3.231 5.814 ( -3.383 -2.613 -2.554) 4.980 5.903 ( -5.544 -1.587 -1.793) 6.039 6.283 ( 13.904 -3.516 4.933) 15.166 6.412 ( -2.174 -5.354 -1.784) 6.048 6.579 ( -2.174 11.770 0.876) 12.001 6.762 ( 0.107 12.496 1.291) 12.563 7.674 ( -0.292 3.235 6.709) 7.454 8.518 ( -1.048 7.182 -3.397) 8.014 8.802 ( -4.676 1.252 -4.976) 6.943 9.014 ( 2.368 -1.145 -10.769) 11.086 9.665 ( -0.819 1.117 5.709) 5.874 9.730 ( 2.336 2.274 7.501) 8.179 10.117 ( 3.211 4.772 3.167) 6.566 10.471 ( 7.274 -14.248 3.826) 16.449 10.756 ( 0.565 -3.139 7.319) 7.984 10.892 ( 4.039 7.600 3.147) 9.163 11.327 ( 2.384 2.710 0.212) 3.615 11.552 ( -12.262 2.264 2.453) 12.708 11.626 ( 1.053 -0.567 1.274) 1.747 11.918 ( 0.316 4.014 1.235) 4.212 12.089 ( -11.981 6.904 3.321) 14.221 12.413 ( -12.856 2.603 -14.480) 19.538 12.598 ( -1.286 -3.468 -0.527) 3.736 12.918 ( 13.755 -3.646 13.875) 19.875 13.953 ( 0.421 -6.187 -4.406) 7.607 14.281 ( 8.860 -2.998 4.419) 10.345 14.599 ( 22.049 -27.912 -3.812) 35.774 15.361 ( -14.870 -27.899 2.462) 31.710 16.026 ( -1.133 -2.256 3.113) 4.008 16.829 ( -6.125 16.779 -11.377) 21.178 17.422 ( 26.292 9.427 15.841) 32.110 18.932 ( -34.488 34.689 -37.837) 61.842 20.589 ( -0.013 0.655 4.213) 4.263 20.776 ( -0.450 -0.321 0.722) 0.909 ======================= Grid point 111 (43/170) ======================= q-point: ( 0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.756 ( 3.312 7.043 16.568) 18.306 0.960 ( 6.573 7.205 19.953) 22.209 1.438 ( -2.315 7.320 -3.717) 8.530 1.496 ( 5.785 1.917 6.389) 8.830 1.619 ( 1.282 5.359 4.146) 6.896 1.790 ( -7.540 11.785 0.707) 14.009 1.922 ( 1.169 4.836 6.122) 7.889 2.144 ( 1.815 -5.651 -0.994) 6.018 2.395 ( -1.966 0.500 -6.353) 6.669 2.639 ( 4.109 -13.050 4.821) 14.506 2.806 ( -7.747 0.555 2.623) 8.197 3.001 ( 3.224 -7.245 3.064) 8.501 3.030 ( -2.282 1.173 3.682) 4.488 3.142 ( 0.917 -3.562 0.382) 3.698 3.298 ( -0.144 -7.855 -0.948) 7.914 3.370 ( -5.110 6.792 2.609) 8.891 3.637 ( 10.094 4.735 4.183) 11.908 3.766 ( -4.306 -9.520 -8.664) 13.573 4.114 ( -2.781 3.273 -7.361) 8.523 4.243 ( 3.378 -0.934 -5.227) 6.293 4.398 ( -6.805 4.552 2.278) 8.498 4.536 ( 15.307 -0.851 -5.647) 16.338 5.131 ( -4.885 -6.997 3.591) 9.258 5.143 ( -1.377 -10.758 -0.922) 10.885 5.405 ( -13.357 -1.670 -4.492) 14.191 5.595 ( -7.051 -3.168 0.860) 7.777 5.764 ( -7.222 -3.084 1.759) 8.048 5.870 ( 3.583 2.373 -0.193) 4.302 6.317 ( -2.944 -8.667 -3.736) 9.887 6.573 ( 9.832 -0.489 6.649) 11.879 6.630 ( 6.995 7.060 -1.824) 10.104 6.804 ( 4.701 14.695 0.728) 15.446 7.776 ( 2.082 2.309 9.346) 9.850 8.491 ( 3.659 3.544 -5.149) 7.242 8.711 ( -3.222 -0.447 -0.544) 3.298 8.941 ( 2.477 -2.805 -11.285) 11.889 9.693 ( -2.245 2.067 5.831) 6.581 9.882 ( 4.325 0.567 8.030) 9.138 10.207 ( 4.040 5.672 2.352) 7.350 10.558 ( 2.867 -11.905 -2.061) 12.418 10.893 ( -0.186 -3.142 8.319) 8.894 10.914 ( 0.361 1.971 2.536) 3.232 11.328 ( -8.474 3.516 0.620) 9.196 11.390 ( -0.937 6.382 -2.575) 6.945 11.654 ( 0.475 -0.432 2.694) 2.769 11.921 ( 0.101 7.593 -2.815) 8.099 12.102 ( -3.897 5.455 10.722) 12.646 12.137 ( -4.334 1.607 0.670) 4.671 12.579 ( 1.047 -0.030 -1.623) 1.932 13.288 ( 13.536 -8.302 12.225) 20.040 13.681 ( -6.011 3.287 -24.959) 25.882 14.306 ( 9.887 0.661 -20.854) 23.089 14.921 ( -6.536 -43.774 20.319) 48.700 14.986 ( -24.964 -23.596 -4.648) 34.664 16.109 ( 3.672 0.622 4.780) 6.060 16.640 ( -11.443 16.795 -1.240) 20.360 18.025 ( 23.328 1.559 19.326) 30.333 18.220 ( -2.052 43.364 -32.332) 54.130 20.643 ( 0.353 0.385 4.990) 5.017 20.772 ( -0.977 -0.544 0.519) 1.233 ======================= Grid point 112 (44/170) ======================= q-point: ( 0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 4.648 4.341 12.935) 14.414 1.208 ( 1.479 6.581 8.558) 10.896 1.373 ( 2.778 3.395 0.074) 4.388 1.497 ( -4.521 6.265 -6.558) 10.134 1.668 ( 5.573 1.378 5.663) 8.064 1.789 ( 3.399 1.615 4.597) 5.941 1.994 ( -3.355 -3.378 2.374) 5.320 2.210 ( -5.236 -0.464 -4.754) 7.087 2.387 ( 10.039 0.806 1.862) 10.242 2.686 ( -9.275 -0.962 1.659) 9.471 2.796 ( 9.023 -6.111 8.827) 14.024 2.998 ( -11.724 0.773 -0.547) 11.763 3.048 ( 2.513 -9.769 -1.549) 10.206 3.082 ( 0.509 -6.584 4.410) 7.941 3.333 ( 5.001 -1.043 -0.999) 5.205 3.405 ( 3.506 7.854 2.587) 8.982 3.580 ( -5.415 -5.322 -7.220) 10.477 3.808 ( 8.917 10.475 -3.018) 14.084 4.017 ( -1.952 -5.126 -3.446) 6.477 4.209 ( -2.906 1.939 0.296) 3.505 4.334 ( -0.660 8.946 -1.869) 9.163 4.703 ( 10.644 -1.261 -4.993) 11.824 4.993 ( -15.830 -8.879 -5.156) 18.868 5.084 ( -6.082 -5.469 4.264) 9.224 5.189 ( -3.467 -3.435 -3.218) 5.846 5.496 ( -9.643 0.495 4.427) 10.623 5.641 ( -8.664 -7.858 0.650) 11.715 5.918 ( 0.817 9.373 1.222) 9.488 6.233 ( -1.784 -11.659 -4.637) 12.673 6.697 ( 4.919 9.445 -1.251) 10.722 6.775 ( 7.448 -0.178 2.891) 7.991 6.936 ( 9.501 12.333 1.251) 15.619 7.934 ( 4.037 -0.592 10.115) 10.907 8.514 ( 6.663 1.650 -6.779) 9.648 8.665 ( -2.400 -2.156 0.153) 3.230 8.864 ( 1.117 -2.721 -7.614) 8.163 9.742 ( 0.563 -0.533 6.056) 6.105 10.014 ( 0.307 1.587 9.041) 9.184 10.280 ( 1.991 2.648 1.584) 3.672 10.505 ( 0.535 -3.700 -13.795) 14.293 10.854 ( -1.748 -0.216 5.223) 5.512 11.060 ( -2.147 4.631 6.807) 8.508 11.213 ( -4.869 -1.250 0.773) 5.086 11.382 ( 2.485 -0.520 1.867) 3.151 11.705 ( 0.558 -2.384 5.637) 6.146 11.834 ( -3.236 3.855 -7.728) 9.223 12.010 ( -5.502 3.906 4.517) 8.120 12.372 ( 3.832 -2.743 14.177) 14.940 12.636 ( 6.028 7.746 6.151) 11.583 13.288 ( -2.116 7.750 -28.359) 29.475 13.620 ( 11.028 -12.912 7.185) 18.438 14.218 ( 10.473 -0.473 -24.261) 26.429 14.491 ( -23.230 -15.443 -6.818) 28.716 14.939 ( -14.762 -26.288 14.665) 33.527 16.180 ( -2.508 11.529 5.817) 13.155 16.399 ( -18.971 27.980 2.851) 33.925 18.064 ( 17.616 14.688 -26.575) 35.104 18.560 ( 16.100 -7.091 19.312) 26.123 20.702 ( 0.378 -0.494 4.270) 4.315 20.757 ( -1.192 -0.294 0.145) 1.237 ======================= Grid point 113 (45/170) ======================= q-point: ( 0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( -3.277 9.851 -0.127) 10.382 1.213 ( 1.210 7.365 -4.091) 8.511 1.473 ( 7.015 -1.541 -1.816) 7.408 1.494 ( -1.445 1.198 11.343) 11.498 1.847 ( 10.052 2.381 1.292) 10.411 1.899 ( -0.735 -3.354 8.460) 9.130 1.980 ( -0.319 -1.386 3.375) 3.663 2.061 ( -3.324 2.729 -0.836) 4.381 2.394 ( -2.000 -6.179 -8.389) 10.609 2.514 ( -10.916 -0.576 -4.490) 11.818 2.794 ( -7.846 -4.890 -1.090) 9.309 3.056 ( 2.266 -5.569 6.544) 8.887 3.159 ( 6.084 -7.965 1.130) 10.086 3.176 ( 8.943 -10.137 -0.519) 13.528 3.299 ( 2.993 -0.520 -4.810) 5.689 3.521 ( 9.318 10.606 -2.978) 14.429 3.608 ( 6.646 2.910 11.722) 13.786 3.830 ( 3.287 3.671 -11.242) 12.274 3.974 ( -1.269 1.437 1.147) 2.234 4.192 ( -4.960 2.402 8.386) 10.035 4.314 ( -0.541 6.315 -2.226) 6.718 4.642 ( -12.959 -2.570 -8.315) 15.610 4.767 ( -0.247 1.102 -1.877) 2.191 5.028 ( -5.759 -2.155 2.693) 6.713 5.138 ( -1.092 -7.005 -2.485) 7.512 5.360 ( -10.419 0.346 1.068) 10.480 5.524 ( -9.095 -6.346 4.593) 12.004 5.926 ( -0.371 9.509 0.415) 9.525 6.162 ( -1.545 -12.461 -3.471) 13.027 6.758 ( 4.763 12.717 -1.740) 13.691 6.880 ( 4.242 1.278 -0.625) 4.474 7.116 ( 9.251 8.785 2.879) 13.078 8.108 ( 4.836 -4.187 8.055) 10.286 8.530 ( 3.528 0.482 -7.068) 7.914 8.654 ( 1.394 -3.230 0.631) 3.574 8.822 ( 0.470 -1.683 -2.271) 2.865 9.840 ( 2.627 -4.789 6.764) 8.694 10.086 ( -1.188 1.893 4.542) 5.062 10.292 ( -1.339 -0.877 -1.165) 1.980 10.340 ( -1.332 1.996 -10.327) 10.602 10.956 ( 5.017 0.549 5.009) 7.111 11.009 ( -2.197 4.768 -3.140) 6.117 11.108 ( -8.774 1.254 1.110) 8.932 11.500 ( 0.252 -0.440 7.800) 7.816 11.660 ( -4.360 -1.972 -10.032) 11.114 11.850 ( 4.072 -4.953 9.082) 11.117 11.994 ( -3.719 2.345 8.067) 9.187 12.442 ( -3.127 -7.724 2.189) 8.616 12.811 ( 4.343 3.363 -5.080) 7.482 13.163 ( 13.932 16.901 0.243) 21.905 13.750 ( -1.683 -19.203 -3.735) 19.635 14.083 ( 4.333 -7.820 -17.021) 19.226 14.268 ( 3.448 1.652 -2.340) 4.483 14.801 ( -16.080 -8.498 6.269) 19.237 16.105 ( -21.678 35.430 8.407) 42.378 16.170 ( -4.010 15.438 -1.277) 16.001 18.119 ( 17.543 -2.182 -17.579) 24.931 18.932 ( 6.699 -11.833 14.747) 20.059 20.715 ( -1.353 -1.249 -0.230) 1.855 20.767 ( 0.437 -0.423 2.529) 2.601 ======================= Grid point 114 (46/170) ======================= q-point: ( 0.36 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( -5.977 6.269 -3.735) 9.432 1.222 ( 4.602 6.808 -2.167) 8.498 1.531 ( 2.110 0.185 -1.147) 2.409 1.593 ( 0.704 -0.624 6.742) 6.808 1.853 ( -5.123 -1.587 -0.993) 5.455 1.909 ( -7.336 2.851 6.831) 10.422 2.080 ( 5.485 -2.318 -0.732) 5.999 2.177 ( 0.902 0.872 0.966) 1.584 2.252 ( 5.838 3.491 -3.100) 7.476 2.362 ( -0.261 -4.132 -2.782) 4.988 2.700 ( -2.935 -3.915 -2.262) 5.391 2.980 ( -6.031 -2.566 -5.109) 8.310 3.215 ( 3.751 -17.495 -0.520) 17.900 3.316 ( 8.627 -10.692 2.973) 14.056 3.429 ( 7.589 -1.406 -7.547) 10.795 3.587 ( 4.124 9.040 -5.303) 11.262 3.730 ( 2.756 -7.458 -1.612) 8.113 3.951 ( 9.103 5.867 13.605) 17.389 3.997 ( 0.653 9.255 3.509) 9.919 4.193 ( -8.065 0.707 0.905) 8.146 4.213 ( -5.185 1.248 3.675) 6.477 4.467 ( -0.121 1.265 -4.080) 4.274 4.713 ( -4.307 6.642 0.326) 7.922 4.937 ( -7.928 1.652 -0.585) 8.120 5.067 ( -0.818 -2.451 -6.010) 6.542 5.229 ( -7.064 -0.386 1.254) 7.185 5.447 ( -8.080 -6.815 7.102) 12.734 5.928 ( 0.888 8.256 -0.486) 8.317 6.110 ( -1.756 -13.120 -0.950) 13.271 6.807 ( 3.747 13.734 -2.436) 14.443 6.917 ( 2.514 4.640 -1.615) 5.519 7.263 ( 5.367 5.802 1.166) 7.989 8.250 ( 3.991 -5.646 4.433) 8.214 8.485 ( -0.042 -3.682 -5.072) 6.268 8.709 ( 2.988 -1.806 1.285) 3.721 8.830 ( 0.443 -0.705 2.164) 2.318 9.934 ( -0.098 -5.793 0.889) 5.862 10.042 ( 1.929 -3.164 -6.762) 7.711 10.233 ( -3.070 -2.368 -2.871) 4.825 10.313 ( 0.098 5.025 5.959) 7.796 10.931 ( -1.625 2.155 -3.293) 4.258 10.963 ( -7.452 4.204 1.485) 8.684 11.150 ( 11.269 3.329 -0.098) 11.751 11.422 ( -8.928 -3.039 -10.159) 13.862 11.544 ( -2.104 -0.661 0.361) 2.235 11.918 ( -4.761 -0.272 8.618) 9.849 12.112 ( 3.558 -4.164 6.692) 8.648 12.381 ( -2.956 -7.307 -2.492) 8.267 12.893 ( 10.538 4.991 5.585) 12.928 13.356 ( -1.004 -13.326 -5.883) 14.602 13.704 ( 9.176 2.919 6.665) 11.711 14.115 ( 7.831 -5.662 -1.292) 9.749 14.340 ( 2.670 -5.775 -3.099) 7.077 14.583 ( -9.735 17.390 -2.133) 20.043 15.851 ( -18.188 36.026 5.835) 40.776 16.088 ( -5.134 15.385 -0.544) 16.228 18.228 ( 13.605 -8.573 -9.196) 18.524 19.091 ( -0.987 -13.706 6.564) 15.228 20.688 ( -0.750 -0.942 -1.014) 1.574 20.790 ( -0.165 -1.476 0.881) 1.727 ======================= Grid point 115 (47/170) ======================= q-point: ( 0.45 0.11 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( 0.682 -0.397 1.946) 2.100 1.302 ( 5.301 6.268 0.808) 8.248 1.526 ( -3.119 -1.828 1.421) 3.884 1.654 ( 0.905 1.911 2.435) 3.225 1.732 ( -6.715 0.993 -4.832) 8.332 1.824 ( -4.892 5.340 2.157) 7.556 2.108 ( 1.367 -2.363 3.198) 4.205 2.147 ( 2.115 0.302 -5.151) 5.576 2.384 ( 1.232 -3.606 -1.435) 4.072 2.398 ( 4.700 3.387 -2.623) 6.359 2.605 ( -2.277 -2.795 -7.986) 8.762 2.901 ( 1.404 -0.096 -1.367) 1.962 3.256 ( 2.494 -12.740 0.837) 13.009 3.343 ( 2.390 -10.552 -7.799) 13.337 3.506 ( 5.829 -10.781 1.025) 12.299 3.601 ( 4.118 6.356 -2.925) 8.119 3.836 ( 1.526 -11.755 7.676) 14.122 3.970 ( -4.931 -0.280 -1.521) 5.168 4.039 ( -4.077 6.261 4.919) 8.945 4.161 ( -4.407 0.919 4.126) 6.106 4.239 ( 0.536 7.764 1.194) 7.874 4.486 ( 6.108 -1.659 2.746) 6.900 4.666 ( -6.337 12.364 -0.372) 13.898 4.809 ( -0.442 7.115 -0.119) 7.130 5.033 ( 3.389 -1.389 -4.170) 5.550 5.135 ( -4.442 2.352 -1.190) 5.165 5.416 ( -6.604 -8.549 8.417) 13.694 5.942 ( 1.463 10.795 -1.026) 10.942 6.094 ( -0.695 -16.168 2.109) 16.320 6.817 ( 2.264 11.403 -4.715) 12.545 6.941 ( 1.675 9.510 -0.041) 9.656 7.302 ( 0.387 3.924 -2.372) 4.602 8.311 ( -1.978 -2.676 1.613) 3.697 8.450 ( 3.189 -8.624 -3.743) 9.927 8.760 ( 0.872 -1.507 2.492) 3.040 8.873 ( -0.056 -0.546 4.579) 4.612 9.817 ( -2.209 -1.549 -11.572) 11.882 10.051 ( -0.833 -6.409 -4.617) 7.943 10.182 ( 2.259 -2.818 -0.784) 3.696 10.410 ( 0.763 1.034 10.164) 10.245 10.850 ( -4.626 6.055 -0.049) 7.620 10.932 ( 3.880 3.754 -3.370) 6.364 11.162 ( -6.333 -8.715 -12.482) 16.488 11.326 ( 11.147 2.740 -2.213) 11.690 11.484 ( -4.173 3.955 -1.422) 5.923 11.939 ( -5.607 0.095 10.483) 11.889 12.180 ( -3.097 -6.662 1.028) 7.418 12.327 ( 1.321 -5.752 -1.571) 6.107 13.087 ( -0.379 -5.714 2.905) 6.421 13.371 ( 10.563 -8.931 12.352) 18.545 13.950 ( 2.393 -4.019 7.580) 8.907 14.073 ( -18.573 -8.280 -1.840) 20.418 14.314 ( 14.861 20.098 -4.072) 25.326 14.596 ( 6.360 15.536 0.640) 16.800 15.654 ( -13.155 35.494 4.916) 38.171 16.016 ( -1.525 13.469 -1.529) 13.641 18.355 ( 9.616 -10.603 -2.040) 14.458 19.058 ( -5.224 -13.846 -2.700) 15.043 20.674 ( 0.306 -0.790 -0.854) 1.203 20.779 ( -0.893 -1.845 -1.272) 2.412 ======================= Grid point 116 (48/170) ======================= q-point: (-0.45 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.010 ( 4.631 -0.607 6.815) 8.262 1.375 ( 0.130 3.760 3.592) 5.202 1.440 ( -8.212 -2.095 -2.311) 8.785 1.600 ( -0.817 -0.203 -5.427) 5.492 1.664 ( -0.935 -0.609 1.340) 1.744 1.861 ( 3.509 6.993 4.733) 9.144 2.119 ( -0.842 1.470 -4.370) 4.687 2.148 ( -6.610 3.429 -3.043) 8.044 2.269 ( 0.555 -2.625 -5.515) 6.132 2.374 ( -0.011 1.677 0.414) 1.727 2.554 ( 7.305 -5.839 -9.728) 13.494 2.926 ( 4.655 1.292 -7.648) 9.046 3.292 ( -2.796 -10.456 -2.137) 11.032 3.369 ( 3.503 -15.247 6.641) 16.996 3.534 ( -0.001 -7.969 0.885) 8.018 3.669 ( 4.521 3.754 0.818) 5.933 3.784 ( -20.293 3.070 -6.517) 21.534 3.906 ( -0.012 -8.829 3.848) 9.632 3.980 ( -1.909 1.696 6.902) 7.359 4.193 ( 0.292 0.394 3.630) 3.663 4.286 ( 5.573 5.441 4.430) 8.960 4.479 ( -9.592 11.592 -4.462) 15.693 4.671 ( 9.402 -2.523 3.957) 10.508 4.907 ( 5.586 8.220 1.999) 10.137 5.073 ( 2.239 0.838 -3.644) 4.358 5.097 ( 7.650 1.232 -2.415) 8.116 5.406 ( -6.323 -8.240 8.869) 13.657 5.947 ( 0.083 12.750 -0.330) 12.755 6.134 ( 1.535 -16.472 3.630) 16.937 6.784 ( 1.617 9.810 -6.818) 12.056 6.962 ( -0.646 10.432 1.494) 10.558 7.237 ( -2.958 3.966 -4.717) 6.836 8.218 ( -8.019 -2.574 -1.964) 8.648 8.505 ( 5.563 -8.166 -1.401) 9.980 8.785 ( -1.880 -0.179 3.095) 3.626 8.931 ( 0.990 -2.615 5.707) 6.355 9.667 ( -0.895 -0.602 -10.562) 10.617 9.920 ( -3.409 -0.798 -9.923) 10.522 10.244 ( 3.588 -4.869 0.691) 6.088 10.547 ( 2.195 -3.548 8.219) 9.217 10.803 ( 0.458 4.404 -2.708) 5.190 10.969 ( -2.881 -1.381 0.263) 3.206 11.016 ( 7.696 -4.488 -6.830) 11.226 11.369 ( -4.633 7.273 -1.027) 8.684 11.469 ( 8.146 0.763 -5.634) 9.934 11.943 ( -4.576 -2.975 1.241) 5.598 12.047 ( -8.533 -3.479 1.768) 9.383 12.373 ( 1.894 -8.871 1.357) 9.172 13.125 ( -4.547 -6.725 7.504) 11.055 13.683 ( -3.147 1.730 -4.069) 5.427 13.711 ( -4.014 8.851 16.118) 18.822 14.065 ( 0.840 -15.805 5.254) 16.676 14.505 ( 8.300 18.918 -0.157) 20.660 14.697 ( 3.250 7.591 2.664) 8.677 15.559 ( -2.772 32.283 3.007) 32.541 16.019 ( 3.877 15.531 -1.491) 16.077 18.495 ( 6.197 -11.576 4.546) 13.895 18.882 ( -7.183 -12.775 -10.598) 18.086 20.679 ( 0.988 -0.852 -0.403) 1.366 20.737 ( -1.280 -1.504 -2.851) 3.468 ======================= Grid point 117 (49/170) ======================= q-point: (-0.36 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.104 ( -3.139 4.514 2.323) 5.969 1.241 ( -10.077 0.451 -3.269) 10.603 1.389 ( -3.174 1.134 2.814) 4.391 1.558 ( 1.081 -3.994 -3.074) 5.155 1.678 ( 1.090 -8.296 -1.452) 8.493 1.806 ( -11.975 5.514 -6.924) 14.891 2.030 ( 4.055 7.189 4.463) 9.382 2.079 ( -1.291 5.754 1.431) 6.068 2.356 ( 9.758 -3.391 -2.743) 10.688 2.439 ( 4.994 0.252 -0.652) 5.043 2.597 ( 9.731 -6.993 -7.300) 14.031 2.869 ( 2.876 2.704 -11.884) 12.522 3.160 ( -8.305 -12.585 -2.450) 15.277 3.278 ( -25.158 4.878 -10.545) 27.711 3.527 ( 0.526 -10.372 9.417) 14.019 3.589 ( 1.196 -5.246 5.832) 7.935 3.695 ( -4.414 3.560 2.344) 6.136 3.954 ( 1.298 -5.750 1.140) 6.004 4.042 ( -0.901 1.450 9.696) 9.845 4.237 ( 0.657 5.741 3.457) 6.734 4.297 ( -4.381 10.066 -6.615) 12.817 4.500 ( 12.634 -4.581 5.227) 14.420 4.832 ( 6.274 -3.798 1.557) 7.497 4.984 ( 3.047 6.952 -1.150) 7.677 5.091 ( 6.161 0.446 -3.423) 7.062 5.257 ( 12.284 -1.814 -1.175) 12.473 5.407 ( -5.014 -6.762 8.754) 12.144 5.941 ( -1.020 12.103 0.827) 12.174 6.209 ( 2.528 -13.347 3.587) 14.050 6.724 ( 1.214 7.404 -8.646) 11.448 6.927 ( -5.710 7.118 0.673) 9.150 7.139 ( -3.247 7.871 -2.617) 8.907 8.039 ( -9.921 -2.165 -3.338) 10.689 8.572 ( 3.642 -5.757 -0.548) 6.834 8.766 ( -3.941 0.339 2.669) 4.772 9.039 ( 3.271 -5.418 7.724) 9.986 9.578 ( 2.209 1.273 -7.248) 7.683 9.764 ( -2.691 1.099 -8.783) 9.251 10.287 ( 0.765 -1.072 0.092) 1.321 10.565 ( -0.489 -8.067 -9.418) 12.410 10.815 ( 3.563 -1.546 0.200) 3.889 10.967 ( -0.353 0.533 2.331) 2.417 11.136 ( 7.025 -1.621 3.833) 8.165 11.319 ( -1.203 7.593 3.985) 8.660 11.470 ( 2.358 -8.371 -11.162) 14.150 11.824 ( -1.442 0.719 -4.390) 4.676 12.051 ( -3.472 2.641 10.925) 11.763 12.395 ( -0.844 -10.005 0.457) 10.051 12.902 ( -19.428 10.316 -4.948) 22.546 13.764 ( -5.328 -13.675 0.443) 14.683 13.795 ( 7.502 2.570 18.393) 20.030 14.147 ( -0.425 5.882 6.340) 8.659 14.562 ( 1.567 5.989 -3.037) 6.896 14.763 ( 1.780 2.033 3.741) 4.615 15.640 ( 8.156 27.083 2.335) 28.380 16.101 ( 7.428 19.761 -0.636) 21.120 18.552 ( -8.077 -13.612 -11.396) 19.504 18.714 ( 2.914 -9.545 6.742) 12.044 20.665 ( -1.661 -1.478 -2.814) 3.586 20.709 ( 1.314 -0.223 -0.489) 1.420 ======================= Grid point 118 (50/170) ======================= q-point: (-0.27 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.935 ( -13.372 6.363 -1.695) 14.905 1.042 ( -12.711 7.648 -3.046) 15.144 1.296 ( -6.066 4.253 -10.462) 12.819 1.489 ( -2.382 -8.439 -3.437) 9.418 1.670 ( 0.048 -10.695 -0.638) 10.714 1.751 ( 2.998 5.413 8.351) 10.394 2.019 ( -1.635 7.017 2.652) 7.678 2.252 ( 9.274 3.907 3.968) 10.818 2.352 ( -11.287 0.944 -8.261) 14.018 2.521 ( 8.120 0.695 -2.531) 8.534 2.607 ( 0.339 -6.583 -7.772) 10.191 2.815 ( -5.783 4.818 -3.609) 8.347 2.871 ( 4.285 0.688 -10.249) 11.130 3.037 ( -4.451 -9.770 0.028) 10.736 3.558 ( -9.085 5.122 1.474) 10.533 3.600 ( -3.131 -11.076 7.709) 13.853 3.720 ( 3.173 -6.530 2.318) 7.621 3.907 ( -5.549 -1.259 -2.796) 6.339 4.163 ( 1.548 7.758 3.547) 8.670 4.208 ( -2.646 4.259 8.993) 10.296 4.319 ( 5.501 2.424 1.679) 6.241 4.760 ( 12.787 -6.111 1.294) 14.231 4.892 ( 2.108 -6.486 -3.531) 7.680 5.006 ( 4.284 4.611 -2.808) 6.892 5.189 ( 7.649 -2.562 -0.107) 8.068 5.407 ( 4.112 -0.332 1.874) 4.531 5.475 ( 6.155 -7.107 4.709) 10.515 5.934 ( -1.558 9.747 1.895) 10.051 6.286 ( 2.565 -9.820 2.818) 10.533 6.619 ( -1.932 -0.266 -10.831) 11.006 6.822 ( -6.535 9.700 0.924) 11.733 7.066 ( -5.517 10.734 0.390) 12.075 7.848 ( -9.247 -0.751 -2.337) 9.567 8.603 ( 0.763 -2.033 -0.421) 2.212 8.733 ( -3.341 -0.314 3.139) 4.595 9.191 ( 3.986 -8.556 8.837) 12.930 9.580 ( 3.777 2.585 -2.141) 5.053 9.660 ( -0.271 2.328 -5.417) 5.902 10.265 ( -1.089 2.354 -4.044) 4.805 10.383 ( -4.962 -5.700 -13.138) 15.156 10.832 ( -1.268 -4.144 -5.769) 7.215 10.972 ( 1.644 2.848 0.375) 3.309 11.266 ( 1.736 -5.565 1.553) 6.033 11.401 ( 6.977 -5.262 -7.498) 11.514 11.444 ( 0.793 -1.510 17.008) 17.093 11.820 ( 3.229 7.923 -1.233) 8.644 12.143 ( 0.546 5.139 10.643) 11.831 12.302 ( -11.593 -0.550 -1.336) 11.683 12.616 ( -6.208 4.554 -4.013) 8.682 13.576 ( -13.497 -8.860 -5.311) 16.996 14.013 ( -5.440 7.150 10.579) 13.879 14.290 ( 9.118 -3.560 3.032) 10.247 14.519 ( 4.066 -8.021 -3.620) 9.694 14.851 ( 4.015 6.114 3.396) 8.065 15.823 ( 9.633 19.883 3.033) 22.301 16.240 ( 9.488 23.635 1.262) 25.499 18.179 ( -13.924 -10.124 -19.690) 26.155 18.946 ( 5.599 -10.560 19.193) 22.611 20.604 ( -1.783 -0.503 -2.494) 3.107 20.733 ( 1.307 -0.335 0.516) 1.444 ======================= Grid point 119 (51/170) ======================= q-point: (-0.18 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -13.442 11.767 -0.138) 17.865 0.785 ( -16.505 9.575 2.508) 19.246 1.068 ( -3.382 12.880 -11.117) 17.347 1.398 ( -4.872 0.824 -4.138) 6.445 1.652 ( -5.481 2.298 0.723) 5.987 1.854 ( -20.931 6.517 2.478) 22.061 1.991 ( 9.987 2.126 8.170) 13.077 2.116 ( 2.260 -3.585 0.293) 4.248 2.395 ( 6.017 1.257 -1.881) 6.429 2.536 ( 2.351 -8.105 -3.134) 9.002 2.642 ( 2.110 -2.473 -2.934) 4.379 2.735 ( 2.126 5.343 -1.374) 5.912 2.837 ( 0.063 -5.908 -7.324) 9.410 3.088 ( 8.168 -2.997 -0.601) 8.722 3.414 ( -9.030 3.795 0.262) 9.799 3.575 ( -7.369 -8.381 1.310) 11.237 3.696 ( -4.240 -4.020 -4.631) 7.455 3.845 ( 1.442 -3.724 -0.110) 3.995 4.184 ( 2.669 3.472 -0.489) 4.407 4.306 ( -2.267 11.585 9.433) 15.111 4.456 ( 1.329 -1.133 9.326) 9.488 4.836 ( -2.178 -11.231 -6.314) 13.067 4.887 ( 8.635 0.983 -5.865) 10.485 5.086 ( 5.078 -7.367 1.214) 9.029 5.324 ( 8.352 -5.906 0.873) 10.266 5.503 ( 7.907 3.447 -1.789) 8.809 5.637 ( 6.629 -6.075 5.701) 10.647 5.936 ( -1.482 4.686 3.251) 5.893 6.341 ( 1.249 -7.538 -0.940) 7.699 6.442 ( -5.252 -5.173 -7.346) 10.407 6.760 ( -3.151 12.692 1.621) 13.178 6.941 ( -10.643 11.172 0.006) 15.430 7.706 ( -6.602 0.964 0.247) 6.676 8.592 ( -1.555 2.688 0.171) 3.110 8.747 ( 0.606 0.403 3.772) 3.841 9.325 ( 1.250 -12.869 5.165) 13.923 9.602 ( -0.426 0.652 1.229) 1.455 9.668 ( 2.851 5.522 1.040) 6.300 10.093 ( -2.719 -6.191 -17.953) 19.184 10.255 ( -2.667 7.892 1.281) 8.428 10.720 ( -3.109 -4.785 -4.308) 7.150 10.961 ( -0.439 5.346 -6.206) 8.203 11.289 ( 0.739 -4.027 0.922) 4.196 11.470 ( 7.390 -2.707 -2.755) 8.339 11.632 ( -1.273 -3.480 11.999) 12.558 11.925 ( 3.566 8.033 12.892) 15.603 12.082 ( -9.977 6.316 0.029) 11.808 12.312 ( 6.265 2.489 9.255) 11.450 12.562 ( 0.455 -4.005 -1.063) 4.169 13.243 ( -17.191 0.279 -8.871) 19.347 13.947 ( -6.086 -5.566 -10.408) 13.279 14.213 ( -4.298 5.739 -3.450) 7.957 14.672 ( 7.446 -11.792 -8.280) 16.219 15.052 ( 12.851 -0.518 12.628) 18.024 15.982 ( 4.941 10.816 3.497) 12.394 16.450 ( 13.121 28.985 5.309) 32.257 17.704 ( -17.033 -6.626 -20.895) 27.760 19.298 ( 9.481 -11.679 22.029) 26.675 20.563 ( -1.210 0.257 -0.449) 1.316 20.759 ( 0.728 -0.322 1.006) 1.283 ======================= Grid point 120 (52/170) ======================= q-point: (-0.09 0.11 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.494 ( -11.112 12.913 4.262) 17.562 0.630 ( -12.280 15.579 9.565) 22.022 1.114 ( 4.491 19.118 17.316) 26.182 1.238 ( -13.575 29.951 8.316) 33.920 1.547 ( 3.253 10.454 6.825) 12.902 1.798 ( 0.680 -10.053 5.418) 11.440 2.181 ( 2.236 -6.261 0.574) 6.673 2.203 ( 4.696 2.679 1.093) 5.516 2.394 ( -0.349 -6.888 -4.686) 8.338 2.546 ( 1.563 -10.747 -1.512) 10.965 2.608 ( 1.313 -4.349 -1.350) 4.739 2.761 ( 3.715 4.520 -1.355) 6.006 2.853 ( 1.249 4.244 9.222) 10.228 3.208 ( 9.299 -4.654 -4.296) 11.251 3.283 ( -6.236 5.311 -1.189) 8.277 3.441 ( -5.732 -7.276 -1.901) 9.456 3.560 ( -7.558 -0.582 -3.657) 8.416 3.865 ( 2.433 -7.878 -2.928) 8.750 4.211 ( -0.023 4.135 -0.735) 4.200 4.328 ( -2.398 11.299 1.490) 11.646 4.464 ( -7.045 -1.776 0.974) 7.330 4.690 ( -10.886 -11.707 0.605) 15.997 5.014 ( 12.929 -3.380 -4.237) 14.019 5.152 ( 1.139 -8.346 1.547) 8.564 5.482 ( 9.271 -7.107 1.813) 11.821 5.584 ( 3.826 -0.848 -0.388) 3.938 5.809 ( 6.163 -1.168 3.116) 7.004 5.958 ( -0.557 0.934 3.605) 3.765 6.205 ( -4.589 -8.117 -8.065) 12.328 6.420 ( 0.823 -4.563 1.426) 4.851 6.716 ( -10.284 11.773 -0.252) 15.634 6.762 ( -4.181 12.226 1.145) 12.972 7.646 ( -3.263 2.560 3.424) 5.378 8.566 ( -1.702 5.788 -0.464) 6.051 8.828 ( 5.160 3.119 0.512) 6.052 9.234 ( -8.941 -8.661 -13.231) 18.166 9.619 ( -1.257 0.090 3.497) 3.717 9.674 ( -2.684 4.360 3.726) 6.332 10.016 ( 3.981 -4.288 3.343) 6.739 10.292 ( 4.713 3.818 4.488) 7.545 10.688 ( 0.266 -5.131 3.283) 6.097 10.863 ( -1.654 12.823 -4.657) 13.742 11.301 ( 0.101 -0.691 0.927) 1.161 11.567 ( 5.348 -1.822 0.259) 5.655 11.655 ( -5.514 -0.209 4.307) 7.000 11.937 ( -5.215 3.715 1.862) 6.668 12.196 ( -0.574 -5.252 11.263) 12.441 12.505 ( 5.673 -7.111 9.023) 12.813 12.632 ( 6.263 1.279 5.204) 8.243 12.852 ( -16.103 5.675 -14.558) 22.437 13.703 ( -2.639 -1.464 3.118) 4.339 14.203 ( 2.107 4.386 -1.093) 4.987 14.589 ( 6.720 -1.378 -22.027) 23.070 15.362 ( 5.077 -20.136 10.468) 23.255 16.042 ( -2.019 1.692 3.103) 4.070 16.809 ( 19.273 37.304 11.390) 43.506 17.226 ( -12.521 -6.277 -18.294) 23.040 19.562 ( 0.634 -12.735 -6.584) 14.351 20.558 ( -0.570 0.628 2.166) 2.326 20.775 ( -0.100 -0.214 0.733) 0.770 ======================= Grid point 121 (53/170) ======================= q-point: ( 0.00 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.841 ( 3.752 12.176 11.186) 16.955 0.899 ( -3.719 14.791 5.565) 16.235 1.453 ( 3.622 4.119 -2.738) 6.130 1.576 ( -1.811 -7.368 6.535) 10.014 1.767 ( -4.261 5.078 -10.136) 12.111 1.982 ( -5.375 -4.683 6.531) 9.668 2.051 ( -1.409 20.009 6.586) 21.112 2.235 ( -5.512 2.601 -0.881) 6.158 2.317 ( 2.529 2.140 3.253) 4.643 2.412 ( 6.885 -2.802 6.358) 9.781 2.583 ( 7.230 -8.291 5.458) 12.281 2.965 ( -2.738 -9.227 -7.126) 11.975 3.030 ( 5.709 8.264 1.693) 10.186 3.068 ( -3.056 3.384 3.350) 5.658 3.176 ( -0.961 -5.674 0.054) 5.755 3.450 ( 5.285 -1.825 8.328) 10.031 3.556 ( -2.653 6.491 0.413) 7.025 3.698 ( -1.349 0.804 -2.644) 3.076 4.252 ( 1.640 1.972 -7.372) 7.806 4.301 ( -3.054 -0.226 0.437) 3.093 4.437 ( 1.467 1.742 -2.053) 3.067 4.565 ( -4.355 5.826 2.620) 7.731 4.890 ( -1.218 -9.681 -1.596) 9.887 5.130 ( 2.022 -4.325 -2.447) 5.365 5.342 ( -1.073 -10.935 1.037) 11.037 5.630 ( -0.018 -6.101 1.955) 6.407 5.714 ( 5.561 -6.425 -1.507) 8.630 5.894 ( -10.678 -0.708 -7.950) 13.331 6.211 ( 10.834 -3.219 4.870) 12.307 6.321 ( 2.180 -3.584 -1.574) 4.480 6.836 ( -5.294 14.193 2.624) 15.374 7.028 ( 0.879 13.840 1.340) 13.933 7.765 ( -0.032 6.187 5.888) 8.541 8.659 ( 0.459 3.976 -1.845) 4.407 8.759 ( -5.781 -2.672 -5.830) 8.634 8.980 ( -1.085 -2.161 -9.136) 9.451 9.678 ( 3.358 0.051 5.189) 6.181 9.790 ( -0.499 3.878 4.478) 5.945 10.113 ( 4.741 -4.963 9.812) 11.974 10.325 ( 0.768 -0.537 -0.872) 1.280 10.636 ( 1.374 -7.224 11.863) 13.957 10.976 ( -4.820 -0.988 2.001) 5.312 11.471 ( 5.131 10.763 -1.890) 12.072 11.589 ( -2.679 0.338 2.921) 3.978 11.723 ( -4.525 9.316 4.538) 11.307 12.008 ( 4.083 6.851 0.883) 8.024 12.213 ( -5.605 4.854 -1.757) 7.620 12.406 ( -7.802 -5.609 -4.064) 10.433 12.492 ( -0.272 -4.542 2.514) 5.198 12.957 ( 4.226 7.608 -1.670) 8.861 13.865 ( 10.507 -5.014 15.242) 19.180 14.184 ( 0.852 -3.747 -12.842) 13.404 14.402 ( 8.769 1.033 -20.241) 22.083 14.952 ( -17.265 -14.170 1.999) 22.425 15.874 ( -2.189 -11.807 4.642) 12.874 16.817 ( 4.433 -12.500 -11.435) 17.512 17.841 ( 7.928 27.525 14.508) 32.108 19.235 ( -8.469 3.267 -18.427) 20.542 20.607 ( 0.211 1.232 3.466) 3.684 20.768 ( -0.534 -0.667 0.374) 0.932 ======================= Grid point 122 (54/170) ======================= q-point: ( 0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.923 ( 0.744 8.988 8.965) 12.717 1.099 ( 4.842 6.396 14.619) 16.675 1.396 ( -5.128 -3.907 -1.510) 6.621 1.596 ( -2.234 -3.658 4.094) 5.927 1.704 ( 7.518 9.063 -4.256) 12.521 1.948 ( -5.248 -2.180 2.831) 6.349 1.991 ( -7.743 3.515 -6.854) 10.922 2.238 ( 1.324 0.811 8.300) 8.444 2.397 ( -0.708 3.461 -3.834) 5.214 2.498 ( 7.032 7.858 8.648) 13.637 2.725 ( -4.800 -7.819 6.894) 11.476 2.850 ( 1.173 -8.428 -5.583) 10.177 2.971 ( -2.774 -3.515 -5.974) 7.465 3.122 ( -4.081 2.207 8.818) 9.964 3.258 ( 4.251 4.219 5.831) 8.359 3.521 ( -1.246 6.262 0.148) 6.386 3.543 ( -3.719 -9.291 -0.024) 10.008 3.767 ( 10.363 8.314 3.609) 13.768 4.187 ( -3.102 4.274 -9.737) 11.077 4.257 ( 4.077 2.508 -3.986) 6.229 4.516 ( -2.240 5.981 2.130) 6.733 4.523 ( 7.965 -0.387 -0.516) 7.991 4.839 ( -4.394 -12.610 0.363) 13.359 5.087 ( -1.755 -4.655 -4.253) 6.545 5.315 ( -7.103 -7.379 3.750) 10.907 5.521 ( -6.236 -6.801 -2.995) 9.701 5.643 ( -10.926 -5.592 -4.049) 12.924 5.905 ( 11.647 -1.493 0.808) 11.770 6.180 ( -5.333 -3.942 -3.309) 7.412 6.545 ( 13.827 -2.261 3.186) 14.368 6.832 ( 1.675 13.005 0.994) 13.150 7.089 ( 4.122 13.744 2.323) 14.535 7.845 ( 0.090 4.899 8.592) 9.891 8.576 ( 0.563 4.176 -9.927) 10.785 8.671 ( -3.931 -3.755 1.517) 5.643 8.881 ( -0.734 -2.927 -6.870) 7.503 9.752 ( -2.569 3.885 4.583) 6.534 9.872 ( 4.288 -1.547 6.715) 8.116 10.275 ( 4.832 -0.837 1.875) 5.250 10.345 ( 3.265 -8.088 1.112) 8.793 10.809 ( 0.797 -4.272 12.122) 12.877 10.911 ( -4.348 -2.201 4.693) 6.765 11.440 ( -7.380 6.582 0.219) 9.891 11.528 ( -5.165 6.911 -1.579) 8.771 11.703 ( -4.082 5.366 4.556) 8.137 12.034 ( -2.628 2.849 -4.114) 5.652 12.149 ( -7.149 -0.128 -5.681) 9.133 12.233 ( 3.695 6.471 5.288) 9.138 12.598 ( 4.873 3.197 7.028) 9.130 13.121 ( 8.771 -7.653 7.286) 13.733 13.789 ( -1.871 7.640 -26.589) 27.728 14.283 ( 10.024 -9.231 -19.943) 24.154 14.409 ( 6.008 -5.367 13.904) 16.069 14.627 ( -18.394 -11.318 -3.069) 21.814 15.998 ( 9.903 -10.276 5.611) 15.334 16.818 ( 7.411 -1.445 -8.631) 11.468 18.126 ( 4.707 10.958 18.439) 21.960 18.803 ( -14.705 17.411 -20.506) 30.657 20.652 ( 0.039 0.598 4.202) 4.244 20.759 ( -0.925 -0.840 0.240) 1.272 ======================= Grid point 123 (55/170) ======================= q-point: ( 0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.088 ( 5.648 4.319 10.462) 12.649 1.268 ( -0.139 -1.332 8.194) 8.303 1.361 ( 3.569 -1.636 -1.304) 4.137 1.637 ( 1.209 3.894 2.695) 4.887 1.783 ( -9.713 0.509 3.523) 10.345 1.822 ( 6.812 10.147 -0.810) 12.248 1.927 ( 0.802 -2.854 -0.032) 2.964 2.251 ( -9.399 3.802 0.516) 10.152 2.322 ( 2.339 -5.050 -6.773) 8.766 2.579 ( -4.904 -8.078 3.434) 10.054 2.766 ( 0.354 -4.233 -0.276) 4.256 2.843 ( 2.552 -7.909 -2.591) 8.705 2.914 ( -0.327 -5.074 -0.324) 5.094 3.113 ( -2.470 8.007 6.931) 10.874 3.383 ( -3.506 2.933 1.253) 4.739 3.426 ( 3.926 -1.497 2.142) 4.716 3.586 ( 3.259 6.064 4.639) 8.301 3.940 ( -0.185 0.578 2.840) 2.904 4.051 ( 6.623 11.728 -11.991) 18.034 4.263 ( -1.486 3.688 1.483) 4.244 4.490 ( 0.157 6.526 -2.613) 7.031 4.681 ( 8.478 -0.962 0.678) 8.560 4.735 ( -10.800 -13.569 2.017) 17.460 5.018 ( -0.084 -2.122 -4.441) 4.922 5.166 ( -9.579 -1.845 -2.118) 9.982 5.429 ( -7.153 -13.759 -0.318) 15.511 5.464 ( -6.849 -3.201 1.532) 7.714 6.015 ( -2.411 -11.017 -4.975) 12.326 6.101 ( 4.730 9.524 0.458) 10.644 6.755 ( 10.185 -2.103 -0.693) 10.423 6.898 ( 5.044 12.038 1.107) 13.099 7.205 ( 5.859 13.433 3.731) 15.123 7.944 ( 0.559 1.919 8.370) 8.605 8.532 ( 5.662 0.225 -7.972) 9.781 8.605 ( -5.618 -4.469 0.615) 7.205 8.815 ( -0.650 -1.871 -2.996) 3.592 9.747 ( -2.154 1.336 3.198) 4.080 10.015 ( 2.802 -1.555 7.131) 7.818 10.290 ( -0.534 -2.181 -1.938) 2.966 10.416 ( 3.909 -5.786 -5.083) 8.637 10.824 ( -2.593 -2.195 7.144) 7.911 11.069 ( 2.173 -2.362 13.820) 14.188 11.310 ( -8.445 8.349 0.805) 11.903 11.414 ( -3.160 4.523 -2.050) 5.886 11.680 ( -5.335 0.099 4.779) 7.163 11.917 ( -5.254 3.962 -6.521) 9.265 12.010 ( -5.773 -4.354 2.750) 7.736 12.337 ( -0.560 -0.473 4.120) 4.185 12.806 ( 8.371 8.955 7.481) 14.361 13.328 ( 6.251 -14.119 5.707) 16.462 13.486 ( 3.441 10.418 -25.859) 28.090 14.083 ( -5.575 -13.562 -19.404) 24.321 14.383 ( 2.814 8.785 -9.043) 12.918 14.683 ( 4.302 -2.739 12.623) 13.614 16.250 ( 11.360 -3.889 5.962) 13.406 16.814 ( -0.815 13.143 -3.645) 13.664 18.299 ( -2.389 2.323 -8.047) 8.709 18.482 ( -3.263 6.013 7.153) 9.898 20.690 ( -0.802 -0.678 3.156) 3.326 20.746 ( -0.835 -0.849 0.420) 1.263 ======================= Grid point 124 (56/170) ======================= q-point: ( 0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( 4.334 6.316 5.899) 9.668 1.288 ( -1.868 -0.537 0.115) 1.947 1.462 ( 9.869 1.531 -2.729) 10.353 1.559 ( -9.752 6.960 2.308) 12.201 1.792 ( -1.009 -6.075 11.043) 12.644 1.938 ( -1.364 3.176 -0.703) 3.528 1.967 ( 9.163 2.284 -0.704) 9.469 2.128 ( -1.505 2.565 0.988) 3.134 2.275 ( 1.914 -3.536 -6.211) 7.399 2.494 ( -9.455 -2.352 -1.241) 9.822 2.663 ( -4.750 -7.145 -1.991) 8.808 2.863 ( 1.443 -9.237 -1.416) 9.456 2.902 ( 3.520 -14.746 -4.357) 15.774 3.154 ( -5.998 2.586 2.357) 6.944 3.331 ( 5.861 -1.060 1.271) 6.090 3.615 ( -0.877 -2.082 4.225) 4.791 3.705 ( 8.346 9.149 0.550) 12.396 3.875 ( 0.824 5.335 3.410) 6.385 4.115 ( 3.861 9.614 -2.491) 10.655 4.264 ( -2.921 4.758 6.303) 8.420 4.402 ( -6.739 0.720 -7.110) 9.822 4.575 ( -5.555 -1.920 -1.741) 6.130 4.795 ( 3.266 1.995 2.649) 4.654 5.003 ( 1.888 -0.179 -1.653) 2.515 5.032 ( -3.818 -4.028 -2.012) 5.904 5.267 ( -8.293 -9.810 -2.416) 13.071 5.423 ( -6.188 -4.954 5.689) 9.757 5.879 ( -4.993 -9.216 -5.335) 11.761 6.190 ( 4.030 10.408 -0.208) 11.163 6.859 ( 7.141 -0.592 -4.815) 8.633 7.013 ( 6.654 11.562 1.692) 13.447 7.341 ( 4.564 12.371 4.910) 14.071 8.041 ( 2.566 -2.219 4.784) 5.865 8.498 ( -4.587 -4.229 -2.369) 6.674 8.585 ( 4.916 -3.052 -1.112) 5.892 8.792 ( -0.697 -1.410 0.493) 1.648 9.767 ( 0.315 -2.454 3.368) 4.179 10.079 ( 0.312 -1.868 -1.630) 2.499 10.234 ( -3.433 -5.229 -2.312) 6.669 10.380 ( 0.064 0.953 -2.837) 2.993 10.927 ( 2.203 -2.385 8.989) 9.558 11.110 ( -5.381 4.165 1.418) 6.951 11.202 ( -2.843 8.781 -2.647) 9.602 11.486 ( 2.585 -0.944 9.211) 9.613 11.595 ( -6.267 -5.629 -5.758) 10.204 11.820 ( -2.868 2.671 5.752) 6.960 11.971 ( -5.322 -5.792 5.731) 9.732 12.316 ( -4.612 -4.131 1.331) 6.333 12.892 ( 1.964 3.067 -5.057) 6.232 13.360 ( 3.063 -0.180 -19.188) 19.432 13.449 ( 5.972 -8.994 3.796) 11.444 13.897 ( -2.502 -7.850 4.606) 9.439 14.430 ( 17.066 19.535 -13.791) 29.378 14.863 ( 5.493 10.543 6.647) 13.620 16.432 ( 4.346 8.244 1.871) 9.506 16.706 ( -11.416 25.551 3.109) 28.158 18.085 ( 0.353 -1.269 -16.112) 16.166 18.640 ( 0.411 -16.414 13.327) 21.148 20.685 ( -1.504 -1.677 0.043) 2.253 20.749 ( -0.602 -1.471 1.673) 2.308 ======================= Grid point 125 (57/170) ======================= q-point: ( 0.36 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( -11.822 7.379 -4.527) 14.653 1.344 ( 3.156 8.196 0.469) 8.795 1.553 ( -1.592 1.062 6.165) 6.455 1.583 ( 7.552 0.104 -2.273) 7.887 1.852 ( -2.872 1.797 1.058) 3.550 1.922 ( 0.949 -1.971 7.000) 7.334 2.048 ( -0.102 -1.315 -6.529) 6.661 2.146 ( 1.858 -2.727 0.220) 3.308 2.298 ( 2.203 -1.846 -5.240) 5.976 2.359 ( 3.986 6.276 0.823) 7.480 2.623 ( -1.031 -3.429 1.422) 3.853 2.875 ( 1.694 -11.815 -5.296) 13.058 2.898 ( 1.687 -10.699 -0.221) 10.834 3.125 ( 1.081 -7.122 5.003) 8.770 3.430 ( -2.749 -0.580 -7.018) 7.559 3.497 ( -3.081 -13.744 1.310) 14.146 3.771 ( 5.356 9.546 -4.705) 11.915 4.011 ( -6.665 -0.854 7.452) 10.034 4.121 ( -0.613 3.975 3.646) 5.428 4.239 ( -2.743 2.705 0.575) 3.895 4.307 ( 1.081 7.079 4.691) 8.561 4.506 ( 1.001 5.131 -6.299) 8.186 4.852 ( 1.132 6.171 2.681) 6.823 4.981 ( -0.063 -0.317 -1.059) 1.107 5.029 ( 1.441 1.856 -2.442) 3.389 5.140 ( -5.005 -7.409 0.552) 8.958 5.369 ( -8.215 -3.993 5.800) 10.820 5.767 ( -2.471 -11.547 -3.149) 12.221 6.225 ( 1.652 12.561 -1.231) 12.729 6.900 ( 5.075 0.649 -5.479) 7.496 7.131 ( 6.285 12.704 0.322) 14.177 7.434 ( 0.621 10.724 3.576) 11.321 8.131 ( 4.636 -5.715 1.363) 7.484 8.396 ( -5.792 -5.514 -0.672) 8.025 8.661 ( 3.681 -2.692 1.140) 4.700 8.802 ( -0.768 -2.147 3.482) 4.162 9.815 ( 0.981 -5.557 1.838) 5.935 9.999 ( 0.059 -1.392 -10.565) 10.657 10.157 ( -3.228 -5.083 -0.267) 6.027 10.382 ( -0.676 1.505 2.449) 2.953 10.984 ( -1.096 2.407 -1.725) 3.157 11.062 ( -2.787 4.923 1.282) 5.801 11.202 ( 5.135 3.197 1.460) 6.222 11.338 ( -7.264 -3.118 -15.865) 17.726 11.575 ( -2.751 1.429 5.181) 6.038 11.887 ( -4.353 -3.998 9.688) 11.348 11.984 ( -0.784 -8.965 6.466) 11.082 12.258 ( -2.402 -3.678 -0.414) 4.412 12.951 ( 6.022 -1.800 9.151) 11.102 13.107 ( -3.276 -7.605 -18.356) 20.138 13.616 ( 4.654 -8.168 6.657) 11.519 13.993 ( -3.719 -6.812 13.877) 15.899 14.618 ( 23.731 30.821 -12.853) 40.966 15.005 ( 6.263 23.892 1.255) 24.732 16.409 ( -3.552 19.065 -4.676) 19.949 16.551 ( -15.316 30.954 8.005) 35.452 18.003 ( 6.443 -14.017 -9.540) 18.138 18.729 ( -2.270 -22.818 5.374) 23.552 20.660 ( -0.718 -1.923 -0.955) 2.264 20.749 ( -1.063 -2.703 0.608) 2.967 ======================= Grid point 126 (58/170) ======================= q-point: ( 0.45 0.22 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.976 ( -2.402 7.710 0.861) 8.122 1.412 ( 3.665 5.453 0.501) 6.589 1.541 ( -5.155 3.538 2.417) 6.703 1.621 ( 0.490 -3.901 -3.059) 4.982 1.812 ( -4.482 5.514 -4.140) 8.224 1.909 ( 0.068 2.211 0.822) 2.360 2.053 ( 3.048 -2.629 2.956) 4.994 2.145 ( 1.555 -0.560 -3.747) 4.096 2.324 ( 3.541 -2.047 -0.798) 4.168 2.437 ( 4.167 -0.298 -4.531) 6.162 2.601 ( -4.617 3.041 -2.269) 5.976 2.874 ( 3.350 -2.877 0.676) 4.468 2.960 ( 2.404 -13.571 3.828) 14.304 3.209 ( -3.563 -7.938 -4.569) 9.828 3.270 ( 5.917 -11.433 -1.392) 12.949 3.460 ( -4.220 -15.864 1.421) 16.477 3.840 ( 6.295 10.048 -0.032) 11.857 3.925 ( -4.316 -6.042 -1.342) 7.546 4.086 ( -8.396 -0.836 5.371) 10.002 4.206 ( -5.912 3.170 -0.709) 6.746 4.418 ( 6.040 7.461 0.639) 9.621 4.497 ( 1.960 5.710 3.199) 6.833 4.894 ( -2.289 9.693 -2.682) 10.314 4.964 ( 4.943 2.129 -1.300) 5.537 5.014 ( 0.447 5.041 -1.219) 5.206 5.122 ( -1.475 -3.149 3.136) 4.682 5.301 ( -7.527 -3.980 6.624) 10.787 5.749 ( 1.652 -13.979 1.097) 14.119 6.226 ( 0.564 13.624 -1.543) 13.723 6.908 ( 3.700 1.907 -6.279) 7.533 7.216 ( 3.939 14.050 -0.099) 14.592 7.431 ( -3.538 9.187 0.542) 9.860 8.221 ( 4.901 -6.834 0.318) 8.416 8.294 ( -5.835 -6.416 -0.508) 8.687 8.722 ( 1.729 -2.094 2.315) 3.568 8.833 ( -1.938 -3.441 5.633) 6.879 9.777 ( -1.929 -2.667 -7.291) 7.999 9.934 ( 2.875 -4.143 -5.634) 7.561 10.136 ( 0.036 -2.641 -0.040) 2.641 10.399 ( -0.395 -1.885 3.299) 3.820 10.948 ( 0.705 3.714 -3.976) 5.486 10.969 ( -1.750 -5.872 -15.921) 17.059 11.089 ( -3.576 7.213 -2.712) 8.495 11.344 ( 7.803 -0.764 -0.518) 7.857 11.557 ( -3.989 2.928 2.380) 5.491 11.890 ( -5.177 -7.029 7.219) 11.328 11.989 ( -4.882 -11.542 -0.302) 12.536 12.233 ( 0.046 -2.514 -0.208) 2.523 12.957 ( 0.695 -5.111 -1.306) 5.321 13.291 ( 9.898 -2.184 24.323) 26.350 13.716 ( -1.098 -9.830 6.944) 12.085 13.999 ( -9.222 -4.640 6.585) 12.245 14.871 ( 19.198 34.923 -8.071) 40.661 15.067 ( 2.065 30.301 -2.938) 30.513 16.315 ( -4.157 26.505 -1.090) 26.851 16.376 ( -9.979 26.559 1.703) 28.423 18.062 ( 7.886 -19.306 -2.243) 20.974 18.684 ( -4.565 -24.152 -2.961) 24.757 20.647 ( 0.405 -2.015 -0.895) 2.242 20.728 ( -1.154 -3.291 -1.044) 3.641 ======================= Grid point 127 (59/170) ======================= q-point: (-0.45 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 7.258 6.110 5.320) 10.877 1.444 ( -0.410 2.346 -0.542) 2.443 1.455 ( -7.774 5.404 0.672) 9.492 1.548 ( -2.246 -3.988 -5.400) 7.079 1.685 ( -3.973 2.457 -4.657) 6.596 1.976 ( 2.476 2.815 2.588) 4.556 2.107 ( -0.086 -3.228 -1.689) 3.644 2.138 ( 2.289 -1.306 -0.413) 2.667 2.342 ( -3.248 7.100 -5.260) 9.414 2.408 ( 5.891 -1.296 -4.302) 7.409 2.464 ( -4.431 1.032 -1.388) 4.757 2.914 ( 0.641 -2.793 -3.073) 4.202 3.052 ( -1.120 -12.452 -1.275) 12.568 3.101 ( -0.188 -13.049 6.862) 14.745 3.362 ( 5.260 -9.287 -0.466) 10.683 3.534 ( 7.350 -14.069 2.406) 16.054 3.848 ( -9.308 -2.824 -2.398) 10.018 3.856 ( -5.599 4.252 -4.793) 8.509 3.999 ( 2.862 4.191 4.559) 6.822 4.158 ( 0.011 -0.961 3.307) 3.444 4.480 ( -0.078 9.910 2.486) 10.218 4.613 ( 5.111 -0.312 4.190) 6.617 4.758 ( -5.666 13.192 -6.281) 15.671 4.978 ( 1.147 -2.725 -3.040) 4.241 5.086 ( 3.481 3.751 2.198) 5.569 5.154 ( 3.214 2.412 1.661) 4.348 5.285 ( -4.329 -3.973 7.665) 9.658 5.830 ( 4.502 -13.589 3.588) 14.759 6.213 ( -0.447 13.533 -1.042) 13.580 6.878 ( 2.249 2.443 -8.534) 9.157 7.246 ( -1.459 15.382 0.864) 15.475 7.354 ( -4.000 8.018 -1.322) 9.058 8.154 ( -8.176 -3.868 -1.492) 9.167 8.333 ( 6.189 -9.009 0.499) 10.941 8.768 ( -0.164 -1.205 3.312) 3.528 8.858 ( -2.305 -4.617 6.202) 8.068 9.669 ( -0.219 0.835 -7.584) 7.633 9.900 ( 0.873 -1.137 -8.393) 8.515 10.146 ( 3.315 -4.498 -1.550) 5.799 10.454 ( 1.448 -5.598 2.814) 6.430 10.762 ( -0.893 -8.642 -11.541) 14.446 10.932 ( 0.748 3.265 -2.040) 3.922 11.103 ( 5.580 6.976 -2.132) 9.184 11.385 ( 2.864 -8.631 -10.233) 13.690 11.506 ( -4.687 5.243 2.071) 7.331 11.851 ( -1.766 -4.805 -3.561) 6.236 11.932 ( -4.715 -9.089 10.057) 14.352 12.245 ( 0.707 -3.618 0.464) 3.715 13.069 ( 2.766 0.361 11.519) 11.852 13.589 ( -4.961 -3.423 7.992) 10.010 13.852 ( 3.636 -4.947 21.551) 22.409 13.889 ( -7.110 0.168 6.804) 9.842 14.951 ( -2.915 24.670 -5.353) 25.412 15.043 ( 1.683 30.691 -5.045) 31.149 16.188 ( -3.508 29.916 -3.182) 30.288 16.401 ( 7.210 22.606 0.677) 23.737 18.189 ( 6.585 -19.361 3.349) 20.722 18.530 ( -5.462 -23.200 -9.618) 25.702 20.650 ( 0.649 -2.089 -0.579) 2.263 20.695 ( -0.351 -2.820 -2.273) 3.639 ======================= Grid point 128 (60/170) ======================= q-point: (-0.36 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 4.357 1.387 2.418) 5.172 1.288 ( -10.085 7.228 -1.755) 12.531 1.418 ( -2.239 0.989 -2.359) 3.399 1.443 ( -4.069 -3.158 -5.424) 7.479 1.564 ( -2.884 -1.508 -5.751) 6.608 1.915 ( -7.397 3.062 -3.278) 8.651 2.123 ( 2.119 -2.605 0.159) 3.362 2.152 ( 2.027 4.393 3.085) 5.738 2.321 ( 1.469 1.798 1.000) 2.528 2.421 ( 4.102 -3.349 -2.639) 5.917 2.538 ( 8.620 3.443 1.042) 9.340 2.847 ( 0.050 -6.432 -7.920) 10.203 2.960 ( -3.006 -5.630 -1.693) 6.603 3.262 ( 0.450 -12.259 7.823) 14.550 3.415 ( 0.628 -10.463 1.966) 10.665 3.464 ( -16.329 8.301 -10.141) 20.937 3.640 ( 2.859 -10.070 -0.091) 10.468 3.898 ( 2.427 2.210 4.357) 5.455 4.085 ( 1.790 2.610 2.768) 4.204 4.283 ( 8.472 -1.804 3.648) 9.399 4.473 ( -2.661 5.444 2.214) 6.451 4.585 ( -6.252 13.992 -2.563) 15.538 4.737 ( 4.401 -4.773 0.511) 6.513 5.018 ( 6.512 -3.537 -1.626) 7.587 5.112 ( -1.237 1.755 1.322) 2.522 5.246 ( 4.913 0.531 0.629) 4.982 5.321 ( -0.581 -2.484 6.865) 7.324 5.947 ( 5.599 -12.147 1.759) 13.491 6.190 ( -2.231 12.099 1.081) 12.350 6.783 ( -0.710 1.538 -11.671) 11.793 7.177 ( -6.679 15.058 1.053) 16.506 7.310 ( -2.221 9.332 0.916) 9.637 7.993 ( -8.587 -2.216 -2.406) 9.189 8.436 ( 5.522 -8.089 0.536) 9.809 8.773 ( -3.356 0.589 3.550) 4.920 8.919 ( 0.700 -6.163 7.439) 9.686 9.622 ( 1.879 2.944 -3.595) 5.012 9.796 ( 0.821 2.531 -10.954) 11.272 10.214 ( 4.765 -6.261 0.704) 7.900 10.413 ( -0.025 -6.895 -12.183) 13.999 10.744 ( 0.713 -6.748 4.402) 8.088 10.908 ( 0.156 -5.970 -5.675) 8.239 11.182 ( 5.751 4.478 -1.011) 7.359 11.271 ( 1.404 -8.801 -9.522) 13.042 11.478 ( -1.693 8.024 2.544) 8.586 11.849 ( 3.068 0.728 0.034) 3.153 12.001 ( -0.443 -7.195 9.498) 11.924 12.265 ( 1.378 -4.716 0.308) 4.923 13.108 ( -12.493 10.709 3.329) 16.788 13.508 ( -5.857 -8.058 1.647) 10.097 13.882 ( -0.750 3.619 13.558) 14.053 14.244 ( 3.949 0.636 25.142) 25.458 14.747 ( -10.428 12.615 -10.653) 19.529 14.956 ( -7.259 21.918 0.264) 23.090 16.163 ( 5.216 22.567 -6.612) 24.088 16.561 ( 9.916 26.683 2.325) 28.561 18.229 ( -4.548 -18.948 -12.340) 23.065 18.433 ( 5.674 -18.616 5.703) 20.280 20.631 ( -0.865 -1.929 -2.254) 3.090 20.692 ( 1.770 -1.663 -0.714) 2.531 ======================= Grid point 129 (61/170) ======================= q-point: (-0.27 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( -11.494 7.535 0.972) 13.778 1.150 ( -9.759 1.815 -5.381) 11.291 1.300 ( -0.883 -7.002 -3.652) 7.946 1.423 ( 0.358 -0.351 -3.380) 3.417 1.490 ( 2.939 2.887 -7.077) 8.188 1.852 ( 1.626 3.434 3.229) 4.986 2.099 ( -3.000 0.322 0.538) 3.065 2.285 ( 0.844 -3.092 7.053) 7.748 2.339 ( 3.602 -0.332 -0.308) 3.631 2.520 ( 5.899 -2.044 0.834) 6.298 2.605 ( -0.891 8.067 -5.763) 9.954 2.792 ( 3.152 -4.966 -6.501) 8.767 2.937 ( 2.469 0.822 -5.058) 5.688 3.015 ( -13.936 10.483 -3.561) 17.799 3.339 ( -4.287 -11.193 2.734) 12.294 3.463 ( 0.764 -12.004 0.897) 12.061 3.711 ( 2.268 -3.968 4.873) 6.681 3.904 ( -4.569 6.816 -0.430) 8.217 4.188 ( 6.409 -2.719 4.165) 8.113 4.334 ( -3.526 8.211 -1.840) 9.124 4.468 ( -0.928 7.612 4.462) 8.873 4.624 ( 9.784 -6.023 2.038) 11.669 4.772 ( -0.371 -4.844 -0.467) 4.881 5.073 ( -1.515 1.889 -0.059) 2.423 5.123 ( 4.537 -3.697 -1.178) 5.970 5.323 ( 5.830 -6.605 -0.894) 8.855 5.430 ( 5.000 -0.080 6.656) 8.326 6.009 ( 2.859 -7.409 -4.953) 9.360 6.187 ( -2.138 5.100 6.088) 8.225 6.610 ( -4.016 1.112 -12.353) 13.036 7.093 ( -5.351 15.233 1.616) 16.227 7.266 ( -6.283 9.720 2.538) 11.849 7.842 ( -6.781 0.416 -1.902) 7.054 8.519 ( 4.403 -6.695 0.169) 8.015 8.762 ( -2.771 3.189 4.374) 6.081 9.025 ( 1.564 -7.604 7.999) 11.147 9.630 ( 1.097 2.438 -1.412) 3.024 9.734 ( 3.490 5.046 -4.949) 7.883 10.220 ( -1.405 -4.747 -15.293) 16.074 10.306 ( 2.165 -4.409 -0.372) 4.925 10.682 ( -3.902 -10.478 -10.165) 15.111 10.919 ( 0.867 -9.661 7.390) 12.194 11.249 ( 3.096 5.229 -1.345) 6.224 11.304 ( 9.546 -2.689 -1.959) 10.109 11.510 ( 0.807 5.937 4.513) 7.501 11.927 ( 5.510 2.951 1.454) 6.417 12.108 ( 2.509 -6.001 6.407) 9.131 12.298 ( 1.968 -3.532 0.606) 4.089 12.832 ( -17.703 16.645 -2.564) 24.434 13.413 ( -9.668 -6.735 3.345) 12.248 14.077 ( 1.857 1.450 9.141) 9.440 14.404 ( -5.661 7.701 -4.180) 10.432 14.470 ( -7.800 7.047 3.634) 11.122 14.918 ( -2.016 4.660 9.251) 10.553 16.155 ( 0.258 9.985 -4.496) 10.954 16.759 ( 10.698 27.930 3.188) 30.079 17.935 ( -8.046 -14.055 -18.733) 24.763 18.696 ( 12.483 -13.892 12.241) 22.331 20.594 ( -0.564 -0.520 -2.162) 2.294 20.718 ( 1.661 -1.346 0.184) 2.145 ======================= Grid point 130 (62/170) ======================= q-point: (-0.18 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.899 ( -9.523 5.970 -5.181) 12.376 1.013 ( -9.721 13.666 7.680) 18.446 1.325 ( 6.860 1.466 1.401) 7.153 1.398 ( 4.259 0.553 -3.257) 5.390 1.486 ( 4.292 -1.129 -4.075) 6.025 1.994 ( 8.158 -2.795 2.207) 8.901 2.057 ( -4.592 -1.535 3.736) 6.115 2.277 ( -10.382 5.966 6.375) 13.566 2.360 ( -6.374 6.323 -6.599) 11.142 2.418 ( -0.808 5.758 -2.939) 6.514 2.587 ( 2.125 -2.331 -3.188) 4.485 2.801 ( 5.718 2.232 -3.436) 7.035 2.849 ( 2.091 5.844 -1.100) 6.303 3.057 ( 5.873 -1.022 -0.297) 5.969 3.286 ( -4.197 -10.044 1.559) 10.997 3.433 ( -2.972 -9.853 -3.392) 10.836 3.749 ( -5.615 6.306 3.908) 9.304 3.811 ( -3.817 1.599 -0.684) 4.195 4.242 ( 0.061 4.098 -0.940) 4.205 4.383 ( 4.666 -6.730 6.603) 10.520 4.523 ( -0.642 7.728 6.010) 9.811 4.649 ( -5.571 -5.451 -6.237) 9.982 4.835 ( 6.549 -5.120 2.769) 8.761 5.036 ( 0.240 1.243 -2.088) 2.442 5.191 ( 5.147 -7.106 0.087) 8.775 5.415 ( 7.305 -9.385 -2.818) 12.222 5.626 ( 10.367 0.693 6.569) 12.293 5.940 ( -3.586 -4.829 -4.925) 7.775 6.227 ( -0.304 -2.915 1.583) 3.332 6.418 ( -4.641 2.311 -8.000) 9.533 7.034 ( -4.735 14.313 2.180) 15.233 7.152 ( -10.606 10.591 2.104) 15.136 7.747 ( -3.532 3.513 -0.002) 4.981 8.587 ( 3.907 -4.589 0.064) 6.027 8.790 ( -0.077 4.663 5.132) 6.935 9.120 ( 0.594 -7.962 4.994) 9.417 9.622 ( 0.509 1.363 -1.117) 1.834 9.791 ( 1.584 6.545 4.602) 8.156 9.991 ( -3.323 -3.521 -15.870) 16.592 10.327 ( 0.270 -0.460 -0.712) 0.889 10.544 ( -1.701 -11.723 -4.304) 12.604 11.000 ( -0.251 -5.207 4.948) 7.187 11.298 ( 4.996 7.636 -1.286) 9.215 11.439 ( 9.204 -0.124 -2.369) 9.505 11.595 ( 0.764 0.639 8.438) 8.496 12.061 ( 7.569 3.759 3.682) 9.218 12.175 ( -0.773 -0.631 -0.825) 1.295 12.333 ( 1.324 -2.123 1.229) 2.788 12.585 ( -10.241 9.901 3.074) 14.572 13.283 ( -11.222 3.687 3.950) 12.456 13.871 ( -11.372 -2.366 -18.807) 22.105 14.368 ( -3.842 4.157 1.592) 5.880 14.463 ( 4.461 2.140 0.019) 4.948 15.032 ( -0.910 -2.625 12.035) 12.352 16.070 ( -7.433 -3.077 0.254) 8.049 16.945 ( 6.058 14.849 3.016) 16.318 17.627 ( -3.649 3.649 -16.268) 17.067 19.065 ( 16.479 -11.607 10.204) 22.592 20.572 ( -0.164 0.717 -0.595) 0.946 20.746 ( 1.113 -1.096 0.676) 1.702 ======================= Grid point 131 (63/170) ======================= q-point: (-0.09 0.22 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.752 ( -4.083 13.022 1.785) 13.763 0.954 ( -8.005 16.545 6.074) 19.357 1.391 ( 7.257 5.610 -5.108) 10.498 1.518 ( 1.485 -12.928 3.720) 13.535 1.721 ( 16.958 19.304 12.825) 28.718 2.023 ( -1.200 -4.866 1.671) 5.283 2.029 ( -4.562 10.016 0.345) 11.012 2.151 ( -6.477 1.196 6.443) 9.214 2.310 ( 0.061 -0.956 -0.857) 1.286 2.350 ( -3.869 1.998 -1.854) 4.733 2.559 ( 1.476 -1.957 -5.396) 5.926 2.906 ( 9.111 8.198 -1.419) 12.338 2.937 ( 3.408 3.156 7.512) 8.832 3.082 ( 0.646 -5.692 -5.121) 7.684 3.265 ( -1.938 -8.757 -1.886) 9.165 3.334 ( -1.543 -2.614 0.817) 3.144 3.650 ( -8.598 8.654 1.647) 12.310 3.757 ( -2.843 -0.852 -0.946) 3.115 4.267 ( 1.145 1.675 2.013) 2.859 4.421 ( -8.368 -5.444 -7.985) 12.784 4.461 ( -1.649 -3.157 2.526) 4.367 4.579 ( -2.341 7.794 5.007) 9.555 4.906 ( 1.726 -5.235 -1.545) 5.724 5.076 ( 5.522 -2.838 -0.848) 6.267 5.301 ( 6.439 -9.590 0.484) 11.561 5.496 ( 7.123 -7.630 -1.415) 10.534 5.796 ( -4.559 -4.327 -2.242) 6.673 5.916 ( 12.799 -3.289 5.911) 14.477 6.128 ( -6.153 -0.845 -8.889) 10.844 6.344 ( -1.197 -2.305 0.264) 2.611 6.948 ( -11.095 12.247 3.461) 16.884 7.032 ( -3.153 14.280 0.440) 14.631 7.726 ( -1.102 5.750 2.712) 6.452 8.640 ( 2.526 -1.020 -0.077) 2.725 8.842 ( 0.365 1.058 0.883) 1.426 9.111 ( -2.376 -4.377 -5.687) 7.559 9.621 ( -0.095 0.074 0.208) 0.240 9.770 ( -2.702 4.802 0.410) 5.526 9.952 ( 2.850 -1.007 7.138) 7.752 10.322 ( 0.200 0.133 -0.088) 0.256 10.535 ( 0.355 -9.584 3.900) 10.353 11.012 ( -2.995 -0.730 2.830) 4.184 11.379 ( 7.391 10.206 -2.149) 12.783 11.545 ( 5.407 0.494 -0.231) 5.434 11.695 ( -0.678 2.754 8.683) 9.134 12.051 ( -6.113 6.694 -3.710) 9.795 12.240 ( 4.974 5.777 4.220) 8.713 12.353 ( 0.448 -6.731 1.687) 6.953 12.569 ( -2.250 -7.207 4.512) 8.796 13.101 ( -9.983 20.029 -8.359) 23.889 13.611 ( -0.372 -9.701 0.783) 9.739 14.304 ( -1.944 5.092 -4.138) 6.844 14.480 ( 6.834 -2.379 -15.269) 16.897 15.090 ( -7.182 -9.046 8.638) 14.423 15.942 ( -10.036 -10.779 3.583) 15.157 16.930 ( -3.013 -14.015 -8.173) 16.501 17.594 ( 8.958 32.830 2.139) 34.098 19.349 ( 9.813 -10.153 -2.968) 14.429 20.577 ( 0.058 1.320 1.607) 2.080 20.765 ( 0.281 -0.844 0.632) 1.091 ======================= Grid point 132 (64/170) ======================= q-point: ( 0.00 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.025 ( -2.379 3.798 4.168) 6.120 1.105 ( -3.595 5.361 3.732) 7.456 1.340 ( 1.439 -9.578 8.605) 12.956 1.515 ( 7.191 -2.545 -1.431) 7.761 1.703 ( -4.110 -0.955 -3.657) 5.584 1.998 ( -1.997 -0.040 2.488) 3.191 2.051 ( -3.405 -7.230 3.417) 8.692 2.205 ( -3.224 -1.268 -5.736) 6.701 2.406 ( 7.214 3.901 5.213) 9.718 2.436 ( 2.569 -2.994 -7.627) 8.587 2.737 ( -1.945 2.681 -0.167) 3.316 2.818 ( -0.286 -3.545 -7.941) 8.701 3.082 ( -7.102 10.108 9.100) 15.343 3.146 ( 2.807 1.936 3.031) 4.563 3.300 ( 5.865 13.362 1.809) 14.704 3.406 ( 5.462 4.920 9.005) 11.625 3.654 ( -9.457 6.041 5.749) 12.609 3.898 ( 2.074 13.571 -0.032) 13.729 4.222 ( 1.754 -2.067 -5.047) 5.729 4.349 ( 0.992 2.672 3.169) 4.262 4.451 ( -0.111 0.605 1.290) 1.429 4.661 ( -3.014 2.169 -1.061) 3.862 4.742 ( -2.962 -6.075 -2.695) 7.276 4.999 ( 1.280 -9.114 -4.223) 10.126 5.158 ( -0.336 -7.861 -0.004) 7.868 5.424 ( -3.848 -13.930 -1.370) 14.517 5.622 ( 9.551 -2.766 -0.108) 9.944 5.830 ( -6.654 -5.521 -6.944) 11.090 6.191 ( 3.363 0.933 2.068) 4.057 6.275 ( 5.571 -1.532 -0.609) 5.810 7.102 ( -4.713 12.714 3.098) 13.909 7.257 ( 0.299 9.094 1.051) 9.160 7.912 ( -0.102 9.118 4.886) 10.345 8.554 ( -0.919 -10.041 2.260) 10.333 8.816 ( -2.563 3.967 -8.349) 9.592 8.937 ( -2.585 -2.179 -8.221) 8.889 9.679 ( 3.938 0.641 4.142) 5.751 9.860 ( 0.966 1.653 3.158) 3.693 10.022 ( 2.245 -2.129 3.113) 4.389 10.317 ( -0.169 -3.152 -2.245) 3.873 10.555 ( 0.854 0.500 18.204) 18.231 10.895 ( -6.072 -6.362 5.322) 10.280 11.585 ( 1.736 1.893 3.623) 4.442 11.653 ( -3.570 4.856 -2.397) 6.486 11.858 ( -1.275 2.767 4.865) 5.741 12.125 ( 9.404 -3.376 -4.574) 10.989 12.268 ( -5.178 3.603 -1.565) 6.500 12.293 ( -8.223 1.991 -0.978) 8.517 12.485 ( 6.479 4.156 6.483) 10.063 13.080 ( -3.768 -0.448 -12.713) 13.267 13.835 ( 12.416 8.307 17.313) 22.867 14.227 ( -1.110 5.459 -20.806) 21.539 14.458 ( 2.669 2.085 -12.874) 13.312 14.787 ( -14.259 -4.291 1.557) 14.972 15.634 ( -0.059 -10.293 2.548) 10.604 16.476 ( 6.978 -21.575 -9.233) 24.483 18.343 ( 1.354 23.482 9.997) 25.558 19.191 ( -2.312 -6.380 -6.164) 9.167 20.637 ( 0.300 1.800 2.441) 3.048 20.748 ( -0.370 -1.392 0.385) 1.491 ======================= Grid point 133 (65/170) ======================= q-point: ( 0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( -2.850 -2.374 6.631) 7.598 1.151 ( -3.459 -2.697 8.449) 9.519 1.411 ( -1.570 6.985 -0.573) 7.182 1.545 ( 2.613 -0.035 5.418) 6.015 1.703 ( 2.184 -3.776 3.750) 5.753 1.971 ( -3.907 1.957 -0.986) 4.479 2.053 ( -3.864 -0.105 -8.735) 9.552 2.085 ( 3.018 -7.547 4.527) 9.304 2.378 ( 0.820 -3.260 -5.257) 6.240 2.533 ( 0.693 -7.003 2.075) 7.337 2.691 ( 2.813 -6.454 -8.972) 11.404 2.727 ( -2.339 -1.834 -6.250) 6.921 3.069 ( -7.050 11.883 9.395) 16.708 3.203 ( -2.420 3.856 6.556) 7.981 3.401 ( -3.513 5.908 5.927) 9.076 3.514 ( 0.277 16.116 7.809) 17.910 3.628 ( -1.264 4.185 5.062) 6.688 3.982 ( 5.983 13.235 1.297) 14.582 4.215 ( 2.758 -0.457 -3.630) 4.582 4.379 ( 2.360 7.761 -4.066) 9.074 4.507 ( 4.131 -1.601 2.382) 5.030 4.575 ( -3.703 -0.808 1.491) 4.073 4.674 ( -2.519 -3.524 -3.921) 5.843 4.972 ( 2.001 -7.123 -3.955) 8.389 5.143 ( -3.751 -10.120 2.002) 10.977 5.295 ( -7.717 -14.059 -2.240) 16.194 5.598 ( -10.042 -0.844 -6.529) 12.008 5.784 ( 7.298 -8.889 -1.107) 11.554 6.199 ( 2.190 4.375 -0.664) 4.937 6.487 ( 14.085 -3.724 0.838) 14.593 7.093 ( 0.125 13.112 2.001) 13.264 7.304 ( 3.263 8.049 2.325) 8.991 7.967 ( -1.543 7.687 7.311) 10.720 8.529 ( -4.413 -8.431 1.616) 9.653 8.669 ( -0.951 3.108 -11.348) 11.804 8.835 ( -1.229 -2.112 -5.085) 5.642 9.815 ( 3.403 1.004 6.713) 7.593 9.870 ( -1.154 3.278 1.013) 3.620 10.139 ( 6.307 -7.833 4.783) 11.136 10.277 ( -1.142 -3.802 -3.204) 5.102 10.763 ( -0.649 -0.649 16.606) 16.631 10.847 ( -6.116 -3.810 8.436) 11.094 11.526 ( -8.470 2.629 -0.260) 8.872 11.639 ( -1.187 4.560 3.159) 5.673 11.815 ( -6.910 2.914 1.566) 7.661 12.039 ( -7.590 0.722 -6.614) 10.093 12.129 ( -7.608 -3.004 -1.207) 8.268 12.299 ( 2.190 1.199 -1.374) 2.850 12.721 ( 11.591 8.523 9.283) 17.122 13.033 ( 4.774 -1.965 0.527) 5.189 13.927 ( -2.271 5.465 -27.174) 27.811 14.118 ( 3.940 -4.751 -11.282) 12.860 14.414 ( 7.340 2.312 6.444) 10.037 14.642 ( 0.511 10.637 -3.435) 11.189 15.775 ( 12.596 -10.664 4.231) 17.037 16.591 ( 18.152 -19.845 -8.862) 28.317 18.413 ( -8.234 16.740 12.793) 22.621 18.972 ( -13.780 1.819 -7.906) 15.991 20.667 ( -0.434 0.908 3.029) 3.192 20.739 ( -1.037 -1.212 0.245) 1.614 ======================= Grid point 134 (66/170) ======================= q-point: ( 0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( 5.835 -2.729 8.402) 10.587 1.169 ( -3.346 -7.172 7.355) 10.804 1.409 ( 3.191 7.560 1.008) 8.267 1.664 ( -0.287 1.805 8.601) 8.793 1.824 ( 4.931 -3.911 5.408) 8.298 1.849 ( -5.013 2.822 -4.659) 7.403 1.956 ( 2.253 1.042 -6.044) 6.534 2.154 ( 0.106 -7.061 0.405) 7.074 2.362 ( 0.300 -2.027 0.756) 2.184 2.507 ( -5.571 0.020 0.493) 5.592 2.589 ( -0.302 -7.035 -12.068) 13.972 2.654 ( 3.013 -8.548 -6.133) 10.943 2.999 ( -10.675 7.886 2.806) 13.565 3.237 ( -3.404 0.803 8.129) 8.849 3.316 ( -7.525 3.482 -0.014) 8.292 3.599 ( -3.524 4.005 6.359) 8.300 3.729 ( 5.003 13.870 10.939) 18.359 4.007 ( -2.135 5.973 -3.131) 7.074 4.274 ( 8.929 9.395 -2.344) 13.172 4.352 ( -0.944 5.304 -2.381) 5.890 4.526 ( -9.590 -7.247 1.219) 12.082 4.554 ( 1.653 -0.721 -1.534) 2.367 4.697 ( 8.120 3.993 3.620) 9.746 4.980 ( 1.970 -2.913 -2.958) 4.596 5.061 ( -5.623 -10.498 -0.613) 11.925 5.148 ( -5.907 -12.283 -3.903) 14.177 5.416 ( -5.998 -0.941 -2.375) 6.520 5.800 ( -1.349 -11.361 -3.310) 11.910 6.283 ( 7.794 9.155 -0.444) 12.032 6.692 ( 11.951 -4.374 -2.338) 12.939 7.146 ( 3.660 12.811 1.936) 13.463 7.405 ( 4.641 6.766 4.067) 9.157 8.012 ( -2.458 5.138 6.821) 8.886 8.470 ( -5.322 -7.888 1.942) 9.711 8.558 ( 1.558 1.619 -8.845) 9.126 8.781 ( -0.769 -2.370 -2.257) 3.362 9.800 ( -3.737 4.189 0.198) 5.617 9.979 ( 4.382 -1.330 5.000) 6.780 10.206 ( -3.140 -5.786 -3.071) 7.264 10.280 ( 5.958 -7.819 0.491) 9.842 10.801 ( -4.196 0.133 10.033) 10.876 11.011 ( 0.942 -3.912 19.031) 19.452 11.404 ( -7.186 2.567 2.129) 7.922 11.577 ( -7.149 10.675 -2.601) 13.108 11.701 ( -7.988 -0.356 0.001) 7.996 11.881 ( -5.262 -2.383 -1.195) 5.899 12.004 ( -6.348 1.634 -1.375) 6.698 12.269 ( -4.165 -8.009 0.559) 9.045 12.967 ( 7.097 7.767 1.680) 10.654 13.172 ( 7.527 -1.988 4.904) 9.201 13.612 ( -0.132 2.589 -26.178) 26.307 13.858 ( -6.516 -9.235 -15.346) 19.059 14.722 ( 17.054 23.073 -8.385) 29.892 14.758 ( 14.900 9.824 12.753) 21.936 16.093 ( 18.830 -10.044 5.265) 21.981 16.818 ( 19.690 -13.107 -8.227) 25.044 18.338 ( -15.945 6.729 7.851) 19.004 18.642 ( -17.666 5.582 -2.369) 18.678 20.679 ( -1.684 -0.316 1.991) 2.627 20.724 ( -1.238 -1.354 0.620) 1.936 ======================= Grid point 135 (67/170) ======================= q-point: ( 0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( 0.013 -4.525 4.279) 6.228 1.329 ( 10.153 -0.871 4.857) 11.288 1.528 ( 9.060 4.623 0.808) 10.203 1.684 ( -6.672 1.460 5.685) 8.886 1.750 ( -2.495 5.367 -1.920) 6.222 1.908 ( 2.987 -2.837 -0.335) 4.133 2.008 ( 4.199 -2.432 1.691) 5.139 2.106 ( -3.903 -3.620 -1.343) 5.490 2.355 ( 0.578 6.419 -5.154) 8.253 2.423 ( -2.292 -1.792 2.050) 3.559 2.523 ( 1.939 -6.967 -3.290) 7.945 2.649 ( 3.254 -10.689 -4.183) 11.930 2.828 ( -9.097 5.238 -1.891) 10.666 3.164 ( -6.736 -0.779 -2.781) 7.329 3.292 ( -4.427 -1.684 9.564) 10.672 3.540 ( -7.269 -4.351 -0.718) 8.502 3.908 ( 2.679 9.810 -1.058) 10.224 3.982 ( -0.718 4.491 12.092) 12.919 4.269 ( -5.615 4.061 -3.502) 7.764 4.336 ( -9.422 -4.422 -1.863) 10.574 4.399 ( 6.154 10.645 -0.075) 12.296 4.594 ( 3.015 1.053 -0.497) 3.231 4.852 ( 3.278 1.698 3.307) 4.956 4.941 ( -0.417 -5.038 1.949) 5.418 4.997 ( -2.761 -3.292 -2.348) 4.897 5.077 ( 4.295 -4.176 -5.270) 7.979 5.327 ( -5.055 -4.025 0.680) 6.497 5.712 ( -4.193 -8.796 -3.369) 10.311 6.397 ( 6.944 10.528 -1.579) 12.710 6.819 ( 9.174 -3.442 -5.347) 11.163 7.247 ( 5.786 12.043 2.146) 13.532 7.526 ( 3.343 5.819 5.382) 8.602 8.036 ( -0.836 1.890 2.803) 3.482 8.379 ( -7.018 -7.460 0.601) 10.260 8.554 ( 3.828 -0.004 -1.282) 4.037 8.756 ( -1.292 -2.804 0.539) 3.133 9.756 ( -1.637 1.514 0.143) 2.235 10.045 ( 1.657 -1.649 -3.233) 3.989 10.115 ( -4.001 -5.671 -1.590) 7.120 10.340 ( 2.344 -5.169 -0.703) 5.719 10.905 ( 0.730 0.981 12.574) 12.633 11.176 ( -1.911 2.059 6.702) 7.267 11.379 ( -2.679 -3.081 9.753) 10.574 11.415 ( -6.060 7.386 -3.903) 10.320 11.555 ( -6.724 -0.500 -4.415) 8.059 11.824 ( -1.983 -3.065 0.871) 3.753 11.893 ( -10.064 0.601 5.304) 11.392 12.212 ( -3.158 -8.624 0.567) 9.202 12.933 ( -0.261 2.957 -10.720) 11.123 13.287 ( 0.784 -6.739 -28.046) 28.855 13.379 ( 4.067 2.753 7.743) 9.170 13.772 ( -1.497 -6.362 8.554) 10.765 14.977 ( 26.914 33.176 -10.950) 44.101 15.138 ( 17.102 17.219 9.069) 25.908 16.440 ( 16.748 -5.936 3.413) 18.093 17.001 ( 10.571 0.989 -4.527) 11.542 18.057 ( -17.786 0.078 -6.271) 18.859 18.410 ( -15.846 -6.033 8.452) 18.945 20.656 ( -2.118 -1.122 -0.018) 2.397 20.712 ( -1.706 -2.252 1.109) 3.035 ======================= Grid point 136 (68/170) ======================= q-point: ( 0.36 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( -2.432 3.348 -1.469) 4.391 1.497 ( 7.090 0.705 -1.210) 7.227 1.585 ( -5.877 8.313 0.746) 10.208 1.638 ( 4.238 3.655 -2.509) 6.133 1.809 ( 3.636 -5.852 8.057) 10.601 1.912 ( -1.900 -0.790 -0.385) 2.093 2.010 ( -2.052 -0.925 -1.213) 2.557 2.119 ( 5.327 -0.830 -0.564) 5.421 2.303 ( 1.888 2.348 -7.453) 8.039 2.448 ( 0.635 2.208 2.731) 3.569 2.579 ( 4.462 -1.315 2.002) 5.064 2.688 ( 6.966 -9.847 -2.732) 12.368 2.721 ( -2.005 -2.080 0.816) 3.002 3.046 ( -5.238 -1.870 0.415) 5.577 3.250 ( -11.020 -11.410 1.816) 15.967 3.388 ( -8.110 -3.784 -1.927) 9.154 3.924 ( -0.257 3.028 1.822) 3.544 3.962 ( -9.300 -0.085 0.112) 9.301 4.157 ( -5.145 -0.479 -2.597) 5.783 4.265 ( -0.612 -0.133 3.697) 3.750 4.477 ( 4.797 10.282 -1.195) 11.409 4.626 ( 2.014 5.986 -1.007) 6.396 4.880 ( 0.546 -1.935 2.264) 3.028 4.965 ( -1.633 -8.407 3.206) 9.145 5.028 ( 4.206 3.906 0.457) 5.758 5.121 ( 6.058 5.708 -1.997) 8.559 5.256 ( -5.232 -6.082 2.203) 8.320 5.611 ( -4.203 -6.015 -2.141) 7.643 6.463 ( 4.533 11.798 -3.075) 13.008 6.885 ( 6.921 -2.185 -5.911) 9.360 7.362 ( 5.663 11.123 1.258) 12.545 7.609 ( -0.411 6.019 4.828) 7.727 8.055 ( 1.856 -1.727 -0.465) 2.578 8.277 ( -6.336 -6.568 0.690) 9.153 8.620 ( 2.293 -1.284 3.313) 4.229 8.750 ( -2.016 -3.269 3.210) 5.006 9.746 ( -0.040 -1.152 -0.237) 1.177 9.973 ( -0.771 -2.834 -8.001) 8.523 10.073 ( -0.849 -1.713 0.252) 1.928 10.353 ( 0.589 -4.533 -1.322) 4.758 11.020 ( -0.598 2.415 3.993) 4.704 11.125 ( -3.820 2.365 -5.024) 6.740 11.305 ( 0.303 5.532 -6.592) 8.611 11.325 ( -3.911 0.407 -7.556) 8.518 11.533 ( -2.715 -5.271 9.804) 11.458 11.796 ( -10.717 -3.288 8.171) 13.872 11.840 ( -0.628 -4.267 4.067) 5.928 12.179 ( -0.839 -6.631 -0.905) 6.745 12.883 ( 1.543 -1.529 0.338) 2.199 13.035 ( 2.049 -3.295 -11.860) 12.478 13.540 ( 1.817 0.631 9.377) 9.572 13.861 ( -3.121 -6.734 11.679) 13.838 15.318 ( 28.836 38.644 -11.162) 49.492 15.487 ( 16.000 25.904 4.425) 30.767 16.649 ( 7.668 4.159 -2.966) 9.214 17.055 ( -4.446 18.167 5.103) 19.387 17.721 ( -9.470 -13.484 -10.613) 19.599 18.277 ( -10.711 -21.564 5.460) 24.689 20.622 ( -1.265 -1.678 -0.847) 2.266 20.689 ( -1.975 -3.305 0.303) 3.862 ======================= Grid point 137 (69/170) ======================= q-point: ( 0.45 0.33 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 0.322 10.899 -0.335) 10.909 1.516 ( -1.144 4.843 -1.915) 5.332 1.545 ( 0.490 -2.553 -3.729) 4.545 1.647 ( -0.175 5.112 -0.813) 5.179 1.844 ( -4.004 -3.215 0.546) 5.163 1.938 ( 1.827 2.030 -0.406) 2.761 1.996 ( 1.601 -3.111 1.375) 3.759 2.167 ( 2.254 2.740 -2.735) 4.480 2.310 ( 4.804 1.393 -0.716) 5.053 2.445 ( -1.235 2.462 -1.529) 3.151 2.648 ( 2.443 -0.486 -1.985) 3.185 2.758 ( 1.717 -4.751 2.900) 5.825 2.814 ( 6.866 -5.664 1.390) 9.008 3.028 ( -13.100 -11.005 -1.789) 17.202 3.045 ( 2.831 -8.806 3.606) 9.928 3.247 ( -4.353 -7.155 -1.476) 8.504 3.790 ( -6.710 -5.626 -0.928) 8.805 4.001 ( -2.451 -3.798 5.051) 6.778 4.046 ( 1.975 5.871 -6.280) 8.821 4.253 ( -4.134 1.140 -0.867) 4.375 4.534 ( 4.158 6.677 -1.609) 8.029 4.653 ( 0.588 7.727 2.641) 8.187 4.912 ( 0.620 -3.737 -0.900) 3.894 5.004 ( -0.449 -1.433 6.873) 7.035 5.049 ( -0.929 -0.124 -0.112) 0.944 5.196 ( 3.481 8.055 -1.047) 8.837 5.235 ( -2.032 -1.773 5.455) 6.085 5.555 ( -0.534 -6.392 0.433) 6.429 6.482 ( 2.563 12.630 -3.765) 13.426 6.916 ( 4.826 -1.209 -6.145) 7.906 7.446 ( 3.563 10.084 0.348) 10.700 7.609 ( -4.657 7.613 2.935) 9.394 8.095 ( 4.174 -5.012 -0.754) 6.566 8.184 ( -6.061 -5.458 0.119) 8.157 8.689 ( 0.874 -1.314 4.656) 4.916 8.757 ( -3.024 -3.885 5.553) 7.422 9.730 ( -0.450 -1.127 -2.352) 2.646 9.896 ( 2.036 -1.127 -7.010) 7.386 10.086 ( 0.730 -1.557 1.423) 2.232 10.336 ( 0.730 -4.811 -2.869) 5.649 10.882 ( -4.641 -1.611 -20.442) 21.024 11.009 ( 0.836 3.114 -4.379) 5.438 11.244 ( -0.537 6.771 -3.036) 7.440 11.279 ( 2.054 -6.927 -7.194) 10.196 11.571 ( -3.025 -1.479 6.516) 7.334 11.728 ( -6.985 -6.853 5.730) 11.339 11.838 ( -2.155 -2.508 1.122) 3.492 12.166 ( 0.173 -5.821 -0.955) 5.902 12.929 ( 3.426 1.851 6.564) 7.632 13.230 ( 9.218 -4.582 22.375) 24.629 13.626 ( -3.308 -0.062 8.618) 9.232 13.897 ( -6.702 -5.542 9.522) 12.896 15.605 ( 16.088 39.880 -8.879) 43.909 15.692 ( 8.993 33.501 -4.343) 34.957 16.684 ( 5.287 13.876 -3.527) 15.262 16.909 ( -17.853 23.572 1.877) 29.629 17.628 ( 6.725 -25.182 -2.631) 26.197 18.161 ( -6.923 -28.974 -1.733) 29.840 20.603 ( 0.164 -2.174 -0.892) 2.356 20.658 ( -1.364 -3.705 -0.844) 4.037 ======================= Grid point 138 (70/170) ======================= q-point: (-0.45 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( 0.752 8.577 2.768) 9.044 1.462 ( -3.691 -0.928 -2.773) 4.708 1.482 ( 1.929 -1.994 -7.329) 7.837 1.620 ( -2.284 9.603 -0.587) 9.888 1.778 ( -4.855 7.297 -3.442) 9.416 1.895 ( -1.899 -7.467 -0.521) 7.722 2.062 ( 0.789 -4.701 1.707) 5.063 2.141 ( 0.678 1.240 -2.920) 3.244 2.380 ( 2.822 2.294 -3.508) 5.053 2.443 ( 2.968 3.746 2.849) 5.564 2.569 ( -5.685 5.401 -2.229) 8.153 2.772 ( -4.924 -10.275 -1.880) 11.548 2.866 ( -3.013 -9.313 4.796) 10.900 2.926 ( 6.287 -2.781 0.741) 6.915 3.164 ( 4.572 -10.456 2.225) 11.626 3.295 ( 7.811 -10.117 0.608) 12.796 3.733 ( 1.536 -5.461 -1.590) 5.891 3.910 ( -4.748 -1.867 -3.836) 6.383 4.120 ( 4.133 6.489 2.104) 7.976 4.160 ( -2.098 1.795 -2.072) 3.453 4.575 ( 2.715 1.403 -2.056) 3.683 4.684 ( -3.377 6.774 5.430) 9.315 4.884 ( 2.001 -3.323 -5.161) 6.456 5.020 ( -6.558 5.642 4.130) 9.586 5.053 ( -1.760 -1.361 5.060) 5.527 5.223 ( 2.070 3.626 1.238) 4.355 5.275 ( -0.648 2.320 3.878) 4.565 5.613 ( 4.606 -9.029 2.830) 10.524 6.468 ( 0.502 12.617 -3.487) 13.100 6.898 ( 2.151 -0.653 -8.148) 8.453 7.484 ( 0.564 9.059 0.516) 9.091 7.536 ( -7.221 9.610 2.177) 12.216 8.078 ( -6.184 -3.549 -1.301) 7.248 8.173 ( 5.606 -7.307 0.256) 9.213 8.750 ( -0.181 -0.793 5.393) 5.454 8.772 ( -2.969 -3.720 6.600) 8.138 9.693 ( 0.090 1.838 -2.810) 3.359 9.884 ( 4.513 -0.655 -6.312) 7.787 10.089 ( 0.061 -1.142 -2.638) 2.876 10.340 ( 2.337 -6.224 -1.380) 6.790 10.624 ( 0.181 -4.497 -17.308) 17.883 10.944 ( -1.684 -4.367 -10.840) 11.807 11.188 ( 0.776 -7.194 -8.250) 10.974 11.237 ( 4.232 5.784 -3.677) 8.056 11.584 ( -2.175 2.654 4.460) 5.627 11.718 ( -0.531 -8.558 4.380) 9.628 11.847 ( -0.383 1.073 4.461) 4.604 12.151 ( 0.105 -6.836 -2.364) 7.234 13.139 ( 4.456 6.594 16.457) 18.280 13.595 ( -7.266 3.372 9.099) 12.123 13.699 ( 8.086 -9.502 26.610) 29.390 13.872 ( -7.978 -2.569 10.541) 13.467 15.489 ( -12.815 30.554 -9.939) 34.592 15.745 ( -0.021 39.646 -6.712) 40.210 16.606 ( -10.235 11.357 -6.822) 16.741 16.849 ( 12.887 22.273 0.943) 25.750 17.796 ( 11.638 -19.725 3.711) 23.201 18.005 ( -5.641 -30.670 -8.086) 32.215 20.605 ( 0.646 -2.356 -0.723) 2.548 20.634 ( 0.537 -3.212 -1.703) 3.675 ======================= Grid point 139 (71/170) ======================= q-point: (-0.36 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( -7.905 -4.931 -0.273) 9.321 1.323 ( -9.097 -3.518 -4.450) 10.721 1.438 ( -0.980 4.961 -7.679) 9.194 1.535 ( -4.178 6.466 -3.856) 8.610 1.675 ( -0.382 9.032 -3.107) 9.560 1.884 ( -1.033 -4.044 -0.588) 4.215 2.023 ( -0.469 -6.508 -1.924) 6.803 2.194 ( 2.969 -0.579 3.596) 4.699 2.397 ( 0.068 4.856 0.032) 4.856 2.426 ( -0.942 5.106 1.489) 5.401 2.634 ( 7.244 4.377 3.648) 9.217 2.687 ( 0.041 -7.487 -2.477) 7.886 2.897 ( 0.549 -3.881 1.819) 4.321 3.039 ( 3.144 -8.077 2.383) 8.989 3.212 ( 0.890 -9.321 0.818) 9.399 3.410 ( 8.310 -10.874 -3.511) 14.129 3.658 ( -8.619 8.447 -7.066) 13.985 3.910 ( 8.699 -1.623 2.827) 9.290 4.178 ( 2.339 5.069 0.741) 5.632 4.221 ( 7.074 -2.127 1.426) 7.523 4.528 ( -4.862 -0.414 -2.501) 5.483 4.688 ( -1.654 -0.300 5.084) 5.355 4.861 ( -3.940 11.626 -6.050) 13.685 4.949 ( 0.662 -0.995 2.710) 2.962 5.093 ( -3.032 -3.243 7.916) 9.076 5.249 ( -2.276 0.264 0.680) 2.390 5.320 ( 3.071 1.708 3.163) 4.728 5.725 ( 5.339 -10.812 1.653) 12.171 6.422 ( -2.147 11.591 -2.514) 12.053 6.802 ( -1.260 -0.117 -10.764) 10.838 7.440 ( -7.306 11.384 2.610) 13.776 7.480 ( -3.055 7.741 2.252) 8.622 7.964 ( -5.217 -0.450 -2.218) 5.687 8.270 ( 5.648 -8.775 0.446) 10.445 8.787 ( -2.463 0.241 6.915) 7.345 8.828 ( 0.526 -2.573 6.484) 6.995 9.685 ( 1.407 3.752 -1.210) 4.186 9.865 ( 3.110 4.182 -9.117) 10.501 10.085 ( 3.366 -5.958 -0.934) 6.907 10.304 ( 0.695 -4.750 -11.191) 12.177 10.577 ( 4.007 -9.411 1.100) 10.287 10.712 ( -5.381 -12.975 -17.113) 22.140 11.194 ( 6.563 1.600 -3.087) 7.427 11.290 ( 6.174 4.545 -2.888) 8.192 11.609 ( 0.062 5.340 3.104) 6.177 11.794 ( 3.523 -6.192 4.506) 8.429 11.914 ( 2.225 -0.558 5.035) 5.533 12.127 ( 1.296 -9.154 -3.143) 9.765 13.307 ( -6.562 9.732 11.911) 16.722 13.467 ( -11.353 2.127 1.239) 11.617 13.920 ( -1.047 0.550 16.709) 16.750 14.165 ( 7.425 -7.136 28.643) 30.438 15.090 ( -19.384 22.685 -13.400) 32.710 15.519 ( -18.822 32.165 -2.635) 37.360 16.410 ( -5.392 3.602 -8.722) 10.869 17.083 ( 10.451 25.365 3.278) 27.629 17.807 ( -1.096 -25.938 -15.009) 29.988 18.083 ( 16.210 -14.981 6.356) 22.970 20.597 ( 0.456 -1.496 -1.815) 2.396 20.648 ( 2.348 -2.633 -0.764) 3.610 ======================= Grid point 140 (72/170) ======================= q-point: (-0.27 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.030 ( -7.407 -12.434 2.028) 14.615 1.092 ( -8.673 -2.914 -5.177) 10.512 1.344 ( -2.286 8.306 -2.950) 9.106 1.461 ( -1.519 3.322 -3.553) 5.096 1.608 ( -1.499 4.252 -6.217) 7.680 1.861 ( 1.391 -2.278 -0.579) 2.731 2.040 ( 2.747 -5.362 -2.210) 6.418 2.243 ( -4.439 -0.791 6.596) 7.990 2.407 ( 2.963 7.385 -0.228) 7.960 2.501 ( 2.641 0.574 3.788) 4.653 2.709 ( 6.128 1.502 -0.189) 6.312 2.762 ( 4.363 2.794 -1.464) 5.384 2.943 ( 2.195 -1.692 2.050) 3.447 3.027 ( -3.068 -7.634 -0.816) 8.268 3.249 ( 2.708 -8.688 -1.045) 9.160 3.416 ( -5.139 15.664 -8.522) 18.558 3.551 ( 5.516 -7.967 4.233) 10.575 4.098 ( 7.006 0.270 4.457) 8.308 4.152 ( -2.472 9.559 -5.426) 11.266 4.371 ( 7.676 -5.684 1.219) 9.628 4.470 ( -1.458 -4.346 2.583) 5.262 4.697 ( -6.218 10.525 -3.416) 12.693 4.718 ( -1.663 -1.477 4.273) 4.817 5.038 ( 5.115 -2.702 0.994) 5.870 5.105 ( -3.564 -0.619 3.781) 5.233 5.194 ( -3.121 -5.934 -0.315) 6.712 5.431 ( 5.802 0.403 4.081) 7.105 5.797 ( 3.575 -11.977 -2.483) 12.743 6.347 ( -4.656 9.171 -1.006) 10.335 6.640 ( -3.809 0.951 -10.677) 11.376 7.357 ( -7.074 11.378 3.325) 13.804 7.432 ( -6.663 7.174 3.125) 10.277 7.877 ( -2.472 3.628 -1.778) 4.736 8.359 ( 4.921 -9.468 0.293) 10.674 8.834 ( -0.620 3.507 6.087) 7.052 8.918 ( 1.023 -3.417 7.495) 8.301 9.690 ( 1.529 4.150 -3.715) 5.776 9.838 ( 2.140 5.652 -1.087) 6.140 10.128 ( -0.408 -6.106 -8.054) 10.116 10.195 ( 4.386 -5.137 -4.858) 8.320 10.461 ( -2.934 -10.915 -14.337) 18.257 10.699 ( 3.271 -12.125 7.644) 14.702 11.305 ( 9.513 2.468 -1.624) 9.962 11.367 ( 7.465 5.542 -2.733) 9.691 11.640 ( 0.225 6.744 1.754) 6.972 11.923 ( 6.213 -2.826 4.909) 8.408 11.996 ( 2.334 -5.112 1.066) 5.720 12.163 ( 6.576 -8.455 -0.380) 10.718 13.137 ( -17.457 12.545 -0.828) 21.513 13.353 ( -10.084 0.087 7.877) 12.796 14.126 ( 3.017 3.902 11.416) 12.435 14.523 ( 2.472 -3.052 17.843) 18.271 14.619 ( -18.773 15.595 -10.640) 26.624 15.182 ( -19.408 19.596 1.052) 27.600 16.197 ( -11.952 -2.339 -5.148) 13.222 17.138 ( -8.840 2.441 0.154) 9.172 17.738 ( 14.284 0.667 -12.832) 19.213 18.455 ( 21.064 -10.778 5.802) 24.362 20.588 ( 1.010 0.095 -1.760) 2.031 20.682 ( 2.257 -2.324 -0.120) 3.242 ======================= Grid point 141 (73/170) ======================= q-point: (-0.18 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( -1.672 0.493 0.135) 1.749 1.029 ( 0.583 -10.961 8.825) 14.084 1.279 ( -3.458 3.378 -1.407) 5.035 1.417 ( 2.115 -0.756 -6.350) 6.736 1.575 ( 4.640 5.617 2.269) 7.631 1.891 ( 2.005 -5.010 -2.830) 6.093 2.047 ( 0.137 -3.287 0.487) 3.326 2.249 ( -1.644 1.789 5.146) 5.691 2.406 ( -1.147 3.505 -3.667) 5.200 2.551 ( 2.067 0.870 -3.056) 3.790 2.752 ( -2.076 6.895 0.642) 7.230 2.864 ( 7.415 3.368 1.229) 8.236 2.934 ( -0.752 -0.092 3.985) 4.057 3.058 ( 4.619 -0.353 -1.574) 4.892 3.245 ( -0.299 -5.858 -3.871) 7.027 3.278 ( -2.791 16.103 -3.481) 16.710 3.700 ( 2.483 -6.932 7.549) 10.545 4.012 ( -5.868 12.873 -3.319) 14.532 4.239 ( 4.953 -5.452 1.215) 7.466 4.374 ( -4.083 6.504 -3.604) 8.483 4.502 ( -0.336 -4.391 2.489) 5.059 4.642 ( -1.714 -0.756 2.259) 2.934 4.765 ( 3.297 -2.416 3.266) 5.232 5.057 ( -3.540 -0.624 -0.387) 3.615 5.085 ( 1.745 -3.033 -0.528) 3.539 5.220 ( 5.494 -9.456 0.396) 10.944 5.600 ( 9.543 -2.685 4.227) 10.777 5.772 ( -0.711 -10.767 -6.479) 12.586 6.258 ( -4.879 5.007 -0.955) 7.056 6.467 ( -5.340 1.481 -7.171) 9.063 7.277 ( -8.321 10.362 4.240) 13.950 7.340 ( -7.127 8.361 1.770) 11.128 7.850 ( 0.024 7.221 0.007) 7.221 8.440 ( 4.423 -9.732 0.848) 10.723 8.886 ( 0.127 4.325 3.547) 5.595 9.013 ( 1.438 -3.465 5.532) 6.684 9.659 ( 0.201 2.757 -3.530) 4.484 9.901 ( 2.332 4.619 4.019) 6.552 9.952 ( -4.636 -1.680 -10.196) 11.326 10.274 ( 4.882 -4.866 -0.354) 6.902 10.332 ( 0.575 -7.208 -5.045) 8.816 10.825 ( 0.915 -11.481 8.654) 14.406 11.425 ( 6.459 3.623 -0.518) 7.424 11.501 ( 12.297 5.684 -2.478) 13.772 11.667 ( 0.962 6.382 2.883) 7.069 12.000 ( 2.510 -9.596 -3.269) 10.443 12.119 ( 8.536 -1.985 5.714) 10.462 12.284 ( 6.338 -2.379 0.076) 6.770 12.823 ( -17.924 11.699 -2.903) 21.601 13.309 ( -6.154 -3.305 10.045) 12.235 13.973 ( -16.151 15.820 -17.938) 28.860 14.411 ( 0.330 5.252 2.263) 5.728 14.654 ( -5.741 6.556 4.905) 10.000 14.996 ( -9.873 0.398 9.640) 13.804 15.934 ( -15.224 -7.100 -1.466) 16.863 16.875 ( -15.376 -17.073 -6.837) 23.972 17.929 ( 17.091 22.083 -3.191) 28.106 18.855 ( 20.573 -10.548 3.937) 23.452 20.592 ( 1.064 1.400 -0.633) 1.868 20.715 ( 1.667 -2.027 0.365) 2.649 ======================= Grid point 142 (74/170) ======================= q-point: (-0.09 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( 0.773 10.949 0.438) 10.985 1.176 ( -4.265 -0.727 9.969) 10.867 1.220 ( 0.569 -11.802 3.463) 12.313 1.402 ( 6.806 -3.921 -5.923) 9.838 1.794 ( 2.712 -5.526 3.320) 6.994 1.878 ( 8.278 -1.265 2.003) 8.610 2.050 ( -2.949 0.061 3.663) 4.703 2.278 ( -0.781 -1.715 -0.043) 1.885 2.321 ( -1.306 8.534 -3.615) 9.360 2.502 ( 1.185 0.346 -8.461) 8.551 2.748 ( -3.100 10.597 5.405) 12.293 2.888 ( 1.441 -4.036 -5.126) 6.681 3.056 ( -1.576 6.759 8.188) 10.733 3.112 ( 4.082 1.947 0.766) 4.587 3.195 ( 4.824 6.553 -4.820) 9.458 3.261 ( 1.671 5.499 2.066) 6.108 3.742 ( -7.988 0.860 7.629) 11.079 3.913 ( -2.735 12.627 -1.504) 13.007 4.263 ( 0.611 -5.296 -4.382) 6.901 4.318 ( -0.667 3.061 1.303) 3.393 4.466 ( -4.144 0.747 2.039) 4.678 4.666 ( 0.319 -1.031 2.209) 2.458 4.813 ( -1.675 -4.426 0.077) 4.733 5.011 ( 0.846 -4.720 -2.858) 5.582 5.141 ( 3.536 -6.633 -0.043) 7.517 5.337 ( 9.126 -7.954 0.444) 12.114 5.649 ( -4.418 -7.792 -5.798) 10.670 5.817 ( 10.926 -7.262 1.708) 13.230 6.164 ( -3.546 3.946 -3.089) 6.140 6.326 ( -5.275 -0.466 -2.273) 5.763 7.177 ( -9.136 10.927 4.326) 14.886 7.270 ( -2.960 9.635 0.570) 10.095 7.869 ( 0.602 9.044 2.253) 9.340 8.514 ( 2.856 -10.017 1.558) 10.532 8.896 ( -1.101 3.149 -1.084) 3.508 9.045 ( -0.508 -2.878 -3.208) 4.340 9.630 ( 0.361 1.280 -1.491) 1.998 9.830 ( -1.478 0.476 -0.790) 1.742 9.970 ( 2.007 2.466 1.839) 3.673 10.324 ( 1.592 -3.540 -0.626) 3.932 10.375 ( 1.440 -1.630 9.739) 9.979 10.900 ( -2.727 -9.157 7.315) 12.033 11.512 ( 4.637 3.294 0.254) 5.693 11.653 ( 7.667 7.829 -2.450) 11.228 11.756 ( 3.186 3.723 7.156) 8.673 12.019 ( 6.333 -8.837 -4.431) 11.740 12.301 ( 4.826 -1.649 3.303) 6.076 12.343 ( 3.111 2.478 0.105) 3.979 12.520 ( -15.667 7.385 -1.945) 17.429 13.336 ( -2.400 -16.064 -7.695) 17.973 13.589 ( -7.332 28.614 2.863) 29.677 14.392 ( 0.321 5.188 -8.715) 10.148 14.559 ( -2.660 5.906 -6.014) 8.839 14.952 ( -10.824 -6.855 7.624) 14.909 15.711 ( -11.008 -9.694 1.003) 14.702 16.585 ( -7.708 -21.160 -9.203) 24.328 18.166 ( 10.580 26.005 4.314) 28.404 19.149 ( 12.058 -10.947 -0.767) 16.304 20.609 ( 0.740 2.006 1.015) 2.367 20.740 ( 0.716 -1.736 0.537) 1.953 ======================= Grid point 143 (75/170) ======================= q-point: ( 0.00 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( -9.610 -2.709 6.543) 11.937 1.041 ( -6.379 -8.729 6.844) 12.796 1.322 ( 8.366 6.647 8.731) 13.799 1.447 ( 9.395 -5.311 3.617) 11.382 1.832 ( -4.159 11.660 -3.829) 12.958 1.972 ( -2.226 -1.226 1.101) 2.769 1.974 ( 0.640 -1.530 2.300) 2.835 2.073 ( -2.730 -10.896 -5.765) 12.626 2.426 ( 2.060 1.062 -9.465) 9.744 2.445 ( 2.461 -0.237 -6.554) 7.005 2.701 ( -1.428 -0.402 -7.122) 7.275 2.740 ( -1.453 -3.879 -6.748) 7.918 3.143 ( -1.248 0.258 10.736) 10.812 3.152 ( -1.436 -0.830 9.916) 10.053 3.593 ( 2.901 11.043 5.598) 12.716 3.699 ( -5.925 5.744 7.662) 11.260 3.801 ( 5.612 17.750 4.686) 19.197 4.051 ( 2.857 -2.107 1.612) 3.899 4.245 ( 0.433 5.638 -0.517) 5.678 4.369 ( 2.347 -2.550 2.794) 4.452 4.493 ( -3.156 5.851 2.496) 7.101 4.628 ( -3.491 -5.224 0.109) 6.284 4.662 ( -0.430 -0.445 -1.431) 1.559 4.792 ( -0.331 -11.416 -3.574) 11.967 5.065 ( -0.587 -0.694 -4.205) 4.303 5.162 ( -1.772 -10.809 -4.964) 12.025 5.625 ( 4.201 2.980 -1.752) 5.441 5.715 ( -1.061 -5.770 -3.979) 7.089 6.221 ( 1.942 1.724 -0.001) 2.597 6.250 ( 4.238 -1.271 -0.384) 4.441 7.300 ( -2.961 7.154 2.446) 8.120 7.359 ( -1.111 1.203 1.524) 2.237 8.112 ( -0.389 11.322 3.947) 11.997 8.338 ( -0.721 -11.839 3.139) 12.270 8.868 ( -2.007 1.817 -7.966) 8.413 8.900 ( -2.478 -1.694 -7.807) 8.364 9.718 ( 3.443 3.497 3.127) 5.819 9.806 ( 3.154 -5.144 3.014) 6.745 10.081 ( 0.576 6.271 -0.391) 6.309 10.211 ( 0.498 -6.691 -0.953) 6.777 10.630 ( -2.206 5.871 16.218) 17.389 10.758 ( -5.005 -7.232 10.869) 13.982 11.637 ( 0.966 3.591 1.695) 4.087 11.695 ( -3.963 -0.904 -1.879) 4.478 11.862 ( 1.166 0.798 3.412) 3.693 11.953 ( 0.126 -8.393 -0.576) 8.413 12.358 ( -0.591 4.404 -0.259) 4.451 12.392 ( -1.841 1.727 -2.223) 3.364 12.653 ( 5.846 13.011 0.421) 14.270 12.919 ( 1.992 -13.115 -7.111) 15.051 14.179 ( 1.282 21.870 7.851) 23.271 14.329 ( -5.069 4.464 -17.607) 18.858 14.440 ( -0.646 -2.198 -10.113) 10.369 14.634 ( -3.617 -15.213 5.799) 16.678 15.639 ( 2.580 12.873 -4.202) 13.785 16.026 ( 5.239 -23.823 -7.677) 25.572 18.736 ( -0.177 17.275 5.865) 18.244 19.014 ( -0.712 -11.778 0.928) 11.836 20.675 ( 0.178 2.104 1.475) 2.576 20.715 ( -0.094 -1.968 0.763) 2.113 ======================= Grid point 144 (76/170) ======================= q-point: ( 0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -5.928 -1.008 10.813) 12.373 1.016 ( -6.261 -8.259 8.855) 13.632 1.551 ( 6.183 5.002 8.833) 11.886 1.604 ( 4.883 1.148 3.756) 6.267 1.717 ( -4.383 8.621 -1.609) 9.804 1.929 ( -4.902 -9.143 -5.030) 11.529 1.974 ( -0.364 -1.518 2.044) 2.572 1.999 ( 1.621 -3.240 -1.195) 3.815 2.358 ( 1.782 1.263 -7.921) 8.216 2.411 ( 1.699 -4.537 -6.219) 7.883 2.614 ( 2.376 -0.775 -10.311) 10.610 2.656 ( 0.940 -4.209 -8.780) 9.782 3.194 ( -7.228 2.576 11.326) 13.681 3.217 ( -5.040 -0.452 10.601) 11.747 3.595 ( -8.746 9.952 5.376) 14.298 3.688 ( -6.334 0.612 5.976) 8.730 3.936 ( 1.308 20.855 8.496) 22.557 4.172 ( 4.159 -5.069 2.486) 7.012 4.218 ( 1.639 10.324 -1.267) 10.530 4.422 ( -1.331 -6.738 1.130) 6.961 4.499 ( -0.911 3.486 2.154) 4.198 4.562 ( -0.986 -0.575 0.111) 1.147 4.669 ( 4.386 3.068 -3.136) 6.204 4.805 ( 7.197 -9.968 -2.211) 12.492 4.977 ( -4.359 -3.609 -5.612) 7.970 5.055 ( -4.224 -9.650 -3.589) 11.129 5.592 ( -6.398 0.511 -4.684) 7.946 5.640 ( 0.065 -5.045 -2.467) 5.616 6.300 ( 8.275 5.585 -0.302) 9.988 6.403 ( 12.044 -4.935 -0.141) 13.017 7.305 ( 0.493 8.053 2.094) 8.335 7.384 ( 1.756 0.035 2.115) 2.749 8.138 ( -2.847 9.925 5.648) 11.770 8.339 ( -3.855 -10.569 3.951) 11.924 8.728 ( -1.472 3.081 -10.795) 11.322 8.787 ( -1.073 -2.909 -7.390) 8.014 9.840 ( 5.351 2.602 5.094) 7.833 9.905 ( 3.902 -2.496 1.740) 4.948 10.074 ( -1.066 3.080 1.907) 3.776 10.179 ( -2.385 -5.929 -1.844) 6.652 10.763 ( -3.959 0.372 16.603) 17.073 10.785 ( -6.169 -2.241 13.110) 14.661 11.582 ( -6.152 3.828 -1.430) 7.385 11.662 ( -1.963 -2.999 1.212) 3.784 11.840 ( -4.042 3.350 0.806) 5.312 11.952 ( -0.581 -7.392 2.928) 7.972 12.197 ( -12.470 6.902 -4.454) 14.932 12.292 ( -7.499 -2.499 -4.814) 9.255 12.876 ( 13.239 7.035 5.897) 16.110 12.985 ( 8.684 -3.997 1.843) 9.736 14.003 ( -5.652 3.019 -25.159) 25.962 14.056 ( -6.033 -2.636 -21.398) 22.388 14.568 ( 13.989 12.658 12.020) 22.370 14.768 ( 11.538 -3.163 5.411) 13.131 15.741 ( 14.976 11.178 -3.551) 19.022 16.136 ( 18.258 -25.184 -8.083) 32.140 18.713 ( -11.301 13.503 6.947) 18.929 18.915 ( -12.204 -7.109 0.699) 14.141 20.688 ( -0.884 1.243 1.779) 2.344 20.714 ( -1.092 -1.395 0.782) 1.937 ======================= Grid point 145 (77/170) ======================= q-point: ( 0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( 0.556 -2.449 12.604) 12.852 1.059 ( 1.604 -4.368 8.511) 9.700 1.606 ( 1.350 11.166 -2.880) 11.610 1.722 ( 0.949 3.905 7.843) 8.813 1.753 ( 1.166 -3.404 3.775) 5.215 1.834 ( 1.132 -6.139 0.171) 6.245 1.954 ( -0.487 1.355 -3.441) 3.730 2.026 ( 0.025 -5.894 -0.608) 5.926 2.332 ( 2.123 0.687 -2.346) 3.238 2.387 ( 2.949 -5.344 -4.392) 7.519 2.549 ( 2.610 -1.904 -9.395) 9.935 2.566 ( 0.485 -2.048 -9.620) 9.847 3.143 ( -11.102 5.776 6.459) 14.083 3.216 ( -8.324 -1.934 9.022) 12.427 3.472 ( -11.523 9.570 3.236) 15.324 3.601 ( -9.814 -2.828 2.905) 10.618 4.013 ( -2.446 12.016 7.974) 14.627 4.102 ( -4.136 2.201 -3.046) 5.589 4.363 ( 3.190 0.286 3.956) 5.090 4.395 ( -3.173 -1.283 0.728) 3.499 4.492 ( -2.906 1.370 2.463) 4.048 4.527 ( 1.770 -0.665 0.749) 2.034 4.810 ( -0.591 -4.433 -5.814) 7.335 4.825 ( 7.699 6.152 0.369) 9.861 4.922 ( 5.592 -6.816 -4.494) 9.896 4.978 ( 1.278 -5.973 -1.374) 6.261 5.446 ( -5.508 4.332 -3.844) 7.992 5.588 ( -2.306 -9.971 -2.880) 10.631 6.449 ( 10.467 8.027 -1.488) 13.275 6.589 ( 12.005 -6.345 -2.399) 13.789 7.359 ( 3.073 8.597 2.514) 9.469 7.458 ( 3.471 -1.333 3.339) 4.997 8.138 ( -4.480 7.697 5.117) 10.271 8.301 ( -5.716 -9.014 3.394) 11.200 8.618 ( 0.470 4.356 -7.304) 8.517 8.711 ( -0.202 -4.733 -4.699) 6.672 9.900 ( -2.619 5.637 -1.985) 6.525 9.971 ( 4.216 -0.632 1.089) 4.400 10.104 ( -2.925 -3.214 0.282) 4.355 10.141 ( 3.344 -5.863 2.429) 7.173 10.832 ( -4.181 3.122 15.071) 15.949 10.917 ( -2.168 -5.274 19.176) 20.006 11.473 ( -5.800 5.088 -1.011) 7.781 11.596 ( -5.856 -7.097 -0.752) 9.232 11.798 ( -4.153 11.079 -0.513) 11.843 11.944 ( -9.667 5.714 -2.332) 11.469 11.980 ( -2.464 -5.114 3.508) 6.673 12.077 ( -11.658 -9.324 -3.208) 15.269 13.100 ( 7.506 5.563 -1.533) 9.468 13.165 ( 8.914 -1.031 2.320) 9.269 13.642 ( -4.800 2.124 -23.974) 24.542 13.718 ( -5.838 -5.614 -16.374) 18.268 14.989 ( 21.106 12.771 11.224) 27.103 15.094 ( 23.021 7.613 2.139) 24.341 16.018 ( 21.866 8.129 -2.102) 23.423 16.406 ( 24.958 -25.788 -8.335) 36.842 18.521 ( -20.895 9.909 5.539) 23.780 18.660 ( -20.234 -3.633 1.764) 20.633 20.681 ( -2.092 0.492 1.181) 2.452 20.698 ( -1.876 -1.236 0.810) 2.388 ======================= Grid point 146 (78/170) ======================= q-point: ( 0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.177 ( 4.962 1.491 7.100) 8.789 1.257 ( 9.714 -5.534 6.190) 12.779 1.634 ( 4.549 6.139 -1.214) 7.737 1.711 ( -1.258 0.002 -0.929) 1.564 1.850 ( -1.302 1.514 -1.437) 2.460 1.890 ( 2.613 4.766 3.910) 6.695 1.920 ( -0.120 -5.343 1.381) 5.520 2.010 ( 0.671 -6.213 1.130) 6.350 2.354 ( 3.205 0.195 -3.503) 4.752 2.394 ( 3.908 -3.396 -5.075) 7.250 2.496 ( 1.691 -0.581 -3.335) 3.784 2.512 ( 1.047 -2.657 -2.225) 3.621 2.992 ( -11.872 9.699 1.336) 15.389 3.147 ( -8.537 -4.863 3.575) 10.455 3.304 ( -12.656 6.727 1.884) 14.456 3.454 ( -10.750 -5.818 1.038) 12.267 4.017 ( -5.252 2.319 2.206) 6.151 4.042 ( -4.479 0.779 4.940) 6.714 4.287 ( -6.875 -0.584 -1.279) 7.017 4.291 ( -7.323 -0.663 -3.044) 7.959 4.597 ( 5.289 2.645 5.454) 8.044 4.626 ( 5.268 7.281 2.699) 9.383 4.728 ( -0.624 -4.070 1.245) 4.302 4.866 ( -0.632 -8.764 -4.502) 9.872 5.006 ( 9.068 4.856 -1.843) 10.450 5.068 ( 7.664 -1.215 -2.800) 8.249 5.337 ( -3.934 6.419 -1.735) 7.726 5.522 ( -2.332 -10.738 -1.628) 11.108 6.584 ( 9.110 8.720 -3.233) 13.019 6.727 ( 10.008 -6.068 -4.774) 12.640 7.451 ( 4.170 8.471 3.103) 9.939 7.557 ( 3.226 -2.262 4.470) 5.959 8.109 ( -3.725 5.347 2.126) 6.855 8.232 ( -5.910 -7.275 1.649) 9.518 8.589 ( 1.120 3.580 -0.768) 3.829 8.678 ( -0.619 -4.943 -0.349) 4.994 9.826 ( -2.757 5.505 -2.191) 6.535 9.950 ( -2.448 -6.853 -3.875) 8.245 10.107 ( 1.447 3.672 0.235) 3.954 10.214 ( 2.870 -6.822 -0.003) 7.402 10.973 ( -0.135 5.811 15.961) 16.986 11.112 ( 0.816 -7.697 17.404) 19.048 11.356 ( -6.597 4.130 -3.266) 8.441 11.468 ( -6.137 -6.459 -5.486) 10.463 11.649 ( -9.405 12.431 0.415) 15.593 11.850 ( -10.990 -6.096 0.435) 12.575 11.867 ( -3.182 5.453 2.785) 6.900 12.011 ( -0.449 -9.904 1.398) 10.012 13.022 ( -0.196 5.812 -17.156) 18.114 13.147 ( 0.662 -7.059 -22.930) 24.001 13.492 ( 1.171 7.449 6.195) 9.759 13.638 ( -0.423 -7.425 7.186) 10.341 15.464 ( 25.892 15.851 5.684) 30.886 15.535 ( 29.473 15.348 0.113) 33.230 16.356 ( 21.122 4.686 -1.598) 21.695 16.721 ( 24.056 -24.694 -8.073) 35.407 18.168 ( -27.285 9.360 2.012) 28.916 18.322 ( -24.947 -5.620 3.723) 25.842 20.648 ( -2.646 0.351 0.125) 2.672 20.670 ( -2.538 -1.848 0.584) 3.193 ======================= Grid point 147 (79/170) ======================= q-point: ( 0.36 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.307 ( 5.253 6.485 -0.175) 8.348 1.440 ( 8.715 -5.964 -2.043) 10.756 1.683 ( 1.603 1.416 -1.316) 2.511 1.716 ( -1.648 -1.868 2.142) 3.286 1.750 ( -2.494 6.464 0.408) 6.940 1.862 ( -1.258 -4.550 -3.126) 5.662 2.022 ( 1.623 2.564 3.923) 4.960 2.085 ( 6.279 -2.978 0.975) 7.017 2.356 ( 5.348 3.435 -5.295) 8.273 2.452 ( 6.874 -4.225 -0.489) 8.083 2.519 ( 2.135 -0.754 0.772) 2.392 2.573 ( 4.664 -3.087 3.633) 6.670 2.817 ( -9.468 9.746 -0.695) 13.605 3.016 ( -10.316 -8.489 -0.172) 13.361 3.117 ( -11.220 5.023 0.531) 12.305 3.278 ( -11.275 -7.938 -0.489) 13.798 3.914 ( -12.118 0.592 2.458) 12.379 3.963 ( -8.625 -3.304 2.866) 9.671 4.172 ( 0.660 3.020 -5.785) 6.559 4.234 ( 0.866 -2.794 -0.645) 2.996 4.676 ( 3.379 9.591 -2.786) 10.544 4.727 ( 1.580 4.810 6.078) 7.911 4.817 ( 1.038 -5.149 8.755) 10.210 4.829 ( 0.782 -5.614 -1.859) 5.965 5.072 ( 4.250 1.612 -3.603) 5.800 5.122 ( 2.492 -3.821 -2.609) 5.255 5.313 ( 1.357 9.359 1.517) 9.577 5.484 ( -1.530 -7.764 -0.048) 7.914 6.669 ( 6.718 9.234 -4.682) 12.342 6.812 ( 7.659 -5.542 -5.695) 11.037 7.546 ( 3.130 7.597 2.945) 8.728 7.643 ( 0.924 -2.152 4.664) 5.219 8.072 ( -1.708 3.136 -0.531) 3.610 8.158 ( -4.628 -5.514 0.462) 7.214 8.621 ( 0.206 1.625 3.991) 4.314 8.678 ( -1.496 -3.839 3.292) 5.274 9.776 ( -0.995 3.922 -1.593) 4.349 9.876 ( -1.481 -5.904 -3.099) 6.831 10.115 ( 1.437 4.856 -2.567) 5.678 10.233 ( 1.627 -6.908 -2.615) 7.564 11.105 ( -1.986 6.492 5.950) 9.027 11.188 ( -3.700 4.425 -9.102) 10.776 11.261 ( -1.616 -8.696 3.760) 9.611 11.281 ( -2.603 -4.477 -10.351) 11.575 11.569 ( -5.729 8.180 6.237) 11.775 11.716 ( -9.152 -6.021 4.296) 11.767 11.863 ( -1.410 5.649 3.108) 6.600 12.013 ( -0.487 -9.241 0.961) 9.304 12.899 ( 1.813 2.430 -4.303) 5.264 12.962 ( 2.472 -3.871 -7.864) 9.107 13.610 ( -0.384 5.683 10.565) 12.003 13.732 ( -2.029 -6.638 11.046) 13.046 15.931 ( 28.533 21.695 -1.193) 35.864 16.016 ( 29.662 22.324 -1.283) 37.146 16.619 ( 13.985 0.814 -3.853) 14.528 16.980 ( 17.541 -24.348 -6.844) 30.779 17.709 ( -30.272 11.745 0.210) 32.471 17.954 ( -24.844 -13.080 3.958) 28.355 20.606 ( -2.057 0.180 -0.554) 2.137 20.631 ( -2.394 -2.403 -0.099) 3.393 ======================= Grid point 148 (80/170) ======================= q-point: ( 0.45 0.44 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 5.874 9.311 -2.518) 11.294 1.499 ( 5.419 -3.735 -6.498) 9.248 1.590 ( -6.969 3.001 -5.078) 9.130 1.654 ( -3.890 -3.752 -1.007) 5.498 1.828 ( -0.434 2.195 7.460) 7.788 1.885 ( 4.901 -3.809 3.004) 6.896 2.043 ( -0.482 5.331 -2.453) 5.888 2.149 ( 2.493 -4.480 -3.916) 6.452 2.427 ( 5.664 8.836 -0.358) 10.501 2.538 ( -1.840 6.521 0.482) 6.793 2.580 ( 7.444 -6.124 -1.106) 9.703 2.678 ( -0.041 -7.417 1.937) 7.666 2.725 ( 0.877 1.368 1.327) 2.098 2.832 ( -9.459 -7.979 0.384) 12.381 3.002 ( -3.194 3.021 1.890) 4.785 3.114 ( -5.956 -7.074 -0.326) 9.253 3.749 ( -7.023 1.824 -1.569) 7.423 3.852 ( -5.699 -8.004 -0.741) 9.854 4.175 ( 3.526 5.213 -2.140) 6.647 4.244 ( 0.081 -2.014 -0.635) 2.113 4.683 ( 0.347 8.291 -2.806) 8.760 4.774 ( -0.383 5.291 3.600) 6.411 4.826 ( 0.634 -5.667 -2.371) 6.175 4.886 ( -3.666 -6.955 6.721) 10.343 5.110 ( 3.601 3.969 2.192) 5.790 5.179 ( 3.550 -2.953 4.098) 6.174 5.357 ( 1.098 6.714 0.489) 6.821 5.461 ( -1.370 -4.427 0.244) 4.641 6.702 ( 4.208 9.882 -5.340) 11.995 6.853 ( 5.111 -5.537 -5.997) 9.630 7.606 ( 0.506 6.384 2.619) 6.919 7.680 ( -2.454 -0.584 4.209) 4.907 8.050 ( 0.644 0.381 -1.563) 1.733 8.093 ( -3.275 -3.669 -0.787) 4.980 8.673 ( -0.823 -0.026 6.300) 6.354 8.696 ( -2.200 -2.341 5.482) 6.354 9.755 ( 0.163 3.494 -1.273) 3.722 9.841 ( 0.654 -4.537 -2.338) 5.146 10.113 ( 2.007 4.234 -2.580) 5.348 10.222 ( 1.888 -6.407 -4.123) 7.850 10.914 ( -5.035 4.732 -19.991) 21.151 11.036 ( -2.804 -4.837 -16.998) 17.894 11.166 ( 0.461 1.865 -2.341) 3.028 11.274 ( 0.673 -4.680 -3.128) 5.670 11.567 ( -3.195 2.858 6.036) 7.404 11.639 ( -5.704 -3.520 3.933) 7.772 11.882 ( -0.638 5.679 3.176) 6.538 12.022 ( -0.233 -8.140 0.847) 8.187 13.003 ( 5.737 5.315 12.635) 14.860 13.119 ( 7.801 -6.388 18.079) 20.701 13.682 ( -4.672 4.929 10.063) 12.140 13.789 ( -5.617 -5.708 10.613) 13.296 16.306 ( 11.837 29.895 -1.943) 32.211 16.371 ( 21.577 36.214 -11.517) 43.700 16.755 ( 14.884 -8.592 -5.254) 17.971 17.045 ( -8.543 -26.470 -10.943) 29.890 17.327 ( -8.066 11.888 6.511) 15.772 17.644 ( -17.618 -21.866 2.901) 28.230 20.576 ( -0.491 -0.302 -0.837) 1.016 20.597 ( -1.139 -2.355 -0.787) 2.732 ======================= Grid point 149 (81/170) ======================= q-point: (-0.45 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -10.887 6.254 -2.891) 12.884 1.430 ( -5.826 -1.600 -6.055) 8.554 1.487 ( 8.473 3.698 -3.688) 9.953 1.641 ( 4.512 -8.951 -1.798) 10.184 1.865 ( -4.147 6.632 0.846) 7.867 1.946 ( -3.167 6.629 -3.279) 8.045 1.982 ( -1.845 -2.351 2.980) 4.221 2.093 ( -1.000 -5.599 -3.302) 6.577 2.484 ( -3.121 4.840 0.377) 5.771 2.513 ( 5.041 5.232 2.031) 7.544 2.583 ( -4.889 -5.504 -1.791) 7.577 2.617 ( -2.002 -3.229 -0.839) 3.891 2.783 ( 1.806 0.363 3.245) 3.732 2.852 ( 7.032 -5.373 0.402) 8.859 3.050 ( 3.372 0.249 3.160) 4.628 3.132 ( 5.384 -6.887 0.661) 8.766 3.691 ( 3.243 1.767 -2.470) 4.443 3.795 ( 1.832 -7.766 -2.810) 8.459 4.210 ( -0.328 2.587 -1.249) 2.891 4.215 ( 0.805 2.243 -0.424) 2.421 4.631 ( -2.045 4.908 -3.053) 6.131 4.747 ( -4.624 -4.752 -4.139) 7.816 4.833 ( 0.527 3.142 6.105) 6.887 4.924 ( -1.240 -5.212 8.239) 9.828 5.208 ( 1.474 6.346 3.548) 7.418 5.262 ( 0.042 0.165 3.383) 3.388 5.344 ( -1.971 4.797 0.656) 5.228 5.463 ( 1.582 -7.034 0.755) 7.249 6.689 ( 1.326 10.004 -5.469) 11.478 6.841 ( 1.939 -5.473 -7.058) 9.139 7.619 ( -2.488 4.990 2.858) 6.266 7.656 ( -5.678 2.001 3.804) 7.121 8.034 ( -1.760 -0.594 -2.149) 2.840 8.064 ( 2.688 -3.683 -1.060) 4.681 8.725 ( -2.397 -0.644 7.770) 8.157 8.735 ( -0.628 -1.123 6.653) 6.776 9.753 ( 1.244 4.435 -0.975) 4.709 9.844 ( 3.052 -3.997 -2.591) 5.657 10.114 ( 0.864 3.777 -2.721) 4.735 10.217 ( 2.337 -6.292 -2.947) 7.330 10.617 ( -1.484 4.024 -22.519) 22.923 10.766 ( -3.681 -10.538 -21.663) 24.370 11.183 ( 4.373 4.289 -1.599) 6.331 11.274 ( 4.627 -2.922 -3.932) 6.739 11.598 ( -0.373 0.392 5.460) 5.487 11.627 ( -0.980 -1.593 4.277) 4.668 11.902 ( -0.359 4.263 1.855) 4.663 12.010 ( -0.736 -6.865 -1.614) 7.090 13.300 ( 5.648 9.656 20.276) 23.157 13.498 ( 6.170 -10.602 22.409) 25.546 13.692 ( -6.076 5.738 13.074) 15.516 13.798 ( -6.962 -4.902 12.606) 15.213 16.081 ( -20.496 29.282 -10.543) 37.265 16.464 ( -20.903 15.692 -7.825) 27.284 16.621 ( 3.416 8.257 -10.345) 13.670 17.137 ( 29.421 -3.812 -7.401) 30.576 17.420 ( -13.909 -17.768 3.654) 22.859 17.503 ( 14.335 -11.321 3.481) 18.595 20.572 ( 0.930 -0.725 -0.924) 1.498 20.583 ( 0.957 -1.820 -1.263) 2.413 ======================= Grid point 150 (82/170) ======================= q-point: (-0.36 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -13.931 2.070 -3.732) 14.570 1.220 ( -12.161 -6.390 -4.864) 14.573 1.553 ( 3.139 6.189 -5.040) 8.577 1.649 ( -1.703 0.400 -7.805) 7.999 1.718 ( -3.274 2.262 -2.281) 4.587 1.846 ( -5.084 -5.725 -5.486) 9.420 1.976 ( 0.247 6.100 3.782) 7.181 2.122 ( -0.225 -6.669 4.656) 8.137 2.475 ( -0.434 3.659 3.753) 5.259 2.528 ( -1.545 -0.682 0.719) 1.835 2.614 ( 4.678 3.798 3.126) 6.788 2.682 ( 8.037 -1.128 5.375) 9.734 2.842 ( 1.223 1.228 0.627) 1.843 2.927 ( 3.572 -5.825 -3.732) 7.785 3.122 ( 4.186 1.229 -0.593) 4.403 3.225 ( 7.555 -8.076 -3.100) 11.486 3.776 ( 7.183 4.296 -2.411) 8.710 3.860 ( 9.076 -3.921 -1.102) 9.948 4.182 ( 1.244 2.791 -0.336) 3.074 4.259 ( 2.045 -1.790 1.974) 3.359 4.540 ( -4.611 3.732 -5.250) 7.922 4.643 ( -3.173 -5.109 -0.561) 6.040 4.920 ( 0.563 3.072 7.985) 8.574 5.000 ( -1.702 -3.902 9.161) 10.102 5.136 ( -8.086 8.985 -2.794) 12.406 5.241 ( -5.531 -2.019 -0.819) 5.945 5.379 ( 2.928 4.932 3.153) 6.545 5.526 ( 3.771 -9.698 1.267) 10.482 6.625 ( -2.044 9.085 -5.322) 10.726 6.759 ( -1.664 -4.608 -8.242) 9.588 7.589 ( -5.763 3.529 2.886) 7.348 7.591 ( -6.887 3.521 4.556) 8.977 7.994 ( 0.021 3.915 -2.243) 4.512 8.109 ( 3.843 -7.566 -0.731) 8.518 8.785 ( -1.054 0.584 8.770) 8.852 8.806 ( 0.011 -1.054 7.316) 7.392 9.776 ( 2.977 5.687 -1.280) 6.546 9.883 ( 5.604 -4.104 -3.354) 7.713 10.066 ( -2.465 5.546 -3.277) 6.897 10.205 ( -1.307 -6.569 -3.636) 7.621 10.438 ( 4.269 -2.923 -12.717) 13.730 10.495 ( -0.844 -8.060 -19.159) 20.803 11.264 ( 7.701 4.633 -2.122) 9.234 11.332 ( 7.342 -1.109 -3.731) 8.310 11.674 ( 2.963 1.763 4.099) 5.356 11.710 ( 4.943 -2.103 5.071) 7.387 11.918 ( 0.489 0.765 1.677) 1.906 11.971 ( -0.867 -5.650 -2.416) 6.205 13.465 ( -7.761 5.946 10.025) 14.004 13.514 ( -11.888 0.969 3.200) 12.349 13.932 ( 3.147 1.884 22.211) 22.512 14.020 ( 7.133 -6.902 27.441) 29.181 15.564 ( -26.615 24.473 -11.811) 38.037 15.903 ( -30.971 -3.332 -7.654) 32.076 16.554 ( -5.275 22.950 -7.048) 24.581 17.149 ( -14.377 -30.468 -5.106) 34.074 17.579 ( 27.088 15.110 -2.461) 31.115 17.847 ( 22.905 -11.670 1.941) 25.780 20.581 ( 1.817 0.049 -1.362) 2.272 20.601 ( 2.503 -1.951 -0.964) 3.317 ======================= Grid point 151 (83/170) ======================= q-point: (-0.27 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.887 ( -11.474 -0.705 0.359) 11.501 0.983 ( -10.471 -8.054 -1.002) 13.248 1.466 ( -2.432 5.345 -9.585) 11.241 1.519 ( -3.128 1.275 -6.478) 7.305 1.690 ( -0.035 3.894 -0.120) 3.896 1.778 ( 1.849 -5.492 -1.286) 5.936 2.005 ( -0.342 3.795 1.089) 3.963 2.147 ( -2.206 -8.227 4.125) 9.464 2.534 ( 0.675 2.149 4.437) 4.976 2.540 ( 0.798 2.686 2.103) 3.504 2.774 ( 3.700 3.934 5.803) 7.928 2.824 ( 5.908 3.341 -1.725) 7.003 2.850 ( -2.717 -2.603 2.942) 4.776 2.941 ( 6.777 -4.411 -1.024) 8.150 3.185 ( 7.281 2.997 -5.115) 9.389 3.331 ( 10.876 -10.092 -3.722) 15.296 3.802 ( 0.126 17.492 -2.305) 17.644 4.024 ( 9.327 -5.353 0.023) 10.754 4.245 ( 4.620 -3.442 -1.039) 5.855 4.309 ( 0.412 -9.543 0.642) 9.574 4.427 ( -1.053 12.720 -0.291) 12.767 4.632 ( -0.234 -7.659 2.646) 8.107 4.933 ( -10.026 11.596 -3.986) 15.839 5.018 ( 0.557 0.769 6.741) 6.808 5.061 ( -2.842 -3.028 6.500) 7.713 5.102 ( -8.185 -5.378 -1.718) 9.943 5.462 ( 4.385 3.422 1.319) 5.717 5.584 ( 3.282 -9.300 -1.558) 9.984 6.512 ( -5.143 7.459 -4.628) 10.174 6.619 ( -4.603 -3.403 -7.755) 9.639 7.510 ( -7.948 4.305 4.160) 9.951 7.527 ( -6.955 2.330 3.386) 8.078 7.990 ( 1.817 7.964 -1.211) 8.258 8.168 ( 4.037 -9.967 -0.229) 10.756 8.876 ( 0.414 0.977 8.208) 8.277 8.888 ( 0.530 -0.359 6.718) 6.748 9.798 ( 2.141 6.992 -4.641) 8.661 9.924 ( 3.951 -1.457 -5.105) 6.618 10.007 ( -2.201 -0.699 -0.001) 2.309 10.103 ( -1.544 -5.963 -5.206) 8.064 10.349 ( 4.567 1.073 -11.360) 12.291 10.474 ( 5.248 -10.319 0.460) 11.586 11.376 ( 8.939 4.116 -2.122) 10.068 11.426 ( 9.117 -0.055 -3.050) 9.613 11.746 ( 1.473 4.633 0.916) 4.947 11.852 ( 3.854 -5.865 0.801) 7.063 11.937 ( 3.826 2.003 1.877) 4.709 12.026 ( 8.141 -5.845 3.132) 10.500 13.300 ( -15.390 5.295 -0.651) 16.288 13.360 ( -13.147 -0.878 4.745) 14.005 14.236 ( 5.194 7.403 17.144) 19.383 14.393 ( 5.461 -8.341 20.679) 22.957 15.011 ( -26.330 22.234 -9.734) 35.810 15.350 ( -28.318 -7.852 -4.986) 29.807 16.316 ( -15.014 19.673 -4.968) 25.242 16.817 ( -18.917 -26.954 -5.629) 33.407 17.979 ( 25.362 16.414 -2.473) 30.311 18.251 ( 24.472 -11.624 1.069) 27.113 20.601 ( 2.264 1.229 -1.193) 2.839 20.635 ( 2.654 -2.273 -0.574) 3.541 ======================= Grid point 152 (84/170) ======================= q-point: (-0.18 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( -1.494 -2.701 9.019) 9.532 0.929 ( -0.568 -9.902 7.402) 12.376 1.309 ( -4.450 4.665 -8.556) 10.713 1.401 ( -1.937 -2.809 -7.264) 8.026 1.738 ( 4.863 7.926 2.180) 9.551 1.841 ( 5.196 -2.364 0.228) 5.713 1.998 ( -1.613 2.653 1.288) 3.362 2.154 ( -1.591 -9.391 2.828) 9.935 2.531 ( -0.281 5.185 -3.763) 6.412 2.576 ( 1.132 0.343 -3.140) 3.356 2.784 ( -2.708 0.753 4.389) 5.212 2.831 ( -2.458 -3.952 5.512) 7.214 2.969 ( 4.705 3.060 2.541) 6.161 3.032 ( 3.905 -3.194 -2.100) 5.465 3.266 ( 11.199 9.972 -5.221) 15.878 3.498 ( 10.934 -11.011 0.730) 15.534 3.762 ( -3.327 23.706 0.753) 23.950 4.098 ( -0.223 -7.675 -1.606) 7.844 4.222 ( 0.465 3.079 -2.550) 4.024 4.340 ( 2.524 -9.413 -1.378) 9.843 4.503 ( 2.558 7.533 5.145) 9.474 4.665 ( -2.539 -3.973 2.949) 5.561 4.747 ( -4.984 7.228 -2.283) 9.072 4.937 ( -7.802 -9.818 -0.751) 12.563 5.076 ( 0.163 1.218 1.682) 2.084 5.120 ( 1.798 -2.605 4.440) 5.453 5.557 ( 6.686 -0.971 0.001) 6.757 5.597 ( 2.630 -5.917 -4.523) 7.898 6.370 ( -6.551 5.683 -3.460) 9.338 6.455 ( -6.570 -2.736 -5.478) 8.981 7.425 ( -8.059 4.712 4.014) 10.162 7.449 ( -6.290 2.348 2.368) 7.120 8.022 ( 2.425 10.355 0.379) 10.642 8.234 ( 3.696 -11.226 0.752) 11.842 8.944 ( 0.085 1.864 3.447) 3.920 8.971 ( 0.963 -1.345 5.023) 5.289 9.737 ( -1.511 5.393 -5.097) 7.572 9.859 ( -3.015 -6.563 -6.752) 9.887 10.001 ( 3.106 5.325 0.096) 6.165 10.125 ( 4.871 -7.619 -1.095) 9.109 10.372 ( 4.364 8.264 1.195) 9.422 10.585 ( 2.973 -12.709 6.674) 14.660 11.503 ( 8.479 4.593 -1.080) 9.703 11.564 ( 10.315 -0.096 -0.716) 10.340 11.767 ( 1.702 2.719 0.632) 3.269 11.831 ( -0.460 -5.849 -3.219) 6.692 12.125 ( 10.602 3.456 3.964) 11.834 12.218 ( 10.404 -4.705 1.718) 11.547 13.019 ( -15.746 9.069 -3.907) 18.586 13.184 ( -11.372 -8.114 0.555) 13.981 14.375 ( -6.079 19.917 -0.032) 20.824 14.559 ( -6.347 7.258 -1.209) 9.717 14.641 ( -5.682 -1.188 10.670) 12.147 14.913 ( -22.037 -13.795 0.985) 26.017 16.004 ( -16.231 16.624 -4.194) 23.609 16.445 ( -17.877 -25.223 -6.612) 31.615 18.332 ( 19.591 18.503 0.111) 26.948 18.634 ( 20.479 -13.071 1.394) 24.335 20.626 ( 1.929 2.110 -0.411) 2.888 20.671 ( 2.088 -2.436 -0.014) 3.208 ======================= Grid point 153 (85/170) ======================= q-point: (-0.09 0.44 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( 1.703 -5.316 12.737) 13.907 1.040 ( -3.150 -10.358 10.029) 14.758 1.183 ( 0.829 8.712 -3.396) 9.387 1.325 ( 3.059 -5.497 -4.913) 7.982 1.871 ( 5.671 6.440 2.663) 8.985 1.900 ( 2.107 4.912 -0.964) 5.431 1.990 ( -1.385 -1.995 1.579) 2.896 2.144 ( -1.634 -10.566 -0.765) 10.719 2.473 ( 0.946 4.526 -6.379) 7.879 2.514 ( 0.683 -0.173 -8.782) 8.811 2.786 ( -4.035 0.896 2.009) 4.595 2.828 ( -2.006 -2.913 -1.746) 3.944 3.050 ( 1.693 -1.117 3.319) 3.889 3.059 ( 1.528 -2.743 5.457) 6.296 3.431 ( 10.947 13.840 0.734) 17.661 3.661 ( 6.098 -6.267 3.302) 9.347 3.725 ( -4.203 24.060 4.112) 24.768 4.047 ( -2.378 -3.518 -0.338) 4.259 4.229 ( 1.669 2.537 -0.984) 3.192 4.339 ( -0.002 -5.091 -0.479) 5.114 4.547 ( -5.903 9.045 3.789) 11.446 4.604 ( 0.182 -0.121 1.376) 1.394 4.732 ( -1.945 -3.780 -0.266) 4.259 4.841 ( -3.764 -12.116 -0.011) 12.687 5.090 ( 1.631 1.592 -2.077) 3.083 5.185 ( 3.034 -7.565 -1.212) 8.241 5.587 ( 3.374 1.781 -4.240) 5.704 5.677 ( 7.711 -6.546 -1.159) 10.181 6.244 ( -4.427 3.888 -2.032) 6.232 6.303 ( -6.033 -2.107 -2.569) 6.887 7.345 ( -6.323 5.897 3.243) 9.234 7.385 ( -4.078 2.007 1.658) 4.838 8.069 ( 1.558 11.433 2.046) 11.718 8.298 ( 2.180 -11.942 1.914) 12.289 8.947 ( -1.052 2.332 -1.873) 3.171 8.993 ( -0.827 -2.547 -2.357) 3.567 9.681 ( -0.015 3.994 -1.610) 4.307 9.774 ( -0.939 -5.055 -1.248) 5.291 10.055 ( 3.616 5.989 -1.254) 7.108 10.186 ( 3.202 -7.386 -0.296) 8.055 10.489 ( 0.966 9.339 11.297) 14.689 10.695 ( -0.983 -11.370 9.929) 15.127 11.595 ( 3.702 5.755 -0.387) 6.854 11.722 ( 5.132 -4.942 3.053) 7.752 11.782 ( 0.967 3.311 -1.473) 3.751 11.873 ( 8.292 -5.112 0.044) 9.741 12.302 ( 6.595 3.002 1.217) 7.348 12.357 ( 5.537 -1.402 0.095) 5.713 12.744 ( -10.696 13.477 -5.049) 17.931 13.024 ( -4.683 -15.582 -5.924) 17.316 14.170 ( -10.571 29.724 3.301) 31.720 14.501 ( -0.705 5.115 -6.077) 7.974 14.582 ( -7.555 -4.009 -4.191) 9.525 14.713 ( -10.176 -18.829 6.066) 22.246 15.743 ( -9.446 14.259 -4.065) 17.580 16.141 ( -9.118 -23.778 -7.303) 26.493 18.598 ( 10.725 19.086 3.324) 22.144 18.913 ( 11.453 -13.910 1.423) 18.074 20.652 ( 1.129 2.445 0.638) 2.768 20.700 ( 1.078 -2.373 0.510) 2.656 ======================= Grid point 198 (86/170) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.789 ( 0.518 0.000 18.484) 18.491 0.959 ( 10.328 0.000 21.977) 24.283 1.374 ( -2.264 0.000 -4.019) 4.613 1.475 ( 3.802 0.000 2.169) 4.377 1.647 ( -7.419 0.000 13.571) 15.467 1.773 ( -9.109 0.000 -11.827) 14.928 1.976 ( -4.631 0.000 11.836) 12.710 2.168 ( -1.564 0.000 -0.481) 1.636 2.358 ( -0.592 0.000 -6.609) 6.635 2.735 ( 10.922 0.000 -2.939) 11.311 2.841 ( 1.690 0.000 4.335) 4.653 2.935 ( -2.351 0.000 -5.858) 6.312 3.099 ( -1.310 0.000 5.817) 5.963 3.221 ( 0.681 0.000 11.495) 11.515 3.369 ( 0.213 0.000 2.314) 2.324 3.421 ( 1.058 0.000 -4.283) 4.411 3.681 ( -0.223 0.000 5.126) 5.130 3.803 ( 2.762 0.000 -3.685) 4.605 3.931 ( 1.337 0.000 -8.704) 8.806 4.083 ( 12.534 0.000 -10.393) 16.283 4.401 ( -8.292 0.000 -1.887) 8.504 4.470 ( -6.682 0.000 -5.631) 8.738 5.129 ( 5.311 0.000 4.292) 6.828 5.426 ( -2.422 0.000 -9.755) 10.051 5.547 ( -3.955 0.000 8.244) 9.144 5.754 ( 1.880 0.000 1.259) 2.262 5.835 ( -8.709 0.000 -1.327) 8.810 5.885 ( 0.788 0.000 -1.940) 2.094 6.430 ( 9.898 0.000 4.517) 10.880 6.442 ( 6.172 0.000 0.378) 6.184 6.528 ( -5.167 0.000 0.904) 5.245 6.530 ( -2.336 0.000 -3.434) 4.153 7.836 ( -1.051 0.000 12.034) 12.080 8.343 ( 1.540 0.000 -9.112) 9.241 8.731 ( -1.600 0.000 0.209) 1.614 8.820 ( 1.221 0.000 -6.867) 6.974 9.803 ( -5.829 0.000 7.345) 9.377 9.840 ( 5.016 0.000 4.693) 6.869 10.122 ( 2.938 0.000 6.082) 6.754 10.525 ( 4.120 0.000 -11.008) 11.754 10.833 ( 8.192 0.000 9.405) 12.472 11.046 ( 1.300 0.000 9.981) 10.066 11.335 ( -2.695 0.000 0.268) 2.708 11.411 ( -12.388 0.000 -11.558) 16.942 11.661 ( 3.562 0.000 -0.789) 3.648 11.789 ( -1.513 0.000 -2.239) 2.703 12.212 ( -7.913 0.000 -0.630) 7.938 12.352 ( -5.779 0.000 21.295) 22.065 12.479 ( 3.541 0.000 -7.649) 8.429 13.303 ( 9.108 0.000 15.474) 17.955 13.548 ( -7.864 0.000 -30.654) 31.647 13.963 ( 5.963 0.000 -17.843) 18.813 15.648 ( 57.039 0.000 6.218) 57.377 15.848 ( -26.668 0.000 -1.698) 26.722 15.977 ( -19.231 0.000 6.251) 20.221 16.239 ( 15.582 0.000 -4.891) 16.331 17.603 ( 41.410 0.000 9.389) 42.461 17.954 ( -70.958 0.000 -6.983) 71.301 20.686 ( -0.041 0.000 5.152) 5.152 20.793 ( -0.350 0.000 -0.001) 0.350 ======================= Grid point 199 (87/170) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( 1.882 0.000 14.778) 14.897 1.191 ( -5.671 0.000 -7.235) 9.193 1.362 ( 8.372 0.000 16.824) 18.792 1.381 ( -3.303 0.000 -13.038) 13.449 1.626 ( -1.500 0.000 -1.702) 2.269 1.727 ( 4.889 0.000 5.473) 7.339 2.135 ( -3.552 0.000 10.519) 11.103 2.232 ( 8.725 0.000 13.970) 16.471 2.249 ( -3.281 0.000 -7.341) 8.041 2.832 ( -4.312 0.000 -4.217) 6.031 2.851 ( 12.109 0.000 -9.727) 15.532 2.868 ( -0.717 0.000 0.740) 1.031 3.176 ( 2.622 0.000 6.791) 7.280 3.258 ( -6.349 0.000 6.390) 9.008 3.335 ( -10.417 0.000 0.207) 10.419 3.411 ( 6.800 0.000 -9.703) 11.849 3.610 ( -5.857 0.000 9.027) 10.761 3.666 ( -10.002 0.000 -9.142) 13.550 4.008 ( 9.841 0.000 0.558) 9.856 4.112 ( 3.620 0.000 -16.159) 16.560 4.301 ( -4.126 0.000 4.719) 6.268 4.485 ( 10.003 0.000 0.569) 10.019 5.200 ( -11.438 0.000 -9.639) 14.958 5.209 ( -1.541 0.000 4.781) 5.023 5.530 ( -8.661 0.000 7.393) 11.387 5.661 ( -11.550 0.000 1.117) 11.604 5.785 ( 0.102 0.000 1.145) 1.149 5.862 ( -2.729 0.000 0.284) 2.744 6.449 ( -3.179 0.000 -1.892) 3.699 6.460 ( 0.636 0.000 -4.193) 4.241 6.597 ( 11.989 0.000 0.330) 11.993 6.649 ( 9.884 0.000 1.363) 9.978 7.989 ( 2.871 0.000 13.178) 13.487 8.289 ( 5.956 0.000 -12.589) 13.927 8.712 ( -1.337 0.000 1.038) 1.693 8.791 ( 1.918 0.000 -3.839) 4.292 9.798 ( -1.505 0.000 4.769) 5.001 9.991 ( 7.006 0.000 3.341) 7.761 10.243 ( 2.414 0.000 6.591) 7.019 10.398 ( -0.743 0.000 -15.222) 15.240 10.964 ( -10.805 0.000 -4.542) 11.721 11.086 ( 2.803 0.000 10.268) 10.644 11.302 ( 1.399 0.000 2.263) 2.660 11.304 ( 4.823 0.000 0.797) 4.888 11.705 ( -1.830 0.000 -7.162) 7.392 11.735 ( 3.854 0.000 2.765) 4.743 12.127 ( -7.035 0.000 8.181) 10.790 12.463 ( 4.169 0.000 -6.496) 7.719 12.617 ( 0.451 0.000 31.553) 31.557 13.077 ( -9.213 0.000 -29.793) 31.185 13.622 ( 11.767 0.000 11.423) 16.399 13.851 ( 7.732 0.000 -22.574) 23.861 15.132 ( -40.470 0.000 -10.541) 41.821 15.917 ( -8.462 0.000 6.929) 10.937 16.055 ( 3.149 0.000 -0.724) 3.231 16.564 ( -15.081 0.000 8.479) 17.301 17.092 ( 3.775 0.000 -14.393) 14.879 18.379 ( 34.736 0.000 16.773) 38.574 20.738 ( 0.259 0.000 4.098) 4.107 20.776 ( -0.980 0.000 -1.120) 1.489 ======================= Grid point 200 (88/170) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.028 ( -5.066 0.000 -3.682) 6.262 1.043 ( -1.172 0.000 -7.761) 7.849 1.363 ( 8.017 0.000 -1.404) 8.139 1.571 ( 5.079 0.000 0.216) 5.083 1.689 ( 4.093 0.000 11.592) 12.293 1.870 ( 4.828 0.000 5.005) 6.954 2.115 ( -4.619 0.000 -4.348) 6.343 2.163 ( -4.048 0.000 8.415) 9.338 2.429 ( -0.713 0.000 -1.410) 1.580 2.682 ( -9.788 0.000 -2.699) 10.154 2.931 ( 0.413 0.000 5.933) 5.947 2.931 ( 15.275 0.000 -15.442) 21.721 3.125 ( -2.921 0.000 1.040) 3.100 3.232 ( -3.926 0.000 4.245) 5.782 3.335 ( 5.131 0.000 7.137) 8.790 3.354 ( -6.713 0.000 -14.936) 16.375 3.426 ( 6.702 0.000 -10.194) 12.200 3.709 ( -0.116 0.000 14.037) 14.037 3.972 ( 0.174 0.000 -12.841) 12.842 4.179 ( 7.352 0.000 5.081) 8.937 4.352 ( -2.880 0.000 11.743) 12.091 4.613 ( 4.660 0.000 -3.420) 5.780 4.886 ( -14.739 0.000 -6.340) 16.044 5.187 ( -5.997 0.000 3.135) 6.767 5.413 ( -12.916 0.000 2.180) 13.098 5.506 ( -9.475 0.000 1.700) 9.627 5.780 ( -1.781 0.000 0.502) 1.850 5.813 ( -5.645 0.000 4.238) 7.059 6.401 ( -0.221 0.000 -2.112) 2.123 6.450 ( 2.416 0.000 -2.362) 3.379 6.771 ( 6.053 0.000 -2.382) 6.505 6.819 ( 14.732 0.000 -0.070) 14.732 8.197 ( 4.445 0.000 13.127) 13.859 8.262 ( 8.609 0.000 -14.083) 16.506 8.720 ( -0.508 0.000 3.775) 3.809 8.793 ( 1.627 0.000 -1.399) 2.146 9.879 ( 5.265 0.000 4.475) 6.909 10.080 ( 0.886 0.000 -4.235) 4.326 10.236 ( 0.366 0.000 -7.898) 7.906 10.312 ( -0.967 0.000 2.967) 3.121 10.819 ( 0.454 0.000 -4.626) 4.648 11.036 ( -5.844 0.000 -3.753) 6.946 11.287 ( -7.077 0.000 1.999) 7.354 11.552 ( 6.613 0.000 9.569) 11.632 11.613 ( -0.273 0.000 -6.335) 6.341 11.857 ( 7.707 0.000 5.636) 9.548 12.132 ( -6.261 0.000 11.278) 12.899 12.481 ( 5.563 0.000 -3.568) 6.609 12.650 ( -6.855 0.000 -21.663) 22.722 13.016 ( 5.005 0.000 32.997) 33.374 13.742 ( 10.059 0.000 -24.408) 26.399 13.913 ( 11.310 0.000 7.465) 13.552 14.416 ( -28.468 0.000 -14.526) 31.960 15.825 ( -12.144 0.000 6.841) 13.938 15.895 ( -35.156 0.000 -1.064) 35.172 16.095 ( -16.872 0.000 9.685) 19.454 17.467 ( 38.681 0.000 -16.436) 42.028 19.009 ( 18.265 0.000 17.834) 25.528 20.739 ( -1.292 0.000 -2.102) 2.467 20.782 ( 0.703 0.000 2.468) 2.566 ======================= Grid point 201 (89/170) ======================= q-point: ( 0.27 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( -2.165 0.000 -5.995) 6.374 1.003 ( 4.510 0.000 -4.290) 6.224 1.451 ( 5.690 0.000 -3.305) 6.580 1.659 ( 5.346 0.000 0.540) 5.373 1.877 ( 5.334 0.000 6.932) 8.746 1.981 ( 4.258 0.000 -4.486) 6.185 2.020 ( -3.970 0.000 3.924) 5.582 2.177 ( -6.725 0.000 5.771) 8.861 2.261 ( -7.516 0.000 -5.421) 9.267 2.500 ( -9.014 0.000 0.962) 9.065 2.809 ( -8.794 0.000 -1.631) 8.944 2.947 ( 5.138 0.000 -21.804) 22.401 3.108 ( 7.458 0.000 -10.176) 12.616 3.360 ( 6.181 0.000 6.034) 8.638 3.385 ( 14.643 0.000 7.211) 16.322 3.438 ( 7.376 0.000 -9.179) 11.776 3.468 ( 3.781 0.000 1.981) 4.268 3.812 ( 0.596 0.000 -0.674) 0.900 3.948 ( 4.531 0.000 9.244) 10.295 4.346 ( 3.336 0.000 7.656) 8.352 4.415 ( -5.012 0.000 12.419) 13.392 4.471 ( -12.284 0.000 -5.844) 13.604 4.701 ( -4.978 0.000 -1.688) 5.256 5.099 ( -6.113 0.000 -2.349) 6.549 5.172 ( -15.682 0.000 -0.984) 15.713 5.380 ( -9.005 0.000 1.408) 9.114 5.752 ( -1.154 0.000 -0.374) 1.213 5.779 ( -6.584 0.000 7.404) 9.908 6.386 ( 0.706 0.000 -1.799) 1.932 6.481 ( 2.521 0.000 0.256) 2.534 6.805 ( 3.443 0.000 -4.760) 5.875 7.041 ( 12.495 0.000 -1.141) 12.547 8.264 ( 10.164 0.000 -13.254) 16.703 8.374 ( 1.137 0.000 9.416) 9.485 8.792 ( 0.319 0.000 9.768) 9.773 8.812 ( 1.740 0.000 -0.079) 1.742 9.938 ( -2.912 0.000 -11.964) 12.314 10.040 ( 8.253 0.000 3.086) 8.811 10.262 ( 2.769 0.000 2.920) 4.024 10.263 ( -4.418 0.000 -3.945) 5.923 10.869 ( 10.165 0.000 -3.739) 10.830 10.904 ( -3.199 0.000 -5.842) 6.661 11.145 ( -12.061 0.000 2.145) 12.250 11.541 ( -1.725 0.000 -4.791) 5.092 11.550 ( -7.854 0.000 -4.211) 8.911 12.062 ( 8.148 0.000 3.558) 8.890 12.155 ( -6.714 0.000 12.074) 13.815 12.438 ( -1.428 0.000 -8.250) 8.372 12.669 ( 14.642 0.000 12.746) 19.413 13.465 ( 8.686 0.000 28.391) 29.691 13.544 ( -0.382 0.000 -30.516) 30.518 14.068 ( 1.698 0.000 -5.036) 5.314 14.130 ( 7.154 0.000 3.821) 8.111 15.257 ( -38.907 0.000 0.071) 38.907 15.680 ( -14.863 0.000 7.243) 16.534 16.003 ( -6.017 0.000 1.207) 6.137 17.861 ( 28.269 0.000 -10.046) 30.001 19.319 ( 0.984 0.000 10.758) 10.803 20.695 ( -0.867 0.000 -2.472) 2.620 20.809 ( 0.270 0.000 0.562) 0.624 ======================= Grid point 202 (90/170) ======================= q-point: ( 0.36 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.891 ( 4.907 0.000 1.134) 5.036 1.090 ( 8.661 0.000 -0.093) 8.661 1.499 ( 3.860 0.000 -1.538) 4.155 1.726 ( -1.135 0.000 4.962) 5.091 1.862 ( -10.950 0.000 -4.157) 11.713 1.901 ( -4.100 0.000 -1.966) 4.547 2.024 ( 0.660 0.000 -5.263) 5.304 2.130 ( 8.526 0.000 -2.704) 8.945 2.241 ( -1.242 0.000 4.791) 4.950 2.449 ( -2.674 0.000 2.939) 3.973 2.645 ( -8.215 0.000 -6.373) 10.397 2.761 ( 1.812 0.000 -16.754) 16.852 3.215 ( 14.651 0.000 -7.525) 16.470 3.438 ( -3.998 0.000 3.494) 5.309 3.474 ( 7.533 0.000 -6.002) 9.632 3.577 ( 10.711 0.000 6.900) 12.741 3.658 ( 9.575 0.000 1.001) 9.628 3.871 ( 6.518 0.000 0.063) 6.518 4.128 ( 3.526 0.000 -0.947) 3.651 4.295 ( -6.997 0.000 11.959) 13.855 4.370 ( -7.963 0.000 7.348) 10.835 4.514 ( -2.369 0.000 10.825) 11.081 4.589 ( -4.802 0.000 -2.791) 5.554 4.853 ( -10.264 0.000 -9.225) 13.801 5.029 ( -5.356 0.000 0.615) 5.391 5.227 ( -10.801 0.000 -0.068) 10.802 5.749 ( 1.088 0.000 0.057) 1.089 5.754 ( -7.062 0.000 8.144) 10.779 6.382 ( 1.290 0.000 -1.738) 2.165 6.524 ( 1.182 0.000 1.283) 1.745 6.801 ( 3.058 0.000 -4.471) 5.417 7.168 ( 6.305 0.000 -3.916) 7.422 8.306 ( 11.185 0.000 -10.881) 15.605 8.428 ( -3.496 0.000 4.734) 5.885 8.850 ( 2.722 0.000 0.738) 2.821 8.903 ( -2.928 0.000 11.976) 12.329 9.777 ( -2.763 0.000 -9.000) 9.414 10.084 ( -2.871 0.000 -12.824) 13.142 10.194 ( 4.426 0.000 2.060) 4.882 10.365 ( 5.634 0.000 3.291) 6.525 10.828 ( 0.798 0.000 -4.064) 4.141 10.975 ( -12.219 0.000 3.728) 12.775 11.025 ( 13.145 0.000 -3.726) 13.663 11.338 ( -8.722 0.000 -5.858) 10.507 11.452 ( -3.954 0.000 -2.837) 4.866 12.173 ( -7.215 0.000 11.965) 13.972 12.234 ( 5.607 0.000 5.198) 7.646 12.333 ( -1.336 0.000 -5.824) 5.975 13.129 ( 12.021 0.000 15.598) 19.693 13.247 ( 10.492 0.000 -20.990) 23.467 13.887 ( 10.433 0.000 19.683) 22.277 14.168 ( -8.566 0.000 -0.002) 8.566 14.205 ( 13.082 0.000 1.230) 13.140 14.697 ( -25.727 0.000 -2.159) 25.817 15.519 ( -15.070 0.000 8.703) 17.403 15.914 ( -4.751 0.000 -1.460) 4.970 18.175 ( 20.536 0.000 -3.939) 20.910 19.304 ( -8.758 0.000 0.261) 8.762 20.665 ( 0.186 0.000 -1.983) 1.992 20.798 ( -0.918 0.000 -1.426) 1.696 ======================= Grid point 203 (91/170) ======================= q-point: ( 0.45 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( 6.283 0.000 9.513) 11.401 1.255 ( 9.366 0.000 2.537) 9.703 1.534 ( 2.092 0.000 -1.971) 2.874 1.629 ( -10.856 0.000 -3.392) 11.373 1.750 ( -3.879 0.000 7.116) 8.105 1.844 ( -2.925 0.000 2.669) 3.960 1.988 ( 4.900 0.000 -6.177) 7.885 2.200 ( -2.614 0.000 -1.367) 2.950 2.299 ( 4.779 0.000 -1.877) 5.134 2.378 ( -5.907 0.000 -2.851) 6.559 2.393 ( -4.386 0.000 -11.717) 12.511 2.658 ( 5.771 0.000 -16.058) 17.063 3.406 ( 11.095 0.000 3.173) 11.540 3.505 ( 2.267 0.000 10.051) 10.303 3.552 ( 7.812 0.000 -2.491) 8.199 3.709 ( -0.466 0.000 -3.650) 3.680 3.804 ( 8.201 0.000 4.193) 9.211 3.887 ( -6.160 0.000 -4.147) 7.426 4.141 ( 4.461 0.000 0.971) 4.566 4.285 ( -10.776 0.000 4.691) 11.753 4.345 ( -5.501 0.000 9.355) 10.853 4.438 ( -10.679 0.000 -1.252) 10.752 4.612 ( 8.000 0.000 2.333) 8.333 4.746 ( 1.362 0.000 0.947) 1.659 4.983 ( 1.311 0.000 -2.152) 2.520 5.056 ( -7.730 0.000 -1.998) 7.984 5.727 ( -7.045 0.000 7.918) 10.598 5.781 ( 1.454 0.000 1.578) 2.146 6.392 ( 1.816 0.000 -1.032) 2.089 6.529 ( -0.361 0.000 -1.872) 1.907 6.829 ( 3.583 0.000 -0.020) 3.583 7.162 ( 0.367 0.000 -6.684) 6.694 8.370 ( -7.874 0.000 1.603) 8.036 8.388 ( 11.534 0.000 -7.953) 14.010 8.920 ( 4.583 0.000 1.410) 4.796 8.927 ( -6.725 0.000 7.386) 9.989 9.654 ( -3.418 0.000 -4.657) 5.777 9.889 ( -2.714 0.000 -12.408) 12.701 10.280 ( 3.229 0.000 1.716) 3.657 10.493 ( 7.699 0.000 -1.173) 7.788 10.840 ( 4.824 0.000 -2.274) 5.333 10.851 ( -8.243 0.000 4.170) 9.238 11.175 ( -6.515 0.000 -1.904) 6.787 11.192 ( 12.335 0.000 -4.291) 13.060 11.376 ( -4.788 0.000 4.137) 6.328 12.119 ( -7.499 0.000 -10.898) 13.229 12.181 ( -7.277 0.000 11.220) 13.373 12.423 ( 4.733 0.000 2.243) 5.238 13.198 ( 19.329 0.000 -9.280) 21.441 13.653 ( 13.840 0.000 19.012) 23.516 13.757 ( -29.689 0.000 -6.971) 30.496 14.245 ( 8.374 0.000 13.522) 15.905 14.431 ( -4.751 0.000 -2.304) 5.280 14.431 ( 7.109 0.000 0.509) 7.127 15.414 ( -10.577 0.000 11.847) 15.881 15.828 ( -1.980 0.000 -3.848) 4.327 18.452 ( 15.718 0.000 1.775) 15.818 19.085 ( -12.203 0.000 -8.007) 14.596 20.661 ( 1.280 0.000 -0.876) 1.551 20.753 ( -1.790 0.000 -2.628) 3.180 ======================= Grid point 204 (92/170) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -2.938 0.000 7.899) 8.428 1.417 ( -4.795 0.000 1.018) 4.902 1.429 ( -0.320 0.000 0.896) 0.951 1.530 ( 2.655 0.000 -1.692) 3.148 1.774 ( -2.635 0.000 4.115) 4.886 1.889 ( 3.419 0.000 5.000) 6.057 1.902 ( -16.635 0.000 -7.978) 18.449 2.050 ( 3.130 0.000 0.313) 3.146 2.257 ( -0.957 0.000 -4.404) 4.506 2.341 ( 4.459 0.000 0.162) 4.462 2.441 ( 12.011 0.000 -6.486) 13.651 2.572 ( 5.849 0.000 -16.652) 17.649 3.515 ( -8.863 0.000 -0.850) 8.903 3.560 ( 1.857 0.000 3.095) 3.610 3.573 ( -22.309 0.000 -5.547) 22.988 3.687 ( 5.659 0.000 5.471) 7.871 3.779 ( 5.683 0.000 7.052) 9.057 3.887 ( 1.678 0.000 -2.133) 2.714 4.164 ( -5.622 0.000 0.939) 5.700 4.232 ( 1.379 0.000 5.853) 6.013 4.284 ( -7.725 0.000 0.729) 7.759 4.432 ( 7.161 0.000 3.780) 8.098 4.757 ( 7.479 0.000 -1.265) 7.586 4.787 ( 1.660 0.000 -0.613) 1.770 4.981 ( 1.842 0.000 -1.734) 2.529 5.052 ( 10.726 0.000 -2.171) 10.944 5.697 ( -6.781 0.000 7.121) 9.834 5.824 ( 0.575 0.000 3.212) 3.263 6.419 ( 1.900 0.000 0.451) 1.953 6.483 ( -0.223 0.000 -4.875) 4.880 6.902 ( 2.234 0.000 3.801) 4.409 7.053 ( -3.485 0.000 -7.994) 8.721 8.219 ( -11.276 0.000 -0.101) 11.276 8.495 ( 10.033 0.000 -5.183) 11.293 8.875 ( -6.329 0.000 3.790) 7.377 9.028 ( 6.934 0.000 1.459) 7.086 9.571 ( -3.839 0.000 0.775) 3.917 9.743 ( -2.145 0.000 -7.367) 7.673 10.321 ( -1.111 0.000 2.072) 2.351 10.542 ( 3.807 0.000 -9.232) 9.986 10.798 ( -1.740 0.000 1.515) 2.307 10.930 ( 7.317 0.000 -0.937) 7.376 11.077 ( -3.389 0.000 -0.708) 3.462 11.298 ( 7.375 0.000 -4.841) 8.822 11.458 ( 1.264 0.000 16.608) 16.656 11.857 ( -7.498 0.000 -13.067) 15.066 12.185 ( -6.638 0.000 10.486) 12.410 12.483 ( 3.863 0.000 -2.323) 4.508 13.175 ( -31.535 0.000 -6.248) 32.149 13.571 ( 28.348 0.000 2.657) 28.473 13.982 ( 2.148 0.000 17.325) 17.458 14.204 ( -12.607 0.000 -7.647) 14.745 14.449 ( 4.165 0.000 3.949) 5.740 14.581 ( 8.532 0.000 -3.459) 9.207 15.461 ( -1.716 0.000 15.114) 15.211 15.780 ( 2.764 0.000 -5.379) 6.048 18.734 ( 13.539 0.000 7.249) 15.357 18.761 ( -13.771 0.000 -12.518) 18.610 20.684 ( 1.821 0.000 0.333) 1.851 20.690 ( -2.308 0.000 -2.660) 3.522 ======================= Grid point 205 (93/170) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.103 ( -12.197 0.000 -0.189) 12.199 1.187 ( -13.742 0.000 -4.036) 14.322 1.469 ( -20.790 0.000 -2.512) 20.941 1.551 ( 4.590 0.000 1.431) 4.808 1.640 ( 6.695 0.000 6.132) 9.079 1.902 ( 4.737 0.000 5.599) 7.334 1.913 ( -8.716 0.000 -2.776) 9.148 2.082 ( 6.144 0.000 3.695) 7.169 2.336 ( 9.565 0.000 -1.340) 9.658 2.378 ( -0.004 0.000 -2.620) 2.620 2.523 ( 7.411 0.000 -9.470) 12.025 2.588 ( 12.920 0.000 -4.455) 13.667 3.096 ( -28.140 0.000 -2.141) 28.221 3.348 ( -9.945 0.000 0.173) 9.946 3.550 ( -6.145 0.000 2.670) 6.700 3.748 ( 1.026 0.000 -2.266) 2.487 3.876 ( 0.152 0.000 -1.485) 1.493 3.906 ( 1.419 0.000 -0.615) 1.546 4.067 ( -6.345 0.000 -2.707) 6.898 4.291 ( 3.556 0.000 8.703) 9.401 4.334 ( -1.299 0.000 13.502) 13.564 4.636 ( 16.185 0.000 -1.376) 16.244 4.769 ( 0.565 0.000 -5.538) 5.566 4.819 ( 5.353 0.000 -5.872) 7.945 5.061 ( 8.609 0.000 -0.786) 8.645 5.251 ( 14.275 0.000 -1.562) 14.360 5.667 ( -5.325 0.000 5.973) 8.002 5.869 ( -0.100 0.000 4.597) 4.598 6.430 ( 0.984 0.000 -5.630) 5.716 6.460 ( 1.359 0.000 2.025) 2.439 6.891 ( -5.719 0.000 -7.545) 9.467 6.959 ( -1.576 0.000 4.699) 4.956 8.030 ( -12.067 0.000 1.176) 12.125 8.579 ( 5.382 0.000 -3.314) 6.321 8.820 ( -4.407 0.000 2.315) 4.978 9.176 ( 9.761 0.000 1.082) 9.821 9.562 ( -1.870 0.000 6.476) 6.741 9.660 ( -1.753 0.000 -2.096) 2.732 10.290 ( -4.841 0.000 1.566) 5.088 10.403 ( -4.711 0.000 -13.061) 13.885 10.835 ( 4.692 0.000 -1.043) 4.807 10.927 ( -6.756 0.000 0.626) 6.785 11.138 ( 11.199 0.000 -3.044) 11.605 11.351 ( 6.144 0.000 -5.599) 8.312 11.638 ( -3.397 0.000 -9.480) 10.070 11.732 ( 4.276 0.000 24.725) 25.092 12.207 ( -4.488 0.000 11.103) 11.976 12.514 ( 4.229 0.000 -3.976) 5.805 12.644 ( -26.742 0.000 -3.862) 27.020 13.857 ( -17.103 0.000 -11.759) 20.755 14.011 ( 10.453 0.000 1.789) 10.605 14.213 ( 15.327 0.000 18.666) 24.152 14.439 ( -4.067 0.000 -6.768) 7.896 14.634 ( 5.726 0.000 -8.075) 9.899 15.656 ( 4.967 0.000 14.286) 15.125 15.809 ( 7.762 0.000 -5.052) 9.261 18.374 ( -16.444 0.000 -14.099) 21.661 19.053 ( 13.561 0.000 11.550) 17.813 20.628 ( -2.335 0.000 -1.401) 2.723 20.722 ( 1.690 0.000 1.297) 2.130 ======================= Grid point 206 (94/170) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.880 ( -14.048 0.000 -9.019) 16.694 0.882 ( -14.479 0.000 0.966) 14.511 1.186 ( -17.904 0.000 9.965) 20.490 1.597 ( -4.283 0.000 3.913) 5.801 1.680 ( -11.999 0.000 -2.707) 12.301 1.872 ( 10.210 0.000 7.481) 12.658 2.057 ( 7.029 0.000 3.699) 7.943 2.210 ( 7.974 0.000 -2.957) 8.505 2.233 ( -16.928 0.000 3.250) 17.238 2.427 ( 6.794 0.000 -4.949) 8.405 2.628 ( 7.031 0.000 3.777) 7.981 2.726 ( 9.977 0.000 -6.602) 11.964 2.753 ( -11.368 0.000 2.699) 11.684 3.229 ( -6.180 0.000 2.678) 6.736 3.439 ( -10.074 0.000 1.206) 10.146 3.737 ( 3.948 0.000 -7.940) 8.867 3.776 ( -3.212 0.000 -10.249) 10.741 3.810 ( -8.177 0.000 -3.012) 8.714 4.042 ( 3.085 0.000 2.280) 3.837 4.443 ( -6.177 0.000 14.763) 16.003 4.487 ( 5.916 0.000 9.104) 10.857 4.711 ( 2.993 0.000 -8.237) 8.764 4.780 ( 7.081 0.000 -12.122) 14.038 4.937 ( 16.952 0.000 0.005) 16.952 5.218 ( 11.354 0.000 -0.462) 11.364 5.407 ( 5.551 0.000 -1.204) 5.680 5.689 ( 2.393 0.000 4.097) 4.744 5.920 ( -0.023 0.000 4.871) 4.871 6.400 ( 2.505 0.000 -4.942) 5.541 6.497 ( -0.099 0.000 2.273) 2.275 6.719 ( -6.706 0.000 -4.868) 8.286 6.932 ( -7.536 0.000 3.278) 8.218 7.872 ( -10.849 0.000 4.253) 11.653 8.590 ( 0.136 0.000 -2.439) 2.443 8.785 ( -2.578 0.000 1.612) 3.041 9.340 ( 10.188 0.000 -5.134) 11.408 9.643 ( -0.745 0.000 2.704) 2.805 9.647 ( 0.155 0.000 11.418) 11.419 10.178 ( -6.720 0.000 -6.929) 9.652 10.210 ( -6.775 0.000 1.559) 6.953 10.803 ( -7.631 0.000 -0.732) 7.666 10.864 ( 1.736 0.000 -5.331) 5.606 11.261 ( 7.205 0.000 -3.373) 7.955 11.395 ( 5.856 0.000 -2.035) 6.199 11.564 ( 2.949 0.000 -3.963) 4.940 12.107 ( 8.036 0.000 23.083) 24.442 12.249 ( -19.510 0.000 2.328) 19.648 12.310 ( 1.297 0.000 13.868) 13.929 12.531 ( 4.027 0.000 -5.288) 6.647 13.416 ( -18.926 0.000 -15.097) 24.210 14.053 ( -0.948 0.000 0.913) 1.316 14.179 ( -12.981 0.000 -14.125) 19.184 14.528 ( 2.181 0.000 -13.136) 13.316 14.849 ( 27.417 0.000 16.256) 31.874 15.897 ( 7.612 0.000 10.948) 13.334 15.908 ( 9.889 0.000 -3.831) 10.605 17.923 ( -20.782 0.000 -14.065) 25.095 19.408 ( 14.511 0.000 10.331) 17.813 20.592 ( -1.727 0.000 0.913) 1.954 20.763 ( 1.093 0.000 1.794) 2.101 ======================= Grid point 207 (95/170) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.680 ( -6.624 0.000 6.090) 8.998 0.694 ( -13.273 0.000 7.508) 15.249 1.107 ( -7.658 0.000 14.606) 16.492 1.480 ( -8.081 0.000 -2.029) 8.331 1.515 ( -17.211 0.000 22.525) 28.348 2.053 ( -9.191 0.000 7.057) 11.588 2.100 ( 6.660 0.000 1.691) 6.871 2.199 ( 4.366 0.000 1.739) 4.700 2.301 ( 8.875 0.000 -1.671) 9.031 2.471 ( 6.160 0.000 -5.707) 8.398 2.688 ( -2.013 0.000 4.113) 4.579 2.787 ( 4.800 0.000 8.503) 9.764 2.819 ( 7.106 0.000 -0.707) 7.141 3.207 ( -0.031 0.000 2.060) 2.061 3.261 ( -10.817 0.000 -1.844) 10.974 3.587 ( -4.222 0.000 -11.830) 12.561 3.600 ( -7.459 0.000 -3.981) 8.455 3.772 ( 5.290 0.000 -6.606) 8.464 4.107 ( 2.128 0.000 -1.712) 2.731 4.399 ( -10.694 0.000 2.332) 10.945 4.581 ( -0.741 0.000 1.087) 1.315 4.763 ( 4.788 0.000 -9.543) 10.676 4.775 ( 10.436 0.000 -0.420) 10.445 5.213 ( 15.627 0.000 1.520) 15.701 5.418 ( 13.780 0.000 -0.012) 13.780 5.440 ( 0.394 0.000 1.841) 1.882 5.799 ( 6.160 0.000 0.770) 6.208 5.963 ( -0.061 0.000 2.342) 2.343 6.393 ( 1.786 0.000 -4.347) 4.700 6.474 ( -3.468 0.000 -1.958) 3.983 6.609 ( -4.498 0.000 2.433) 5.113 6.787 ( -12.401 0.000 1.059) 12.447 7.779 ( -8.399 0.000 7.468) 11.239 8.542 ( -2.497 0.000 -2.699) 3.677 8.768 ( -1.532 0.000 1.061) 1.864 9.252 ( -2.914 0.000 -22.143) 22.334 9.693 ( 0.105 0.000 7.025) 7.025 9.759 ( -4.497 0.000 10.631) 11.543 10.120 ( -6.717 0.000 2.509) 7.171 10.189 ( 7.990 0.000 10.038) 12.830 10.693 ( -4.297 0.000 -0.475) 4.323 10.810 ( -1.321 0.000 -0.278) 1.350 11.310 ( 2.437 0.000 -0.514) 2.490 11.511 ( 6.972 0.000 2.831) 7.525 11.603 ( 4.739 0.000 -2.710) 5.459 12.008 ( -9.920 0.000 -1.213) 9.994 12.364 ( 5.442 0.000 2.921) 6.177 12.528 ( 3.556 0.000 -6.546) 7.449 12.686 ( 8.604 0.000 30.349) 31.545 12.940 ( -17.367 0.000 -16.566) 24.001 13.846 ( -8.905 0.000 1.477) 9.026 14.043 ( 3.522 0.000 -6.766) 7.627 14.326 ( -4.656 0.000 -18.439) 19.017 15.464 ( 23.223 0.000 15.671) 28.016 16.028 ( 9.026 0.000 -2.940) 9.493 16.156 ( 11.383 0.000 11.169) 15.947 17.406 ( -23.405 0.000 -14.407) 27.484 19.637 ( 5.451 0.000 -7.417) 9.204 20.595 ( -0.864 0.000 3.401) 3.509 20.789 ( -0.044 0.000 1.208) 1.209 ======================= Grid point 208 (96/170) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 170 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.650 ( -7.214 0.000 15.587) 17.176 0.677 ( -5.632 0.000 17.154) 18.055 1.269 ( 2.431 0.000 16.278) 16.458 1.406 ( -0.148 0.000 1.170) 1.179 1.616 ( -5.452 0.000 17.898) 18.710 2.008 ( -6.802 0.000 5.850) 8.971 2.042 ( -5.761 0.000 -10.247) 11.756 2.219 ( -0.756 0.000 -3.288) 3.374 2.402 ( 2.559 0.000 -3.213) 4.107 2.568 ( 12.097 0.000 -1.988) 12.259 2.746 ( 1.275 0.000 6.777) 6.896 2.977 ( 3.398 0.000 10.163) 10.716 3.009 ( 5.052 0.000 11.349) 12.422 3.095 ( -4.023 0.000 -1.544) 4.309 3.303 ( 10.663 0.000 1.981) 10.845 3.454 ( 3.698 0.000 -3.816) 5.314 3.476 ( -3.922 0.000 -2.085) 4.441 3.784 ( 5.041 0.000 -6.353) 8.110 4.048 ( -1.203 0.000 -8.907) 8.988 4.199 ( -10.332 0.000 -5.022) 11.487 4.538 ( -5.552 0.000 -0.509) 5.575 4.669 ( -4.137 0.000 -9.744) 10.585 4.960 ( 10.245 0.000 2.463) 10.537 5.434 ( 10.985 0.000 -4.090) 11.722 5.492 ( 0.435 0.000 5.811) 5.827 5.648 ( 11.973 0.000 1.023) 12.017 5.874 ( 3.443 0.000 -1.566) 3.783 5.947 ( -3.080 0.000 -1.374) 3.372 6.333 ( -3.872 0.000 0.614) 3.920 6.405 ( -0.996 0.000 -1.272) 1.616 6.581 ( -4.447 0.000 3.684) 5.775 6.626 ( -6.175 0.000 -1.383) 6.328 7.765 ( -5.066 0.000 10.103) 11.302 8.445 ( -3.603 0.000 -5.733) 6.771 8.753 ( -1.442 0.000 0.433) 1.506 8.945 ( -4.910 0.000 -14.013) 14.849 9.764 ( -3.030 0.000 6.005) 6.726 9.778 ( -2.081 0.000 9.839) 10.056 10.066 ( -3.045 0.000 3.428) 4.585 10.457 ( 11.257 0.000 1.537) 11.362 10.682 ( 1.993 0.000 2.945) 3.556 10.882 ( 3.095 0.000 9.593) 10.080 11.340 ( -0.011 0.000 2.084) 2.084 11.622 ( 0.682 0.000 0.759) 1.021 11.634 ( 3.145 0.000 -3.044) 4.377 11.868 ( -6.340 0.000 -2.896) 6.970 12.313 ( -9.285 0.000 -2.752) 9.684 12.501 ( -13.133 0.000 -10.206) 16.632 12.507 ( 3.326 0.000 -7.468) 8.175 13.025 ( 1.874 0.000 18.367) 18.462 13.959 ( 0.869 0.000 -29.253) 29.266 14.049 ( -1.991 0.000 -8.966) 9.184 14.417 ( 54.053 0.000 30.481) 62.055 15.829 ( 5.618 0.000 9.039) 10.642 16.129 ( 7.425 0.000 -2.785) 7.930 16.421 ( -15.701 0.000 15.778) 22.259 17.035 ( 14.031 0.000 -12.004) 18.466 19.166 ( -43.317 0.000 -27.080) 51.085 20.632 ( -0.280 0.000 4.990) 4.998 20.793 ( -0.384 0.000 0.742) 0.836 ======================= Grid point 209 (97/170) ======================= q-point: ( 0.00 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( -1.418 8.093 15.993) 17.981 1.017 ( 9.558 5.823 20.463) 23.324 1.421 ( 0.842 6.484 -0.520) 6.559 1.487 ( -1.558 -0.004 -2.965) 3.349 1.703 ( -6.709 2.153 0.860) 7.098 1.861 ( -5.541 7.704 -11.512) 14.920 2.061 ( -4.849 8.784 21.056) 23.324 2.120 ( 0.633 -1.081 0.479) 1.341 2.341 ( -0.034 -1.830 -6.195) 6.459 2.611 ( 4.047 -9.075 2.248) 10.187 2.877 ( 2.380 3.850 2.207) 5.036 2.974 ( 2.609 -6.984 3.432) 8.207 3.068 ( -0.387 4.472 -3.570) 5.735 3.133 ( -1.254 -11.177 1.930) 11.411 3.339 ( -1.978 -4.942 1.402) 5.505 3.429 ( 1.542 5.145 1.404) 5.552 3.577 ( 8.964 -2.741 8.935) 12.950 3.758 ( -2.478 -5.791 -2.092) 6.637 4.042 ( 7.465 -0.092 -9.077) 11.752 4.060 ( -3.606 6.651 -11.284) 13.586 4.423 ( -0.986 1.983 0.915) 2.396 4.515 ( -7.473 3.849 -3.143) 8.974 5.104 ( 5.050 -4.923 0.892) 7.109 5.208 ( -1.564 -13.358 0.524) 13.459 5.605 ( -11.946 -1.828 0.903) 12.119 5.641 ( 4.988 -5.959 0.893) 7.822 5.775 ( 3.595 -4.202 -1.473) 5.723 5.870 ( -4.532 -3.486 -2.334) 6.176 6.348 ( 13.061 -3.978 1.389) 13.724 6.373 ( -4.288 -5.834 -1.580) 7.411 6.638 ( -2.606 13.283 4.385) 14.228 6.765 ( 0.717 13.964 -0.978) 14.017 7.864 ( -0.449 2.705 11.867) 12.179 8.386 ( -0.211 4.219 -10.336) 11.166 8.758 ( -2.772 1.022 -0.413) 2.983 8.834 ( 1.309 1.151 -5.915) 6.166 9.798 ( -0.619 -0.018 6.721) 6.750 9.863 ( 0.950 1.410 4.923) 5.208 10.179 ( 2.493 4.706 3.608) 6.432 10.443 ( 3.879 -7.442 -5.789) 10.196 10.921 ( 5.060 5.288 8.974) 11.580 11.009 ( -0.766 -1.519 8.152) 8.327 11.326 ( 1.563 0.864 -1.244) 2.177 11.487 ( -11.251 7.112 -8.548) 15.819 11.655 ( 1.235 2.298 2.423) 3.561 11.875 ( 0.482 5.890 -4.810) 7.620 12.231 ( -7.662 2.166 -0.469) 7.976 12.325 ( -2.650 -2.055 15.832) 16.183 12.537 ( 0.485 3.737 -2.658) 4.611 13.236 ( 8.264 -5.937 16.763) 19.609 13.536 ( -6.643 -0.823 -30.825) 31.544 13.958 ( 6.934 -0.675 -19.735) 20.929 14.946 ( 26.098 -40.293 18.656) 51.504 15.353 ( -20.278 -28.910 -3.283) 35.465 16.145 ( -3.564 1.287 8.564) 9.365 16.590 ( 1.169 10.072 -12.166) 15.838 17.740 ( 31.260 16.517 15.404) 38.565 18.380 ( -37.807 30.736 -19.806) 52.596 20.687 ( 0.122 0.033 4.842) 4.844 20.787 ( -0.498 -0.553 -0.010) 0.744 ======================= Grid point 210 (98/170) ======================= q-point: ( 0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 1.399 5.414 15.715) 16.680 1.267 ( -4.236 5.478 -7.471) 10.186 1.332 ( 0.935 0.142 5.111) 5.197 1.480 ( 3.744 6.865 -1.673) 7.996 1.646 ( 0.101 1.699 1.043) 1.996 1.754 ( 3.137 4.338 0.080) 5.353 2.090 ( -3.459 -5.508 4.923) 8.157 2.242 ( -3.501 0.417 -6.598) 7.481 2.316 ( 3.585 7.053 13.245) 15.428 2.713 ( 8.036 -5.739 1.263) 9.955 2.844 ( -7.198 0.942 1.007) 7.329 2.989 ( 1.277 -1.521 -1.667) 2.593 3.090 ( 2.542 -1.096 -2.605) 3.801 3.126 ( -0.472 -14.321 0.707) 14.346 3.295 ( -4.865 0.076 1.017) 4.970 3.417 ( -2.126 3.113 -0.885) 3.872 3.618 ( -8.403 -1.394 -6.429) 10.671 3.733 ( 1.084 5.467 6.207) 8.342 3.976 ( 3.026 -2.621 -3.685) 5.441 4.103 ( 10.305 0.529 -8.735) 13.519 4.386 ( -4.342 6.922 1.026) 8.236 4.520 ( 8.002 3.094 1.737) 8.754 5.101 ( -6.445 -6.018 -3.473) 9.478 5.182 ( -0.240 -11.464 -0.064) 11.467 5.364 ( -16.268 -3.699 3.314) 17.009 5.675 ( -6.033 -4.253 4.691) 8.746 5.760 ( -5.612 -6.807 -0.809) 8.859 5.868 ( 6.533 3.711 -0.453) 7.528 6.234 ( -5.198 -9.355 -4.062) 11.446 6.570 ( 10.761 -0.759 -2.860) 11.161 6.687 ( 3.140 8.476 3.310) 9.626 6.814 ( 6.627 16.018 0.162) 17.335 8.000 ( 0.529 1.400 11.711) 11.806 8.315 ( 6.434 2.117 -11.066) 12.974 8.718 ( -2.948 0.504 1.072) 3.177 8.804 ( 0.852 0.692 -2.628) 2.848 9.801 ( -2.593 0.319 3.678) 4.511 10.002 ( 7.194 0.394 3.431) 7.980 10.268 ( 2.252 1.569 3.933) 4.796 10.374 ( 0.302 -2.256 -11.608) 11.829 10.972 ( -7.670 -0.164 1.661) 7.849 11.135 ( 3.323 1.949 8.340) 9.186 11.257 ( -4.294 2.520 -4.128) 6.468 11.370 ( 3.210 4.124 2.910) 5.982 11.706 ( 1.057 2.335 1.617) 3.031 11.807 ( -0.488 5.246 -5.368) 7.522 12.168 ( -6.341 2.826 7.872) 10.496 12.440 ( 2.279 -2.702 2.117) 4.120 12.665 ( 3.102 4.797 22.097) 22.823 13.088 ( -6.003 1.826 -29.954) 30.605 13.540 ( 9.153 -8.064 12.066) 17.158 13.836 ( 7.667 -1.386 -23.702) 24.949 14.846 ( -29.656 -21.275 -9.142) 37.625 15.285 ( -5.313 -38.833 13.945) 41.601 16.208 ( 0.404 5.168 4.158) 6.646 16.602 ( 4.494 3.466 -1.402) 5.846 17.726 ( -13.152 42.186 -18.972) 48.089 18.397 ( 26.374 2.802 17.870) 31.981 20.736 ( 0.080 -0.238 3.725) 3.734 20.770 ( -0.830 -0.566 -0.933) 1.371 ======================= Grid point 211 (99/170) ======================= q-point: ( 0.18 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.145 ( -4.271 10.272 -3.567) 11.683 1.153 ( 0.597 8.685 -6.839) 11.071 1.332 ( 5.681 -2.721 0.370) 6.310 1.594 ( 3.059 2.192 0.272) 3.774 1.724 ( 4.347 4.076 8.532) 10.407 1.896 ( 5.625 2.072 7.096) 9.289 2.071 ( -4.239 -4.459 -2.273) 6.559 2.132 ( -3.610 -2.099 4.428) 6.087 2.369 ( -3.070 -5.588 -2.066) 6.702 2.676 ( -12.511 0.503 -3.079) 12.894 2.865 ( 4.076 -7.452 -7.560) 11.371 3.015 ( 0.536 -7.722 -3.028) 8.312 3.041 ( 5.044 6.162 5.348) 9.592 3.135 ( 1.279 -13.608 0.646) 13.683 3.273 ( -5.392 4.532 -7.501) 10.290 3.352 ( 3.978 0.775 -1.264) 4.245 3.530 ( 8.060 10.182 -0.906) 13.018 3.780 ( -1.897 -0.105 3.096) 3.633 3.993 ( 1.668 4.991 0.679) 5.306 4.204 ( 7.569 1.191 -0.267) 7.667 4.379 ( -3.323 2.939 6.965) 8.258 4.637 ( 3.126 2.537 -1.797) 4.409 4.867 ( -12.211 -2.033 -4.939) 13.328 5.162 ( -2.997 -6.845 -0.057) 7.473 5.205 ( -10.538 -9.230 5.838) 15.176 5.537 ( -11.122 -2.645 -1.031) 11.478 5.699 ( -6.686 -5.205 5.148) 9.914 5.932 ( 1.035 7.787 0.250) 7.860 6.139 ( -0.667 -13.468 -4.063) 14.084 6.652 ( 5.545 5.272 -3.388) 8.368 6.787 ( 5.693 4.625 -0.435) 7.348 6.970 ( 10.900 14.128 1.174) 17.882 8.101 ( 3.107 -4.713 1.429) 5.823 8.366 ( 7.629 5.393 -1.791) 9.513 8.695 ( -2.256 -2.041 3.336) 4.515 8.804 ( 0.775 0.601 0.011) 0.981 9.837 ( 2.859 -3.389 2.732) 5.208 10.073 ( 0.354 -1.415 -6.448) 6.611 10.281 ( 2.108 4.010 -3.769) 5.893 10.308 ( -0.947 -1.108 0.943) 1.736 10.902 ( 0.623 6.938 -1.624) 7.152 11.042 ( -5.197 1.143 -6.033) 8.044 11.254 ( -5.278 -2.341 2.234) 6.191 11.533 ( 2.858 0.429 9.400) 9.834 11.656 ( -2.170 2.352 -5.370) 6.251 11.848 ( 4.189 0.015 6.030) 7.342 12.160 ( -5.705 1.490 8.640) 10.460 12.502 ( 1.283 -1.005 3.207) 3.598 12.664 ( -1.876 3.925 -19.766) 20.239 13.095 ( 8.420 6.901 25.412) 27.646 13.672 ( 4.378 -9.811 -21.708) 24.221 13.784 ( 7.988 -7.102 0.630) 10.708 14.352 ( -14.767 -5.921 -7.115) 17.428 15.195 ( -19.559 -27.113 10.121) 34.930 16.200 ( -2.478 12.916 -2.543) 13.395 16.527 ( -18.683 21.561 8.435) 29.750 17.607 ( 20.791 15.232 -19.128) 32.096 18.922 ( 13.892 -8.111 16.782) 23.246 20.729 ( -1.379 -0.974 -1.762) 2.440 20.781 ( 0.487 -0.256 2.041) 2.114 ======================= Grid point 212 (100/170) ======================= q-point: ( 0.27 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.023 ( -5.419 12.675 -5.453) 14.824 1.123 ( 4.051 8.553 -4.365) 10.422 1.411 ( 6.982 -3.016 -3.631) 8.428 1.661 ( 4.073 0.383 1.333) 4.302 1.846 ( 1.373 -2.010 2.509) 3.495 1.979 ( -1.586 -2.503 -2.833) 4.100 2.052 ( 4.577 2.590 4.728) 7.072 2.180 ( -1.111 -0.472 8.873) 8.954 2.242 ( -7.522 -1.311 -4.987) 9.120 2.427 ( -10.462 -3.730 -2.122) 11.308 2.739 ( -3.992 -5.679 -6.036) 9.199 2.990 ( -2.938 -7.434 -9.389) 12.331 3.106 ( 10.228 0.277 -9.102) 13.695 3.156 ( 5.102 -6.121 -6.454) 10.254 3.278 ( 5.634 -2.825 6.584) 9.114 3.458 ( 7.332 1.719 1.394) 7.659 3.684 ( 3.419 5.802 -2.622) 7.227 3.805 ( 8.486 4.807 3.399) 10.328 4.094 ( 2.858 10.862 11.379) 15.989 4.285 ( -3.039 -3.710 1.012) 4.901 4.371 ( -3.467 -3.852 3.310) 6.149 4.509 ( -10.213 2.780 0.673) 10.606 4.766 ( -1.456 5.086 1.041) 5.392 5.076 ( -5.816 -3.313 -3.703) 7.650 5.095 ( -9.935 -5.286 2.731) 11.580 5.358 ( -8.447 -3.590 -0.668) 9.203 5.639 ( -7.600 -4.014 5.806) 10.373 5.922 ( -0.989 4.295 -0.784) 4.477 6.119 ( 0.276 -11.439 -0.042) 11.443 6.697 ( 5.350 6.505 -4.820) 9.704 6.850 ( 3.755 6.999 -1.342) 8.055 7.151 ( 9.323 11.114 0.231) 14.509 8.157 ( 7.497 -6.963 -5.772) 11.748 8.450 ( 0.787 3.834 2.313) 4.546 8.735 ( -0.246 -3.523 7.145) 7.970 8.836 ( 1.591 0.608 3.192) 3.618 9.911 ( -0.538 -3.764 -6.362) 7.412 9.958 ( 3.311 -4.885 -2.855) 6.556 10.236 ( -3.157 -1.306 -5.941) 6.854 10.347 ( 2.604 4.431 3.807) 6.396 10.881 ( -0.781 2.173 -8.610) 8.914 10.985 ( 6.882 5.817 -1.322) 9.107 11.148 ( -9.902 0.758 2.431) 10.224 11.456 ( -7.953 -5.145 -9.013) 13.075 11.610 ( -3.890 3.582 1.177) 5.417 11.993 ( 4.151 -3.113 5.971) 7.910 12.193 ( -3.492 0.231 9.693) 10.306 12.414 ( -4.571 -3.047 -3.771) 6.663 12.765 ( 14.492 8.131 10.584) 19.702 13.335 ( -4.637 -15.640 -13.637) 21.262 13.591 ( 12.974 9.070 11.204) 19.394 13.896 ( 8.337 -5.825 -1.246) 10.246 14.294 ( 5.675 2.459 2.322) 6.607 14.907 ( -25.007 -12.034 3.902) 28.025 16.083 ( -7.256 18.459 -3.671) 20.171 16.291 ( -18.182 29.678 6.113) 35.338 17.825 ( 23.597 -3.184 -11.132) 26.285 19.177 ( 0.174 -13.802 9.447) 16.726 20.687 ( -0.886 -0.934 -2.350) 2.679 20.799 ( -0.107 -1.002 0.420) 1.092 ======================= Grid point 213 (101/170) ======================= q-point: ( 0.36 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( -0.883 4.739 -0.362) 4.834 1.196 ( 7.699 7.336 -0.746) 10.661 1.489 ( 5.562 -0.043 -1.970) 5.901 1.726 ( -0.408 0.192 4.824) 4.845 1.801 ( -5.219 -4.679 -4.064) 8.103 1.912 ( -1.979 0.163 -6.199) 6.510 2.047 ( -5.244 2.206 -3.466) 6.661 2.150 ( 2.480 -1.320 1.761) 3.316 2.251 ( 2.452 1.890 0.983) 3.248 2.384 ( 0.045 -3.320 2.963) 4.451 2.616 ( -4.128 -0.864 -6.480) 7.732 2.850 ( -1.678 3.556 -8.415) 9.288 3.148 ( 10.199 -5.954 -12.301) 17.053 3.215 ( 4.983 -12.860 0.454) 13.799 3.433 ( 6.958 -10.166 4.905) 13.259 3.529 ( 1.716 4.543 2.005) 5.254 3.797 ( 9.201 -0.024 5.467) 10.703 3.952 ( 6.149 8.227 -4.775) 11.326 4.104 ( -8.235 -2.112 -3.310) 9.123 4.288 ( -1.766 1.685 13.015) 13.242 4.402 ( -10.749 1.121 6.928) 12.837 4.415 ( 4.969 -1.559 2.242) 5.670 4.761 ( -3.126 10.128 3.827) 11.269 4.871 ( -8.383 1.795 -6.868) 10.985 4.998 ( -4.155 -2.181 -0.388) 4.709 5.230 ( -7.753 -0.943 -0.998) 7.874 5.601 ( -5.910 -6.058 7.591) 11.369 5.901 ( 0.694 2.559 -2.168) 3.425 6.137 ( -0.647 -9.824 4.064) 10.651 6.707 ( 3.909 5.401 -7.483) 10.023 6.899 ( 3.498 11.349 0.146) 11.877 7.247 ( 3.783 8.283 -2.502) 9.443 8.228 ( 9.610 -6.336 -6.456) 13.198 8.442 ( -4.063 -0.053 1.701) 4.405 8.800 ( 0.159 -3.237 4.949) 5.916 8.918 ( -0.167 0.214 7.344) 7.349 9.764 ( -2.976 -1.211 -8.989) 9.546 10.031 ( 0.182 -9.577 -2.138) 9.814 10.107 ( 1.729 0.161 -8.297) 8.477 10.436 ( 3.725 2.129 3.141) 5.317 10.795 ( 2.388 -2.037 -7.940) 8.538 11.008 ( -10.344 3.465 2.651) 11.226 11.116 ( 10.088 6.529 -2.544) 12.283 11.216 ( -8.704 -7.892 -6.517) 13.436 11.546 ( -4.265 6.133 0.236) 7.474 12.093 ( -2.353 -4.741 5.882) 7.913 12.249 ( 0.776 -3.171 6.587) 7.352 12.312 ( -4.483 -1.874 -2.216) 5.340 13.046 ( 2.939 -9.275 -8.184) 12.714 13.280 ( 16.573 5.390 14.665) 22.776 13.955 ( 12.996 5.548 9.850) 17.225 14.037 ( 6.338 -5.212 2.632) 8.618 14.434 ( -4.186 -9.087 7.732) 12.644 14.513 ( -13.767 17.471 -4.784) 22.753 15.916 ( -11.025 26.082 1.010) 28.334 16.090 ( -10.891 20.758 0.336) 23.444 18.088 ( 18.962 -8.891 -4.252) 21.370 19.153 ( -8.098 -14.989 -0.352) 17.040 20.657 ( 0.223 -0.885 -1.940) 2.143 20.783 ( -1.111 -1.500 -1.343) 2.299 ======================= Grid point 214 (102/170) ======================= q-point: ( 0.45 0.11 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( 5.128 -1.585 8.811) 10.317 1.327 ( 7.321 4.762 1.090) 8.801 1.517 ( -0.514 -1.473 -2.120) 2.632 1.622 ( -7.710 -0.403 -5.411) 9.428 1.749 ( -4.701 -1.072 6.137) 7.805 1.864 ( 1.304 2.365 0.379) 2.727 2.007 ( 5.150 1.951 -4.328) 7.004 2.188 ( -0.195 -3.527 1.546) 3.855 2.297 ( 5.825 -2.435 -5.562) 8.414 2.309 ( -8.811 2.438 -6.960) 11.490 2.466 ( -5.615 3.909 -2.885) 7.425 2.740 ( 3.889 6.456 -14.079) 15.970 3.257 ( 9.180 -13.188 1.363) 16.126 3.322 ( 5.663 -11.066 3.513) 12.917 3.568 ( 1.241 -11.701 3.335) 12.230 3.611 ( 3.377 3.034 3.965) 6.027 3.902 ( 1.354 -5.160 -3.130) 6.185 3.968 ( -3.069 2.164 -1.007) 3.888 4.017 ( 1.358 2.006 2.358) 3.380 4.292 ( -8.547 1.280 1.899) 8.848 4.303 ( -3.234 -1.850 6.337) 7.351 4.532 ( 1.123 6.625 -2.117) 7.045 4.664 ( -5.299 4.501 4.488) 8.275 4.840 ( 3.674 7.705 2.121) 8.796 4.966 ( 2.669 -0.586 -2.713) 3.851 5.091 ( -5.919 2.809 -2.712) 7.091 5.601 ( -6.081 -6.826 9.492) 13.178 5.899 ( 2.788 3.067 -3.553) 5.459 6.185 ( -0.989 -8.827 7.122) 11.385 6.667 ( 2.875 5.034 -9.615) 11.227 6.964 ( 2.702 12.913 2.125) 13.363 7.224 ( -1.108 6.665 -4.966) 8.385 8.320 ( 5.217 -4.716 -2.643) 7.513 8.365 ( -2.909 -2.643 -1.885) 4.359 8.858 ( -0.175 -3.280 5.231) 6.176 8.957 ( -1.508 0.427 3.390) 3.734 9.634 ( -3.377 -1.587 -5.224) 6.419 9.882 ( -3.264 -0.822 -11.126) 11.624 10.171 ( 6.088 -7.766 0.507) 9.881 10.514 ( 3.522 -1.488 -2.504) 4.570 10.804 ( 5.663 -4.009 -2.041) 7.232 10.890 ( -5.914 4.114 1.027) 7.277 11.055 ( -5.840 -6.347 0.765) 8.659 11.248 ( 9.513 3.287 -5.079) 11.274 11.490 ( -4.847 7.729 3.466) 9.760 12.001 ( -6.729 -8.289 -7.701) 13.164 12.224 ( -6.989 0.204 7.085) 9.954 12.350 ( 2.840 -7.355 1.703) 8.066 13.116 ( 12.207 -5.147 1.899) 13.383 13.699 ( 4.895 5.709 8.840) 11.606 13.959 ( -13.667 11.228 1.980) 17.798 14.145 ( -2.006 -12.161 9.512) 15.569 14.322 ( 9.685 10.548 1.336) 14.382 14.617 ( 6.495 10.565 1.004) 12.442 15.757 ( -12.234 28.859 5.405) 31.807 15.969 ( -1.445 14.206 -3.386) 14.676 18.345 ( 14.945 -10.933 1.478) 18.576 18.944 ( -11.271 -14.079 -8.002) 19.730 20.654 ( 1.307 -0.838 -0.911) 1.800 20.738 ( -1.801 -1.526 -2.417) 3.379 ======================= Grid point 215 (103/170) ======================= q-point: (-0.45 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.183 ( 0.517 -0.723 9.762) 9.803 1.385 ( -8.671 -1.740 -2.633) 9.227 1.427 ( 1.550 0.389 1.181) 1.987 1.515 ( 0.149 -2.249 -5.034) 5.516 1.713 ( -6.248 -4.873 3.355) 8.604 1.931 ( 0.081 2.830 -0.166) 2.836 2.001 ( -7.050 7.683 -2.639) 10.756 2.110 ( 3.358 5.580 1.059) 6.598 2.198 ( 3.604 -4.258 -1.889) 5.890 2.363 ( 9.357 -5.229 -7.795) 13.254 2.401 ( -0.778 5.406 1.067) 5.565 2.667 ( 5.719 6.284 -13.671) 16.096 3.294 ( -8.297 -13.549 0.695) 15.903 3.443 ( 2.242 -9.166 -1.690) 9.586 3.615 ( 1.965 -7.290 5.415) 9.291 3.633 ( -7.743 -4.710 -0.545) 9.079 3.781 ( -6.569 4.110 3.923) 8.686 3.949 ( 2.310 -4.585 0.632) 5.173 4.136 ( -0.311 -4.198 4.774) 6.365 4.198 ( 2.623 6.737 -0.887) 7.284 4.316 ( -3.165 2.375 0.504) 3.989 4.473 ( -0.318 6.426 1.607) 6.631 4.744 ( 4.443 -1.403 3.866) 6.054 4.906 ( 4.174 5.801 -2.276) 7.501 4.998 ( 0.185 2.407 -3.345) 4.126 5.057 ( 9.549 2.610 -1.477) 10.009 5.600 ( -6.965 -6.332 9.799) 13.587 5.911 ( 3.499 3.374 -3.764) 6.148 6.253 ( -1.208 -7.023 8.304) 10.943 6.599 ( 2.621 4.012 -10.864) 11.874 7.011 ( -1.971 11.094 3.068) 11.677 7.137 ( -1.247 8.057 -4.644) 9.383 8.196 ( -11.133 -2.209 0.093) 11.351 8.449 ( 9.287 -4.679 -3.593) 11.002 8.867 ( -4.882 -0.702 3.896) 6.285 9.007 ( 5.180 -2.126 1.578) 5.818 9.555 ( -2.660 -0.713 0.331) 2.774 9.732 ( -2.091 -0.940 -8.099) 8.418 10.271 ( 2.866 -5.152 2.819) 6.535 10.464 ( 0.355 -7.436 -10.932) 13.226 10.807 ( -2.882 1.515 0.833) 3.361 10.956 ( 10.839 1.336 -1.632) 11.042 11.031 ( -2.139 -4.375 5.162) 7.097 11.294 ( 4.926 -2.604 -8.391) 10.073 11.491 ( -3.643 3.722 10.773) 11.965 11.806 ( -3.467 -2.826 -8.728) 9.808 12.215 ( -5.031 0.484 8.456) 9.851 12.390 ( 1.693 -8.354 -0.154) 8.525 13.219 ( -19.663 4.085 1.074) 20.111 13.592 ( 14.053 0.563 -2.319) 14.254 14.002 ( -7.709 0.792 10.953) 13.417 14.249 ( 0.816 11.808 8.752) 14.720 14.490 ( 7.354 5.004 0.183) 8.897 14.659 ( 3.469 4.751 -6.449) 8.729 15.688 ( -4.685 21.581 8.808) 23.775 15.970 ( 5.970 18.108 -3.489) 19.383 18.587 ( 2.272 -13.845 1.074) 14.072 18.661 ( -2.331 -11.067 -6.648) 13.119 20.671 ( -0.455 -1.298 -0.799) 1.590 20.684 ( 0.121 -0.779 -1.436) 1.638 ======================= Grid point 216 (104/170) ======================= q-point: (-0.36 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( -11.458 4.372 -1.833) 12.400 1.232 ( -9.940 2.037 -1.857) 10.315 1.391 ( -10.440 -5.078 -1.067) 11.658 1.483 ( 1.049 -4.685 0.042) 4.802 1.661 ( -0.206 -5.120 3.793) 6.376 1.822 ( -3.852 2.008 3.239) 5.418 2.066 ( -0.565 6.564 -0.291) 6.594 2.143 ( 6.112 4.904 2.427) 8.204 2.318 ( 7.202 -0.327 -0.279) 7.215 2.428 ( 3.925 3.649 2.081) 5.749 2.443 ( 7.434 -3.366 -7.480) 11.070 2.654 ( 7.690 3.657 -7.497) 11.346 3.084 ( -18.995 -5.388 -4.524) 20.256 3.182 ( -14.626 -4.998 0.340) 15.460 3.641 ( -0.117 -11.172 -0.440) 11.182 3.674 ( -0.522 -1.523 3.588) 3.933 3.740 ( -4.225 -1.115 0.866) 4.455 3.944 ( -2.445 -2.491 -1.405) 3.762 4.142 ( 3.394 5.978 -5.315) 8.689 4.250 ( -1.558 -1.046 6.878) 7.129 4.373 ( 2.948 4.746 11.023) 12.358 4.571 ( 10.441 -3.174 0.410) 10.920 4.802 ( 0.913 -0.473 -4.469) 4.586 4.925 ( 3.036 9.221 -3.108) 10.193 5.039 ( 8.567 -2.146 -2.249) 9.114 5.227 ( 12.253 -1.366 -1.451) 12.414 5.593 ( -5.927 -5.242 8.647) 11.721 5.929 ( 2.973 2.565 -2.588) 4.703 6.315 ( -1.409 -4.861 6.450) 8.198 6.520 ( 1.641 0.334 -9.988) 10.127 6.936 ( -6.805 9.160 -0.368) 11.417 7.122 ( -0.657 11.604 1.225) 11.687 8.014 ( -11.657 -1.567 1.189) 11.822 8.542 ( 5.761 -3.778 -2.215) 7.237 8.821 ( -4.245 0.335 2.318) 4.848 9.134 ( 7.849 -4.323 1.450) 9.077 9.568 ( -0.282 1.593 6.537) 6.734 9.646 ( -1.038 -1.105 -2.849) 3.227 10.242 ( -4.367 -5.367 -8.928) 11.295 10.372 ( -1.189 -3.001 -1.555) 3.583 10.782 ( 0.410 -3.699 -3.299) 4.974 11.007 ( -3.677 4.710 2.001) 6.302 11.135 ( 10.918 -0.421 -2.288) 11.163 11.252 ( 2.881 -8.397 -7.784) 11.807 11.605 ( -0.425 -3.147 12.147) 12.555 11.765 ( 4.189 3.782 2.863) 6.329 12.243 ( -2.167 0.396 7.540) 7.855 12.403 ( -0.485 -7.404 0.025) 7.420 12.802 ( -22.180 13.644 -3.956) 26.340 13.728 ( -7.264 -8.944 -2.642) 11.821 14.122 ( 9.609 -3.025 12.178) 15.805 14.216 ( -4.711 15.983 -3.112) 16.951 14.501 ( -3.421 0.964 -1.452) 3.840 14.686 ( 9.905 7.512 -9.065) 15.386 15.789 ( 3.411 13.940 9.507) 17.215 16.079 ( 10.569 23.780 -1.264) 26.053 18.262 ( -15.675 -11.324 -13.189) 23.407 18.916 ( 12.927 -13.548 9.993) 21.226 20.620 ( -2.143 -0.904 -1.211) 2.622 20.716 ( 1.804 -0.747 1.017) 2.201 ======================= Grid point 217 (105/170) ======================= q-point: (-0.27 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.897 ( -10.133 9.948 -2.410) 14.403 1.015 ( -11.654 4.032 -3.041) 12.701 1.218 ( -13.408 3.802 9.533) 16.885 1.455 ( -5.515 -7.227 -0.083) 9.091 1.720 ( -1.281 -6.642 4.549) 8.152 1.893 ( 8.177 1.714 4.375) 9.430 2.084 ( 1.881 4.514 3.301) 5.900 2.239 ( -1.761 5.930 -0.125) 6.188 2.282 ( -8.947 3.925 -2.316) 10.041 2.424 ( 6.251 -1.009 -3.110) 7.055 2.598 ( 5.954 -1.517 3.121) 6.892 2.708 ( 5.329 -2.341 -5.677) 8.131 2.776 ( -8.959 1.762 1.215) 9.211 3.065 ( -3.815 -7.848 2.203) 9.000 3.549 ( -6.276 -7.254 -3.913) 10.359 3.666 ( -3.634 -9.246 -3.689) 10.597 3.676 ( -2.830 8.036 -0.399) 8.529 3.850 ( -4.099 1.896 -3.398) 5.652 4.144 ( 2.520 6.094 0.877) 6.653 4.384 ( 4.614 -3.848 3.622) 7.015 4.531 ( 2.062 2.274 14.332) 14.657 4.696 ( -1.694 -0.477 -11.397) 11.532 4.747 ( 9.213 -2.592 -3.689) 10.257 4.981 ( 8.030 3.526 -1.067) 8.834 5.175 ( 9.798 -3.975 -1.075) 10.628 5.377 ( 7.769 -3.505 -2.304) 8.828 5.625 ( 0.537 -4.001 6.942) 8.031 5.952 ( 2.205 0.656 -0.833) 2.446 6.319 ( -1.055 -4.947 -3.985) 6.439 6.454 ( -1.841 -3.600 -0.123) 4.045 6.836 ( -4.959 11.897 0.372) 12.894 7.088 ( -6.328 12.362 1.792) 14.003 7.862 ( -10.151 -0.902 3.716) 10.848 8.582 ( 2.056 -1.267 -1.854) 3.044 8.793 ( -2.162 1.025 2.226) 3.268 9.255 ( 6.652 -7.583 -4.133) 10.901 9.633 ( -0.049 -0.960 3.257) 3.396 9.690 ( 1.693 4.838 11.868) 12.928 10.036 ( -5.645 -7.348 -9.701) 13.415 10.331 ( -4.369 4.170 1.888) 6.328 10.725 ( -1.724 -6.933 -3.900) 8.140 10.953 ( -3.615 6.817 -1.127) 7.798 11.233 ( 5.068 -3.046 -1.876) 6.203 11.309 ( 9.696 -3.961 -1.941) 10.652 11.663 ( 2.076 4.860 -0.941) 5.367 12.003 ( 6.913 -7.111 18.100) 20.639 12.254 ( -7.188 -1.821 -2.214) 7.739 12.373 ( -4.003 3.623 11.386) 12.601 12.552 ( -3.564 6.176 -1.146) 7.222 13.439 ( -17.590 2.577 -9.744) 20.273 13.972 ( -8.612 -5.178 -10.341) 14.419 14.299 ( -6.770 11.334 -0.126) 13.203 14.488 ( 4.941 -13.064 -8.863) 16.542 14.851 ( 20.210 9.399 3.315) 22.534 15.951 ( 5.228 10.070 5.944) 12.809 16.284 ( 13.465 27.441 3.497) 30.766 17.836 ( -19.545 -8.508 -12.960) 24.947 19.239 ( 13.329 -15.874 8.915) 22.564 20.588 ( -1.449 -0.417 0.876) 1.743 20.755 ( 1.236 -0.775 1.534) 2.117 ======================= Grid point 218 (106/170) ======================= q-point: (-0.18 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.757 ( -12.506 9.402 6.781) 17.052 0.873 ( -7.107 11.620 5.763) 14.791 1.221 ( 0.137 12.345 14.469) 19.021 1.366 ( -4.311 -3.640 2.330) 6.105 1.730 ( -5.428 6.449 8.662) 12.087 2.019 ( -15.706 1.197 13.914) 21.017 2.077 ( 6.664 -3.225 -0.724) 7.439 2.170 ( 2.513 3.045 2.004) 4.428 2.307 ( 5.513 -0.650 -3.372) 6.495 2.467 ( 4.059 -3.719 -4.332) 7.005 2.629 ( -1.536 -3.556 3.436) 5.178 2.700 ( 2.254 -5.957 -2.677) 6.909 2.862 ( 7.468 2.598 8.205) 11.395 3.078 ( 2.304 -3.093 0.264) 3.866 3.385 ( -8.110 -0.022 -3.910) 9.004 3.518 ( -6.683 -8.309 -4.707) 11.655 3.598 ( -4.227 6.940 -3.857) 8.995 3.793 ( 1.254 0.475 -3.613) 3.854 4.200 ( 0.545 6.284 -0.018) 6.308 4.405 ( -3.862 1.912 -0.219) 4.315 4.538 ( -3.205 -3.400 -7.279) 8.650 4.728 ( 4.378 -4.244 1.783) 6.353 4.795 ( 7.740 1.831 -2.550) 8.353 5.123 ( 6.148 -6.881 1.728) 9.388 5.327 ( 10.301 -6.599 -0.543) 12.246 5.467 ( 7.760 -1.538 -0.485) 7.926 5.744 ( 5.414 -2.527 4.017) 7.199 5.978 ( 1.404 -0.970 -0.027) 1.707 6.202 ( -3.936 -9.172 -8.000) 12.791 6.455 ( -2.168 -3.368 4.617) 6.112 6.783 ( -2.625 12.924 0.448) 13.195 6.948 ( -12.378 13.447 0.853) 18.297 7.776 ( -7.118 0.010 6.536) 9.664 8.574 ( -0.278 2.428 -2.279) 3.342 8.799 ( 0.375 2.460 1.141) 2.737 9.177 ( -2.473 -6.353 -16.940) 18.260 9.691 ( -0.305 -0.857 6.790) 6.850 9.777 ( -5.206 1.390 5.615) 7.782 10.012 ( 4.367 -4.094 9.581) 11.297 10.300 ( -1.395 4.494 2.535) 5.345 10.705 ( 1.404 -3.215 3.533) 4.979 10.868 ( -3.836 8.629 -2.290) 9.717 11.291 ( 2.758 -1.804 -0.050) 3.296 11.459 ( 8.783 -3.065 1.495) 9.421 11.682 ( 1.657 5.823 -1.184) 6.169 12.044 ( -8.187 3.098 -3.429) 9.401 12.271 ( 2.902 -7.589 7.027) 10.742 12.540 ( 4.895 -7.322 5.958) 10.633 12.597 ( 3.069 3.503 16.893) 17.523 12.988 ( -18.901 5.617 -17.711) 26.504 13.768 ( -3.702 -5.756 -1.376) 6.981 14.173 ( -2.884 10.526 -6.080) 12.493 14.343 ( -0.960 -4.514 -19.322) 19.865 15.262 ( 17.934 -10.964 7.516) 22.323 16.070 ( 3.140 7.887 3.522) 9.191 16.604 ( 19.144 29.402 8.403) 36.077 17.357 ( -22.817 -3.502 -11.886) 25.964 19.453 ( 5.887 -16.027 -4.841) 17.747 20.594 ( -0.579 -0.076 3.176) 3.229 20.783 ( 0.241 -0.612 1.197) 1.366 ======================= Grid point 219 (107/170) ======================= q-point: (-0.09 0.11 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.730 ( -2.683 7.685 16.618) 18.504 0.829 ( -7.635 11.633 10.893) 17.671 1.356 ( -0.978 2.638 6.275) 6.877 1.455 ( 6.507 12.687 5.708) 15.359 1.764 ( -5.497 7.644 8.855) 12.925 1.989 ( -9.448 2.334 14.409) 17.388 2.087 ( -5.828 4.759 -9.175) 11.866 2.130 ( 2.925 -6.879 -4.163) 8.556 2.375 ( 1.789 -2.727 -1.090) 3.439 2.516 ( 6.250 -6.696 -0.119) 9.160 2.728 ( 7.304 -3.338 8.748) 11.875 2.797 ( 6.286 -7.481 6.801) 11.905 3.086 ( -0.101 7.148 6.701) 9.798 3.144 ( 9.402 -13.180 0.721) 16.206 3.247 ( -0.357 6.391 0.044) 6.401 3.399 ( -2.747 -7.140 -2.468) 8.039 3.482 ( -3.224 6.613 -3.124) 7.993 3.784 ( 1.345 -2.451 -2.787) 3.948 4.116 ( -2.859 4.550 -8.232) 9.831 4.263 ( -6.872 6.771 -7.912) 12.477 4.464 ( -3.303 -4.760 0.361) 5.805 4.673 ( -6.077 -0.313 -3.246) 6.896 4.966 ( 11.002 -2.589 -0.386) 11.310 5.197 ( 1.111 -11.778 2.018) 12.001 5.494 ( 10.617 -7.714 -0.451) 13.131 5.612 ( 6.447 -3.525 2.343) 7.712 5.830 ( -0.230 -1.527 -0.754) 1.718 5.961 ( -3.289 0.441 -3.410) 4.758 6.126 ( 5.896 -9.650 0.416) 11.316 6.456 ( -3.323 -5.115 2.237) 6.497 6.712 ( -8.823 16.033 0.406) 18.304 6.788 ( -4.443 11.957 1.085) 12.802 7.777 ( -3.378 1.430 9.326) 10.022 8.510 ( -2.666 5.881 -5.831) 8.700 8.808 ( -0.346 2.961 -1.214) 3.219 8.927 ( -3.331 -1.713 -12.904) 13.437 9.727 ( -1.796 -2.390 5.795) 6.521 9.810 ( -0.956 1.798 8.276) 8.523 10.133 ( -0.945 4.769 4.886) 6.893 10.372 ( 6.145 -6.292 1.806) 8.978 10.820 ( -0.942 3.862 4.066) 5.686 10.855 ( 6.258 5.067 7.854) 11.248 11.319 ( 0.388 -1.873 0.718) 2.043 11.594 ( 4.359 -0.614 2.044) 4.853 11.672 ( -2.968 4.332 -0.968) 5.340 11.924 ( -2.725 4.031 -2.811) 5.619 12.289 ( -5.135 -2.627 4.149) 7.105 12.471 ( -10.461 4.331 -15.452) 19.156 12.606 ( -3.478 1.077 -5.237) 6.379 12.919 ( 5.245 -6.995 21.880) 23.562 13.891 ( 0.642 -6.692 -6.031) 9.031 14.019 ( 10.086 -0.345 -23.705) 25.764 14.286 ( 15.923 -9.008 11.604) 21.664 15.496 ( 2.286 -24.023 3.012) 24.319 16.127 ( -1.674 4.143 4.965) 6.680 16.876 ( -17.678 2.053 -13.134) 22.119 17.101 ( 27.124 29.082 13.481) 41.990 19.172 ( -23.331 0.051 -22.858) 32.662 20.633 ( -0.041 0.055 4.674) 4.674 20.790 ( -0.401 -0.316 0.656) 0.831 ======================= Grid point 220 (108/170) ======================= q-point: ( 0.00 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.040 ( -2.540 6.472 9.413) 11.702 1.148 ( 7.080 6.818 17.049) 19.680 1.443 ( -3.885 -4.183 -5.069) 7.635 1.594 ( 2.451 8.491 -0.011) 8.837 1.692 ( -5.942 -3.484 0.710) 6.925 1.982 ( -3.106 4.482 -8.712) 10.277 2.003 ( 0.697 -3.277 -2.148) 3.979 2.225 ( 0.296 -5.842 -4.805) 7.570 2.461 ( 0.653 -6.141 5.045) 7.974 2.515 ( -0.727 20.141 12.067) 23.490 2.742 ( 4.160 -12.064 3.611) 13.262 2.854 ( -2.691 -12.915 -2.910) 13.510 3.000 ( -1.220 5.520 0.570) 5.681 3.128 ( 6.755 3.124 4.465) 8.679 3.335 ( -2.136 4.388 7.372) 8.840 3.517 ( -2.450 2.554 -3.239) 4.798 3.617 ( 9.598 5.270 7.056) 13.026 3.700 ( -5.932 4.125 5.393) 9.015 4.079 ( 4.708 1.959 -9.614) 10.883 4.151 ( -4.791 4.810 -13.603) 15.203 4.466 ( 2.037 2.043 4.089) 5.004 4.599 ( -5.316 4.210 -0.364) 6.791 4.896 ( -0.656 -11.200 2.434) 11.480 5.053 ( 0.845 -7.219 -4.363) 8.477 5.416 ( 1.744 -10.971 5.348) 12.329 5.604 ( -7.662 -6.062 -3.841) 10.498 5.688 ( 11.013 -4.454 -1.086) 11.929 5.768 ( -7.107 -5.382 -4.640) 10.050 6.260 ( -4.056 -3.984 0.856) 5.750 6.302 ( 12.465 -2.482 -0.492) 12.720 6.916 ( -6.621 14.722 4.768) 16.832 7.040 ( 2.835 13.826 -0.515) 14.123 7.937 ( 0.471 4.978 11.095) 12.170 8.481 ( -2.627 5.003 -13.453) 14.591 8.735 ( -1.652 -3.708 1.491) 4.324 8.841 ( -0.506 -0.743 -4.588) 4.675 9.801 ( 4.710 -0.084 6.227) 7.808 9.881 ( -2.257 0.900 3.721) 4.444 10.231 ( 2.651 -3.304 2.309) 4.824 10.293 ( 1.519 -4.207 -1.868) 4.848 10.910 ( 1.597 -1.793 12.551) 12.779 11.036 ( -4.856 0.295 3.859) 6.210 11.453 ( 4.401 10.946 0.033) 11.798 11.622 ( -5.798 5.292 -2.000) 8.101 11.771 ( -1.759 8.800 1.935) 9.180 11.980 ( 2.722 4.815 -4.741) 7.285 12.263 ( -9.645 -2.048 1.083) 9.920 12.279 ( -1.309 -0.859 2.989) 3.375 12.590 ( 3.471 2.546 5.986) 7.373 13.109 ( 4.847 -6.663 14.315) 16.517 13.558 ( -3.500 4.326 -31.855) 32.337 13.931 ( 8.398 -1.662 -18.128) 20.048 14.427 ( 12.457 -13.181 16.908) 24.795 14.911 ( -18.209 -15.815 -5.591) 24.758 16.026 ( -5.751 -11.785 10.374) 16.721 16.554 ( 8.152 -10.978 -14.045) 19.602 18.162 ( 11.780 23.824 16.515) 31.291 18.847 ( -12.759 16.270 -18.748) 27.911 20.688 ( 0.428 0.143 4.036) 4.062 20.773 ( -0.696 -0.871 -0.104) 1.120 ======================= Grid point 221 (109/170) ======================= q-point: ( 0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( 0.526 0.921 12.050) 12.097 1.299 ( -0.911 -0.109 -5.935) 6.005 1.382 ( -2.986 1.909 7.459) 8.258 1.592 ( 5.167 4.227 -1.836) 6.924 1.730 ( 3.085 6.140 4.261) 8.085 1.858 ( 1.427 4.090 -6.124) 7.501 1.965 ( -5.665 -5.656 2.859) 8.500 2.201 ( 3.619 -4.940 -7.298) 9.527 2.447 ( -9.149 4.135 4.719) 11.094 2.637 ( 2.383 -3.892 2.925) 5.420 2.758 ( -3.119 -13.578 -2.719) 14.194 2.802 ( 1.579 -13.896 0.313) 13.989 2.972 ( -4.529 9.951 5.255) 12.130 3.237 ( -1.203 9.309 2.184) 9.637 3.357 ( -0.706 3.035 -2.779) 4.175 3.442 ( -0.160 5.114 3.007) 5.935 3.663 ( -4.829 5.285 6.444) 9.632 3.855 ( 6.158 8.626 -1.362) 10.685 3.942 ( 0.297 -0.306 -5.495) 5.512 4.140 ( 11.166 3.172 -7.179) 13.648 4.515 ( -3.573 5.491 -0.692) 6.588 4.580 ( 5.760 2.604 3.922) 7.439 4.894 ( -4.808 -13.782 3.993) 15.133 4.993 ( -1.568 -5.934 -4.427) 7.568 5.337 ( -13.171 -2.536 -1.534) 13.501 5.529 ( -2.054 -12.385 4.126) 13.215 5.583 ( -7.894 -7.866 -2.003) 11.322 5.887 ( 11.415 -3.841 -2.076) 12.222 6.128 ( -7.297 -0.512 -1.845) 7.544 6.521 ( 13.682 -3.514 -3.981) 14.676 6.907 ( -1.191 13.291 4.824) 14.190 7.120 ( 7.052 14.476 0.488) 16.110 8.048 ( -2.678 3.652 9.641) 10.652 8.360 ( 5.223 2.653 -9.371) 11.051 8.701 ( -4.853 -3.053 1.290) 5.877 8.806 ( 0.176 -0.721 -1.002) 1.247 9.815 ( -4.060 1.213 0.902) 4.332 9.985 ( 6.281 -2.045 3.341) 7.402 10.266 ( 1.138 -2.081 -0.897) 2.536 10.308 ( 3.195 -4.784 -3.846) 6.920 10.949 ( -5.246 -0.972 5.202) 7.452 11.123 ( 4.222 -1.144 7.577) 8.749 11.423 ( -8.786 11.921 -6.890) 16.333 11.492 ( -2.572 7.030 6.792) 10.108 11.779 ( -2.847 4.548 2.690) 6.002 11.916 ( -1.678 5.134 -6.650) 8.567 12.164 ( -7.144 -4.335 6.327) 10.481 12.373 ( 2.745 -3.191 5.976) 7.310 12.783 ( 5.424 6.683 12.651) 15.301 13.133 ( 2.092 -0.091 -26.911) 26.992 13.388 ( 2.372 -3.096 11.239) 11.897 13.809 ( 7.190 -1.086 -23.327) 24.434 14.511 ( -19.207 -10.638 -7.032) 23.055 14.765 ( 4.233 -14.366 15.477) 21.537 16.140 ( 6.669 -10.007 7.912) 14.395 16.620 ( 14.700 -5.250 -10.325) 18.715 18.354 ( -13.296 20.442 -9.005) 25.995 18.552 ( 4.525 14.774 8.808) 17.786 20.729 ( -0.553 -0.546 2.584) 2.698 20.757 ( -0.443 -0.776 -0.332) 0.953 ======================= Grid point 222 (110/170) ======================= q-point: ( 0.18 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( 6.852 -1.791 -2.062) 7.376 1.287 ( -2.018 2.913 -6.249) 7.184 1.334 ( 1.754 5.391 5.618) 7.981 1.658 ( -1.335 4.547 -1.192) 4.887 1.826 ( 7.370 2.706 3.796) 8.721 1.922 ( -2.305 -6.411 5.219) 8.582 1.934 ( 1.675 1.227 2.164) 2.999 2.172 ( 0.184 3.604 -2.036) 4.144 2.276 ( -10.697 -1.073 -1.184) 10.816 2.649 ( -1.618 -8.046 -1.548) 8.351 2.669 ( -8.461 -9.406 -1.800) 12.779 2.802 ( 1.874 -14.050 -5.081) 15.057 2.895 ( -3.954 -1.623 -0.759) 4.341 3.273 ( -4.638 5.020 3.108) 7.508 3.284 ( 2.405 3.855 1.614) 4.822 3.514 ( 5.837 14.549 -8.343) 17.758 3.717 ( -2.047 -0.267 6.155) 6.492 3.774 ( 7.842 10.291 -3.343) 13.363 4.092 ( 3.629 3.839 8.632) 10.121 4.242 ( 8.416 3.889 -3.780) 10.012 4.441 ( -5.148 2.486 -1.554) 5.924 4.697 ( -0.976 2.289 1.652) 2.987 4.793 ( -5.582 -5.455 1.606) 7.969 4.964 ( 0.914 -6.027 0.094) 6.097 5.138 ( -9.362 -3.415 0.119) 9.966 5.389 ( -9.480 -12.168 -2.499) 15.625 5.570 ( -4.086 -8.265 6.948) 11.545 5.912 ( -4.374 -9.394 -4.698) 11.378 6.093 ( 5.846 8.191 -1.244) 10.140 6.652 ( 10.294 -2.656 -6.872) 12.659 6.970 ( 2.628 12.290 3.839) 13.141 7.265 ( 8.787 14.302 1.683) 16.870 8.049 ( -0.671 -0.484 -1.184) 1.445 8.440 ( 5.832 2.696 2.363) 6.845 8.635 ( -4.753 -4.633 2.962) 7.269 8.809 ( -0.156 -0.189 1.350) 1.372 9.779 ( -0.166 -2.059 -0.276) 2.084 10.030 ( 0.269 -2.543 -6.056) 6.573 10.244 ( -1.237 -5.405 -3.013) 6.311 10.339 ( 3.768 0.558 -0.009) 3.809 10.957 ( 0.377 -0.116 3.046) 3.072 11.151 ( -3.108 6.910 -5.880) 9.591 11.262 ( -4.855 5.815 0.177) 7.577 11.592 ( -1.377 4.246 13.845) 14.546 11.654 ( -8.245 -2.064 -7.159) 11.113 11.887 ( 0.192 2.800 3.896) 4.801 12.134 ( -5.990 -4.263 7.390) 10.424 12.426 ( -4.936 -5.302 3.702) 8.135 12.779 ( 3.885 5.201 -12.820) 14.369 13.161 ( 5.810 -3.533 0.683) 6.835 13.445 ( 0.227 -7.495 0.693) 7.531 13.816 ( 13.620 9.687 -1.987) 16.832 14.240 ( -5.311 -2.284 -4.790) 7.508 14.909 ( -1.751 -3.550 9.750) 10.522 16.329 ( 8.270 -1.669 0.762) 8.471 16.758 ( 8.383 3.636 -0.792) 9.172 17.984 ( -9.124 20.316 -16.285) 27.590 18.765 ( 0.801 -6.094 13.943) 15.238 20.706 ( -1.716 -1.263 -1.408) 2.553 20.769 ( -0.078 -0.980 1.442) 1.745 ======================= Grid point 223 (111/170) ======================= q-point: ( 0.27 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -1.114 0.863 -6.798) 6.943 1.321 ( -3.814 13.565 -2.035) 14.237 1.382 ( 11.537 1.033 -4.123) 12.295 1.660 ( -1.133 -1.176 6.688) 6.884 1.856 ( -2.223 0.198 -6.511) 6.883 1.907 ( 2.891 -0.412 -4.075) 5.013 2.014 ( 1.716 -2.664 6.568) 7.292 2.167 ( -2.329 -3.599 3.811) 5.736 2.234 ( 1.882 0.376 1.213) 2.271 2.440 ( -11.011 3.430 -2.234) 11.747 2.605 ( 0.946 -5.841 -3.808) 7.036 2.776 ( 2.656 -12.257 -5.657) 13.758 2.902 ( 0.090 -9.493 4.579) 10.540 3.190 ( -3.534 -2.073 1.015) 4.221 3.376 ( 0.166 8.113 -9.188) 12.259 3.472 ( 7.101 0.875 -3.773) 8.089 3.707 ( -0.685 2.974 3.459) 4.613 4.004 ( 10.092 9.775 2.709) 14.309 4.194 ( 0.441 -1.142 4.201) 4.375 4.273 ( -8.873 0.127 -3.897) 9.692 4.354 ( 4.806 6.048 4.520) 8.950 4.559 ( -10.896 1.867 2.684) 11.376 4.851 ( 2.917 3.413 2.352) 5.068 4.990 ( 1.012 -2.492 -0.605) 2.757 5.025 ( -5.639 -3.249 1.008) 6.586 5.232 ( -6.709 -8.966 -0.658) 11.217 5.557 ( -6.993 -6.980 7.157) 12.200 5.784 ( -3.990 -9.354 -3.918) 10.898 6.165 ( 4.140 8.588 -1.569) 9.663 6.720 ( 8.337 -1.330 -7.931) 11.583 7.061 ( 4.218 12.810 2.467) 13.711 7.407 ( 5.865 13.325 1.204) 14.609 8.047 ( 4.412 -3.934 -4.146) 7.221 8.474 ( -3.701 -1.744 0.933) 4.196 8.675 ( 0.243 -2.357 9.037) 9.342 8.836 ( 0.706 -0.506 3.347) 3.458 9.798 ( 2.076 -5.611 -0.679) 6.021 9.915 ( -1.756 -0.824 -9.763) 9.954 10.176 ( -1.845 -5.027 -3.855) 6.598 10.394 ( 1.544 -0.387 0.772) 1.769 10.921 ( -1.358 1.710 -11.872) 12.071 11.105 ( 4.011 6.748 0.720) 7.884 11.190 ( -6.438 3.446 1.516) 7.458 11.377 ( -11.313 -2.777 -9.942) 15.314 11.677 ( -3.363 2.806 5.660) 7.157 11.972 ( 2.084 -0.977 6.129) 6.547 12.121 ( -6.360 -6.480 6.653) 11.256 12.330 ( -6.285 -5.369 0.497) 8.281 12.884 ( 11.658 2.746 4.144) 12.674 13.031 ( -3.771 -13.220 -7.468) 15.645 13.642 ( 5.021 -2.954 15.513) 16.571 14.097 ( 22.329 26.035 -5.200) 34.690 14.204 ( -1.939 -6.926 7.652) 10.502 14.956 ( -0.042 12.245 2.670) 12.532 16.381 ( 1.462 10.640 -5.355) 12.001 16.813 ( -6.729 20.170 5.786) 22.036 17.780 ( 5.331 0.134 -13.695) 14.697 18.847 ( -4.928 -18.335 7.227) 20.314 20.662 ( -1.205 -1.501 -2.090) 2.841 20.770 ( -0.973 -1.992 0.165) 2.223 ======================= Grid point 224 (112/170) ======================= q-point: ( 0.36 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.046 ( -6.342 6.565 -2.981) 9.603 1.342 ( 5.646 8.979 -0.911) 10.645 1.486 ( 6.559 -1.473 -5.039) 8.401 1.686 ( -4.609 -3.599 4.141) 7.165 1.809 ( 2.449 5.863 -3.580) 7.293 1.877 ( 3.299 -3.161 -9.563) 10.598 2.070 ( -6.393 -1.823 1.398) 6.793 2.099 ( 0.482 -1.266 -0.307) 1.389 2.252 ( 1.280 -1.195 1.538) 2.330 2.418 ( 0.079 4.751 4.219) 6.355 2.596 ( 1.542 -1.618 -3.677) 4.303 2.791 ( 5.288 -7.729 -1.193) 9.441 2.962 ( 0.349 -8.867 3.857) 9.676 3.168 ( -0.799 2.398 -13.226) 13.465 3.236 ( 1.313 -9.739 4.324) 10.736 3.521 ( -0.489 -6.680 -2.027) 6.998 3.798 ( 1.422 4.532 8.400) 9.650 3.969 ( -4.225 -1.675 -7.409) 8.692 4.189 ( -0.972 -6.475 2.412) 6.978 4.252 ( 3.165 9.166 -3.565) 10.332 4.415 ( -8.700 0.869 3.907) 9.577 4.524 ( 2.531 6.995 9.542) 12.099 4.892 ( 1.316 2.273 0.028) 2.626 4.936 ( -4.265 4.814 -2.519) 6.907 4.993 ( 0.433 3.175 -0.286) 3.217 5.177 ( -2.417 -3.697 1.967) 4.836 5.507 ( -8.379 -5.186 7.619) 12.456 5.727 ( 0.558 -12.375 -1.203) 12.446 6.200 ( 1.744 9.322 0.010) 9.484 6.748 ( 6.402 0.457 -9.118) 11.151 7.154 ( 4.417 13.630 1.590) 14.416 7.460 ( 0.372 12.258 -0.855) 12.293 8.102 ( 7.447 -6.044 -3.556) 10.229 8.401 ( -6.212 -4.208 1.015) 7.572 8.756 ( -0.792 -1.188 6.566) 6.720 8.902 ( 0.092 -1.702 6.170) 6.401 9.738 ( -2.718 -1.451 -8.357) 8.907 9.862 ( 2.284 -6.322 -1.833) 6.967 10.114 ( -0.486 -0.497 -5.034) 5.082 10.407 ( 1.060 -4.406 -0.605) 4.572 10.747 ( 1.074 -2.986 -17.242) 17.532 11.063 ( -8.933 -0.423 0.602) 8.963 11.147 ( -6.250 3.537 -3.475) 7.978 11.210 ( 6.351 2.646 -2.004) 7.166 11.655 ( -4.333 4.590 3.324) 7.134 11.996 ( -5.101 -6.212 -1.620) 8.200 12.086 ( -3.213 -11.942 4.184) 13.055 12.256 ( -3.184 -3.885 0.654) 5.066 12.912 ( 3.864 -3.066 -0.535) 4.961 13.335 ( 13.646 -0.686 26.066) 29.430 13.830 ( -1.301 -6.824 12.661) 14.441 14.190 ( 0.623 2.085 -2.449) 3.276 14.459 ( 15.881 22.229 5.379) 27.843 14.977 ( 3.576 26.628 -3.976) 27.160 16.307 ( -1.524 17.089 -5.199) 17.927 16.658 ( -16.457 31.146 2.258) 35.299 17.845 ( 13.590 -15.869 -5.477) 21.599 18.769 ( -8.331 -23.335 -1.079) 24.801 20.630 ( 0.041 -1.811 -1.817) 2.565 20.742 ( -1.691 -2.725 -1.138) 3.403 ======================= Grid point 225 (113/170) ======================= q-point: ( 0.45 0.22 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 3.398 5.456 6.759) 9.327 1.413 ( 3.027 4.135 -0.698) 5.172 1.489 ( 0.885 -1.849 -4.949) 5.357 1.608 ( -5.406 -0.860 -3.102) 6.292 1.739 ( -5.458 1.983 -0.265) 5.813 1.899 ( 6.170 0.013 -3.575) 7.131 2.044 ( 4.258 0.457 -2.044) 4.746 2.120 ( -0.493 -1.171 1.958) 2.334 2.265 ( 2.442 -0.365 -3.839) 4.564 2.398 ( -6.072 4.768 -2.116) 8.005 2.538 ( -3.796 3.389 -0.725) 5.140 2.843 ( 0.372 3.105 -8.590) 9.142 2.983 ( 8.870 -13.029 1.359) 15.821 3.151 ( 1.408 -7.852 3.330) 8.645 3.336 ( 0.643 -11.501 4.165) 12.249 3.475 ( 0.395 -14.754 0.656) 14.773 3.822 ( 1.248 -0.956 -3.205) 3.570 3.939 ( -0.555 -1.924 2.791) 3.435 4.123 ( -9.733 5.107 -1.442) 11.085 4.224 ( -2.931 -5.541 4.376) 7.645 4.409 ( 5.514 6.492 -1.251) 8.609 4.624 ( -0.303 4.687 6.357) 7.904 4.801 ( -5.041 7.537 -4.810) 10.264 4.963 ( -0.447 1.328 -1.491) 2.046 4.999 ( 5.202 8.114 1.354) 9.733 5.159 ( -1.390 3.897 0.620) 4.184 5.476 ( -7.271 -6.502 10.013) 13.978 5.763 ( 4.805 -12.109 -1.226) 13.085 6.231 ( -0.206 9.033 3.597) 9.725 6.727 ( 4.461 1.977 -11.138) 12.159 7.234 ( 3.310 13.813 1.625) 14.297 7.411 ( -3.767 11.845 -2.214) 12.625 8.203 ( 8.224 -6.842 -1.856) 10.857 8.293 ( -8.090 -4.743 0.323) 9.384 8.811 ( -0.139 -1.302 5.572) 5.724 8.941 ( -2.141 -1.962 4.023) 4.962 9.618 ( -1.766 0.549 -5.703) 5.996 9.848 ( -1.720 -2.976 -5.179) 6.216 10.060 ( 3.592 -2.719 -4.926) 6.676 10.418 ( 0.927 -7.239 -4.998) 8.846 10.653 ( 4.915 -10.643 -4.608) 12.596 10.957 ( -5.132 1.250 -0.060) 5.282 11.054 ( -1.907 5.758 -1.148) 6.173 11.246 ( 3.523 -4.715 -8.182) 10.079 11.622 ( -4.784 5.579 4.144) 8.437 11.851 ( -4.041 -6.189 -6.305) 9.715 12.082 ( -3.845 -12.555 6.165) 14.506 12.243 ( -0.160 -4.418 0.267) 4.429 13.086 ( 8.433 2.368 11.361) 14.346 13.751 ( -3.428 0.992 9.941) 10.562 13.937 ( 8.042 -7.978 18.483) 21.678 14.145 ( -10.527 4.543 11.147) 15.991 14.722 ( 17.007 29.166 -6.790) 34.438 14.965 ( 0.792 26.337 -6.689) 27.184 16.274 ( 2.930 20.968 -2.403) 21.308 16.392 ( -15.344 28.866 -0.454) 32.694 18.045 ( 13.291 -19.585 0.964) 23.688 18.572 ( -9.839 -23.550 -7.539) 26.613 20.626 ( 1.296 -2.029 -0.946) 2.587 20.695 ( -1.922 -2.874 -1.947) 3.968 ======================= Grid point 226 (114/170) ======================= q-point: (-0.45 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( 3.877 3.916 9.602) 11.070 1.401 ( -4.917 -0.252 -4.231) 6.491 1.408 ( -3.144 -0.177 -2.222) 3.854 1.496 ( -1.685 1.908 -5.615) 6.165 1.636 ( -9.799 -1.234 2.728) 10.246 1.942 ( 2.884 -2.571 -5.120) 6.414 2.087 ( 3.424 0.277 1.200) 3.638 2.137 ( -3.611 -0.538 -1.282) 3.869 2.264 ( 5.056 6.363 -0.543) 8.145 2.297 ( 4.340 1.957 -4.324) 6.431 2.525 ( -1.128 6.327 4.611) 7.910 2.747 ( 1.461 1.339 -10.079) 10.272 3.043 ( -8.470 -11.602 0.364) 14.369 3.236 ( 9.952 -12.434 3.422) 16.290 3.414 ( 2.637 -11.381 4.254) 12.433 3.488 ( -0.782 -11.069 -5.143) 12.231 3.782 ( -14.487 -0.485 -1.110) 14.538 3.868 ( 4.796 -3.795 2.776) 6.716 4.120 ( 0.477 2.129 5.466) 5.885 4.204 ( 1.699 -2.716 0.875) 3.320 4.509 ( 3.634 7.622 2.307) 8.753 4.611 ( -2.847 9.158 -7.421) 12.126 4.740 ( -1.250 2.544 6.545) 7.132 4.914 ( 1.547 -0.161 -3.309) 3.656 5.106 ( 2.346 6.236 -0.092) 6.663 5.162 ( 3.879 6.260 -0.766) 7.404 5.476 ( -6.580 -6.808 10.205) 13.921 5.832 ( 6.807 -9.716 -4.328) 12.628 6.271 ( -2.417 7.223 7.636) 10.785 6.650 ( 2.345 2.190 -13.060) 13.448 7.275 ( -3.224 14.629 1.453) 15.050 7.332 ( -0.776 11.400 -0.644) 11.445 8.139 ( -10.211 -3.573 0.169) 10.819 8.328 ( 8.022 -7.358 -0.896) 10.922 8.856 ( -2.352 -0.149 4.575) 5.147 8.953 ( 1.016 -3.185 2.530) 4.193 9.576 ( 0.753 3.129 -0.195) 3.224 9.722 ( -2.073 0.228 -8.638) 8.887 10.139 ( 5.884 -7.639 2.274) 9.907 10.304 ( -1.472 -8.075 -12.313) 14.798 10.778 ( 3.182 -9.785 6.702) 12.280 10.868 ( -1.536 -4.461 -3.880) 6.108 11.063 ( 4.042 4.627 -1.671) 6.367 11.165 ( 0.855 -7.915 -9.138) 12.120 11.590 ( -5.255 5.585 5.677) 9.542 11.791 ( 2.485 0.538 -2.860) 3.826 12.104 ( -2.308 -10.548 6.805) 12.763 12.244 ( 0.988 -7.236 -1.091) 7.385 13.322 ( -2.218 6.640 12.249) 14.109 13.588 ( -6.764 1.080 -5.127) 8.556 14.103 ( -10.474 6.466 15.051) 19.444 14.365 ( 9.004 -2.843 21.713) 23.677 14.800 ( -6.142 19.639 -9.987) 22.872 14.866 ( 8.449 27.497 -11.498) 30.979 16.164 ( -8.666 24.244 1.012) 25.766 16.399 ( 10.860 24.426 -0.842) 26.745 18.238 ( -1.572 -21.325 -1.281) 21.421 18.346 ( 2.603 -20.895 -4.575) 21.548 20.635 ( -1.228 -2.337 -1.069) 2.848 20.656 ( 1.426 -2.158 -0.934) 2.750 ======================= Grid point 227 (115/170) ======================= q-point: (-0.36 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( -8.336 -2.675 -10.158) 13.410 1.290 ( -7.502 9.425 1.517) 12.142 1.341 ( -2.130 -0.861 8.317) 8.628 1.409 ( -2.270 -1.385 -4.797) 5.485 1.540 ( -7.474 -2.555 5.980) 9.907 1.876 ( -2.616 0.831 -1.440) 3.100 2.080 ( 1.216 -3.756 -2.824) 4.854 2.216 ( 7.922 2.817 0.843) 8.450 2.341 ( 3.663 0.536 -0.373) 3.721 2.414 ( 8.025 3.276 2.612) 9.053 2.579 ( 0.741 8.389 3.551) 9.139 2.682 ( 2.067 -1.014 -6.255) 6.665 2.906 ( -4.673 -7.221 -3.390) 9.245 3.226 ( -12.980 3.298 -6.456) 14.867 3.399 ( -2.123 -12.445 -0.854) 12.654 3.480 ( 0.221 -12.262 2.588) 12.534 3.680 ( 2.518 -7.582 4.315) 9.080 3.974 ( -0.284 5.513 2.556) 6.084 4.117 ( 2.561 -4.498 0.375) 5.189 4.337 ( 2.793 1.824 1.222) 3.552 4.488 ( 3.204 5.362 -5.002) 8.002 4.567 ( -1.465 5.315 6.495) 8.519 4.795 ( -1.169 0.355 3.689) 3.886 4.970 ( 8.229 -2.941 -2.643) 9.130 5.085 ( 0.034 6.255 -3.530) 7.183 5.239 ( 4.730 2.161 -1.171) 5.330 5.491 ( -3.515 -5.504 8.603) 10.801 5.876 ( 6.182 -7.832 -7.087) 12.238 6.308 ( -4.249 3.945 8.070) 9.937 6.529 ( -0.165 1.802 -11.557) 11.698 7.190 ( -5.662 15.131 0.181) 16.157 7.352 ( -1.039 11.713 2.865) 12.103 7.977 ( -10.078 -2.056 0.859) 10.321 8.437 ( 6.124 -6.983 -0.379) 9.296 8.842 ( -2.997 1.961 2.661) 4.462 9.033 ( 3.934 -5.241 2.990) 7.203 9.614 ( 0.080 1.043 -0.575) 1.193 9.662 ( 3.389 4.935 2.464) 6.474 10.119 ( -3.073 -6.172 -13.180) 14.874 10.267 ( 4.107 -7.873 3.406) 9.511 10.669 ( -5.874 -9.514 -8.657) 14.141 10.971 ( 1.890 -9.638 8.222) 12.809 11.124 ( 7.257 -2.611 -3.939) 8.660 11.161 ( 6.127 3.482 -2.055) 7.341 11.595 ( -2.577 2.952 7.627) 8.575 11.842 ( 5.639 3.171 -0.498) 6.488 12.145 ( -0.527 -8.746 4.356) 9.784 12.261 ( 2.470 -8.716 -0.590) 9.079 13.118 ( -18.908 16.733 -2.810) 25.405 13.593 ( -4.663 -3.263 8.070) 9.874 14.137 ( -2.138 2.631 6.437) 7.275 14.464 ( -12.874 10.617 -14.782) 22.293 14.639 ( -0.820 6.755 11.212) 13.115 14.880 ( 6.852 20.001 -6.452) 22.105 16.121 ( -0.016 16.638 2.274) 16.793 16.600 ( 12.740 28.651 1.941) 31.416 17.961 ( -12.871 -19.210 -11.595) 25.868 18.575 ( 13.314 -20.313 7.000) 25.276 20.595 ( -1.386 -1.548 -0.974) 2.295 20.690 ( 2.168 -1.933 0.580) 2.962 ======================= Grid point 228 (116/170) ======================= q-point: (-0.27 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -6.795 -1.529 -2.489) 7.396 1.191 ( -5.743 16.450 2.025) 17.541 1.341 ( -0.957 -0.639 -2.086) 2.383 1.359 ( -6.147 3.258 10.373) 12.490 1.514 ( -4.059 -8.914 7.391) 12.270 1.900 ( 5.046 -1.803 0.273) 5.365 2.094 ( 1.917 -2.823 0.642) 3.472 2.291 ( 4.476 0.974 -5.705) 7.317 2.375 ( -0.773 -3.186 -0.617) 3.336 2.479 ( -1.394 5.231 -1.951) 5.754 2.648 ( -0.126 8.638 8.905) 12.406 2.660 ( 1.476 0.369 -4.479) 4.730 2.807 ( -2.849 3.577 -4.468) 6.393 3.035 ( -1.993 2.789 1.709) 3.830 3.336 ( -1.810 -10.966 -2.818) 11.466 3.456 ( -3.712 -10.687 -1.199) 11.377 3.810 ( 2.522 -1.648 4.832) 5.694 3.903 ( -7.239 6.869 0.929) 10.022 4.248 ( 4.618 1.463 -5.384) 7.242 4.260 ( 3.718 -2.446 1.702) 4.765 4.586 ( 1.073 -2.190 -0.668) 2.528 4.658 ( 4.367 1.306 6.930) 8.294 4.765 ( -1.752 2.806 -0.687) 3.379 5.046 ( -0.887 3.308 -2.369) 4.164 5.083 ( 7.806 -4.868 -2.105) 9.437 5.286 ( 4.570 -5.139 -2.449) 7.300 5.572 ( 3.560 -2.270 6.617) 7.850 5.878 ( 3.607 -8.245 -7.110) 11.469 6.273 ( -4.323 0.587 -2.780) 5.173 6.436 ( -3.124 1.877 0.464) 3.674 7.112 ( -4.342 15.363 0.295) 15.967 7.329 ( -6.536 11.822 3.435) 13.938 7.849 ( -7.618 -0.044 2.545) 8.032 8.519 ( 4.663 -5.563 -0.258) 7.263 8.836 ( -1.011 3.455 2.276) 4.259 9.108 ( 3.036 -6.606 -1.363) 7.397 9.617 ( 0.841 -0.339 1.712) 1.938 9.819 ( 4.199 7.213 11.501) 14.210 9.920 ( -4.226 -3.872 -11.316) 12.685 10.328 ( -0.373 -4.363 1.300) 4.568 10.533 ( -1.143 -12.289 -2.795) 12.654 11.047 ( -0.968 -0.911 4.504) 4.696 11.200 ( 6.203 2.458 -1.139) 6.769 11.275 ( 9.035 -0.482 -1.785) 9.222 11.670 ( 0.464 -1.374 8.079) 8.208 11.966 ( 8.008 1.853 3.411) 8.900 12.168 ( 0.307 -7.432 -0.363) 7.448 12.308 ( 2.777 -6.973 0.783) 7.547 12.815 ( -14.639 15.321 -0.202) 21.191 13.532 ( -13.231 6.456 8.029) 16.769 13.885 ( -13.705 -2.268 -21.952) 25.978 14.309 ( 2.788 -0.584 -6.120) 6.751 14.585 ( -10.943 15.706 2.000) 19.247 15.004 ( 10.319 6.042 -0.347) 11.963 16.156 ( -1.249 7.158 3.877) 8.236 16.837 ( 11.494 27.425 4.218) 30.034 17.629 ( -12.353 -11.467 -10.133) 19.666 18.881 ( 15.105 -19.207 5.859) 25.128 20.577 ( -0.468 -0.534 0.630) 0.950 20.732 ( 1.683 -1.718 1.119) 2.652 ======================= Grid point 229 (117/170) ======================= q-point: (-0.18 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.892 ( -9.102 5.324 4.783) 11.579 1.132 ( -7.153 13.020 2.684) 15.096 1.332 ( 0.812 -0.038 2.476) 2.606 1.545 ( 12.444 16.942 12.577) 24.497 1.575 ( -0.028 -13.053 10.312) 16.635 1.964 ( 4.674 -8.269 -2.722) 9.881 2.132 ( -1.622 -0.997 4.501) 4.888 2.262 ( -0.648 0.243 -6.613) 6.649 2.306 ( -1.984 -5.163 -2.473) 6.059 2.412 ( -3.675 7.861 -0.772) 8.712 2.595 ( -8.618 9.780 8.808) 15.731 2.737 ( 7.839 6.338 -2.952) 10.504 2.849 ( 7.615 -2.887 -0.841) 8.188 3.089 ( 2.368 1.840 4.113) 5.090 3.296 ( -2.050 -8.770 -0.813) 9.043 3.356 ( -4.135 -4.555 -2.209) 6.537 3.797 ( -3.676 2.272 -1.538) 4.587 3.805 ( -8.421 10.889 2.584) 14.006 4.265 ( 2.636 1.014 3.317) 4.356 4.374 ( 5.179 -11.122 -9.094) 15.271 4.495 ( -4.620 3.963 -4.346) 7.480 4.712 ( -4.669 3.129 7.936) 9.725 4.820 ( 5.990 -0.219 -3.363) 6.873 5.017 ( 1.054 -3.246 -0.668) 3.478 5.185 ( 7.314 -7.296 -0.639) 10.351 5.359 ( 7.558 -8.258 -2.021) 11.376 5.736 ( 8.435 -0.464 3.734) 9.236 5.846 ( 1.175 -11.251 -4.092) 12.029 6.141 ( -4.949 1.500 -6.327) 8.171 6.409 ( -4.438 -0.955 4.243) 6.214 7.055 ( -2.982 14.537 -0.092) 14.840 7.210 ( -12.238 12.625 3.147) 17.862 7.797 ( -3.666 2.606 4.849) 6.614 8.584 ( 3.937 -2.613 -0.603) 4.764 8.850 ( -0.019 2.941 0.802) 3.048 9.060 ( -1.047 -4.921 -11.303) 12.372 9.656 ( -1.360 -2.250 3.915) 4.716 9.793 ( -0.925 0.602 -0.823) 1.377 9.999 ( 2.167 1.141 10.713) 10.989 10.331 ( -0.377 -0.463 1.815) 1.910 10.571 ( 1.939 -8.877 7.708) 11.915 11.055 ( -0.729 6.171 1.133) 6.317 11.283 ( 4.026 3.479 0.133) 5.323 11.419 ( 9.976 -0.916 0.731) 10.045 11.759 ( 1.393 1.391 5.079) 5.447 12.076 ( -1.320 -2.052 -4.032) 4.713 12.201 ( 5.552 0.501 5.362) 7.735 12.363 ( 2.066 -7.634 3.552) 8.669 12.677 ( -6.116 1.703 4.254) 7.643 13.228 ( -18.423 19.518 -15.514) 31.001 13.622 ( -1.401 -9.478 2.069) 9.802 14.214 ( 0.890 -2.714 -17.841) 18.069 14.403 ( -8.471 12.461 -5.028) 15.885 15.141 ( 5.689 -3.142 -0.032) 6.499 16.141 ( -7.146 -3.288 5.818) 9.784 16.936 ( -4.503 -1.970 -5.154) 7.122 17.484 ( 5.107 22.097 3.570) 22.959 19.138 ( 12.218 -14.885 -2.443) 19.411 20.594 ( 0.286 0.165 2.513) 2.534 20.765 ( 0.817 -1.361 1.077) 1.918 ======================= Grid point 230 (118/170) ======================= q-point: (-0.09 0.22 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.904 ( 0.564 9.218 12.313) 15.391 1.045 ( -6.824 10.535 4.467) 13.323 1.406 ( 2.468 2.189 5.083) 6.060 1.677 ( -1.925 -6.416 5.740) 8.822 1.701 ( 1.808 0.876 -5.710) 6.053 2.050 ( 0.045 1.732 -1.536) 2.316 2.102 ( -4.164 4.671 -6.599) 9.094 2.282 ( -0.223 -1.614 -2.556) 3.031 2.324 ( 12.635 -11.417 12.956) 21.398 2.382 ( -1.170 9.865 7.377) 12.373 2.586 ( -2.982 4.431 9.114) 10.564 2.853 ( 7.078 0.875 -1.928) 7.388 2.918 ( 5.742 -3.816 -3.817) 7.880 3.173 ( -6.422 -7.531 -3.886) 10.633 3.232 ( 2.940 4.376 12.522) 13.586 3.381 ( 5.526 2.852 1.927) 6.510 3.669 ( -8.697 11.138 -0.632) 14.146 3.736 ( -3.163 1.051 0.680) 3.402 4.198 ( -4.806 1.624 -9.788) 11.025 4.335 ( -2.215 -1.139 -4.189) 4.874 4.417 ( -0.130 2.007 -0.847) 2.183 4.683 ( -6.075 2.137 2.774) 7.012 4.867 ( 3.156 -4.841 -0.760) 5.829 5.052 ( 3.601 -6.179 -2.361) 7.532 5.306 ( 6.954 -9.994 0.801) 12.202 5.493 ( 10.344 -7.727 0.451) 12.919 5.746 ( -3.753 -8.790 -3.179) 10.072 5.940 ( -0.514 -5.980 -5.375) 8.057 6.038 ( 7.366 3.449 2.594) 8.537 6.366 ( -5.484 -3.812 2.026) 6.979 7.007 ( -5.656 14.234 1.408) 15.381 7.050 ( -7.406 13.958 1.789) 15.902 7.832 ( -0.577 4.521 7.714) 8.960 8.616 ( 1.346 3.128 -4.060) 5.299 8.800 ( -4.941 -2.937 -4.797) 7.487 8.906 ( 0.295 -0.271 -9.061) 9.070 9.683 ( 0.933 -1.917 4.939) 5.379 9.843 ( 0.680 1.819 5.752) 6.071 10.130 ( 2.650 -5.816 7.259) 9.672 10.320 ( -1.648 1.151 -1.073) 2.278 10.735 ( 1.739 -4.528 14.357) 15.154 11.061 ( -1.510 5.247 2.375) 5.954 11.355 ( 6.172 8.498 -0.520) 10.516 11.586 ( 5.920 -0.475 4.233) 7.293 11.807 ( -1.047 7.795 1.269) 7.967 11.985 ( -1.251 1.620 -3.045) 3.669 12.272 ( -1.103 0.802 1.121) 1.765 12.479 ( 1.250 -5.311 5.223) 7.553 12.551 ( -10.812 -5.119 -6.986) 13.853 12.938 ( -1.191 8.935 3.410) 9.637 13.787 ( 12.081 -6.019 7.897) 15.637 13.948 ( -1.708 -0.594 -29.159) 29.215 14.256 ( -1.226 4.889 -4.233) 6.582 15.145 ( -4.895 -12.107 -2.302) 13.261 16.069 ( -10.510 -10.244 8.553) 16.987 16.694 ( -6.772 -13.875 -12.754) 20.026 17.778 ( 14.635 33.012 13.277) 38.474 19.152 ( -0.491 -2.315 -14.123) 14.320 20.636 ( 0.547 0.349 3.817) 3.872 20.778 ( -0.187 -0.917 0.546) 1.083 ======================= Grid point 231 (119/170) ======================= q-point: ( 0.00 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( -5.701 2.376 5.143) 8.037 1.255 ( 3.776 3.306 12.393) 13.371 1.387 ( 0.357 0.680 -5.642) 5.694 1.567 ( 0.669 -7.415 7.073) 10.270 1.711 ( 0.118 4.196 3.230) 5.297 1.977 ( 0.755 0.205 -4.569) 4.635 2.031 ( -3.559 -0.851 -7.534) 8.375 2.101 ( -2.918 -5.704 -2.608) 6.918 2.346 ( 0.460 -5.987 0.241) 6.009 2.460 ( 7.267 -11.088 1.049) 13.298 2.617 ( -2.358 -7.712 -6.980) 10.666 2.701 ( -0.823 -6.829 -7.087) 9.876 3.255 ( 2.373 13.028 10.986) 17.206 3.328 ( -6.676 14.203 10.567) 18.920 3.465 ( 5.348 14.670 11.183) 19.206 3.580 ( 0.008 4.680 7.240) 8.621 3.731 ( -4.302 7.799 2.359) 9.214 3.910 ( 2.726 13.645 2.017) 14.060 4.087 ( 3.995 0.726 -8.579) 9.491 4.298 ( -2.266 9.245 -10.723) 14.338 4.493 ( 1.981 0.765 4.971) 5.406 4.649 ( -4.212 0.573 -0.649) 4.300 4.719 ( -4.058 -7.484 1.188) 8.596 4.889 ( 2.493 -9.661 -6.056) 11.671 5.199 ( 0.911 -11.612 3.845) 12.265 5.377 ( -3.867 -15.896 -3.344) 16.698 5.605 ( 11.347 -3.529 -1.092) 11.933 5.692 ( -8.158 -3.423 -6.043) 10.714 6.214 ( -3.186 -0.812 0.865) 3.399 6.264 ( 10.273 -1.507 -0.771) 10.411 7.180 ( -6.074 12.025 4.174) 14.104 7.272 ( 2.114 9.589 0.066) 9.820 8.059 ( 0.582 7.610 9.567) 12.238 8.565 ( -4.361 2.772 -13.256) 14.228 8.620 ( 0.211 -6.917 2.814) 7.471 8.805 ( -1.299 -2.882 -5.503) 6.346 9.793 ( 5.460 -0.207 6.215) 8.275 9.909 ( -1.730 1.263 1.362) 2.539 10.098 ( 3.597 -5.778 4.098) 7.945 10.255 ( -0.768 -3.064 -3.748) 4.901 10.916 ( 0.098 2.186 14.522) 14.686 11.022 ( -5.919 -1.162 6.574) 8.922 11.629 ( -2.043 5.604 0.627) 5.998 11.681 ( -0.019 1.003 3.911) 4.037 11.901 ( -2.385 2.560 0.393) 3.521 12.034 ( 4.233 -0.744 -4.160) 5.981 12.229 ( -6.843 0.512 -4.215) 8.054 12.256 ( -1.920 0.465 -0.680) 2.089 12.657 ( 8.194 4.384 10.524) 14.040 12.997 ( 3.871 -5.351 4.570) 8.032 13.707 ( -3.743 10.263 -25.424) 27.672 13.951 ( 1.442 3.939 -14.183) 14.790 14.345 ( 9.416 2.066 9.240) 13.354 14.756 ( -14.258 -0.805 -4.911) 15.102 15.747 ( -3.277 -15.392 8.857) 18.058 16.243 ( 9.371 -20.031 -13.197) 25.753 18.579 ( 2.863 18.617 12.513) 22.613 19.031 ( -3.687 3.827 -9.416) 10.812 20.694 ( 0.538 0.515 2.875) 2.970 20.754 ( -0.607 -1.151 -0.012) 1.302 ======================= Grid point 232 (120/170) ======================= q-point: ( 0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( -1.520 -0.997 6.388) 6.641 1.321 ( -3.545 -0.507 2.097) 4.150 1.378 ( -1.138 1.465 2.489) 3.105 1.660 ( 7.103 2.859 2.044) 7.925 1.790 ( 2.032 0.235 4.926) 5.334 1.891 ( -0.621 -0.335 -6.617) 6.655 1.920 ( -5.210 0.387 -0.772) 5.281 2.092 ( 4.189 -5.295 -3.263) 7.498 2.397 ( 1.000 -6.945 6.529) 9.584 2.486 ( -0.556 -11.802 -7.259) 13.867 2.559 ( 2.429 -9.865 -1.831) 10.324 2.593 ( -3.891 -4.928 -5.260) 8.191 3.220 ( -13.036 12.499 2.930) 18.296 3.393 ( -5.280 6.010 8.511) 11.681 3.458 ( -7.748 10.261 2.812) 13.161 3.712 ( 7.410 19.293 8.744) 22.441 3.736 ( -5.443 1.830 4.841) 7.511 3.992 ( 0.306 5.675 -5.094) 7.632 4.078 ( 8.809 13.237 -4.701) 16.581 4.228 ( 8.763 6.397 -6.721) 12.763 4.576 ( -3.134 0.662 -0.787) 3.299 4.609 ( 4.321 -0.162 3.826) 5.773 4.679 ( -4.166 -7.547 4.680) 9.809 4.881 ( 3.871 -6.119 -4.551) 8.552 5.204 ( -6.887 -13.823 3.550) 15.846 5.235 ( -8.044 -13.946 -3.360) 16.446 5.496 ( -7.113 -1.531 -2.943) 7.849 5.746 ( 5.594 -8.954 -1.777) 10.706 6.182 ( 1.790 4.569 -0.995) 5.007 6.447 ( 13.108 -4.130 -4.051) 14.328 7.164 ( -1.479 12.564 4.199) 13.329 7.345 ( 5.896 8.377 1.222) 10.316 8.140 ( -4.500 5.866 7.868) 10.796 8.424 ( 3.435 4.032 -7.595) 9.259 8.600 ( -6.012 -6.942 1.914) 9.381 8.763 ( 1.160 -3.920 -1.698) 4.427 9.851 ( -3.835 2.499 -2.042) 5.012 9.942 ( 4.863 -1.910 3.517) 6.298 10.196 ( 0.272 -5.152 -3.114) 6.026 10.203 ( 3.477 -4.833 0.690) 5.993 10.962 ( -5.035 2.222 7.376) 9.203 11.113 ( 3.095 -0.255 9.046) 9.564 11.569 ( -7.145 0.686 5.517) 9.053 11.651 ( -5.816 10.696 -2.266) 12.384 11.830 ( -6.439 -3.196 0.944) 7.250 11.960 ( -5.936 2.446 -3.812) 7.467 12.104 ( -5.356 0.133 2.838) 6.063 12.295 ( 2.388 -5.512 0.803) 6.061 12.900 ( 5.341 5.292 6.214) 9.755 13.077 ( 5.047 -2.584 -7.524) 9.421 13.452 ( -3.775 6.064 -7.569) 10.407 13.784 ( 2.976 -2.508 -12.012) 12.626 14.518 ( -3.549 11.367 -9.099) 14.987 14.670 ( 11.703 2.839 13.267) 17.917 15.893 ( 10.202 -14.081 7.048) 18.763 16.368 ( 21.982 -19.744 -12.339) 32.020 18.638 ( -12.303 12.252 6.076) 18.395 18.827 ( -7.851 10.011 -3.546) 13.207 20.718 ( -1.168 -0.404 1.318) 1.807 20.741 ( -0.360 -0.859 0.246) 0.963 ======================= Grid point 233 (121/170) ======================= q-point: ( 0.18 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.208 ( 3.181 -1.886 0.931) 3.814 1.283 ( -1.380 -3.082 0.404) 3.401 1.422 ( 5.598 4.658 1.058) 7.359 1.746 ( 1.409 -5.513 -5.638) 8.011 1.762 ( -1.899 5.817 -2.655) 6.670 1.869 ( 1.800 0.123 6.976) 7.205 1.988 ( 2.577 0.647 6.560) 7.077 2.126 ( 2.226 -5.128 0.545) 5.617 2.321 ( -5.042 -3.533 -10.237) 11.946 2.459 ( -1.925 -7.919 -5.879) 10.049 2.533 ( 0.038 -4.675 9.348) 10.452 2.578 ( 0.374 -7.314 -0.660) 7.354 2.991 ( -12.934 10.245 -3.034) 16.776 3.262 ( -8.794 3.277 -0.736) 9.413 3.475 ( -4.726 6.455 10.164) 12.935 3.638 ( -7.343 -3.107 -4.826) 9.320 3.821 ( 3.541 13.180 -5.013) 14.539 4.020 ( 7.891 11.704 4.890) 14.938 4.181 ( 4.802 6.963 -2.786) 8.906 4.343 ( 6.769 5.603 1.562) 8.925 4.462 ( -7.491 0.328 -3.636) 8.333 4.639 ( -4.957 -4.333 5.584) 8.632 4.780 ( 6.949 2.108 3.621) 8.115 4.914 ( 5.061 -1.759 -3.005) 6.143 5.058 ( -7.821 -4.912 -1.799) 9.409 5.097 ( -8.082 -16.738 1.959) 18.690 5.417 ( -4.091 -6.079 2.072) 7.615 5.736 ( -2.416 -9.561 -2.707) 10.226 6.251 ( 7.599 7.896 -2.406) 11.220 6.585 ( 11.448 -4.044 -6.777) 13.905 7.218 ( 2.217 12.621 4.122) 13.461 7.475 ( 7.401 6.908 2.180) 10.356 8.084 ( -3.882 4.032 -1.792) 5.876 8.481 ( -2.154 -0.775 0.993) 2.495 8.525 ( -0.254 -3.679 5.648) 6.745 8.780 ( 0.128 -3.183 2.124) 3.829 9.771 ( -1.939 1.402 -2.978) 3.820 9.989 ( 0.885 -1.693 -3.781) 4.236 10.126 ( -1.476 -5.679 -4.652) 7.488 10.287 ( 3.723 -5.340 0.712) 6.549 10.988 ( -0.580 3.716 5.023) 6.275 11.217 ( 1.804 1.649 1.210) 2.727 11.468 ( -8.953 11.408 -4.814) 15.280 11.539 ( -7.595 -4.962 3.369) 9.677 11.709 ( -9.744 1.583 4.036) 10.665 11.864 ( -1.701 -2.385 1.207) 3.168 12.089 ( -5.787 0.207 8.168) 10.013 12.291 ( -4.798 -9.348 1.238) 10.580 12.837 ( 1.351 1.871 -11.261) 11.495 13.030 ( 0.669 -6.820 -19.530) 20.698 13.441 ( 1.265 5.475 14.056) 15.138 13.897 ( 2.547 -3.986 15.926) 16.613 14.487 ( 16.334 26.778 -14.428) 34.526 14.980 ( 12.270 9.148 8.830) 17.669 16.177 ( 17.068 -11.860 1.722) 20.855 16.642 ( 24.139 -15.741 -7.510) 29.780 18.324 ( -20.687 15.043 -6.870) 26.485 18.719 ( -12.463 0.256 7.351) 14.472 20.687 ( -2.130 -0.633 -1.099) 2.479 20.743 ( -0.952 -1.664 0.858) 2.101 ======================= Grid point 234 (122/170) ======================= q-point: ( 0.27 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.209 ( 0.533 -0.127 -4.395) 4.429 1.335 ( 7.765 -3.068 -4.780) 9.621 1.530 ( 4.657 4.075 0.618) 6.219 1.685 ( -3.111 5.038 -0.906) 5.990 1.746 ( 5.295 -4.642 -4.194) 8.196 1.976 ( -0.748 -1.490 6.551) 6.760 2.057 ( -4.918 4.794 -5.137) 8.577 2.072 ( 0.005 -4.744 4.882) 6.807 2.211 ( 1.327 -1.167 -4.846) 5.158 2.434 ( 5.431 -4.439 -1.739) 7.227 2.575 ( -2.009 -3.341 1.597) 4.213 2.611 ( -0.584 -0.462 5.538) 5.588 2.804 ( -6.284 1.909 0.924) 6.632 3.136 ( -6.204 -0.717 0.014) 6.246 3.423 ( -8.917 -4.182 -7.640) 12.465 3.495 ( -5.476 0.537 4.121) 6.875 3.844 ( 4.832 9.792 -1.423) 11.012 4.126 ( -1.031 3.229 -6.131) 7.005 4.163 ( -4.207 -0.845 -2.804) 5.126 4.301 ( -1.483 1.183 1.522) 2.432 4.469 ( 0.006 4.155 6.681) 7.868 4.612 ( -1.953 5.722 1.671) 6.272 4.873 ( 1.858 -1.790 -1.395) 2.933 4.967 ( 3.861 -1.581 -0.586) 4.213 5.021 ( 2.550 0.679 3.393) 4.298 5.048 ( -1.833 -5.897 4.500) 7.641 5.373 ( -5.406 -9.302 3.928) 11.453 5.652 ( -3.734 -6.436 -2.619) 7.888 6.337 ( 6.624 8.815 -3.621) 11.606 6.678 ( 9.836 -2.956 -7.475) 12.703 7.312 ( 3.904 12.631 3.555) 13.690 7.605 ( 5.168 6.253 1.914) 8.335 8.021 ( 0.085 1.513 -3.625) 3.930 8.387 ( -6.478 -6.693 0.348) 9.321 8.655 ( 1.078 0.267 10.059) 10.120 8.810 ( -0.642 -2.362 4.435) 5.065 9.732 ( 0.363 -0.857 -2.437) 2.608 9.911 ( -1.493 -0.239 -7.986) 8.128 10.069 ( -0.046 -4.718 -2.734) 5.453 10.321 ( 1.139 -6.593 -1.943) 6.967 10.982 ( -0.290 5.133 -10.583) 11.766 11.200 ( -4.225 2.274 -1.296) 4.970 11.266 ( -7.402 2.546 -5.625) 9.639 11.362 ( -6.479 1.895 -4.842) 8.308 11.690 ( -5.140 -2.098 8.402) 10.070 11.886 ( -0.602 -4.388 2.922) 5.306 12.044 ( -10.915 -2.453 6.108) 12.746 12.203 ( -3.641 -7.613 -1.013) 8.499 12.851 ( 2.077 -3.991 -10.289) 11.229 12.897 ( 8.026 -2.092 9.764) 12.812 13.649 ( 0.425 4.117 17.550) 18.032 14.066 ( -4.316 -6.921 16.866) 18.735 14.723 ( 29.042 35.428 -12.540) 47.496 15.268 ( 14.958 18.801 3.712) 24.310 16.424 ( 14.649 -5.619 -5.227) 16.537 16.950 ( 18.271 -7.836 -0.008) 19.881 17.892 ( -21.210 11.729 -9.201) 25.925 18.551 ( -16.056 -11.290 4.681) 20.179 20.637 ( -1.922 -0.853 -1.710) 2.710 20.723 ( -1.954 -2.763 -0.123) 3.387 ======================= Grid point 235 (123/170) ======================= q-point: ( 0.36 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( -0.406 5.036 -3.738) 6.285 1.392 ( 7.815 -4.491 -7.388) 11.654 1.541 ( -1.350 6.099 -2.323) 6.665 1.666 ( -0.633 1.329 0.546) 1.570 1.812 ( 7.463 -1.403 -4.167) 8.662 1.921 ( -0.200 0.608 -7.159) 7.187 2.013 ( -3.387 -1.641 2.860) 4.727 2.113 ( 0.138 2.865 2.085) 3.546 2.236 ( 3.582 0.566 2.568) 4.443 2.514 ( -4.288 4.571 3.606) 7.231 2.543 ( 5.478 -4.084 -3.306) 7.591 2.673 ( 5.031 -2.359 1.329) 5.713 2.826 ( 0.186 -5.504 7.412) 9.234 3.075 ( -2.799 -5.720 2.248) 6.754 3.182 ( -8.725 -2.419 -7.597) 11.819 3.372 ( -11.059 -7.584 -1.317) 13.474 3.905 ( -3.416 1.877 -6.179) 7.306 3.951 ( -2.788 3.314 1.319) 4.528 4.081 ( -0.810 -4.988 -1.051) 5.162 4.328 ( -3.831 -1.264 1.691) 4.374 4.470 ( -0.011 5.351 -1.482) 5.552 4.664 ( 2.017 8.142 5.534) 10.049 4.876 ( 1.901 -3.540 -3.202) 5.139 5.010 ( 1.150 3.214 2.044) 3.979 5.109 ( 2.151 4.093 2.474) 5.244 5.125 ( 3.696 0.475 4.948) 6.194 5.344 ( -4.720 -9.478 6.667) 12.512 5.574 ( -2.395 -4.643 -1.789) 5.522 6.389 ( 4.534 9.679 -3.098) 11.128 6.738 ( 7.876 -1.591 -8.165) 11.455 7.409 ( 3.507 12.427 2.813) 13.215 7.663 ( 0.261 7.626 0.390) 7.640 8.017 ( 3.690 -2.258 -2.598) 5.047 8.289 ( -6.321 -6.984 0.405) 9.428 8.751 ( -1.282 0.462 8.193) 8.306 8.856 ( -1.493 -2.901 6.725) 7.474 9.708 ( -0.128 -0.781 -3.548) 3.635 9.813 ( 0.168 0.350 -6.006) 6.019 10.072 ( 1.663 -3.400 -0.121) 3.787 10.289 ( 0.236 -7.454 -4.851) 8.897 10.723 ( -3.923 1.611 -24.507) 24.871 11.052 ( -7.501 -0.172 -0.840) 7.550 11.196 ( 0.351 -4.203 -6.228) 7.522 11.251 ( -3.604 4.713 -3.172) 6.728 11.690 ( -3.898 -1.577 5.562) 6.973 11.861 ( -4.662 -5.839 -1.642) 7.650 11.910 ( -6.791 -4.011 2.521) 8.280 12.164 ( -1.281 -5.794 -0.701) 5.975 12.918 ( 6.603 3.013 8.468) 11.153 13.270 ( 12.764 -5.528 24.762) 28.402 13.794 ( -4.092 2.722 13.780) 14.630 14.139 ( -7.400 -4.664 14.862) 17.245 15.078 ( 29.157 36.344 -11.144) 47.908 15.516 ( 12.654 28.756 -1.609) 31.458 16.526 ( 8.068 3.516 -7.946) 11.858 17.170 ( -1.573 16.511 4.879) 17.289 17.510 ( -6.064 -14.248 -9.559) 18.198 18.324 ( -14.354 -20.870 -0.412) 25.333 20.596 ( -0.743 -1.432 -1.585) 2.261 20.681 ( -2.318 -3.446 -0.986) 4.268 ======================= Grid point 236 (124/170) ======================= q-point: ( 0.45 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( 5.691 7.797 2.827) 10.058 1.424 ( 4.561 -3.905 -6.086) 8.549 1.459 ( -4.536 0.444 -3.332) 5.646 1.641 ( -1.675 3.451 -1.271) 4.041 1.835 ( -1.904 6.401 -2.497) 7.130 1.878 ( 2.253 -1.209 -4.126) 4.854 2.020 ( 3.580 -1.786 -0.263) 4.009 2.109 ( -1.563 -0.465 -0.855) 1.841 2.315 ( 2.066 4.833 1.251) 5.403 2.470 ( -3.266 3.442 2.643) 5.432 2.576 ( 1.542 -0.198 -3.525) 3.852 2.791 ( 4.041 -6.356 1.062) 7.607 2.841 ( 0.090 -3.274 -2.117) 3.900 3.001 ( -7.488 -7.993 1.624) 11.072 3.140 ( 1.259 -8.260 4.298) 9.396 3.227 ( -0.035 -9.153 -0.172) 9.154 3.751 ( -4.342 -4.668 -2.602) 6.886 3.919 ( -1.464 -3.817 -4.707) 6.235 4.134 ( 0.985 -1.020 5.284) 5.471 4.215 ( -7.885 3.917 -0.248) 8.808 4.493 ( 4.821 3.773 -2.346) 6.556 4.758 ( 1.863 7.480 5.505) 9.473 4.829 ( -2.304 -2.508 -4.770) 5.861 5.073 ( 1.082 6.559 3.666) 7.592 5.134 ( 0.945 4.868 -0.911) 5.041 5.218 ( 0.595 2.066 5.183) 5.611 5.352 ( -4.313 -4.873 6.874) 9.466 5.564 ( 3.060 -7.757 -0.505) 8.355 6.421 ( 2.204 9.912 -0.869) 10.191 6.747 ( 5.160 -0.143 -9.966) 11.223 7.482 ( 1.974 11.676 2.549) 12.113 7.631 ( -3.517 9.761 -0.668) 10.397 8.079 ( 5.860 -5.486 -0.675) 8.055 8.185 ( -6.964 -6.215 -0.010) 9.334 8.808 ( -0.948 0.733 6.469) 6.579 8.891 ( -3.106 -2.892 6.178) 7.495 9.660 ( 0.336 3.435 -3.698) 5.058 9.790 ( 1.306 -1.942 -2.694) 3.569 10.054 ( -0.890 0.563 -5.635) 5.732 10.271 ( 2.566 -7.583 -4.302) 9.088 10.463 ( 1.404 -6.945 -13.878) 15.582 10.916 ( -5.759 -8.316 -8.355) 13.120 11.116 ( 0.065 -3.866 -5.475) 6.702 11.173 ( -1.157 4.936 -3.334) 6.068 11.688 ( -3.538 0.589 4.753) 5.955 11.764 ( -3.263 -4.089 0.111) 5.232 11.899 ( -0.993 -3.652 3.839) 5.391 12.128 ( -0.626 -6.924 -3.118) 7.619 13.189 ( 8.356 7.619 16.318) 19.853 13.761 ( 9.394 -9.859 17.735) 22.360 13.814 ( -4.683 5.334 15.368) 16.927 14.159 ( -10.665 -2.556 16.168) 19.536 15.384 ( 22.493 37.642 -11.500) 45.333 15.564 ( -1.453 33.794 -8.084) 34.778 16.601 ( 12.111 10.949 -4.592) 16.960 16.883 ( -22.820 18.908 -3.706) 29.867 17.621 ( 13.900 -22.496 1.900) 26.512 18.085 ( -11.747 -25.262 -5.139) 28.330 20.583 ( 0.837 -2.158 -0.946) 2.501 20.632 ( -1.900 -3.413 -1.500) 4.184 ======================= Grid point 237 (125/170) ======================= q-point: (-0.45 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( -4.968 1.207 2.595) 5.733 1.350 ( 1.812 -1.208 -3.855) 4.428 1.420 ( -2.612 0.452 -0.259) 2.664 1.573 ( -3.368 5.154 -4.258) 7.486 1.718 ( -7.013 6.677 -1.438) 9.790 1.876 ( 0.849 -2.148 -1.589) 2.803 2.045 ( -3.250 -4.773 -2.790) 6.414 2.115 ( 6.963 0.652 1.146) 7.086 2.357 ( 3.027 5.900 0.931) 6.697 2.432 ( 0.198 6.739 -2.592) 7.223 2.605 ( 2.049 1.411 4.285) 4.954 2.707 ( -4.462 -5.038 -3.694) 7.676 2.885 ( -3.511 -4.511 -1.644) 5.948 2.994 ( 8.817 -11.131 3.931) 14.734 3.212 ( 1.394 -8.963 2.432) 9.391 3.274 ( 2.987 -9.614 -2.848) 10.462 3.730 ( -2.508 -5.111 0.360) 5.704 3.827 ( 1.141 -2.143 -2.344) 3.375 4.157 ( 1.075 -0.341 2.077) 2.364 4.184 ( 0.068 4.238 2.025) 4.697 4.545 ( 0.799 -0.000 0.506) 0.946 4.724 ( 0.751 -2.597 -7.478) 7.951 4.847 ( -1.535 9.938 7.646) 12.633 5.024 ( -4.806 10.115 -1.780) 11.339 5.193 ( 0.547 1.793 3.682) 4.132 5.264 ( 1.579 4.023 1.391) 4.540 5.347 ( -4.347 -5.179 5.896) 8.970 5.634 ( 6.006 -9.887 -2.038) 11.747 6.438 ( -0.866 8.952 1.721) 9.157 6.687 ( 1.982 1.239 -11.444) 11.680 7.526 ( -0.945 10.800 2.726) 11.178 7.558 ( -3.874 11.320 0.200) 11.966 8.062 ( -7.617 -4.188 -0.179) 8.694 8.181 ( 6.234 -7.603 0.308) 9.837 8.866 ( -0.532 0.930 5.625) 5.726 8.901 ( -1.976 -1.819 4.712) 5.424 9.661 ( 1.633 4.790 0.250) 5.067 9.749 ( 0.617 2.376 -6.819) 7.247 10.020 ( 3.125 -3.494 -1.160) 4.829 10.177 ( -0.127 -4.445 -12.598) 13.360 10.524 ( 6.895 -14.216 5.296) 16.664 10.678 ( -7.578 -14.921 -13.352) 21.409 11.101 ( 1.701 1.847 -1.682) 3.022 11.164 ( 4.813 3.865 -3.203) 6.955 11.676 ( -3.220 2.753 4.037) 5.852 11.774 ( 2.574 -3.608 1.344) 4.632 11.941 ( 0.290 -4.022 4.831) 6.293 12.082 ( 0.171 -8.438 -4.286) 9.466 13.475 ( 3.145 8.862 15.870) 18.447 13.651 ( -11.275 4.543 -2.427) 12.396 14.150 ( -8.537 -1.255 14.914) 17.230 14.253 ( 10.278 -7.207 21.247) 24.679 15.276 ( -16.883 30.308 -9.873) 36.071 15.551 ( 8.270 38.714 -10.620) 40.987 16.502 ( -16.189 8.039 -2.704) 18.276 16.843 ( 18.844 19.311 -1.493) 27.023 17.800 ( -7.942 -23.593 -5.488) 25.492 17.907 ( 10.452 -21.795 1.589) 24.224 20.587 ( -0.776 -2.439 -1.017) 2.754 20.606 ( 1.830 -2.816 -0.750) 3.441 ======================= Grid point 238 (126/170) ======================= q-point: (-0.36 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( -7.884 -4.043 -2.534) 9.215 1.235 ( -11.815 -3.673 -1.890) 12.516 1.378 ( -1.238 2.355 3.286) 4.228 1.514 ( -4.211 3.580 1.245) 5.665 1.624 ( -4.901 8.809 -0.177) 10.082 1.847 ( -0.875 -2.930 -2.403) 3.889 1.992 ( 0.237 -3.799 -0.780) 3.885 2.264 ( 8.021 1.676 1.269) 8.292 2.386 ( -0.670 4.302 -0.391) 4.372 2.479 ( 3.179 2.785 1.854) 4.616 2.615 ( 2.277 -1.100 -2.840) 3.803 2.714 ( 1.538 3.105 3.644) 5.028 2.852 ( 4.286 -0.256 -3.193) 5.351 3.125 ( -2.267 -11.286 3.372) 11.995 3.215 ( -0.509 -8.967 -2.344) 9.282 3.291 ( 8.138 -7.369 -4.968) 12.050 3.624 ( -5.508 3.985 3.227) 7.526 3.965 ( 9.446 -6.248 1.455) 11.419 4.174 ( -2.089 9.247 -2.057) 9.701 4.269 ( 7.112 -4.077 4.710) 9.454 4.507 ( -2.054 -4.475 -1.290) 5.090 4.713 ( 1.474 1.374 -3.023) 3.633 4.823 ( -6.609 8.134 3.027) 10.909 5.000 ( 0.785 5.455 3.297) 6.422 5.177 ( -2.209 3.142 -2.218) 4.435 5.262 ( -4.296 -1.167 0.879) 4.537 5.396 ( 2.671 -2.942 5.656) 6.912 5.686 ( 5.397 -10.676 -5.853) 13.318 6.421 ( -4.303 6.756 2.052) 8.269 6.579 ( -0.701 2.537 -9.205) 9.574 7.467 ( -5.143 12.571 0.421) 13.589 7.557 ( -2.807 9.211 4.230) 10.517 7.945 ( -6.495 -0.931 0.260) 6.567 8.281 ( 5.520 -8.902 0.539) 10.488 8.892 ( -1.093 2.832 3.203) 4.413 8.957 ( 1.498 -2.366 4.570) 5.360 9.646 ( -0.128 3.131 -3.237) 4.505 9.782 ( 5.251 5.627 2.616) 8.129 10.042 ( -0.140 -0.682 -10.705) 10.728 10.101 ( 4.338 -8.201 2.702) 9.663 10.423 ( -6.378 -14.335 -10.746) 19.017 10.716 ( 5.529 -15.414 9.943) 19.158 11.140 ( 6.313 3.366 -2.171) 7.477 11.235 ( 6.777 3.250 -2.261) 7.849 11.679 ( -1.450 4.383 3.301) 5.675 11.858 ( 5.716 -1.978 1.646) 6.268 11.988 ( -0.064 -6.133 0.822) 6.189 12.074 ( 3.947 -8.961 -0.298) 9.796 13.373 ( -14.846 9.531 -6.255) 18.718 13.607 ( -7.797 2.744 12.228) 14.760 14.173 ( -1.085 2.244 2.688) 3.666 14.571 ( 6.525 -5.543 6.932) 11.016 14.860 ( -20.351 25.057 -4.783) 32.633 15.435 ( -11.071 31.587 -3.544) 33.659 16.304 ( -7.706 1.457 -0.900) 7.894 17.143 ( 14.573 26.561 2.759) 30.422 17.533 ( -7.985 -25.377 -10.757) 28.696 18.196 ( 17.318 -17.571 4.847) 25.143 20.567 ( 0.039 -1.128 -0.824) 1.397 20.643 ( 2.578 -2.881 0.251) 3.874 ======================= Grid point 239 (127/170) ======================= q-point: (-0.27 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.029 ( -3.643 2.839 -0.085) 4.619 1.130 ( -4.346 -11.424 5.281) 13.315 1.390 ( -4.424 0.255 7.386) 8.614 1.441 ( -6.929 0.637 3.190) 7.655 1.562 ( -1.367 10.328 1.864) 10.583 1.839 ( 1.617 -3.221 -1.791) 4.025 2.018 ( 2.846 -3.853 0.750) 4.848 2.323 ( -2.886 -2.927 0.447) 4.135 2.359 ( 2.898 6.695 -5.388) 9.070 2.480 ( -0.593 -0.846 -4.433) 4.552 2.715 ( 9.224 6.049 -1.095) 11.085 2.758 ( 3.406 2.145 0.158) 4.028 2.941 ( 3.205 4.492 3.413) 6.488 3.045 ( -3.575 -5.208 -1.986) 6.622 3.183 ( 1.552 -5.900 -2.926) 6.766 3.353 ( -1.357 3.460 2.303) 4.372 3.702 ( 4.772 -5.021 9.763) 11.971 4.059 ( -3.019 6.157 -2.908) 7.448 4.127 ( 6.507 -2.082 -2.448) 7.257 4.389 ( -0.595 1.408 -1.570) 2.192 4.511 ( 4.301 -1.633 2.901) 5.439 4.686 ( -1.295 1.135 2.804) 3.290 4.776 ( -2.916 -1.705 0.171) 3.382 5.053 ( 1.711 2.348 0.589) 2.964 5.105 ( -2.900 1.746 -2.614) 4.277 5.192 ( -2.482 -3.958 -0.893) 4.757 5.516 ( 5.386 -3.370 4.139) 7.583 5.679 ( 3.377 -11.130 -8.231) 14.249 6.335 ( -5.811 5.080 -2.168) 8.017 6.487 ( -3.542 2.296 -1.939) 4.645 7.388 ( -5.042 12.418 0.302) 13.406 7.522 ( -7.829 7.727 4.686) 11.957 7.877 ( -2.778 3.460 1.659) 4.738 8.373 ( 5.065 -9.186 0.937) 10.531 8.910 ( 0.059 3.670 1.249) 3.877 9.016 ( 1.756 -2.942 0.368) 3.446 9.634 ( 0.601 2.457 -0.370) 2.557 9.836 ( 1.289 -1.601 -5.869) 6.219 9.994 ( -1.145 5.902 3.399) 6.907 10.193 ( 4.330 -8.398 1.625) 9.588 10.305 ( 0.760 -8.640 1.545) 8.810 10.898 ( 2.294 -12.695 11.295) 17.146 11.262 ( 11.322 2.637 -2.042) 11.803 11.322 ( 6.770 4.630 -1.738) 8.384 11.702 ( -0.184 4.058 4.107) 5.777 11.944 ( 1.774 -6.801 -2.730) 7.540 12.024 ( 7.439 -3.823 2.382) 8.696 12.179 ( 6.427 -5.741 1.529) 8.752 13.048 ( -15.230 9.379 -7.780) 19.505 13.532 ( -11.838 -6.455 4.180) 14.116 14.060 ( -9.383 17.914 -11.275) 23.153 14.442 ( -7.845 12.473 -6.356) 16.048 14.764 ( -2.690 2.265 1.033) 3.665 15.223 ( -12.163 16.827 3.335) 21.029 16.160 ( -12.112 -4.858 2.217) 13.237 17.081 ( -17.143 -10.546 -5.186) 20.784 17.608 ( 20.517 16.282 0.604) 26.200 18.553 ( 20.482 -14.416 3.666) 25.313 20.573 ( 1.016 0.223 0.316) 1.087 20.688 ( 2.298 -2.688 0.784) 3.622 ======================= Grid point 240 (128/170) ======================= q-point: (-0.18 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.006 ( -1.929 6.526 2.918) 7.405 1.189 ( 4.402 -8.026 3.113) 9.669 1.371 ( -7.255 -1.982 6.548) 9.972 1.391 ( -5.177 -1.253 7.212) 8.966 1.732 ( 11.814 -0.105 13.127) 17.660 1.810 ( -0.705 -0.487 -4.417) 4.499 2.085 ( 1.729 -4.610 2.535) 5.538 2.278 ( -0.865 0.042 -2.996) 3.119 2.299 ( -0.972 5.093 -6.806) 8.556 2.406 ( -0.079 -1.785 -7.291) 7.506 2.782 ( 2.717 -2.292 -8.491) 9.205 2.841 ( 4.404 8.219 4.369) 10.297 2.956 ( 2.020 5.629 -4.881) 7.720 3.079 ( 4.157 1.556 6.850) 8.162 3.231 ( 3.661 -1.674 3.064) 5.059 3.333 ( -7.222 10.350 9.075) 15.545 3.867 ( 0.208 -1.652 8.060) 8.230 3.956 ( -3.601 7.447 -2.999) 8.798 4.180 ( 3.205 -3.592 -5.601) 7.385 4.337 ( -0.361 4.548 0.162) 4.565 4.559 ( -4.382 3.139 2.187) 5.817 4.722 ( -2.382 -3.679 4.696) 6.424 4.769 ( 5.446 -4.574 -2.577) 7.565 4.998 ( -3.085 0.054 -4.558) 5.504 5.087 ( 1.803 -3.207 -0.342) 3.695 5.208 ( 5.624 -5.606 -1.512) 8.083 5.613 ( 1.866 -11.565 -6.742) 13.516 5.673 ( 7.266 -5.832 1.311) 9.409 6.213 ( -5.574 5.216 -2.502) 8.033 6.406 ( -5.967 -0.078 0.712) 6.010 7.313 ( -4.260 11.565 -0.052) 12.325 7.412 ( -11.119 8.057 4.238) 14.370 7.888 ( 0.232 6.933 3.678) 7.852 8.466 ( 4.845 -8.923 1.459) 10.258 8.905 ( -1.235 2.388 -1.566) 3.111 8.995 ( 0.361 -2.052 -8.043) 8.309 9.632 ( -1.001 0.419 0.965) 1.452 9.814 ( 2.126 1.184 -0.343) 2.457 9.984 ( -1.560 -2.748 1.620) 3.550 10.282 ( 3.064 -6.593 0.686) 7.302 10.466 ( 3.590 1.707 17.916) 18.352 11.020 ( -1.504 -7.701 9.689) 12.468 11.408 ( 7.780 3.202 -0.682) 8.441 11.457 ( 12.454 7.650 -1.317) 14.675 11.780 ( 2.655 1.893 6.925) 7.654 11.928 ( 1.424 -10.884 -3.356) 11.478 12.211 ( 10.116 -1.635 3.755) 10.913 12.276 ( 4.301 -1.856 -0.796) 4.752 12.733 ( -14.243 5.379 -5.773) 16.282 13.302 ( -8.010 -12.208 -17.022) 22.426 13.818 ( -13.003 29.434 9.443) 33.535 14.279 ( -0.908 7.531 -15.054) 16.857 14.607 ( -8.993 6.653 -9.351) 14.580 15.127 ( -6.185 1.498 2.385) 6.796 15.967 ( -15.897 -11.438 5.172) 20.256 16.708 ( -18.250 -18.098 -8.145) 26.962 17.978 ( 18.690 24.806 6.842) 31.804 18.894 ( 17.932 -10.990 -0.202) 21.033 20.604 ( 1.380 1.014 1.695) 2.410 20.730 ( 1.501 -2.263 0.954) 2.878 ======================= Grid point 241 (129/170) ======================= q-point: (-0.09 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( 2.719 7.468 8.308) 11.497 1.209 ( -3.811 5.319 -0.734) 6.584 1.395 ( 0.091 -3.987 2.270) 4.589 1.442 ( 1.708 -12.419 11.917) 17.296 1.720 ( -2.478 3.121 -3.242) 5.137 2.049 ( -0.448 -5.042 2.989) 5.878 2.091 ( 1.762 -6.678 1.152) 7.002 2.193 ( -2.122 -1.654 -5.734) 6.334 2.289 ( 7.728 3.199 -0.142) 8.365 2.349 ( 1.551 -3.528 -4.299) 5.774 2.704 ( 0.466 -4.895 -7.967) 9.362 2.815 ( -4.336 -3.225 -5.355) 7.608 3.063 ( 10.476 11.155 2.459) 15.499 3.248 ( 1.546 19.256 11.616) 22.542 3.339 ( -4.571 8.613 12.057) 15.507 3.375 ( 6.811 -1.134 8.195) 10.716 3.853 ( -8.099 7.426 2.640) 11.301 3.886 ( -1.080 9.394 -1.486) 9.572 4.143 ( 0.329 -1.402 -5.965) 6.137 4.367 ( 0.358 2.571 2.729) 3.766 4.482 ( -3.446 4.524 -2.167) 6.086 4.711 ( -3.587 -1.320 1.996) 4.312 4.782 ( -1.978 -4.325 -1.937) 5.135 4.922 ( 1.068 -6.889 -5.752) 9.038 5.134 ( 3.607 -7.790 0.311) 8.590 5.334 ( 10.874 -9.591 -1.315) 14.559 5.547 ( -0.868 -8.566 -4.149) 9.557 5.794 ( 4.492 -8.500 -3.167) 10.122 6.135 ( -0.033 5.183 0.431) 5.201 6.311 ( -6.436 -2.054 0.741) 6.796 7.253 ( -5.094 10.848 1.783) 12.116 7.287 ( -6.802 10.032 1.997) 12.284 7.955 ( 1.289 8.155 6.192) 10.321 8.556 ( 3.568 -8.475 2.245) 9.466 8.790 ( -5.195 1.787 -10.929) 12.232 8.894 ( -0.868 -1.148 -7.286) 7.427 9.666 ( 2.194 0.533 4.588) 5.113 9.874 ( 1.610 0.188 3.911) 4.234 10.013 ( 1.715 -3.863 3.174) 5.286 10.297 ( -0.082 -4.545 -1.936) 4.941 10.719 ( 1.089 3.186 19.684) 19.970 11.053 ( -5.373 -3.785 6.950) 9.566 11.545 ( 7.267 4.444 2.737) 8.947 11.620 ( 7.058 7.698 0.108) 10.444 11.902 ( 0.857 -0.081 4.156) 4.244 11.939 ( 6.985 -5.414 -2.797) 9.269 12.292 ( -0.218 1.042 -1.755) 2.053 12.395 ( 3.446 -4.698 0.497) 5.848 12.490 ( -7.430 3.878 2.245) 8.677 13.017 ( -2.587 -5.047 -13.265) 14.426 13.862 ( -0.068 18.293 13.306) 22.620 14.054 ( -2.138 8.716 -21.621) 23.410 14.356 ( -4.193 3.484 -13.373) 14.442 15.004 ( -10.396 -3.752 -1.930) 11.220 15.795 ( -12.936 -15.314 7.666) 21.462 16.372 ( -8.732 -19.369 -10.869) 23.865 18.327 ( 12.347 23.865 10.422) 28.820 19.081 ( 8.262 -5.163 -5.704) 11.289 20.649 ( 1.130 1.067 2.669) 3.089 20.753 ( 0.326 -1.670 0.608) 1.807 ======================= Grid point 242 (130/170) ======================= q-point: ( 0.00 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -8.573 1.506 9.331) 12.761 1.227 ( -6.300 -5.049 11.721) 14.233 1.460 ( 8.787 4.156 -2.717) 10.093 1.495 ( 10.269 -0.514 5.397) 11.612 1.794 ( -4.058 5.534 1.048) 6.941 1.936 ( -4.852 -7.996 -6.285) 11.269 1.986 ( 0.036 0.948 -0.874) 1.290 2.022 ( -1.297 -2.747 0.976) 3.190 2.268 ( 1.841 -1.153 -4.284) 4.803 2.304 ( 4.492 -4.867 -5.227) 8.437 2.520 ( -2.171 -1.401 -8.722) 9.096 2.566 ( -0.685 -5.645 -9.407) 10.992 3.405 ( -2.906 3.475 14.688) 15.371 3.427 ( -5.534 1.010 13.896) 14.992 3.702 ( 4.813 8.611 3.900) 10.608 3.822 ( -2.147 -1.336 1.469) 2.924 3.909 ( 5.071 19.315 6.745) 21.078 4.080 ( 5.061 1.630 0.226) 5.322 4.234 ( -1.917 14.156 0.965) 14.318 4.423 ( 2.080 -0.953 0.883) 2.453 4.522 ( -2.118 4.929 0.272) 5.372 4.623 ( -2.211 -3.213 -0.878) 3.998 4.625 ( -4.938 -1.320 -1.593) 5.354 4.693 ( 1.732 -9.067 -5.497) 10.744 4.994 ( -1.476 -7.221 -1.865) 7.603 5.063 ( -0.374 -13.683 -4.292) 14.345 5.578 ( 4.706 0.835 -2.225) 5.272 5.624 ( -2.109 -3.369 -4.387) 5.920 6.218 ( 0.630 0.888 -0.076) 1.091 6.239 ( 5.391 -1.186 -0.728) 5.568 7.357 ( -3.452 5.790 2.788) 7.295 7.390 ( -0.334 2.383 1.230) 2.703 8.228 ( 0.084 9.792 7.564) 12.374 8.426 ( -0.729 -10.338 5.347) 11.662 8.653 ( -2.418 4.108 -11.745) 12.675 8.735 ( -1.829 -4.201 -8.534) 9.686 9.811 ( 3.900 2.292 5.352) 7.008 9.877 ( 2.115 -3.982 3.276) 5.574 10.083 ( 1.094 3.611 0.617) 3.824 10.174 ( -0.070 -4.925 -2.605) 5.572 10.967 ( -2.777 2.378 14.348) 14.806 11.000 ( -5.406 -1.188 11.419) 12.690 11.665 ( -4.261 0.130 -0.316) 4.275 11.682 ( 0.979 -0.922 1.054) 1.709 11.912 ( -2.068 0.651 2.104) 3.021 11.958 ( 3.213 -4.299 1.343) 5.533 12.282 ( -3.114 3.434 -7.341) 8.682 12.303 ( -2.053 1.623 -5.790) 6.354 12.756 ( 10.010 5.861 9.599) 15.057 12.880 ( 8.157 -6.670 5.083) 11.699 13.895 ( -7.913 7.911 -22.485) 25.115 13.993 ( -8.768 -1.653 -20.956) 22.776 14.506 ( 6.808 14.498 12.210) 20.140 14.752 ( -4.186 -5.754 3.712) 8.026 15.570 ( 1.470 2.120 -1.180) 2.837 15.833 ( 6.008 -20.681 -10.695) 24.045 18.869 ( 0.146 11.444 6.613) 13.218 19.022 ( -0.935 -4.355 -0.620) 4.497 20.708 ( 0.283 0.975 1.604) 1.898 20.730 ( -0.205 -1.233 0.562) 1.371 ======================= Grid point 243 (131/170) ======================= q-point: ( 0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( -4.555 1.999 8.994) 10.278 1.225 ( -7.968 -5.778 9.574) 13.731 1.516 ( 5.004 9.497 -6.110) 12.351 1.666 ( 7.139 -3.897 -5.039) 9.568 1.802 ( 0.082 1.191 6.611) 6.718 1.834 ( -0.876 -2.952 3.188) 4.432 1.956 ( -2.327 2.146 -3.043) 4.391 2.008 ( 1.106 -3.493 -1.547) 3.977 2.292 ( 2.184 -2.747 0.646) 3.569 2.312 ( 1.077 -5.179 -4.347) 6.847 2.437 ( 1.945 -2.177 -4.328) 5.221 2.477 ( 1.130 -5.494 -6.350) 8.472 3.401 ( -11.843 5.980 8.049) 15.518 3.460 ( -9.343 0.061 11.365) 14.712 3.664 ( -8.649 9.019 0.703) 12.516 3.754 ( -6.870 -0.465 -1.051) 6.966 4.049 ( 4.244 11.596 0.076) 12.349 4.126 ( -0.841 5.088 -2.096) 5.567 4.293 ( 6.535 10.057 6.216) 13.509 4.387 ( 0.214 6.350 -4.468) 7.767 4.542 ( -0.507 -0.943 2.442) 2.666 4.570 ( -3.194 -0.922 -0.048) 3.325 4.654 ( 8.800 0.226 2.299) 9.098 4.739 ( 7.959 -8.601 -4.012) 12.387 4.908 ( -7.054 -8.691 -0.356) 11.199 5.000 ( -3.108 -11.819 -1.720) 12.341 5.505 ( -5.849 2.276 -3.292) 7.088 5.589 ( -0.555 -6.524 -1.858) 6.806 6.275 ( 7.506 4.802 -1.905) 9.112 6.364 ( 11.020 -4.425 -3.210) 12.302 7.363 ( 0.261 7.379 3.100) 8.008 7.432 ( 3.105 0.473 2.065) 3.759 8.272 ( -5.426 7.710 5.983) 11.166 8.428 ( -4.965 -7.597 3.671) 9.790 8.540 ( 1.273 5.068 -5.848) 7.842 8.660 ( 1.909 -6.377 -3.915) 7.723 9.899 ( -0.581 1.959 -2.388) 3.143 9.920 ( 3.486 -0.587 1.823) 3.978 10.116 ( 0.904 -2.013 0.928) 2.394 10.128 ( -0.467 -2.809 -1.916) 3.432 11.023 ( -3.972 3.775 10.359) 11.718 11.090 ( -0.547 -2.564 11.457) 11.754 11.578 ( -6.440 2.106 1.531) 6.946 11.674 ( -3.306 -7.163 0.251) 7.893 11.858 ( -5.292 8.459 0.052) 9.978 11.993 ( -1.449 -3.724 -0.121) 3.998 12.123 ( -8.039 3.353 -0.472) 8.723 12.200 ( -5.000 -3.926 -2.368) 6.784 12.986 ( 5.137 3.568 0.013) 6.254 13.039 ( 5.692 -2.072 -3.656) 7.075 13.578 ( -6.678 6.729 -8.625) 12.817 13.701 ( -3.421 -5.724 -6.457) 9.282 14.791 ( 11.742 10.156 3.171) 15.845 14.815 ( 13.145 9.300 3.519) 16.483 15.697 ( 14.320 -1.573 0.121) 14.406 15.935 ( 20.402 -22.146 -10.575) 31.914 18.836 ( -12.241 7.742 4.070) 15.045 18.917 ( -10.248 -0.208 -0.190) 10.252 20.716 ( -1.213 0.193 0.645) 1.387 20.725 ( -0.777 -0.717 0.446) 1.147 ======================= Grid point 244 (132/170) ======================= q-point: ( 0.18 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( 0.381 0.006 3.235) 3.258 1.215 ( -0.744 -2.854 4.007) 4.976 1.531 ( 4.914 6.512 -4.258) 9.202 1.651 ( 3.423 -5.307 -7.831) 10.060 1.879 ( -1.343 5.890 -2.569) 6.565 1.895 ( 1.143 3.123 8.700) 9.314 1.956 ( -0.561 -3.497 4.456) 5.692 2.011 ( 2.470 -6.486 2.550) 7.394 2.242 ( 1.316 -1.096 -7.913) 8.096 2.298 ( 1.774 -6.598 -6.670) 9.548 2.475 ( 1.785 -1.299 5.109) 5.566 2.497 ( 1.769 -2.909 2.887) 4.463 3.227 ( -15.021 11.203 1.708) 18.817 3.351 ( -12.400 0.919 3.352) 12.878 3.519 ( -11.444 2.322 0.843) 11.707 3.597 ( -7.362 -2.231 -3.947) 8.646 4.028 ( -0.099 8.207 -3.609) 8.966 4.129 ( -0.725 -0.944 3.024) 3.250 4.339 ( -1.348 6.006 -6.236) 8.762 4.400 ( -3.496 -0.626 -0.599) 3.602 4.539 ( 0.767 9.107 1.752) 9.306 4.619 ( 3.366 3.590 7.704) 9.142 4.777 ( 0.780 -12.353 -1.568) 12.477 4.814 ( 2.512 -10.112 1.262) 10.495 4.858 ( 5.655 5.336 1.106) 7.853 4.968 ( 1.722 -4.977 0.838) 5.333 5.393 ( -4.797 4.078 -1.257) 6.421 5.542 ( -2.285 -10.006 -1.476) 10.369 6.390 ( 9.756 6.400 -3.785) 12.267 6.499 ( 11.202 -4.946 -5.476) 13.414 7.428 ( 3.059 8.500 3.513) 9.693 7.527 ( 5.035 -1.443 2.787) 5.933 8.195 ( -5.665 7.088 -0.855) 9.114 8.347 ( -6.767 -8.350 0.229) 10.750 8.581 ( 2.534 5.060 5.018) 7.563 8.690 ( 1.106 -5.742 3.250) 6.690 9.831 ( -1.877 4.526 -4.579) 6.706 9.929 ( -0.364 -4.959 -4.457) 6.678 10.085 ( 0.123 2.027 -2.194) 2.990 10.170 ( 2.121 -5.939 0.025) 6.306 11.089 ( -0.196 6.229 6.977) 9.355 11.201 ( 2.076 -4.145 5.428) 7.138 11.473 ( -9.491 1.139 0.423) 9.569 11.559 ( -10.383 -5.742 -2.156) 12.059 11.763 ( -4.190 10.524 -1.484) 11.425 11.903 ( -4.429 0.672 -1.557) 4.742 12.074 ( -5.331 -2.346 6.733) 8.902 12.101 ( -8.900 -7.237 4.822) 12.443 12.877 ( 0.089 2.293 -14.610) 14.789 12.931 ( 0.240 -3.652 -19.441) 19.783 13.593 ( -0.352 9.181 16.066) 18.507 13.767 ( -0.828 -8.369 16.513) 18.531 15.017 ( 23.776 22.534 -8.289) 33.791 15.174 ( 20.979 6.528 5.165) 22.570 15.988 ( 21.052 -2.537 -1.485) 21.256 16.230 ( 26.564 -23.095 -6.993) 35.887 18.570 ( -21.412 10.170 -0.940) 23.724 18.702 ( -18.301 -3.407 2.086) 18.732 20.686 ( -2.267 0.650 -0.563) 2.424 20.710 ( -1.828 -1.632 0.164) 2.456 ======================= Grid point 245 (133/170) ======================= q-point: ( 0.27 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.224 ( 3.482 1.771 -2.153) 4.460 1.272 ( 6.425 -3.031 -4.416) 8.365 1.582 ( 5.749 2.921 -3.610) 7.390 1.648 ( 5.398 -3.723 -6.117) 8.968 1.822 ( -2.720 5.099 0.505) 5.801 1.904 ( -3.036 -4.567 -0.906) 5.559 2.038 ( 2.665 1.107 6.660) 7.258 2.069 ( -2.666 -1.357 3.136) 4.334 2.216 ( 4.631 1.866 -4.132) 6.481 2.305 ( 7.202 -7.012 -3.157) 10.536 2.545 ( -0.058 0.267 5.440) 5.447 2.580 ( 1.044 -2.840 7.550) 8.134 2.997 ( -13.282 13.908 -0.561) 19.240 3.184 ( -10.560 0.369 0.640) 10.586 3.309 ( -11.995 -2.143 -2.921) 12.531 3.431 ( -9.133 -7.162 -3.680) 12.176 4.028 ( 2.168 8.437 0.756) 8.744 4.125 ( -7.105 -1.688 0.689) 7.335 4.178 ( -8.050 0.936 -7.315) 10.917 4.246 ( -5.979 -5.860 -1.285) 8.470 4.589 ( 3.428 8.895 -0.764) 9.563 4.757 ( 3.091 2.910 2.272) 4.815 4.773 ( 1.562 -3.117 0.566) 3.532 4.906 ( 1.629 -5.402 11.336) 12.663 4.968 ( 5.954 1.838 -0.263) 6.237 5.041 ( 4.491 -4.262 -0.170) 6.194 5.332 ( -2.092 6.280 0.973) 6.690 5.500 ( -1.245 -9.156 -0.681) 9.266 6.492 ( 8.625 7.049 -5.030) 12.222 6.605 ( 9.912 -4.715 -6.292) 12.651 7.525 ( 3.834 8.879 3.515) 10.290 7.638 ( 4.499 -2.509 2.829) 5.877 8.102 ( -3.457 6.285 -2.371) 7.554 8.242 ( -5.680 -7.819 -0.677) 9.688 8.683 ( 0.018 2.524 9.016) 9.363 8.747 ( -0.845 -3.806 6.611) 7.675 9.765 ( -0.582 3.886 -3.576) 5.313 9.858 ( -1.070 -5.009 -4.755) 6.988 10.060 ( 0.977 3.879 -4.151) 5.765 10.177 ( 1.173 -7.473 -3.565) 8.363 11.106 ( -0.271 7.027 -9.654) 11.944 11.216 ( -1.807 -2.615 -8.467) 9.044 11.264 ( -10.826 1.519 -3.023) 11.343 11.352 ( -9.015 -4.964 -0.618) 10.310 11.707 ( -4.290 6.330 3.156) 8.272 11.839 ( -3.674 -4.189 -0.422) 5.588 12.000 ( -9.499 -0.090 5.512) 10.983 12.066 ( -3.823 -5.782 4.247) 8.129 12.822 ( 4.486 0.623 -3.033) 5.451 12.855 ( 6.682 -2.252 3.337) 7.801 13.772 ( -2.388 7.771 18.648) 20.344 13.925 ( -3.999 -7.746 18.578) 20.522 15.360 ( 30.712 27.249 -10.979) 42.500 15.587 ( 26.020 7.970 0.600) 27.219 16.295 ( 19.938 -0.331 -4.878) 20.529 16.593 ( 23.925 -24.178 -3.173) 34.162 18.158 ( -26.504 13.612 -2.638) 29.911 18.375 ( -23.679 -8.953 0.950) 25.333 20.636 ( -2.592 0.902 -1.160) 2.980 20.670 ( -2.634 -2.476 -0.567) 3.659 ======================= Grid point 246 (134/170) ======================= q-point: ( 0.36 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.244 ( 4.425 4.368 -4.631) 7.753 1.316 ( 7.603 -3.343 -7.658) 11.297 1.595 ( 0.810 2.140 -5.703) 6.145 1.660 ( 2.523 -3.362 -4.988) 6.523 1.835 ( 3.172 2.798 1.304) 4.426 1.883 ( 1.547 -2.349 -0.326) 2.831 2.031 ( -2.138 3.480 0.267) 4.093 2.111 ( -0.734 -3.383 3.517) 4.935 2.308 ( 7.399 5.320 1.046) 9.172 2.423 ( 8.750 -6.707 -0.898) 11.061 2.597 ( -1.709 3.970 5.281) 6.824 2.683 ( 1.564 -3.666 6.614) 7.722 2.808 ( -8.477 9.150 -0.244) 12.475 3.013 ( -11.922 -7.115 0.032) 13.883 3.107 ( -7.846 1.508 -1.914) 8.216 3.229 ( -9.116 -7.677 -4.585) 12.770 3.901 ( -13.003 0.901 -3.156) 13.410 3.958 ( -9.167 -4.484 -5.353) 11.524 4.106 ( 3.885 7.347 2.204) 8.599 4.243 ( 0.184 -6.382 1.782) 6.629 4.619 ( 2.644 8.886 -3.461) 9.896 4.772 ( 2.494 -6.388 -3.643) 7.766 4.828 ( -0.208 8.393 4.829) 9.685 5.006 ( -2.213 -8.787 4.464) 10.101 5.080 ( 4.152 2.548 7.497) 8.941 5.131 ( 6.010 -2.559 3.640) 7.477 5.344 ( 0.964 7.249 1.263) 7.421 5.479 ( -0.881 -5.965 -0.786) 6.081 6.560 ( 6.573 7.770 -5.034) 11.354 6.680 ( 7.876 -4.597 -6.639) 11.280 7.615 ( 2.528 8.536 3.304) 9.496 7.720 ( 1.901 -1.822 2.497) 3.628 8.036 ( -1.244 4.182 -2.480) 5.019 8.150 ( -4.613 -6.997 -1.015) 8.442 8.766 ( -1.791 1.151 9.045) 9.292 8.801 ( -2.302 -2.513 8.007) 8.702 9.736 ( 0.471 3.443 -1.903) 3.962 9.807 ( 0.014 -2.518 -3.394) 4.226 10.041 ( 2.581 1.924 -3.834) 5.006 10.141 ( 1.430 -7.245 -6.218) 9.653 10.813 ( -7.448 7.203 -23.367) 25.561 10.977 ( -7.575 -8.624 -15.986) 19.680 11.165 ( -3.051 3.659 -0.462) 4.786 11.262 ( -3.015 -4.019 -2.270) 5.513 11.680 ( -4.130 2.841 4.166) 6.518 11.768 ( -5.554 -4.865 1.776) 7.594 11.930 ( -3.390 4.458 1.363) 5.764 12.041 ( -2.112 -6.520 0.008) 6.854 13.010 ( 9.150 6.143 14.569) 18.268 13.142 ( 11.197 -7.216 19.815) 23.876 13.896 ( -6.000 6.824 16.432) 18.777 14.029 ( -7.210 -6.540 17.343) 19.888 15.744 ( 32.184 29.920 -12.819) 45.775 16.007 ( 26.530 13.536 -3.059) 29.940 16.483 ( 11.431 1.402 -8.321) 14.209 16.888 ( 14.550 -28.892 -2.651) 32.457 17.692 ( -26.345 17.502 -1.701) 31.675 17.993 ( -22.906 -14.657 -0.017) 27.194 20.585 ( -1.824 0.567 -1.281) 2.300 20.619 ( -2.464 -2.744 -1.037) 3.831 ======================= Grid point 247 (135/170) ======================= q-point: ( 0.45 0.44 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.301 ( 7.500 3.514 -3.935) 9.169 1.360 ( 6.108 -3.061 -6.368) 9.340 1.502 ( -4.957 5.728 -1.677) 7.758 1.633 ( -1.190 -5.404 -0.095) 5.534 1.879 ( 1.366 1.927 -5.674) 6.146 1.909 ( 3.460 0.258 -4.441) 5.636 2.034 ( 0.499 3.559 4.596) 5.834 2.099 ( -4.453 -1.737 2.115) 5.227 2.423 ( 5.317 6.271 -0.132) 8.223 2.528 ( 5.611 -4.206 -3.266) 7.735 2.557 ( -5.220 5.673 0.961) 7.769 2.701 ( -7.651 -7.913 -0.174) 11.009 2.767 ( 2.974 1.731 2.417) 4.205 2.864 ( -5.370 -6.381 2.290) 8.649 3.053 ( -0.005 -0.185 2.799) 2.805 3.106 ( -0.868 -4.525 -0.341) 4.620 3.703 ( -6.847 0.704 -2.289) 7.253 3.787 ( -4.725 -7.251 -4.692) 9.845 4.185 ( 2.512 4.135 2.199) 5.314 4.244 ( -2.395 -1.225 1.613) 3.137 4.599 ( 1.425 7.079 -5.269) 8.939 4.733 ( -0.895 -6.080 -6.322) 8.816 4.904 ( 0.238 6.653 8.993) 11.190 5.039 ( -1.178 -7.238 8.773) 11.434 5.215 ( 2.565 4.076 5.777) 7.521 5.260 ( 3.444 -0.066 3.343) 4.800 5.356 ( 0.002 4.466 -0.808) 4.539 5.450 ( -0.286 -4.860 -2.026) 5.273 6.595 ( 3.893 7.763 -4.131) 9.617 6.710 ( 4.975 -3.931 -7.304) 9.672 7.673 ( 0.162 7.741 3.364) 8.442 7.748 ( -1.638 1.192 2.045) 2.879 8.014 ( 1.357 -0.362 -1.607) 2.134 8.070 ( -3.718 -5.175 -1.298) 6.503 8.825 ( -1.955 0.801 7.792) 8.074 8.845 ( -2.877 -1.603 8.025) 8.675 9.732 ( 0.594 3.681 -0.633) 3.782 9.779 ( 1.100 -0.534 -3.483) 3.691 10.051 ( 2.385 0.470 -3.899) 4.595 10.126 ( 4.746 -6.847 -3.206) 8.927 10.462 ( -4.877 6.843 -21.049) 22.664 10.672 ( -7.033 -13.581 -17.573) 23.296 11.133 ( 0.196 3.615 -0.614) 3.672 11.204 ( -0.275 -2.155 -2.858) 3.590 11.667 ( -2.516 0.348 3.762) 4.539 11.709 ( -4.419 -2.619 2.734) 5.819 11.916 ( -0.074 3.427 0.482) 3.462 12.003 ( -0.909 -5.584 -2.308) 6.110 13.360 ( 9.636 9.868 18.905) 23.402 13.560 ( 10.629 -10.632 19.884) 24.928 13.941 ( -7.913 7.172 14.944) 18.368 14.072 ( -9.448 -5.991 16.050) 19.564 16.096 ( 27.951 33.694 -13.609) 45.845 16.220 ( -2.336 33.336 -6.333) 34.012 16.593 ( 22.723 -13.079 -9.884) 28.020 16.847 ( -16.096 -25.323 -7.822) 31.008 17.446 ( -1.634 7.751 4.712) 9.217 17.676 ( -16.171 -15.839 0.464) 22.641 20.556 ( -0.201 -0.328 -1.007) 1.078 20.575 ( -1.309 -2.228 -1.191) 2.846 ======================= Grid point 248 (136/170) ======================= q-point: (-0.45 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.280 ( -7.095 0.073 -4.790) 8.561 1.310 ( -1.506 -2.676 -4.703) 5.617 1.506 ( -0.258 6.993 4.425) 8.280 1.632 ( -1.666 -3.213 0.720) 3.690 1.753 ( -4.536 3.165 -6.308) 8.390 1.858 ( -2.352 -4.751 -6.987) 8.771 2.044 ( -4.217 6.311 3.924) 8.544 2.132 ( 3.672 -0.851 4.180) 5.629 2.464 ( 2.483 4.703 -1.689) 5.580 2.513 ( 1.256 0.749 -3.758) 4.033 2.583 ( 1.902 -1.344 2.729) 3.588 2.617 ( 1.983 -3.885 0.795) 4.434 2.833 ( 0.109 -0.859 0.951) 1.286 2.859 ( 3.542 -3.209 0.738) 4.836 3.100 ( 0.529 -1.942 1.563) 2.548 3.135 ( 1.753 -4.839 -0.653) 5.188 3.664 ( 3.541 -0.324 -0.016) 3.556 3.730 ( 3.911 -6.150 -3.022) 7.890 4.207 ( -2.390 4.231 1.718) 5.154 4.252 ( 1.886 0.998 2.615) 3.375 4.558 ( -2.251 2.245 -3.182) 4.498 4.639 ( -0.474 -5.235 -5.558) 7.650 5.011 ( -0.746 7.127 10.617) 12.809 5.135 ( -1.691 -5.643 11.090) 12.557 5.215 ( -4.872 7.826 -2.704) 9.607 5.293 ( -2.747 -0.570 -0.121) 2.808 5.350 ( 2.229 3.558 -0.851) 4.284 5.462 ( 4.161 -7.843 -1.932) 9.087 6.592 ( 0.425 6.584 -3.033) 7.262 6.680 ( 1.446 -2.367 -7.660) 8.146 7.692 ( -2.831 6.069 3.549) 7.579 7.720 ( -3.952 4.172 2.143) 6.133 7.999 ( -2.439 -1.224 -1.038) 2.920 8.049 ( 3.140 -5.607 -0.482) 6.444 8.879 ( -1.060 0.515 6.831) 6.932 8.887 ( -1.676 -0.166 6.699) 6.907 9.735 ( 0.644 2.928 -1.072) 3.184 9.775 ( 3.555 -0.659 -3.404) 4.966 10.047 ( 1.785 6.350 -2.079) 6.916 10.158 ( -0.408 1.148 -7.257) 7.358 10.278 ( 5.347 -8.458 -4.718) 11.062 10.388 ( -5.773 -13.402 -15.001) 20.928 11.157 ( 3.265 3.301 -0.746) 4.703 11.201 ( 4.091 -0.472 -3.050) 5.125 11.688 ( -0.003 -0.697 3.164) 3.240 11.703 ( 0.948 -2.134 2.803) 3.649 11.926 ( 0.244 0.831 0.982) 1.310 11.963 ( -0.907 -3.554 -2.461) 4.417 13.640 ( 0.609 7.359 12.398) 14.431 13.714 ( -7.763 0.461 3.039) 8.349 14.104 ( -1.281 -1.853 16.741) 16.892 14.130 ( 3.957 -4.541 18.137) 19.111 15.886 ( -23.598 30.775 -7.031) 39.414 16.265 ( -6.695 23.655 -10.427) 26.704 16.435 ( -6.382 -4.079 -6.073) 9.708 16.925 ( 25.620 -19.023 -11.176) 33.811 17.480 ( -8.611 -1.031 2.590) 9.051 17.605 ( 11.649 -10.180 4.466) 16.102 20.552 ( 0.354 -0.849 -0.886) 1.278 20.560 ( 1.416 -1.595 -0.757) 2.263 ======================= Grid point 249 (137/170) ======================= q-point: (-0.36 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( -11.313 0.397 1.162) 11.379 1.169 ( -10.893 -4.914 -0.402) 11.957 1.458 ( -4.498 6.430 -2.567) 8.256 1.552 ( -5.961 -0.919 -1.670) 6.259 1.700 ( -1.181 0.966 1.012) 1.830 1.765 ( -1.290 -5.202 -1.447) 5.552 2.036 ( -1.685 8.209 2.321) 8.696 2.206 ( -0.203 -7.473 2.959) 8.040 2.491 ( 3.367 4.208 -3.289) 6.314 2.518 ( 2.165 0.933 -2.595) 3.506 2.675 ( 9.324 6.816 2.719) 11.866 2.758 ( 5.763 0.784 3.323) 6.698 2.838 ( 3.491 -0.250 -1.929) 3.996 2.928 ( 0.922 -8.353 4.569) 9.566 3.091 ( -0.015 -2.273 -2.031) 3.048 3.145 ( 5.247 -6.786 -4.352) 9.618 3.750 ( 5.442 6.466 0.530) 8.468 3.852 ( 10.979 -5.031 0.112) 12.077 4.202 ( 0.087 2.266 0.784) 2.399 4.323 ( 1.838 -6.259 2.942) 7.156 4.453 ( -4.020 8.449 -1.631) 9.498 4.629 ( 1.464 -7.367 0.047) 7.511 5.045 ( -7.655 10.803 -2.844) 13.542 5.105 ( -2.913 4.964 6.682) 8.819 5.181 ( -6.142 -3.912 -4.314) 8.463 5.199 ( -4.296 -3.566 7.976) 9.736 5.400 ( 4.015 2.609 -0.513) 4.815 5.498 ( 4.017 -7.920 -4.397) 9.909 6.540 ( -3.251 5.035 -2.541) 6.509 6.599 ( -1.771 -0.924 -6.162) 6.478 7.647 ( -5.773 5.787 2.144) 8.451 7.682 ( -5.684 2.611 3.939) 7.392 7.969 ( -0.090 4.411 -0.112) 4.413 8.106 ( 3.859 -8.764 0.438) 9.586 8.933 ( -0.084 1.105 4.103) 4.250 8.939 ( 0.334 0.035 4.972) 4.983 9.731 ( 1.529 5.112 -2.522) 5.901 9.815 ( 4.291 -2.498 -3.001) 5.802 10.010 ( -0.656 0.756 -3.890) 4.017 10.097 ( -3.067 -0.735 -3.348) 4.600 10.208 ( 2.983 -0.287 -4.704) 5.578 10.416 ( 6.627 -14.815 6.849) 17.616 11.217 ( 6.539 3.875 -2.393) 7.969 11.265 ( 7.175 -0.544 -2.605) 7.653 11.733 ( 1.975 1.789 1.705) 3.164 11.792 ( 5.179 -4.078 2.358) 7.000 11.922 ( -0.637 0.019 -0.877) 1.084 11.963 ( 2.843 -3.312 1.943) 4.778 13.521 ( -13.859 6.432 -3.756) 15.734 13.614 ( -12.208 -2.649 3.372) 12.939 14.263 ( 5.412 7.096 7.027) 11.359 14.423 ( 8.293 -8.712 9.341) 15.229 15.400 ( -28.585 28.008 -2.187) 40.079 15.800 ( -30.124 -5.840 -0.760) 30.694 16.402 ( -1.742 21.276 -6.334) 22.267 16.976 ( -6.284 -31.626 -9.010) 33.480 17.593 ( 18.992 19.485 2.541) 27.328 17.905 ( 20.064 -13.973 3.292) 24.671 20.560 ( 1.613 0.530 -0.547) 1.784 20.589 ( 2.535 -2.381 -0.123) 3.480 ======================= Grid point 250 (138/170) ======================= q-point: (-0.27 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( -7.129 -1.161 8.153) 10.892 1.048 ( -5.422 -3.581 5.531) 8.533 1.358 ( -6.669 1.853 0.569) 6.945 1.430 ( -6.644 -2.884 -1.037) 7.317 1.710 ( 0.860 4.508 2.283) 5.126 1.784 ( 2.507 -3.416 1.621) 4.537 2.033 ( -1.317 6.841 1.620) 7.153 2.205 ( -2.105 -8.728 1.377) 9.084 2.475 ( 1.158 2.690 -7.812) 8.343 2.484 ( 1.309 0.668 -7.957) 8.091 2.808 ( 3.554 3.726 -1.911) 5.492 2.888 ( 3.707 6.806 3.520) 8.512 2.906 ( 6.304 -2.717 0.114) 6.865 2.991 ( 1.606 -0.884 6.709) 6.955 3.092 ( 3.575 1.195 -0.580) 3.814 3.283 ( 14.095 -12.120 -0.701) 18.603 3.833 ( 0.614 14.858 5.395) 15.819 4.026 ( 8.865 -4.101 0.950) 9.814 4.195 ( -0.352 1.689 -4.024) 4.379 4.303 ( -0.922 -9.576 -1.107) 9.684 4.508 ( 3.742 6.370 6.263) 9.686 4.657 ( 1.337 -6.090 0.318) 6.243 4.869 ( -8.813 9.724 -2.225) 13.310 5.033 ( -5.962 -7.039 -2.746) 9.625 5.119 ( -3.479 3.781 2.101) 5.551 5.177 ( -4.011 -0.804 1.982) 4.545 5.463 ( 4.338 -1.446 -0.952) 4.671 5.498 ( 3.328 -6.122 -5.502) 8.879 6.437 ( -5.606 4.771 -2.742) 7.856 6.498 ( -4.597 -1.335 -3.004) 5.652 7.567 ( -6.552 5.775 1.700) 8.897 7.611 ( -8.113 1.188 3.713) 9.001 7.994 ( 2.023 8.489 1.514) 8.856 8.181 ( 4.150 -10.279 1.408) 11.174 8.962 ( 0.309 1.712 0.421) 1.790 8.984 ( 1.020 -0.882 0.567) 1.462 9.716 ( -0.615 5.742 -2.579) 6.325 9.812 ( 1.290 -2.416 -4.663) 5.408 9.981 ( -2.280 -2.720 -2.767) 4.500 10.035 ( 4.665 -7.088 0.093) 8.486 10.352 ( 5.983 11.239 11.724) 17.308 10.617 ( 4.861 -15.160 12.519) 20.253 11.325 ( 10.213 3.640 -2.596) 11.149 11.373 ( 9.740 -0.251 -2.034) 9.954 11.766 ( 0.607 2.220 0.753) 2.421 11.826 ( -1.037 -4.102 -1.685) 4.554 12.002 ( 8.543 1.926 3.008) 9.259 12.080 ( 8.188 -4.940 2.187) 9.810 13.214 ( -15.130 8.458 -8.630) 19.363 13.379 ( -14.455 -8.525 -5.477) 17.653 14.366 ( 4.351 12.631 -3.638) 13.846 14.550 ( 3.706 -5.432 -5.120) 8.334 14.972 ( -24.960 22.399 5.097) 33.922 15.354 ( -27.910 -10.224 5.795) 30.284 16.214 ( -13.667 16.711 -3.736) 21.909 16.676 ( -17.965 -26.081 -6.623) 32.355 17.990 ( 23.945 18.801 3.158) 30.608 18.297 ( 23.109 -13.501 3.122) 26.945 20.590 ( 2.275 1.631 0.251) 2.810 20.634 ( 2.678 -2.743 0.474) 3.863 ======================= Grid point 251 (139/170) ======================= q-point: (-0.18 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( 2.449 -1.572 11.026) 11.404 1.101 ( 2.814 -0.190 5.198) 5.914 1.271 ( -8.235 -2.951 6.996) 11.201 1.324 ( -6.772 -4.132 1.449) 8.065 1.799 ( 5.819 4.435 4.311) 8.492 1.850 ( 3.200 1.126 0.443) 3.421 2.025 ( -1.567 2.315 1.101) 3.005 2.170 ( -2.766 -8.767 -1.260) 9.279 2.390 ( 0.569 2.063 -8.609) 8.872 2.404 ( 1.554 0.282 -10.436) 10.554 2.774 ( -0.191 1.715 -9.046) 9.209 2.843 ( -1.963 -4.891 -6.752) 8.565 3.063 ( 3.512 6.082 10.707) 12.805 3.142 ( 2.778 -3.045 12.232) 12.908 3.237 ( 11.828 12.489 2.051) 17.323 3.503 ( 12.387 -8.305 0.041) 14.913 3.885 ( -4.389 15.095 9.555) 18.396 4.094 ( -2.702 1.438 -0.432) 3.091 4.172 ( 4.165 2.041 -0.855) 4.716 4.312 ( 2.561 -9.838 -1.163) 10.232 4.603 ( 0.272 1.502 4.145) 4.417 4.680 ( 0.523 -3.632 -1.531) 3.976 4.741 ( -5.129 8.951 1.830) 10.477 4.935 ( -5.583 -8.364 -0.186) 10.058 5.054 ( -1.558 2.119 -3.774) 4.601 5.135 ( -0.356 -4.724 -3.381) 5.820 5.478 ( 4.032 -0.676 -5.642) 6.968 5.548 ( 5.822 -6.199 -0.928) 8.555 6.315 ( -6.224 4.818 -1.544) 8.021 6.385 ( -6.528 -2.321 -1.186) 7.029 7.479 ( -6.074 5.245 1.261) 8.124 7.511 ( -8.533 1.889 3.163) 9.295 8.058 ( 2.645 10.303 3.012) 11.055 8.268 ( 3.979 -11.035 2.405) 11.974 8.939 ( -1.118 1.401 -4.061) 4.439 8.965 ( -0.123 -1.338 -5.918) 6.069 9.680 ( -0.893 4.320 -0.002) 4.411 9.780 ( -0.660 -5.065 -0.430) 5.125 9.985 ( 3.215 4.414 0.175) 5.464 10.119 ( 4.305 -8.590 0.677) 9.632 10.601 ( 3.158 10.174 18.730) 21.548 10.820 ( 0.797 -11.846 15.281) 19.351 11.472 ( 10.087 4.454 -1.530) 11.132 11.551 ( 14.064 -0.961 -0.576) 14.109 11.780 ( -0.511 -1.587 -1.771) 2.432 11.806 ( 1.529 -0.739 3.031) 3.475 12.184 ( 9.520 0.968 1.816) 9.740 12.237 ( 8.771 -3.062 0.281) 9.294 12.875 ( -13.337 8.861 -10.006) 18.882 13.068 ( -10.735 -11.165 -12.175) 19.701 14.341 ( -0.042 17.619 -4.950) 18.302 14.445 ( -4.371 6.632 -9.780) 12.599 14.686 ( -15.618 9.300 -2.257) 18.317 15.039 ( -20.951 -15.687 8.714) 27.586 15.925 ( -16.553 11.510 -2.517) 20.318 16.298 ( -18.666 -22.865 -6.774) 30.284 18.392 ( 19.470 17.993 5.166) 27.010 18.679 ( 19.273 -12.262 2.643) 22.995 20.634 ( 2.094 2.081 1.125) 3.159 20.681 ( 2.070 -2.627 0.926) 3.470 ======================= Grid point 252 (140/170) ======================= q-point: (-0.09 0.44 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 298 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.179 ( -2.258 3.174 6.299) 7.406 1.224 ( -6.290 -2.993 5.174) 8.677 1.271 ( 5.673 -2.169 10.922) 12.497 1.315 ( 4.645 -3.555 4.990) 7.689 1.855 ( -1.468 9.164 -1.842) 9.462 1.957 ( 5.155 -2.309 4.843) 7.440 2.007 ( -1.338 -2.667 0.085) 2.985 2.077 ( -4.297 -8.804 -5.165) 11.075 2.311 ( 1.564 1.015 -8.786) 8.982 2.332 ( 2.303 -0.799 -8.601) 8.939 2.650 ( -2.001 0.050 -9.038) 9.257 2.706 ( -3.210 -5.253 -9.684) 11.475 3.248 ( 1.655 5.623 14.636) 15.766 3.312 ( -0.249 -2.258 14.748) 14.922 3.483 ( 14.118 12.476 3.467) 19.157 3.688 ( 10.661 0.300 0.877) 10.701 3.889 ( -7.058 12.341 8.644) 16.638 4.055 ( -1.200 3.729 0.340) 3.933 4.223 ( 1.832 5.420 0.703) 5.765 4.357 ( 2.154 -6.341 2.494) 7.146 4.602 ( -6.406 7.358 0.489) 9.768 4.629 ( -0.283 -1.773 0.986) 2.049 4.719 ( -2.185 -2.350 -0.851) 3.320 4.808 ( -6.939 -5.576 -3.958) 9.742 5.019 ( 1.415 -2.893 -3.719) 4.920 5.100 ( 2.481 -11.568 -6.223) 13.368 5.511 ( 5.981 3.665 -3.127) 7.680 5.631 ( 5.814 -7.915 -2.974) 10.261 6.221 ( -3.401 3.561 -0.138) 4.926 6.274 ( -5.677 -2.118 -0.195) 6.063 7.406 ( -5.120 4.561 1.910) 7.118 7.419 ( -5.509 3.262 1.880) 6.673 8.140 ( 2.133 10.750 4.863) 11.990 8.357 ( 2.690 -11.307 3.716) 12.202 8.827 ( -3.136 1.867 -10.160) 10.796 8.864 ( -2.140 -1.875 -8.295) 8.769 9.708 ( 1.744 3.795 4.128) 5.872 9.804 ( 1.153 -5.623 3.783) 6.874 10.045 ( 2.985 5.513 0.593) 6.297 10.174 ( 2.310 -7.205 -0.721) 7.601 10.822 ( -1.110 6.605 18.434) 19.613 10.951 ( -4.020 -6.366 13.498) 15.456 11.601 ( 5.950 4.229 1.159) 7.391 11.727 ( 0.234 -7.155 -1.304) 7.277 11.798 ( 9.848 5.227 1.609) 11.265 11.902 ( 4.222 -3.772 2.394) 6.146 12.308 ( 4.549 2.178 -1.036) 5.149 12.355 ( 4.968 -1.587 -1.841) 5.531 12.632 ( -4.135 9.466 -2.903) 10.730 12.834 ( -1.522 -11.121 -9.102) 14.451 14.221 ( -1.987 8.419 -20.623) 22.364 14.339 ( 1.401 4.221 -5.835) 7.337 14.371 ( -16.464 20.154 0.752) 26.035 14.845 ( -14.000 -17.730 6.974) 23.643 15.669 ( -10.724 6.728 -2.160) 12.843 15.973 ( -9.894 -20.658 -8.542) 24.446 18.705 ( 11.033 15.657 6.399) 20.194 18.944 ( 10.289 -9.395 1.117) 13.978 20.678 ( 1.294 1.822 1.633) 2.767 20.716 ( 0.934 -2.080 0.944) 2.468 ======================= Grid point 297 (141/170) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 85 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( -1.637 0.000 -15.525) 15.611 1.134 ( 1.637 0.000 15.525) 15.611 1.351 ( -9.585 0.000 -15.906) 18.571 1.351 ( 9.585 0.000 15.906) 18.571 1.681 ( -5.851 0.000 -3.188) 6.663 1.681 ( 5.851 0.000 3.188) 6.663 2.217 ( -1.355 0.000 -6.774) 6.908 2.217 ( 1.355 0.000 6.774) 6.908 2.458 ( 10.364 0.000 -23.191) 25.402 2.458 ( -10.364 0.000 23.191) 25.402 2.882 ( -0.530 0.000 -0.526) 0.746 2.882 ( 0.530 0.000 0.526) 0.746 3.238 ( 2.203 0.000 -7.346) 7.669 3.238 ( -2.203 0.000 7.346) 7.669 3.404 ( -2.190 0.000 0.514) 2.250 3.404 ( 2.190 0.000 -0.514) 2.250 3.780 ( -1.010 0.000 -4.780) 4.886 3.780 ( 1.010 0.000 4.780) 4.886 3.873 ( 0.082 0.000 -8.320) 8.321 3.873 ( -0.082 0.000 8.320) 8.321 4.391 ( 3.582 0.000 -1.636) 3.938 4.391 ( -3.582 0.000 1.636) 3.938 5.247 ( -4.395 0.000 -7.620) 8.797 5.247 ( 4.395 0.000 7.620) 8.797 5.704 ( 3.369 0.000 -6.332) 7.173 5.704 ( -3.369 0.000 6.333) 7.173 5.842 ( 4.077 0.000 -2.027) 4.553 5.842 ( -4.077 0.000 2.027) 4.553 6.458 ( -4.539 0.000 -1.145) 4.681 6.458 ( 4.539 0.000 1.145) 4.681 6.520 ( -7.134 0.000 -1.613) 7.314 6.520 ( 7.134 0.000 1.613) 7.314 8.102 ( 1.563 0.000 -13.707) 13.796 8.102 ( -1.563 0.000 13.707) 13.796 8.745 ( 1.287 0.000 -1.546) 2.012 8.745 ( -1.287 0.000 1.546) 2.012 9.887 ( -6.264 0.000 0.516) 6.285 9.887 ( 6.264 0.000 -0.516) 6.285 10.293 ( -1.404 0.000 -10.962) 11.051 10.293 ( 1.404 0.000 10.962) 11.051 11.068 ( -11.107 0.000 -11.684) 16.121 11.068 ( 11.107 0.000 11.684) 16.121 11.287 ( -3.074 0.000 -3.704) 4.813 11.287 ( 3.074 0.000 3.704) 4.813 11.701 ( -3.963 0.000 -4.558) 6.040 11.701 ( 3.963 0.000 4.558) 6.040 12.311 ( 5.891 0.000 -8.308) 10.185 12.311 ( -5.891 0.000 8.308) 10.185 12.898 ( -2.973 0.000 -31.637) 31.776 12.898 ( 2.973 0.000 31.637) 31.776 13.621 ( -2.833 0.000 -16.343) 16.587 13.621 ( 2.833 0.000 16.343) 16.587 15.769 ( -42.613 0.000 -5.463) 42.962 15.769 ( 42.613 0.000 5.463) 42.962 16.119 ( 13.479 0.000 -6.945) 15.163 16.119 ( -13.479 0.000 6.945) 15.163 17.791 ( -53.275 0.000 -9.049) 54.038 17.791 ( 53.275 0.000 9.049) 54.038 20.768 ( -0.213 0.000 -2.690) 2.698 20.768 ( 0.213 0.000 2.690) 2.698 ======================= Grid point 299 (142/170) ======================= q-point: ( 0.09 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.954 ( 0.561 0.000 -14.133) 14.144 1.027 ( -4.629 0.000 -15.877) 16.538 1.303 ( 0.685 0.000 7.085) 7.118 1.468 ( 0.271 0.000 -4.446) 4.454 1.777 ( 5.875 0.000 15.359) 16.444 1.821 ( 5.817 0.000 0.697) 5.858 2.119 ( -0.751 0.000 -4.474) 4.536 2.286 ( -1.691 0.000 7.430) 7.620 2.416 ( 15.500 0.000 -23.379) 28.050 2.511 ( -7.142 0.000 6.974) 9.982 2.838 ( -3.627 0.000 -2.190) 4.237 2.930 ( 3.702 0.000 6.052) 7.095 3.211 ( 3.836 0.000 -8.545) 9.367 3.225 ( -6.948 0.000 -5.283) 8.729 3.342 ( -3.706 0.000 0.586) 3.752 3.381 ( -1.537 0.000 6.389) 6.571 3.485 ( -19.782 0.000 -7.733) 21.239 3.793 ( 2.387 0.000 0.263) 2.402 3.854 ( 0.063 0.000 1.233) 1.235 4.077 ( 10.973 0.000 5.796) 12.410 4.465 ( 1.894 0.000 10.229) 10.403 4.510 ( 7.273 0.000 1.688) 7.467 5.041 ( -11.182 0.000 -5.902) 12.643 5.323 ( -4.833 0.000 6.227) 7.882 5.615 ( -4.532 0.000 -5.364) 7.022 5.638 ( -10.710 0.000 2.649) 11.033 5.826 ( -2.456 0.000 2.795) 3.721 5.893 ( 0.528 0.000 2.859) 2.907 6.390 ( -1.933 0.000 -3.696) 4.171 6.403 ( 0.298 0.000 -1.300) 1.334 6.603 ( 10.369 0.000 0.607) 10.386 6.643 ( 6.924 0.000 -1.975) 7.200 8.011 ( 5.682 0.000 -13.835) 14.956 8.256 ( 2.885 0.000 12.489) 12.818 8.759 ( 1.576 0.000 -0.423) 1.632 8.764 ( 0.034 0.000 4.827) 4.827 9.837 ( 1.270 0.000 -1.010) 1.623 9.971 ( 5.664 0.000 -6.843) 8.883 10.157 ( -0.178 0.000 -7.200) 7.202 10.387 ( -2.754 0.000 6.797) 7.334 10.802 ( -5.546 0.000 -8.670) 10.292 11.074 ( -5.248 0.000 -8.081) 9.636 11.359 ( -0.192 0.000 1.292) 1.307 11.497 ( 12.378 0.000 13.123) 18.040 11.604 ( -3.017 0.000 -1.550) 3.391 11.805 ( 3.980 0.000 3.467) 5.278 12.325 ( -5.127 0.000 10.202) 11.418 12.340 ( 5.759 0.000 -4.784) 7.487 12.568 ( -2.036 0.000 -17.353) 17.472 13.298 ( 0.978 0.000 34.956) 34.970 13.416 ( 2.846 0.000 -20.599) 20.795 13.845 ( 6.538 0.000 10.861) 12.677 14.867 ( -47.123 0.000 -16.510) 49.932 15.986 ( -0.756 0.000 -6.029) 6.076 16.045 ( -8.318 0.000 5.476) 9.959 16.654 ( 44.315 0.000 -3.350) 44.441 16.892 ( -49.465 0.000 -1.658) 49.493 18.726 ( 40.446 0.000 18.451) 44.456 20.726 ( -0.465 0.000 -3.849) 3.877 20.792 ( 0.264 0.000 1.170) 1.199 ======================= Grid point 300 (143/170) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( -0.274 0.000 -10.337) 10.340 0.871 ( 5.286 0.000 -9.160) 10.576 1.313 ( 3.320 0.000 -5.971) 6.832 1.486 ( 8.005 0.000 -3.026) 8.558 1.861 ( 4.242 0.000 -7.906) 8.972 1.974 ( -1.009 0.000 11.883) 11.925 2.108 ( -1.811 0.000 2.950) 3.462 2.328 ( -2.677 0.000 4.504) 5.239 2.363 ( -11.800 0.000 -1.219) 11.863 2.436 ( 17.044 0.000 -22.043) 27.864 2.715 ( -8.322 0.000 -1.828) 8.520 2.944 ( -9.557 0.000 -5.178) 10.869 3.008 ( -6.743 0.000 -15.428) 16.837 3.197 ( 12.484 0.000 4.636) 13.317 3.277 ( 3.555 0.000 -5.122) 6.234 3.383 ( 0.969 0.000 8.294) 8.351 3.480 ( 2.109 0.000 7.359) 7.655 3.760 ( 0.995 0.000 -6.055) 6.136 3.980 ( 2.486 0.000 11.047) 11.323 4.314 ( 9.344 0.000 7.370) 11.901 4.570 ( -2.253 0.000 -0.506) 2.309 4.583 ( -2.434 0.000 10.192) 10.479 4.807 ( -10.373 0.000 -2.242) 10.613 5.231 ( -10.792 0.000 0.618) 10.809 5.423 ( -15.674 0.000 -0.478) 15.681 5.491 ( -4.916 0.000 -2.680) 5.599 5.795 ( -3.931 0.000 0.947) 4.043 5.919 ( -2.741 0.000 5.236) 5.910 6.364 ( 0.319 0.000 -0.964) 1.016 6.436 ( 3.444 0.000 0.939) 3.570 6.695 ( 4.441 0.000 -4.836) 6.566 6.807 ( 14.278 0.000 -0.874) 14.305 7.985 ( 8.815 0.000 -12.596) 15.374 8.431 ( 2.771 0.000 8.920) 9.340 8.782 ( 1.652 0.000 -0.349) 1.689 8.879 ( 2.530 0.000 13.250) 13.489 9.874 ( -1.880 0.000 -10.879) 11.040 9.903 ( 8.107 0.000 -2.701) 8.545 10.182 ( 6.383 0.000 -2.597) 6.891 10.328 ( -7.407 0.000 -2.528) 7.827 10.723 ( 3.635 0.000 -3.619) 5.129 10.904 ( -4.120 0.000 -7.743) 8.771 11.307 ( -5.965 0.000 0.086) 5.965 11.560 ( -3.020 0.000 0.710) 3.102 11.607 ( -4.506 0.000 -4.596) 6.436 11.958 ( 8.412 0.000 3.576) 9.140 12.356 ( -5.107 0.000 10.346) 11.538 12.379 ( 2.364 0.000 -1.367) 2.731 12.588 ( 10.533 0.000 11.335) 15.473 13.250 ( 3.309 0.000 -24.836) 25.055 13.662 ( 0.575 0.000 29.272) 29.278 14.063 ( 7.569 0.000 8.095) 11.082 14.094 ( -18.237 0.000 -17.028) 24.951 15.741 ( -21.490 0.000 -11.477) 24.363 15.947 ( -10.933 0.000 5.135) 12.079 16.256 ( -25.937 0.000 2.383) 26.046 17.269 ( 35.462 0.000 -1.948) 35.515 19.359 ( 11.500 0.000 16.889) 20.433 20.675 ( -0.325 0.000 -4.053) 4.066 20.804 ( 0.511 0.000 -0.080) 0.517 ======================= Grid point 301 (144/170) ======================= q-point: ( 0.27 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.802 ( 5.143 0.000 -2.233) 5.607 0.929 ( 9.877 0.000 -3.242) 10.396 1.364 ( 9.784 0.000 -5.677) 11.312 1.645 ( 12.308 0.000 0.254) 12.311 1.794 ( 2.758 0.000 -12.745) 13.040 1.972 ( -8.599 0.000 -0.721) 8.629 2.083 ( -4.727 0.000 1.207) 4.879 2.143 ( -8.556 0.000 0.807) 8.594 2.342 ( -4.198 0.000 4.933) 6.477 2.470 ( 13.603 0.000 -18.712) 23.134 2.595 ( -8.010 0.000 4.845) 9.362 2.738 ( -8.711 0.000 -5.554) 10.332 2.889 ( 10.063 0.000 -10.128) 14.277 3.305 ( 6.426 0.000 -4.912) 8.089 3.456 ( 13.369 0.000 0.070) 13.369 3.547 ( 4.945 0.000 11.280) 12.316 3.560 ( -2.962 0.000 7.983) 8.515 3.770 ( 6.053 0.000 0.098) 6.054 4.083 ( 0.801 0.000 0.119) 0.810 4.503 ( -6.028 0.000 8.251) 10.218 4.524 ( 4.337 0.000 9.100) 10.080 4.600 ( -4.051 0.000 4.532) 6.079 4.651 ( -6.876 0.000 -4.074) 7.992 4.982 ( -15.976 0.000 -5.880) 17.023 5.198 ( -12.123 0.000 1.560) 12.222 5.388 ( -7.441 0.000 0.281) 7.447 5.741 ( -1.573 0.000 -1.109) 1.924 5.915 ( -4.496 0.000 4.906) 6.654 6.357 ( -0.095 0.000 -0.478) 0.487 6.508 ( 2.515 0.000 1.595) 2.978 6.706 ( 3.897 0.000 -3.763) 5.417 6.998 ( 10.617 0.000 -2.931) 11.014 8.022 ( 11.040 0.000 -10.282) 15.086 8.516 ( -1.149 0.000 5.041) 5.170 8.808 ( 2.358 0.000 -0.600) 2.433 9.077 ( -1.589 0.000 16.966) 17.041 9.742 ( -1.821 0.000 -7.220) 7.446 9.946 ( 3.612 0.000 -13.681) 14.150 10.170 ( -2.014 0.000 -3.336) 3.897 10.262 ( 7.021 0.000 -2.536) 7.465 10.810 ( -1.111 0.000 -1.350) 1.748 10.811 ( 9.650 0.000 -1.643) 9.789 11.195 ( -9.708 0.000 2.943) 10.144 11.426 ( -8.129 0.000 -4.903) 9.493 11.509 ( -4.172 0.000 1.110) 4.317 12.151 ( 10.493 0.000 5.257) 11.736 12.326 ( -3.766 0.000 -4.950) 6.220 12.379 ( -5.587 0.000 9.710) 11.203 12.901 ( 0.249 0.000 -31.125) 31.126 13.054 ( 17.293 0.000 19.302) 25.915 13.939 ( 3.608 0.000 15.247) 15.668 14.018 ( 12.056 0.000 1.544) 12.155 14.248 ( 2.173 0.000 10.427) 10.651 15.139 ( -32.512 0.000 -11.138) 34.367 15.812 ( -12.639 0.000 5.760) 13.890 16.016 ( -9.660 0.000 -1.357) 9.755 17.765 ( 27.007 0.000 1.200) 27.034 19.468 ( -8.932 0.000 3.329) 9.533 20.636 ( 0.462 0.000 -3.060) 3.095 20.798 ( -0.558 0.000 -1.408) 1.515 ======================= Grid point 302 (145/170) ======================= q-point: ( 0.36 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( 11.561 0.000 9.907) 15.225 1.096 ( 11.801 0.000 0.377) 11.807 1.466 ( 6.891 0.000 -1.914) 7.152 1.723 ( 6.188 0.000 -11.430) 12.997 1.759 ( -10.102 0.000 -4.538) 11.075 1.836 ( 5.851 0.000 4.185) 7.194 1.988 ( -5.259 0.000 -2.128) 5.673 2.099 ( 0.848 0.000 0.122) 0.857 2.307 ( -4.349 0.000 1.669) 4.658 2.450 ( 3.398 0.000 -10.383) 10.925 2.508 ( -12.525 0.000 -5.627) 13.731 2.509 ( -8.575 0.000 2.825) 9.029 3.111 ( 23.626 0.000 -3.086) 23.827 3.384 ( 8.821 0.000 -3.192) 9.380 3.577 ( 2.010 0.000 6.100) 6.423 3.631 ( 3.606 0.000 0.365) 3.624 3.748 ( 5.336 0.000 8.971) 10.438 3.895 ( 3.315 0.000 1.339) 3.575 4.059 ( 2.781 0.000 -2.298) 3.608 4.466 ( -5.662 0.000 -6.080) 8.308 4.515 ( -9.544 0.000 5.930) 11.236 4.598 ( 0.418 0.000 10.513) 10.522 4.628 ( -12.367 0.000 -10.794) 16.415 4.700 ( 0.507 0.000 6.355) 6.375 5.047 ( -8.388 0.000 0.755) 8.422 5.227 ( -12.833 0.000 0.540) 12.844 5.742 ( 3.166 0.000 -1.505) 3.505 5.885 ( -4.841 0.000 3.691) 6.088 6.361 ( 0.855 0.000 0.555) 1.019 6.516 ( -0.608 0.000 -2.632) 2.701 6.774 ( 4.920 0.000 2.975) 5.749 7.068 ( 3.996 0.000 -5.661) 6.929 8.117 ( 12.451 0.000 -7.304) 14.436 8.509 ( -5.625 0.000 3.602) 6.679 8.851 ( 4.015 0.000 -0.749) 4.084 9.124 ( -8.775 0.000 7.688) 11.667 9.663 ( -1.347 0.000 -2.556) 2.889 9.780 ( 0.182 0.000 -14.826) 14.827 10.231 ( 5.643 0.000 3.711) 6.754 10.349 ( 7.220 0.000 -3.406) 7.983 10.803 ( -0.852 0.000 1.240) 1.504 10.958 ( 9.244 0.000 -2.367) 9.542 11.067 ( -9.726 0.000 4.256) 10.616 11.281 ( -6.848 0.000 0.465) 6.864 11.480 ( -2.515 0.000 5.396) 5.953 12.131 ( -7.595 0.000 -12.915) 14.983 12.361 ( 4.718 0.000 0.828) 4.790 12.384 ( -6.040 0.000 8.759) 10.639 12.729 ( 20.580 0.000 -18.134) 27.429 13.567 ( 18.194 0.000 17.981) 25.580 14.043 ( -6.701 0.000 -0.903) 6.761 14.287 ( 11.665 0.000 6.797) 13.501 14.332 ( -6.239 0.000 11.072) 12.709 14.585 ( -17.400 0.000 -7.586) 18.982 15.683 ( -11.351 0.000 7.416) 13.559 15.853 ( -6.194 0.000 -5.518) 8.295 18.179 ( 20.624 0.000 4.836) 21.183 19.240 ( -14.725 0.000 -6.547) 16.115 20.629 ( 1.511 0.000 -1.233) 1.950 20.759 ( -1.614 0.000 -2.168) 2.702 ======================= Grid point 303 (146/170) ======================= q-point: ( 0.45 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 165 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( 10.618 0.000 -0.007) 10.618 1.290 ( 6.500 0.000 11.958) 13.611 1.478 ( -1.450 0.000 -3.139) 3.458 1.563 ( -8.881 0.000 -3.915) 9.705 1.812 ( 13.417 0.000 -3.677) 13.912 1.889 ( -4.555 0.000 5.206) 6.918 1.921 ( 2.960 0.000 -3.104) 4.289 2.107 ( -8.221 0.000 -5.061) 9.654 2.229 ( 3.586 0.000 -2.193) 4.203 2.342 ( -3.251 0.000 4.894) 5.875 2.353 ( -8.787 0.000 0.482) 8.800 2.401 ( -1.254 0.000 -6.569) 6.688 3.469 ( 15.010 0.000 2.528) 15.221 3.529 ( 14.404 0.000 0.272) 14.407 3.613 ( -3.480 0.000 -2.721) 4.418 3.734 ( 6.155 0.000 7.988) 10.085 3.809 ( -11.214 0.000 -2.740) 11.544 3.859 ( -0.053 0.000 0.038) 0.065 4.164 ( 7.373 0.000 0.977) 7.438 4.323 ( -12.354 0.000 -3.097) 12.737 4.370 ( 3.012 0.000 -5.345) 6.135 4.423 ( -7.444 0.000 2.784) 7.947 4.714 ( 1.244 0.000 6.399) 6.518 4.757 ( 0.881 0.000 -0.632) 1.084 4.962 ( -1.547 0.000 0.111) 1.551 5.031 ( -9.697 0.000 -0.165) 9.698 5.790 ( 4.469 0.000 -1.688) 4.777 5.842 ( -4.641 0.000 2.512) 5.277 6.398 ( 1.625 0.000 2.357) 2.863 6.459 ( -1.650 0.000 -3.598) 3.958 6.901 ( 3.832 0.000 6.434) 7.489 7.018 ( -1.060 0.000 -7.077) 7.156 8.259 ( 12.638 0.000 -4.394) 13.380 8.412 ( -10.457 0.000 2.921) 10.858 8.923 ( 6.125 0.000 -1.064) 6.217 9.024 ( -8.404 0.000 2.088) 8.659 9.641 ( -1.607 0.000 2.714) 3.154 9.673 ( 1.710 0.000 -8.420) 8.592 10.360 ( 1.477 0.000 7.033) 7.186 10.401 ( 4.739 0.000 -5.659) 7.381 10.815 ( 3.107 0.000 -0.626) 3.170 10.905 ( -8.844 0.000 1.624) 8.992 11.112 ( 8.539 0.000 -3.426) 9.201 11.197 ( -7.181 0.000 3.711) 8.083 11.579 ( 2.386 0.000 13.738) 13.943 11.833 ( -6.851 0.000 -17.587) 18.874 12.371 ( 4.615 0.000 -7.236) 8.583 12.376 ( -5.962 0.000 7.921) 9.914 13.097 ( 30.640 0.000 0.482) 30.644 13.637 ( -31.004 0.000 -4.687) 31.357 13.999 ( 13.474 0.000 13.634) 19.169 14.274 ( -3.757 0.000 -10.437) 11.093 14.467 ( 4.353 0.000 1.428) 4.581 14.476 ( -2.917 0.000 7.249) 7.814 15.633 ( -5.520 0.000 9.388) 10.890 15.706 ( -1.668 0.000 -8.868) 9.023 18.547 ( 16.907 0.000 7.964) 18.689 18.903 ( -15.574 0.000 -9.327) 18.154 20.656 ( 2.161 0.000 0.615) 2.247 20.706 ( -2.142 0.000 -1.832) 2.819 ======================= Grid point 309 (147/170) ======================= q-point: ( 0.00 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.211 ( -2.001 4.952 -14.082) 15.061 1.211 ( 2.001 4.952 14.082) 15.061 1.392 ( -9.004 4.509 -14.592) 17.730 1.392 ( 9.004 4.509 14.592) 17.730 1.693 ( -4.007 1.817 -5.065) 6.709 1.693 ( 4.007 1.817 5.065) 6.709 2.183 ( 0.930 -3.976 -6.471) 7.652 2.183 ( -0.930 -3.976 6.471) 7.652 2.516 ( 4.674 5.611 -14.500) 16.235 2.516 ( -4.674 5.611 14.500) 16.235 2.929 ( -1.599 4.987 -3.665) 6.392 2.929 ( 1.599 4.987 3.665) 6.392 3.086 ( -0.755 -13.346 -4.618) 14.143 3.086 ( 0.755 -13.346 4.618) 14.143 3.403 ( 1.498 -0.298 -3.892) 4.181 3.403 ( -1.498 -0.298 3.892) 4.181 3.768 ( -11.218 -0.156 -5.289) 12.403 3.768 ( 11.218 -0.156 5.289) 12.403 3.886 ( -0.771 1.004 -1.729) 2.143 3.886 ( 0.771 1.004 1.729) 2.143 4.451 ( -3.124 5.233 -2.301) 6.514 4.451 ( 3.124 5.233 2.301) 6.514 5.160 ( -3.266 -8.444 -3.882) 9.851 5.160 ( 3.266 -8.444 3.882) 9.851 5.640 ( -12.093 -5.046 1.346) 13.173 5.640 ( 12.093 -5.046 -1.346) 13.173 5.799 ( -3.061 -4.396 -3.874) 6.611 5.799 ( 3.061 -4.396 3.874) 6.611 6.358 ( -11.908 -4.758 -0.049) 12.823 6.358 ( 11.908 -4.758 0.049) 12.823 6.722 ( 0.211 13.947 -3.161) 14.303 6.722 ( -0.211 13.947 3.161) 14.303 8.130 ( -0.245 2.656 -13.847) 14.102 8.130 ( 0.245 2.656 13.847) 14.102 8.768 ( 0.792 1.648 -1.335) 2.264 8.768 ( -0.792 1.648 1.335) 2.264 9.895 ( -5.463 0.531 -1.536) 5.700 9.895 ( 5.463 0.531 1.536) 5.700 10.292 ( -1.257 -0.468 -7.684) 7.801 10.292 ( 1.257 -0.468 7.684) 7.801 11.095 ( -8.029 0.226 -4.306) 9.114 11.095 ( 8.029 0.226 4.306) 9.114 11.310 ( -6.919 5.612 -4.124) 9.817 11.310 ( 6.919 5.612 4.124) 9.817 11.747 ( -1.667 4.387 -6.315) 7.868 11.747 ( 1.667 4.387 6.315) 7.868 12.337 ( 2.916 1.708 -7.460) 8.190 12.337 ( -2.916 1.708 7.460) 8.190 12.888 ( -3.546 -0.754 -30.444) 30.659 12.888 ( 3.546 -0.754 30.444) 30.659 13.584 ( -1.414 -3.424 -17.856) 18.236 13.584 ( 1.414 -3.424 17.856) 18.236 15.226 ( -24.169 -33.196 -9.662) 42.184 15.226 ( 24.169 -33.196 9.662) 42.184 16.351 ( -1.013 5.159 -10.612) 11.843 16.351 ( 1.013 5.159 10.612) 11.843 18.043 ( -34.938 22.534 -15.180) 44.259 18.043 ( 34.938 22.534 15.180) 44.259 20.763 ( -0.377 -0.436 -2.535) 2.600 20.763 ( 0.377 -0.436 2.535) 2.600 ======================= Grid point 311 (148/170) ======================= q-point: ( 0.09 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.051 ( 0.536 4.898 -11.989) 12.963 1.091 ( -2.864 8.180 -16.625) 18.749 1.373 ( -0.658 5.685 9.976) 11.501 1.493 ( 0.590 2.852 -6.571) 7.187 1.772 ( 6.002 0.250 11.099) 12.621 1.865 ( 6.709 3.687 7.858) 10.971 2.098 ( -3.890 -4.275 -3.671) 6.848 2.218 ( -1.076 -3.300 3.491) 4.923 2.418 ( 1.116 -0.129 -6.300) 6.399 2.585 ( 5.195 6.263 -9.669) 12.638 2.820 ( -6.691 0.527 -2.791) 7.269 2.970 ( -0.966 -6.788 -3.050) 7.504 3.068 ( 1.286 1.934 2.433) 3.364 3.141 ( -1.437 -16.228 -0.550) 16.301 3.329 ( -2.598 -3.273 2.715) 4.984 3.376 ( -6.447 1.785 -3.005) 7.333 3.474 ( -6.709 7.461 -5.536) 11.460 3.816 ( 0.618 -2.478 -3.716) 4.509 3.945 ( 3.500 8.231 5.862) 10.694 4.085 ( 9.823 0.652 7.525) 12.391 4.446 ( 1.035 0.467 2.756) 2.981 4.580 ( 5.705 4.679 4.586) 8.688 5.004 ( -9.915 -4.196 -4.192) 11.554 5.205 ( -1.138 -10.705 1.293) 10.843 5.452 ( -13.240 -7.841 3.744) 15.837 5.676 ( -7.381 -4.900 -3.357) 9.474 5.794 ( 2.812 -3.122 2.411) 4.844 5.883 ( 3.800 0.169 3.149) 4.939 6.165 ( -8.176 -8.666 -2.836) 12.247 6.510 ( 8.040 -3.798 -3.023) 9.392 6.719 ( 3.108 14.613 0.221) 14.941 6.808 ( 7.962 13.523 -0.776) 15.712 8.000 ( 2.225 -0.412 -11.643) 11.861 8.320 ( 4.712 5.320 11.577) 13.584 8.763 ( -1.450 -0.274 4.070) 4.329 8.791 ( 1.060 2.167 0.472) 2.458 9.813 ( -0.316 -1.924 -2.314) 3.026 9.978 ( 3.889 -0.042 -6.711) 7.757 10.205 ( 1.480 4.336 -4.031) 6.102 10.351 ( -2.108 -3.717 3.458) 5.497 10.906 ( -4.652 8.507 -5.825) 11.311 11.054 ( -4.691 -0.751 -8.985) 10.164 11.307 ( 0.464 -3.373 2.414) 4.174 11.559 ( 8.592 6.014 11.386) 15.480 11.645 ( -3.411 3.973 -3.692) 6.407 11.841 ( 2.370 3.144 4.874) 6.265 12.297 ( -1.964 -0.354 3.290) 3.848 12.418 ( 5.042 3.894 -2.089) 6.704 12.576 ( -2.820 0.831 -12.502) 12.843 13.300 ( 3.189 0.305 33.895) 34.046 13.368 ( 2.014 -4.788 -22.413) 23.007 13.780 ( 2.153 -5.667 11.289) 12.814 14.607 ( -29.368 -18.801 -14.858) 37.904 15.476 ( -2.684 -31.539 5.202) 32.078 16.221 ( -3.187 9.010 -3.209) 10.082 16.655 ( 15.815 -5.025 7.531) 18.223 17.394 ( -21.582 37.911 -15.158) 46.182 18.758 ( 27.795 3.348 18.693) 33.663 20.721 ( -0.655 -0.510 -3.610) 3.704 20.789 ( 0.358 -0.339 1.088) 1.195 ======================= Grid point 312 (149/170) ======================= q-point: ( 0.18 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.953 ( 5.596 8.312 -11.486) 15.243 1.010 ( 4.178 10.127 -7.197) 13.107 1.348 ( -4.934 3.034 -1.722) 6.043 1.489 ( 7.945 3.170 -6.494) 10.740 1.904 ( 3.374 1.579 -3.294) 4.972 1.982 ( -5.329 -2.455 5.407) 7.979 2.065 ( 1.112 -0.926 6.861) 7.012 2.247 ( 0.671 -4.755 1.611) 5.065 2.371 ( -7.135 -2.140 3.436) 8.203 2.481 ( 4.875 4.149 -19.353) 20.384 2.675 ( -6.078 -2.140 -3.965) 7.566 2.827 ( 1.017 -9.509 -11.948) 15.304 3.020 ( -6.783 -7.624 -6.604) 12.155 3.112 ( -1.765 5.651 -2.758) 6.531 3.269 ( 4.551 -1.903 6.559) 8.207 3.411 ( 3.363 -6.093 5.444) 8.836 3.549 ( 8.847 13.122 1.683) 15.915 3.775 ( -0.607 0.725 -2.128) 2.329 4.105 ( 5.472 10.186 8.597) 14.409 4.295 ( 5.219 -2.013 7.799) 9.598 4.463 ( -3.490 -5.449 0.788) 6.518 4.666 ( -2.819 4.087 4.626) 6.786 4.814 ( -6.767 0.062 -1.170) 6.867 5.155 ( -5.434 -7.774 -1.140) 9.553 5.294 ( -11.195 -7.504 2.957) 13.798 5.492 ( -10.015 -3.943 -2.504) 11.050 5.779 ( -5.272 -1.438 1.315) 5.621 5.947 ( -1.213 2.215 1.801) 3.102 6.103 ( 1.897 -13.067 1.302) 13.268 6.561 ( 5.031 -0.578 -5.343) 7.361 6.784 ( 3.471 11.172 0.108) 11.699 6.970 ( 12.352 14.387 -0.968) 18.986 7.953 ( 6.762 -2.387 -10.388) 12.623 8.484 ( 1.579 4.303 7.080) 8.434 8.797 ( -0.505 1.268 2.199) 2.588 8.859 ( 2.579 -2.077 10.685) 11.187 9.833 ( 4.412 -4.568 -4.282) 7.660 9.882 ( -0.621 -0.826 -7.816) 7.884 10.212 ( 0.085 1.058 -6.834) 6.916 10.326 ( 0.103 0.583 0.297) 0.662 10.830 ( -1.741 8.511 -5.269) 10.160 10.895 ( 0.456 0.137 -6.581) 6.598 11.286 ( -4.626 -1.693 0.797) 4.990 11.525 ( -7.598 -1.748 -4.391) 8.948 11.667 ( -2.013 4.723 0.454) 5.154 11.957 ( 5.508 0.598 4.869) 7.376 12.315 ( -2.824 -3.232 2.142) 4.797 12.454 ( -0.242 4.959 3.986) 6.367 12.648 ( 12.270 4.600 12.238) 17.930 13.134 ( 1.090 -8.947 -27.763) 29.189 13.681 ( -1.031 0.047 25.771) 25.792 13.845 ( 1.300 -7.845 3.773) 8.802 14.236 ( -0.187 2.859 -2.859) 4.048 15.322 ( -19.508 -21.822 1.956) 29.336 16.133 ( -3.945 12.074 -3.355) 13.137 16.668 ( -21.910 22.048 3.564) 31.287 17.314 ( 26.184 8.181 -8.262) 28.649 19.236 ( 7.168 -11.240 14.317) 19.563 20.670 ( -0.504 -0.567 -3.823) 3.897 20.799 ( 0.222 -0.572 -0.151) 0.632 ======================= Grid point 313 (150/170) ======================= q-point: ( 0.27 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.910 ( -0.245 12.628 -4.393) 13.373 1.038 ( 9.189 6.192 -3.837) 11.726 1.352 ( 7.591 -0.826 -2.425) 8.012 1.569 ( 11.309 -2.098 -8.683) 14.412 1.843 ( 0.383 -2.488 -8.001) 8.388 1.918 ( -8.353 -3.128 1.884) 9.117 2.127 ( -0.079 3.589 1.639) 3.947 2.174 ( -8.732 1.424 -0.574) 8.866 2.331 ( -2.505 0.128 4.282) 4.963 2.418 ( 1.967 -3.746 -4.020) 5.836 2.582 ( -1.774 0.211 -2.113) 2.768 2.804 ( 4.751 4.238 -12.906) 14.391 2.849 ( 2.624 -3.730 -5.271) 6.970 3.113 ( 4.256 -8.324 -2.142) 9.592 3.419 ( 3.270 -7.841 7.071) 11.053 3.546 ( 3.058 -4.804 6.412) 8.576 3.688 ( 8.089 11.410 0.871) 14.014 3.803 ( 5.768 6.124 -0.285) 8.417 4.194 ( -3.592 6.108 -2.841) 7.634 4.394 ( -0.665 -8.227 5.398) 9.862 4.428 ( -2.241 -3.081 9.100) 9.866 4.629 ( -7.946 2.189 6.871) 10.730 4.763 ( 1.857 5.756 -3.812) 7.149 4.985 ( -11.980 0.143 -3.136) 12.384 5.146 ( -10.343 -4.643 1.965) 11.506 5.349 ( -7.116 -4.112 0.194) 8.221 5.707 ( -2.964 -2.646 -0.322) 3.987 5.918 ( -3.507 -2.200 1.242) 4.323 6.180 ( 1.394 -8.085 6.059) 10.199 6.568 ( 4.212 0.403 -7.417) 8.539 6.838 ( 3.809 12.101 -0.042) 12.687 7.130 ( 8.246 12.246 -1.996) 14.897 7.989 ( 10.074 -2.933 -8.444) 13.468 8.527 ( -2.498 0.491 3.602) 4.411 8.812 ( 0.965 0.571 0.454) 1.210 9.036 ( -0.846 -3.685 14.519) 15.003 9.735 ( -2.261 -0.735 -7.016) 7.408 9.937 ( 7.823 -4.764 -4.012) 10.000 10.037 ( -5.203 -2.534 -12.160) 13.466 10.370 ( 4.484 3.515 -1.209) 5.825 10.723 ( -0.538 -3.899 -4.713) 6.140 10.952 ( 7.321 8.001 -1.120) 10.902 11.195 ( -8.245 0.332 2.168) 8.532 11.323 ( -10.104 -5.811 -3.612) 12.202 11.621 ( -3.725 7.229 1.517) 8.272 12.116 ( 5.165 -2.974 5.164) 7.886 12.263 ( -2.379 -4.450 -2.572) 5.664 12.434 ( -6.119 0.275 4.187) 7.419 12.835 ( 2.913 -4.170 -24.830) 25.346 13.131 ( 20.231 9.077 19.171) 29.313 13.815 ( 7.352 -5.698 4.503) 10.334 14.107 ( 4.564 -0.251 20.123) 20.635 14.332 ( 7.868 7.035 1.685) 10.688 14.934 ( -27.085 -7.390 -1.896) 28.139 16.021 ( -5.641 13.534 -2.414) 14.860 16.345 ( -17.769 29.053 -0.924) 34.069 17.704 ( 24.603 -5.985 -0.133) 25.321 19.300 ( -8.494 -16.043 2.257) 18.293 20.630 ( 0.319 -0.664 -2.908) 2.999 20.787 ( -0.803 -1.063 -1.361) 1.905 ======================= Grid point 314 (151/170) ======================= q-point: ( 0.36 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( 7.454 2.266 7.648) 10.917 1.184 ( 10.360 4.830 -0.087) 11.431 1.448 ( 6.257 -0.907 -2.618) 6.843 1.616 ( 4.890 -5.915 -11.082) 13.479 1.759 ( -1.352 -3.174 -4.811) 5.920 1.840 ( 0.376 0.817 1.059) 1.390 2.038 ( -7.031 2.241 1.933) 7.629 2.152 ( 1.442 3.172 -0.089) 3.485 2.302 ( -5.562 -0.279 2.510) 6.109 2.391 ( -4.341 -1.190 -1.898) 4.885 2.518 ( -2.492 4.257 -3.012) 5.779 2.632 ( -6.051 6.551 -8.613) 12.398 3.038 ( 17.563 -8.274 -0.285) 19.416 3.209 ( 10.079 -8.147 -1.415) 13.037 3.539 ( 3.511 -9.109 6.870) 11.937 3.646 ( 1.074 -5.308 6.272) 8.287 3.802 ( 5.572 9.088 -5.271) 11.892 3.918 ( 6.535 1.393 1.906) 6.949 4.072 ( -5.779 0.968 1.069) 5.956 4.355 ( -1.567 -7.529 -3.243) 8.346 4.505 ( -8.593 -0.651 5.856) 10.419 4.547 ( -6.629 1.872 0.034) 6.888 4.737 ( 1.653 6.216 -2.273) 6.821 4.850 ( -2.971 9.533 4.513) 10.958 5.006 ( -8.554 -3.697 0.899) 9.362 5.212 ( -10.086 -1.031 -0.202) 10.141 5.701 ( 2.206 -3.810 -0.058) 4.402 5.870 ( -3.899 -2.998 0.968) 5.012 6.271 ( 0.121 -4.518 8.530) 9.654 6.533 ( 2.406 0.752 -8.863) 9.215 6.915 ( 4.968 12.128 1.229) 13.163 7.179 ( 1.877 10.460 -3.780) 11.280 8.089 ( 11.863 -2.737 -6.023) 13.583 8.492 ( -6.143 -1.978 2.643) 6.974 8.846 ( 2.981 -0.279 0.144) 2.997 9.086 ( -6.829 -3.324 6.632) 10.083 9.646 ( -1.998 -1.722 -2.945) 3.954 9.801 ( -1.591 2.226 -14.890) 15.139 10.078 ( 7.047 -9.460 3.988) 12.452 10.424 ( 3.947 1.434 -3.386) 5.395 10.722 ( 2.287 -6.492 1.123) 6.974 11.047 ( 0.584 5.374 -1.025) 5.502 11.085 ( -3.432 2.565 1.640) 4.588 11.165 ( -6.484 -7.282 0.886) 9.791 11.593 ( -3.307 7.481 4.046) 9.125 12.023 ( -7.305 -9.113 -12.025) 16.764 12.309 ( 3.297 -4.345 1.283) 5.603 12.380 ( -5.036 -3.565 3.280) 6.988 12.820 ( 18.436 8.922 -7.642) 21.861 13.618 ( 15.912 6.425 11.152) 20.466 14.026 ( 8.388 -3.496 8.376) 12.359 14.277 ( -6.200 -8.370 4.938) 11.527 14.423 ( -6.533 14.584 1.125) 16.019 14.557 ( -5.405 5.482 3.747) 8.562 15.912 ( -4.556 14.247 -2.019) 15.094 16.077 ( -13.956 25.695 -1.253) 29.267 18.082 ( 19.578 -9.847 4.203) 22.314 19.084 ( -13.604 -15.331 -6.295) 21.441 20.622 ( 1.426 -0.799 -1.223) 2.041 20.747 ( -1.715 -1.196 -1.950) 2.859 ======================= Grid point 315 (152/170) ======================= q-point: ( 0.45 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 7.557 -1.427 10.709) 13.185 1.338 ( 6.685 1.781 0.080) 6.918 1.462 ( -2.208 -1.871 -2.765) 4.003 1.489 ( -3.290 -4.653 -6.783) 8.859 1.793 ( 8.946 -2.595 -3.739) 10.038 1.881 ( -3.209 -1.100 3.914) 5.180 1.994 ( 3.130 5.898 0.810) 6.726 2.169 ( -4.196 3.843 -5.006) 7.579 2.208 ( -4.435 -0.375 -1.323) 4.644 2.241 ( -5.200 -4.042 2.475) 7.036 2.471 ( -0.833 7.411 -0.584) 7.481 2.494 ( -2.224 7.534 -3.748) 8.704 3.296 ( 12.057 -14.106 1.012) 18.584 3.377 ( 4.896 -7.292 2.895) 9.248 3.631 ( -0.179 -9.741 1.651) 9.882 3.676 ( -0.493 -4.103 0.518) 4.165 3.847 ( 7.318 -1.439 -2.394) 7.833 3.932 ( -4.906 5.151 0.679) 7.146 4.099 ( 4.497 -1.411 3.074) 5.627 4.270 ( -11.457 -1.506 -3.307) 12.020 4.373 ( 3.960 0.947 -1.321) 4.280 4.460 ( -5.273 4.853 -0.754) 7.206 4.797 ( 0.114 3.578 4.647) 5.866 4.847 ( -2.002 5.360 -1.156) 5.838 4.945 ( 1.810 1.152 1.587) 2.669 5.050 ( -8.164 3.122 -0.998) 8.798 5.754 ( 3.883 -3.755 -0.080) 5.402 5.815 ( -3.983 -3.330 0.554) 5.221 6.367 ( -0.416 -1.439 9.574) 9.690 6.460 ( 1.073 0.389 -9.569) 9.637 7.020 ( 4.842 10.880 3.015) 12.285 7.124 ( -2.718 10.032 -4.201) 11.211 8.233 ( 12.132 -2.657 -3.662) 12.949 8.385 ( -10.175 -2.752 2.355) 10.800 8.912 ( 5.182 -0.893 -0.118) 5.259 9.005 ( -7.123 -1.670 1.391) 7.447 9.616 ( -1.556 -2.035 2.958) 3.913 9.663 ( 0.624 -0.443 -9.273) 9.304 10.248 ( 5.564 -8.166 7.329) 12.303 10.388 ( -1.566 -4.271 -6.761) 8.149 10.805 ( 6.058 -0.812 0.682) 6.150 10.924 ( -9.427 2.044 1.705) 9.796 11.133 ( -0.839 -4.593 3.703) 5.959 11.140 ( 3.131 -1.010 -2.642) 4.220 11.618 ( -0.582 3.786 7.932) 8.808 11.770 ( -4.998 -4.436 -13.253) 14.842 12.337 ( 2.808 -4.405 -3.240) 6.147 12.350 ( -3.859 -3.893 4.097) 6.844 13.178 ( 25.343 7.272 3.799) 26.638 13.631 ( -19.670 -0.571 -5.781) 20.510 14.158 ( 5.776 15.968 0.440) 16.986 14.221 ( -0.969 2.485 4.782) 5.476 14.458 ( 0.781 -1.564 11.972) 12.099 14.585 ( 0.551 7.191 -5.098) 8.832 15.846 ( 0.240 16.413 -2.636) 16.625 15.890 ( -8.178 21.109 1.016) 22.660 18.431 ( 16.252 -11.763 7.354) 21.368 18.768 ( -14.752 -13.463 -8.705) 21.786 20.647 ( 2.143 -0.958 0.480) 2.396 20.695 ( -2.185 -1.110 -1.610) 2.932 ======================= Grid point 321 (153/170) ======================= q-point: ( 0.00 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( -2.274 -0.267 -10.965) 11.201 1.249 ( 2.274 -0.267 10.965) 11.201 1.488 ( -7.403 3.925 -14.962) 17.148 1.488 ( 7.403 3.925 14.962) 17.148 1.769 ( -3.499 5.119 -10.347) 12.063 1.769 ( 3.499 5.119 10.347) 12.063 2.080 ( -1.799 -5.684 -7.526) 9.601 2.080 ( 1.799 -5.684 7.526) 9.601 2.588 ( -2.748 -1.527 -4.614) 5.584 2.588 ( 2.748 -1.527 4.614) 5.584 2.786 ( -3.058 -14.284 -3.537) 15.030 2.786 ( 3.058 -14.284 3.537) 15.030 3.130 ( 2.387 14.600 -6.903) 16.325 3.130 ( -2.387 14.600 6.903) 16.325 3.420 ( -5.655 4.344 -4.640) 8.508 3.420 ( 5.655 4.344 4.640) 8.508 3.823 ( -9.325 5.239 -6.978) 12.771 3.823 ( 9.325 5.239 6.978) 12.771 3.900 ( -2.985 1.295 -2.574) 4.149 3.900 ( 2.985 1.295 2.574) 4.149 4.550 ( -3.321 4.211 -3.897) 6.630 4.550 ( 3.321 4.211 3.897) 6.630 4.968 ( 0.064 -10.294 -4.118) 11.087 4.968 ( -0.064 -10.294 4.118) 11.087 5.520 ( -7.911 -8.493 -4.267) 12.366 5.520 ( 7.911 -8.493 4.267) 12.366 5.694 ( -9.308 -5.500 -2.074) 11.008 5.694 ( 9.308 -5.500 2.074) 11.008 6.282 ( -11.907 -3.089 1.140) 12.354 6.282 ( 11.907 -3.089 -1.140) 12.354 7.002 ( 3.919 14.342 -3.044) 15.176 7.002 ( -3.919 14.342 3.044) 15.176 8.195 ( -2.641 4.088 -13.971) 14.794 8.195 ( 2.641 4.088 13.971) 14.794 8.775 ( -0.968 -1.545 -2.254) 2.899 8.775 ( 0.968 -1.545 2.254) 2.899 9.898 ( -6.078 -0.185 -2.381) 6.531 9.898 ( 6.078 -0.185 2.381) 6.531 10.257 ( 0.005 -3.347 -1.550) 3.688 10.257 ( -0.005 -3.347 1.550) 3.688 11.070 ( -3.620 -0.983 -2.302) 4.401 11.070 ( 3.620 -0.983 2.302) 4.401 11.509 ( -7.001 11.968 -6.132) 15.161 11.509 ( 7.001 11.968 6.132) 15.161 11.853 ( 0.298 6.062 -6.038) 8.561 11.853 ( -0.298 6.062 6.038) 8.561 12.321 ( -2.011 -4.255 -1.445) 4.923 12.321 ( 2.011 -4.255 1.445) 4.923 12.892 ( -4.544 1.488 -25.454) 25.899 12.892 ( 4.544 1.488 25.454) 25.899 13.527 ( 0.423 -0.988 -20.333) 20.362 13.527 ( -0.423 -0.988 20.333) 20.362 14.732 ( -16.689 -16.566 -12.298) 26.537 14.732 ( 16.689 -16.566 12.298) 26.537 16.272 ( 6.107 -11.295 -13.214) 18.425 16.272 ( -6.107 -11.295 13.214) 18.425 18.494 ( -13.949 21.366 -16.636) 30.460 18.494 ( 13.949 21.366 16.636) 30.460 20.752 ( -0.681 -0.666 -2.140) 2.342 20.752 ( 0.681 -0.666 2.140) 2.342 ======================= Grid point 323 (154/170) ======================= q-point: ( 0.09 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.134 ( 0.826 4.078 -7.939) 8.963 1.226 ( -2.459 4.658 -14.249) 15.191 1.408 ( 0.763 -2.211 10.021) 10.291 1.610 ( 0.389 7.732 -6.123) 9.871 1.779 ( 7.425 -1.394 7.257) 10.476 1.948 ( -2.961 -6.328 0.324) 6.994 1.955 ( 3.350 4.272 6.276) 8.299 2.184 ( 0.838 -2.834 5.627) 6.356 2.433 ( -8.900 0.139 -4.746) 10.087 2.618 ( -0.497 -5.171 -5.920) 7.876 2.734 ( -1.038 -11.551 -2.922) 11.960 2.824 ( -3.082 -12.801 3.199) 13.549 2.952 ( -8.814 10.414 -7.109) 15.384 3.172 ( 6.658 5.607 -5.411) 10.249 3.355 ( -1.453 9.287 2.870) 9.828 3.472 ( -7.828 7.233 -6.436) 12.451 3.641 ( 5.447 8.800 -1.422) 10.447 3.787 ( -1.844 0.618 -1.226) 2.299 4.050 ( 9.502 1.516 2.151) 9.860 4.116 ( 6.275 4.886 12.614) 14.912 4.477 ( -1.882 1.948 -3.108) 4.123 4.667 ( 5.372 3.899 3.727) 7.612 4.893 ( -4.511 -6.359 -3.052) 8.373 4.991 ( -1.939 -10.380 3.363) 11.083 5.320 ( -11.796 -6.623 -0.233) 13.530 5.517 ( -9.158 -10.369 -2.227) 14.013 5.657 ( 1.529 -9.930 5.558) 11.482 5.867 ( 7.805 -4.102 1.086) 8.884 6.091 ( -9.226 1.256 -2.154) 9.557 6.431 ( 9.977 -4.043 -4.325) 11.601 6.987 ( -0.541 13.645 2.767) 13.933 7.102 ( 10.250 14.827 -2.248) 18.165 8.019 ( -1.846 2.692 -9.829) 10.357 8.421 ( 5.272 4.844 12.461) 14.371 8.726 ( -2.988 -3.977 1.628) 5.234 8.818 ( 0.666 0.167 1.920) 2.039 9.779 ( -2.767 -1.301 -3.973) 5.013 9.964 ( 1.768 -1.024 -5.085) 5.480 10.232 ( -0.927 -6.092 -3.102) 6.899 10.284 ( 2.768 0.253 1.612) 3.213 10.966 ( -2.250 0.033 -5.652) 6.084 11.123 ( 1.329 3.200 -3.916) 5.229 11.351 ( -6.862 10.218 -0.466) 12.317 11.662 ( 1.400 2.527 1.977) 3.500 11.763 ( -5.094 8.489 1.622) 10.032 11.907 ( 0.396 2.689 4.135) 4.948 12.264 ( -3.370 -3.325 2.869) 5.536 12.448 ( 9.605 -2.843 1.339) 10.106 12.605 ( -3.639 3.164 -13.225) 14.077 13.174 ( -1.072 -11.508 -0.772) 11.584 13.398 ( 5.496 7.234 8.686) 12.569 13.722 ( 1.051 2.775 11.939) 12.302 14.334 ( -12.497 -8.376 -9.442) 17.762 15.021 ( 3.259 -14.672 9.726) 17.902 16.228 ( 3.889 -8.354 -3.535) 9.870 16.500 ( 16.789 -11.221 3.142) 20.436 18.067 ( -16.519 30.170 -14.966) 37.511 18.847 ( 6.503 5.286 15.664) 17.764 20.709 ( -1.110 -0.631 -3.007) 3.267 20.778 ( 0.364 -0.819 0.862) 1.244 ======================= Grid point 324 (155/170) ======================= q-point: ( 0.18 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( 5.868 3.472 -11.304) 13.201 1.186 ( 7.066 6.222 -3.617) 10.085 1.401 ( -5.119 3.599 -2.336) 6.680 1.645 ( 3.401 7.424 1.947) 8.395 1.784 ( 0.530 -10.958 -9.669) 14.623 1.967 ( -7.501 4.370 1.740) 8.854 2.073 ( 0.865 0.699 7.922) 7.999 2.212 ( -2.585 -2.497 0.794) 3.681 2.267 ( -2.040 -6.357 2.300) 7.061 2.467 ( -0.736 -6.798 -10.191) 12.273 2.689 ( -8.059 2.815 1.108) 8.608 2.724 ( -2.235 -2.558 -2.166) 4.029 2.891 ( 4.523 -1.746 -2.287) 5.361 3.218 ( -5.769 5.912 -11.852) 14.447 3.264 ( 3.767 -6.019 0.675) 7.133 3.371 ( 2.471 9.861 -0.209) 10.168 3.748 ( 1.379 3.256 2.298) 4.217 3.845 ( 10.451 10.507 0.388) 14.825 4.199 ( 2.577 -4.548 4.797) 7.095 4.316 ( 3.705 6.358 6.139) 9.584 4.387 ( -4.744 -0.319 -0.398) 4.771 4.747 ( -4.954 3.217 2.657) 6.477 4.806 ( 1.543 -0.390 -0.468) 1.659 4.990 ( -1.042 -7.360 1.648) 7.614 5.162 ( -8.815 -6.596 1.601) 11.126 5.350 ( -8.734 -9.737 -1.033) 13.121 5.705 ( -3.183 -8.360 5.870) 10.699 5.838 ( -7.006 -8.508 -2.670) 11.340 6.074 ( 5.795 6.018 0.296) 8.360 6.517 ( 8.022 -2.840 -6.251) 10.559 7.031 ( 2.359 13.670 2.190) 14.044 7.263 ( 11.365 14.193 -1.749) 18.267 7.929 ( 2.595 0.549 -7.737) 8.179 8.546 ( -2.435 0.947 3.937) 4.725 8.783 ( 0.634 -3.255 12.706) 13.132 8.841 ( 0.797 1.028 1.364) 1.884 9.739 ( 2.342 -4.226 -3.500) 5.966 9.874 ( -2.531 -0.010 -7.350) 7.774 10.158 ( -1.636 -5.861 -5.667) 8.315 10.356 ( 3.073 0.446 0.189) 3.111 10.835 ( -2.623 -1.337 -14.267) 14.568 11.071 ( -0.518 10.595 -1.109) 10.665 11.282 ( -3.377 2.636 0.703) 4.341 11.493 ( -11.507 -1.919 -6.805) 13.506 11.775 ( -2.986 5.718 3.350) 7.268 11.980 ( 2.665 -0.070 4.864) 5.547 12.248 ( -3.803 -2.897 1.957) 5.166 12.440 ( -6.794 -6.506 -1.706) 9.560 12.705 ( 13.841 -0.757 4.349) 14.528 13.018 ( 0.347 -3.101 -5.694) 6.493 13.710 ( 5.427 5.153 12.495) 14.565 13.808 ( 4.714 6.140 5.235) 9.345 14.266 ( 4.404 1.699 6.973) 8.421 15.071 ( -6.356 -4.605 6.239) 10.026 16.268 ( 5.851 -0.702 -5.925) 8.356 16.810 ( 12.537 -4.505 5.502) 14.413 17.681 ( -9.909 25.561 -13.559) 30.584 19.006 ( -4.372 -10.816 9.828) 15.255 20.656 ( -1.078 -0.704 -3.224) 3.472 20.781 ( -0.418 -1.361 -0.285) 1.452 ======================= Grid point 325 (156/170) ======================= q-point: ( 0.27 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 1.951 0.223 -6.479) 6.770 1.250 ( 2.017 17.806 -3.967) 18.354 1.323 ( 5.583 -3.152 -1.172) 6.518 1.647 ( 5.085 8.756 -13.380) 16.779 1.695 ( 2.174 -8.654 -9.155) 12.784 1.845 ( -4.955 -5.920 4.154) 8.767 2.142 ( -1.820 -0.762 2.713) 3.355 2.169 ( -5.588 -2.236 -0.627) 6.051 2.303 ( 0.609 -3.619 5.508) 6.619 2.452 ( 2.098 3.668 1.450) 4.468 2.567 ( -4.281 0.736 1.891) 4.738 2.738 ( 0.271 -5.514 1.374) 5.689 2.945 ( 10.504 7.523 -11.594) 17.359 3.038 ( -5.496 -0.251 -2.483) 6.035 3.278 ( -1.608 -7.727 2.272) 8.213 3.448 ( 5.830 -1.489 -1.265) 6.149 3.836 ( 4.537 6.167 5.178) 9.243 3.962 ( 2.994 3.831 -5.113) 7.056 4.163 ( -6.145 -4.616 0.341) 7.693 4.263 ( -2.779 -2.214 0.677) 3.617 4.523 ( 5.179 7.729 6.410) 11.298 4.643 ( -10.338 -0.925 5.492) 11.743 4.843 ( 3.532 2.209 -4.693) 6.275 4.991 ( -1.727 0.716 2.092) 2.806 5.053 ( -7.109 -3.490 1.325) 8.029 5.243 ( -4.323 -6.216 1.509) 7.720 5.663 ( -4.960 -2.197 -0.334) 5.436 5.751 ( -4.006 -12.921 3.491) 13.971 6.170 ( 3.792 4.761 3.166) 6.861 6.558 ( 6.583 -0.694 -7.971) 10.361 7.102 ( 3.819 14.463 1.381) 15.022 7.392 ( 6.492 13.237 -2.389) 14.935 7.935 ( 7.027 -1.941 -5.668) 9.234 8.503 ( -4.963 -3.572 1.347) 6.262 8.834 ( -1.562 1.669 3.131) 3.877 8.963 ( 0.882 -3.244 10.439) 10.967 9.709 ( -1.593 -2.232 -6.640) 7.184 9.813 ( 2.456 -4.446 -0.125) 5.081 10.063 ( -1.364 1.391 -8.891) 9.102 10.367 ( 1.234 -3.140 -2.861) 4.423 10.623 ( -2.429 -5.826 -12.389) 13.904 11.098 ( 3.800 6.052 -1.215) 7.249 11.221 ( -5.071 2.565 -0.393) 5.696 11.247 ( -11.730 -2.054 -1.659) 12.023 11.739 ( -3.272 4.122 0.712) 5.311 12.046 ( -2.479 -5.076 -0.223) 5.654 12.154 ( -4.169 -6.762 -1.418) 8.070 12.328 ( -4.605 -8.034 -0.857) 9.300 12.818 ( 6.630 1.154 -1.849) 6.979 13.332 ( 16.584 6.117 24.788) 30.445 13.804 ( 12.512 6.309 -11.903) 18.385 14.039 ( 1.666 1.446 17.561) 17.699 14.494 ( 8.002 7.642 11.670) 16.082 14.983 ( -8.515 10.439 0.675) 13.488 16.261 ( 1.294 8.475 -5.970) 10.447 16.886 ( -9.010 22.668 0.551) 24.399 17.576 ( 11.129 -4.649 -5.012) 13.061 18.929 ( -11.289 -20.084 0.942) 23.059 20.612 ( -0.315 -1.044 -2.485) 2.714 20.757 ( -1.432 -2.021 -1.208) 2.756 ======================= Grid point 326 (157/170) ======================= q-point: ( 0.36 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( 2.987 2.497 4.365) 5.849 1.316 ( 7.080 10.270 -1.212) 12.533 1.400 ( 4.708 -5.016 -3.093) 7.542 1.573 ( 2.511 1.059 -13.073) 13.355 1.676 ( 6.539 -3.217 -6.970) 10.084 1.839 ( -0.521 -1.281 2.376) 2.749 2.045 ( -3.694 -1.522 0.105) 3.997 2.163 ( -3.316 0.337 4.131) 5.308 2.312 ( -5.836 1.623 2.891) 6.712 2.464 ( -3.205 5.322 -0.996) 6.292 2.564 ( -0.223 -0.385 1.936) 1.987 2.763 ( 1.210 3.538 -7.547) 8.422 2.864 ( 3.054 -4.331 -2.902) 6.041 3.120 ( 7.551 -2.903 4.633) 9.322 3.333 ( 3.583 -10.783 4.572) 12.248 3.497 ( 0.414 -9.288 0.042) 9.298 3.802 ( -4.841 -5.408 -7.309) 10.301 3.977 ( 0.787 4.194 4.432) 6.152 4.122 ( 0.174 -2.054 -2.179) 2.999 4.300 ( 4.425 6.125 3.954) 8.528 4.439 ( -12.058 -4.495 -0.182) 12.870 4.678 ( 0.970 6.949 0.528) 7.036 4.818 ( -0.870 0.737 -1.351) 1.767 4.958 ( -3.032 1.649 -0.794) 3.541 5.002 ( -1.491 6.106 3.541) 7.215 5.209 ( -3.316 0.902 1.476) 3.740 5.614 ( 0.808 -4.823 -1.253) 5.049 5.731 ( -4.658 -10.658 4.874) 12.612 6.272 ( 1.980 4.134 7.276) 8.599 6.552 ( 4.423 1.380 -9.848) 10.884 7.182 ( 4.524 14.700 1.004) 15.413 7.415 ( 0.505 12.715 -3.133) 13.105 8.024 ( 9.802 -3.561 -3.572) 11.023 8.423 ( -6.643 -5.337 0.948) 8.574 8.852 ( 0.460 1.112 2.171) 2.482 9.020 ( -3.418 -3.114 4.183) 6.235 9.615 ( -2.182 -0.848 -3.099) 3.883 9.841 ( -3.314 -0.595 -5.968) 6.852 9.951 ( 4.448 -0.853 -2.652) 5.248 10.362 ( 0.231 -7.094 -4.537) 8.424 10.553 ( 3.916 -10.983 0.204) 11.662 11.078 ( -7.926 -1.723 0.989) 8.171 11.116 ( -3.275 -0.306 -3.662) 4.922 11.135 ( -0.793 2.875 -1.718) 3.442 11.699 ( -1.640 2.741 -0.435) 3.224 11.880 ( -7.334 -3.544 -6.067) 10.157 12.155 ( -0.356 -11.329 2.551) 11.618 12.265 ( -2.816 -7.157 -0.536) 7.710 13.005 ( 12.472 8.940 7.110) 16.912 13.803 ( 6.022 9.666 -4.345) 12.189 13.910 ( 13.910 -8.051 17.487) 23.751 14.242 ( 6.416 10.566 10.629) 16.303 14.662 ( -5.044 4.866 8.254) 10.828 14.865 ( 0.653 27.947 -5.779) 28.545 16.205 ( 0.468 14.636 -4.957) 15.460 16.648 ( -15.788 30.368 -2.423) 34.312 17.813 ( 16.225 -17.667 2.766) 24.146 18.701 ( -13.084 -22.671 -5.247) 26.696 20.597 ( 0.948 -1.592 -1.105) 2.158 20.713 ( -2.101 -2.364 -1.516) 3.507 ======================= Grid point 327 (158/170) ======================= q-point: ( 0.45 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 6.523 1.629 11.235) 13.093 1.394 ( 3.220 2.714 -0.588) 4.252 1.416 ( 0.430 -1.863 -2.854) 3.435 1.442 ( -1.964 1.006 -9.531) 9.784 1.744 ( 9.311 -1.309 -4.679) 10.502 1.839 ( -5.231 -2.185 2.816) 6.330 2.068 ( 3.100 -0.562 3.856) 4.979 2.142 ( -0.928 -2.401 -2.130) 3.341 2.229 ( -3.716 4.925 1.654) 6.388 2.320 ( -8.362 6.862 -4.258) 11.625 2.588 ( -0.828 3.739 4.572) 5.964 2.648 ( -0.436 6.980 -7.577) 10.311 3.036 ( 12.743 -12.405 1.786) 17.873 3.221 ( -6.379 -8.994 3.151) 11.468 3.410 ( 1.931 -11.905 3.073) 12.446 3.478 ( -0.846 -13.695 -1.229) 13.776 3.775 ( 7.785 -3.821 -0.778) 8.707 3.934 ( -6.632 -1.969 -2.810) 7.467 4.139 ( 2.442 1.028 2.029) 3.337 4.255 ( -7.875 -2.182 -2.895) 8.669 4.450 ( 5.753 7.015 7.060) 11.496 4.606 ( -3.998 7.549 -6.214) 10.563 4.815 ( -0.277 1.221 3.630) 3.839 4.887 ( -2.578 3.171 -4.462) 6.051 5.068 ( 3.467 7.625 3.775) 9.188 5.155 ( -4.087 6.371 -0.513) 7.587 5.648 ( 4.427 -7.008 -1.684) 8.458 5.699 ( -4.969 -8.435 3.415) 10.369 6.387 ( 0.131 3.574 10.346) 10.946 6.490 ( 2.050 2.814 -11.039) 11.575 7.269 ( 4.545 13.987 1.592) 14.793 7.357 ( -3.189 13.044 -2.710) 13.699 8.161 ( 10.448 -4.560 -1.893) 11.555 8.306 ( -9.081 -5.375 1.010) 10.601 8.899 ( 2.734 -0.147 1.806) 3.280 8.971 ( -4.229 -1.613 -0.405) 4.544 9.592 ( -0.244 0.264 3.079) 3.100 9.678 ( -2.527 2.212 -9.161) 9.757 10.088 ( 5.304 -7.681 7.584) 12.027 10.252 ( -3.857 -8.672 -8.127) 12.495 10.720 ( 9.081 -10.059 6.892) 15.203 10.936 ( -9.317 -4.850 -3.627) 11.112 11.051 ( -0.698 -0.470 0.618) 1.044 11.088 ( -1.132 -2.084 -4.141) 4.772 11.690 ( 1.681 2.920 -0.657) 3.433 11.744 ( -4.616 1.836 -1.415) 5.165 12.180 ( 0.199 -10.934 2.573) 11.234 12.218 ( -1.392 -9.072 -1.933) 9.380 13.331 ( 14.169 8.132 11.236) 19.828 13.652 ( -8.808 3.383 -11.446) 14.833 14.292 ( 12.739 -0.304 5.722) 13.969 14.469 ( -8.492 2.395 15.156) 17.537 14.597 ( 7.331 25.595 0.215) 26.625 14.813 ( -3.002 23.713 -8.242) 25.283 16.217 ( 7.614 20.145 -3.390) 21.801 16.382 ( -14.602 26.596 0.260) 30.342 18.114 ( 14.899 -20.373 6.001) 25.943 18.416 ( -13.622 -21.927 -7.108) 26.774 20.617 ( 1.976 -2.101 0.267) 2.897 20.661 ( -2.330 -2.378 -1.180) 3.532 ======================= Grid point 333 (159/170) ======================= q-point: ( 0.00 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.253 ( 1.100 1.785 -6.385) 6.720 1.253 ( -1.100 1.785 6.385) 6.720 1.525 ( -5.841 -0.401 -11.484) 12.890 1.525 ( 5.841 -0.401 11.484) 12.890 1.834 ( -2.298 1.446 -9.443) 9.825 1.834 ( 2.298 1.446 9.443) 9.825 1.998 ( -2.700 -2.430 -5.599) 6.674 1.998 ( 2.700 -2.430 5.599) 6.674 2.436 ( -2.023 -10.669 -7.116) 12.983 2.436 ( 2.023 -10.669 7.116) 12.983 2.565 ( -1.372 -9.494 -5.409) 11.012 2.565 ( 1.372 -9.494 5.409) 11.012 3.427 ( -9.315 13.247 -2.984) 16.466 3.427 ( 9.315 13.247 2.984) 16.466 3.622 ( -9.607 14.444 -3.381) 17.673 3.622 ( 9.607 14.444 3.381) 17.673 3.868 ( 2.153 1.972 -11.589) 11.951 3.868 ( -2.153 1.972 11.589) 11.951 4.045 ( -0.968 12.598 -10.959) 16.725 4.045 ( 0.968 12.598 10.959) 16.725 4.598 ( -2.948 0.672 -4.516) 5.435 4.598 ( 2.948 0.672 4.516) 5.435 4.781 ( 2.811 -9.266 -4.391) 10.632 4.781 ( -2.811 -9.266 4.391) 10.632 5.292 ( -2.238 -14.742 -4.879) 15.688 5.292 ( 2.238 -14.742 4.879) 15.688 5.608 ( -9.894 -3.398 -1.995) 10.650 5.608 ( 9.894 -3.398 1.995) 10.650 6.239 ( -7.549 -1.410 0.966) 7.740 6.239 ( 7.549 -1.410 -0.966) 7.740 7.249 ( 3.412 10.747 -2.107) 11.470 7.249 ( -3.412 10.747 2.107) 11.470 8.288 ( -3.309 5.583 -12.851) 14.397 8.288 ( 3.309 5.583 12.851) 14.397 8.703 ( -1.762 -5.689 -4.470) 7.446 8.703 ( 1.762 -5.689 4.470) 7.446 9.894 ( -4.654 -0.076 -3.152) 5.621 9.894 ( 4.654 -0.076 3.152) 5.621 10.177 ( -1.936 -4.283 -3.840) 6.069 10.177 ( 1.936 -4.283 3.840) 6.069 11.083 ( -2.051 2.057 -2.007) 3.531 11.083 ( 2.051 2.057 2.007) 3.531 11.680 ( -0.415 4.231 -3.430) 5.462 11.680 ( 0.415 4.231 3.430) 5.462 11.943 ( 2.231 2.324 -4.199) 5.292 11.943 ( -2.231 2.324 4.199) 5.292 12.219 ( 3.222 -3.718 -2.214) 5.395 12.219 ( -3.222 -3.718 2.214) 5.395 12.929 ( -4.192 1.840 -15.435) 16.100 12.929 ( 4.192 1.840 15.435) 16.100 13.575 ( -2.646 5.003 -15.186) 16.206 13.575 ( 2.646 5.003 15.186) 16.206 14.589 ( -13.027 1.220 -11.331) 17.308 14.589 ( 13.027 1.220 11.331) 17.308 15.973 ( 5.593 -18.417 -12.689) 23.054 15.973 ( -5.593 -18.417 12.689) 23.054 18.821 ( -4.598 12.431 -11.229) 17.372 18.821 ( 4.598 12.431 11.229) 17.372 20.740 ( -0.737 -0.598 -1.495) 1.771 20.740 ( 0.737 -0.598 1.495) 1.771 ======================= Grid point 335 (160/170) ======================= q-point: ( 0.09 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.207 ( -1.492 3.515 -0.680) 3.879 1.290 ( -4.416 2.395 -10.836) 11.944 1.356 ( 4.335 -1.666 4.413) 6.407 1.650 ( 1.962 -8.163 -7.165) 11.037 1.747 ( -0.043 5.151 -3.745) 6.369 1.915 ( 0.776 1.714 7.380) 7.616 2.019 ( 3.804 0.725 8.256) 9.119 2.103 ( 2.248 -5.045 4.593) 7.183 2.332 ( -4.496 -8.583 -4.721) 10.779 2.416 ( -3.041 -11.665 -8.120) 14.535 2.595 ( 1.191 -5.910 5.423) 8.109 2.630 ( -0.006 -8.207 8.552) 11.853 3.172 ( -13.857 14.643 -5.876) 20.999 3.416 ( -9.393 13.210 -2.760) 16.442 3.539 ( 2.994 6.859 -2.894) 8.024 3.622 ( -3.006 8.941 -16.879) 19.336 3.816 ( -5.616 5.785 4.023) 9.011 3.869 ( 10.323 10.708 0.655) 14.888 4.086 ( 6.273 5.914 -0.724) 8.652 4.270 ( 7.105 9.502 10.511) 15.850 4.507 ( -2.774 1.325 -4.455) 5.413 4.709 ( 5.189 0.111 3.283) 6.142 4.761 ( -2.507 -7.558 2.164) 8.252 4.824 ( 3.091 -7.057 0.965) 7.765 5.166 ( -7.007 -9.880 -2.711) 12.412 5.282 ( -9.929 -14.472 3.523) 17.900 5.487 ( -2.671 -5.363 1.646) 6.214 5.739 ( 1.758 -8.110 1.417) 8.419 6.158 ( -0.107 4.366 -1.367) 4.576 6.359 ( 9.627 -3.362 -3.882) 10.911 7.236 ( -0.256 11.556 2.533) 11.833 7.340 ( 8.844 9.362 -1.812) 13.005 8.106 ( -3.968 6.261 -8.089) 10.972 8.509 ( 4.339 4.400 12.196) 13.672 8.608 ( -4.141 -7.920 -0.521) 8.952 8.788 ( 1.970 -3.309 3.844) 5.441 9.773 ( -3.462 0.848 -5.256) 6.351 9.948 ( 0.864 -0.903 -2.540) 2.831 10.100 ( -1.519 -5.649 -5.008) 7.701 10.249 ( 2.533 -3.961 2.657) 5.401 11.003 ( -1.385 3.862 -6.009) 7.276 11.151 ( 4.929 0.828 -2.548) 5.610 11.589 ( -7.800 10.674 -1.968) 13.366 11.667 ( -5.964 -0.107 -1.534) 6.159 11.873 ( -5.338 -6.742 2.610) 8.987 11.912 ( -3.616 5.440 2.138) 6.874 12.223 ( -2.074 -0.092 5.862) 6.219 12.328 ( 4.738 -7.051 3.075) 9.034 12.680 ( -1.682 3.758 -14.997) 15.551 12.967 ( -4.912 -8.772 -6.048) 11.732 13.573 ( 2.028 10.138 17.977) 20.738 13.897 ( 12.599 10.101 15.342) 22.274 14.295 ( -6.380 6.653 -11.090) 14.421 14.894 ( 10.208 0.353 8.656) 13.389 15.965 ( 8.964 -16.861 -4.929) 19.722 16.207 ( 19.374 -18.805 1.892) 27.066 18.541 ( -14.620 19.238 -10.093) 26.186 18.934 ( -4.914 3.043 8.526) 10.300 20.701 ( -1.480 -0.093 -2.150) 2.612 20.757 ( -0.031 -1.304 0.438) 1.376 ======================= Grid point 336 (161/170) ======================= q-point: ( 0.18 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( 0.942 3.236 -7.910) 8.598 1.223 ( 1.127 -1.125 -2.384) 2.867 1.464 ( 5.118 0.354 0.425) 5.148 1.577 ( 3.584 -7.641 -10.746) 13.664 1.727 ( 0.601 4.010 1.262) 4.247 2.028 ( -6.400 -3.368 -3.402) 7.993 2.078 ( 1.005 -5.465 -0.391) 5.571 2.158 ( -2.927 4.426 4.986) 7.282 2.191 ( -0.728 -1.931 2.577) 3.302 2.335 ( 2.249 -6.800 -1.768) 7.377 2.625 ( -1.183 -3.087 5.507) 6.423 2.757 ( -2.355 -3.007 11.406) 12.029 2.918 ( -9.499 9.175 -3.511) 13.665 3.251 ( -8.322 3.367 -0.855) 9.018 3.374 ( -1.773 6.154 -16.831) 18.009 3.541 ( 2.066 7.769 -7.076) 10.709 3.827 ( 0.048 5.668 7.118) 9.099 4.009 ( 5.849 3.869 -4.541) 8.354 4.137 ( 2.088 2.738 -1.496) 3.754 4.367 ( -3.922 1.828 -2.613) 5.055 4.504 ( 4.637 7.966 7.895) 12.136 4.717 ( -6.497 -4.241 2.016) 8.017 4.801 ( 4.168 -2.660 -2.392) 5.493 4.906 ( 4.090 -2.121 3.450) 5.756 5.059 ( -3.680 -3.977 1.730) 5.688 5.160 ( -7.155 -8.396 3.223) 11.492 5.488 ( -3.122 -11.004 4.974) 12.474 5.698 ( -4.914 -7.757 -1.201) 9.260 6.204 ( 6.161 6.874 -1.611) 9.371 6.463 ( 9.063 -2.726 -4.747) 10.588 7.287 ( 2.906 12.206 2.505) 12.795 7.478 ( 10.072 7.619 -1.854) 12.765 7.987 ( -1.420 5.519 -5.825) 8.149 8.488 ( -5.928 -6.836 -0.502) 9.063 8.746 ( 2.762 -0.019 13.804) 14.078 8.848 ( 0.328 -0.721 4.000) 4.078 9.693 ( 0.118 -0.137 -4.238) 4.241 9.882 ( -2.517 0.274 -5.606) 6.151 10.035 ( 0.017 -5.444 -3.900) 6.697 10.294 ( 0.685 -6.446 -0.245) 6.487 10.869 ( -1.611 4.821 -17.061) 17.802 11.171 ( 2.138 0.193 -4.811) 5.268 11.409 ( -10.322 6.148 -1.061) 12.061 11.473 ( -11.656 2.811 -3.453) 12.477 11.827 ( -4.882 -3.948 3.479) 7.178 11.909 ( -0.609 -2.999 -0.014) 3.060 12.232 ( -4.955 0.093 4.264) 6.538 12.287 ( -9.108 -7.648 -2.582) 12.170 12.668 ( 10.256 -0.510 -2.928) 10.678 12.932 ( 2.694 -5.974 12.446) 14.066 13.832 ( 0.141 8.122 21.100) 22.609 14.162 ( 10.629 21.357 -14.396) 27.863 14.298 ( 10.100 5.667 18.883) 22.152 15.108 ( 8.774 6.998 3.842) 11.863 16.112 ( 15.975 -13.122 -7.444) 21.973 16.591 ( 23.665 -17.311 2.654) 29.441 18.151 ( -20.046 21.816 -9.435) 31.093 18.846 ( -14.415 -6.325 4.556) 16.387 20.649 ( -1.821 0.093 -2.380) 2.998 20.746 ( -1.227 -2.171 -0.497) 2.543 ======================= Grid point 337 (162/170) ======================= q-point: ( 0.27 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.090 ( 2.340 2.919 -5.739) 6.851 1.224 ( 4.337 -6.013 -4.902) 8.888 1.511 ( 2.167 4.709 -3.458) 6.231 1.571 ( 8.159 -3.555 -7.588) 11.695 1.718 ( -2.854 -1.013 -6.629) 7.288 1.815 ( 1.608 3.279 -5.272) 6.414 2.075 ( -3.244 -4.147 -4.211) 6.742 2.192 ( -2.563 3.599 9.680) 10.640 2.255 ( 1.507 -0.275 6.753) 6.924 2.421 ( 5.689 -4.719 0.975) 7.456 2.660 ( -5.091 1.271 5.895) 7.892 2.693 ( -6.402 7.190 2.385) 9.918 2.908 ( -0.490 -6.193 8.212) 10.298 3.131 ( -1.865 0.286 -5.632) 5.940 3.185 ( -5.157 2.079 -7.640) 9.449 3.467 ( -2.351 -0.145 -6.657) 7.061 3.894 ( -4.583 -3.261 -4.470) 7.185 3.977 ( 4.795 8.083 2.126) 9.636 4.100 ( -5.132 -2.224 -2.425) 6.096 4.334 ( 1.636 3.237 2.273) 4.280 4.582 ( -9.808 -0.717 -1.706) 9.981 4.664 ( 4.324 4.188 6.417) 8.798 4.804 ( 2.042 -4.748 -4.281) 6.711 5.010 ( 2.743 1.325 3.812) 4.880 5.076 ( 1.396 2.981 1.490) 3.613 5.142 ( 0.436 -2.653 3.791) 4.648 5.491 ( -4.522 -12.381 7.470) 15.151 5.603 ( -3.984 -4.684 -2.325) 6.574 6.291 ( 5.567 7.006 0.041) 8.948 6.544 ( 7.567 -1.071 -5.554) 9.447 7.371 ( 4.120 12.832 2.040) 13.631 7.598 ( 6.833 7.326 -2.431) 10.309 7.937 ( 1.933 2.616 -4.011) 5.164 8.388 ( -5.806 -7.972 -0.374) 9.870 8.865 ( -2.661 1.276 7.133) 7.720 8.919 ( 1.225 -1.506 7.126) 7.386 9.670 ( 0.824 -0.546 -3.194) 3.343 9.787 ( -1.948 0.783 -2.812) 3.509 10.032 ( 2.670 -4.288 -0.681) 5.097 10.259 ( -2.021 -8.119 -3.885) 9.225 10.581 ( -5.141 3.018 -22.200) 22.986 11.110 ( -1.271 -5.501 -8.411) 10.130 11.236 ( -10.880 0.839 0.469) 10.923 11.307 ( -5.995 5.278 -0.714) 8.019 11.774 ( -3.222 -0.133 -0.859) 3.337 11.892 ( -1.057 -8.103 0.697) 8.201 12.063 ( -10.798 -2.699 -1.702) 11.260 12.202 ( -3.950 -5.302 -0.227) 6.616 12.864 ( 10.304 3.944 8.499) 13.927 13.284 ( 12.649 -7.558 23.063) 27.368 13.972 ( -1.883 9.165 8.186) 12.432 14.274 ( 8.294 12.950 4.955) 16.157 14.648 ( 13.819 14.543 7.614) 21.458 15.285 ( 12.237 18.868 -1.781) 22.559 16.274 ( 13.521 -6.447 -8.040) 17.001 16.988 ( 20.702 -12.781 3.421) 24.569 17.711 ( -22.043 18.212 -8.138) 29.728 18.594 ( -18.564 -14.019 -0.196) 23.264 20.598 ( -1.430 -0.259 -1.889) 2.383 20.709 ( -2.192 -2.903 -1.081) 3.795 ======================= Grid point 338 (163/170) ======================= q-point: ( 0.36 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 5.647 3.699 0.276) 6.757 1.267 ( 7.246 -6.310 -4.228) 10.498 1.484 ( -0.892 1.839 -4.165) 4.639 1.596 ( 3.488 0.828 -6.577) 7.491 1.687 ( 8.873 5.088 -6.467) 12.101 1.825 ( 1.178 -0.289 -0.689) 1.395 2.000 ( -0.782 -1.586 -1.621) 2.399 2.206 ( -6.346 3.686 5.349) 9.081 2.345 ( 0.095 1.434 5.206) 5.401 2.497 ( 3.197 -2.969 -1.217) 4.529 2.576 ( -6.041 4.335 2.001) 7.700 2.721 ( 2.986 -1.248 2.884) 4.335 2.889 ( -7.170 -0.711 -4.739) 8.624 3.080 ( 0.966 -1.589 3.946) 4.362 3.146 ( 1.726 -7.522 2.855) 8.229 3.310 ( -9.260 -10.630 -3.926) 14.634 3.745 ( -1.415 1.040 -7.966) 8.157 3.972 ( -7.252 -5.840 0.258) 9.315 4.118 ( 4.483 3.794 3.094) 6.638 4.386 ( -10.085 1.012 -3.468) 10.712 4.408 ( 2.734 0.320 3.966) 4.828 4.743 ( 1.213 0.066 -2.475) 2.757 4.820 ( 3.004 2.924 1.641) 4.502 5.068 ( 1.887 6.533 -0.089) 6.800 5.102 ( 0.961 4.543 1.666) 4.933 5.230 ( 3.220 0.878 3.538) 4.864 5.500 ( -1.505 -9.633 1.761) 9.908 5.532 ( -4.391 -5.931 3.245) 8.061 6.386 ( 3.891 6.714 3.250) 8.413 6.579 ( 4.998 1.028 -6.906) 8.586 7.455 ( 3.807 13.015 1.563) 13.650 7.633 ( 1.363 9.153 -3.018) 9.734 7.969 ( 5.887 -1.695 -1.970) 6.435 8.290 ( -6.015 -8.143 -0.300) 10.129 8.886 ( -1.582 2.165 4.080) 4.882 8.972 ( -1.725 -1.911 3.276) 4.167 9.632 ( -0.663 2.828 -2.344) 3.732 9.784 ( -0.086 -2.592 2.615) 3.683 10.025 ( -2.393 4.049 -6.288) 7.853 10.196 ( 0.947 -9.065 -4.279) 10.069 10.344 ( 0.445 -8.039 -7.789) 11.203 10.939 ( -6.219 -13.512 -11.027) 18.516 11.113 ( -4.532 2.303 0.001) 5.084 11.213 ( -5.375 3.612 -0.324) 6.484 11.730 ( -0.359 1.140 -1.351) 1.804 11.859 ( -6.400 -1.341 1.256) 6.659 11.949 ( -1.938 -7.273 2.365) 7.889 12.124 ( -3.023 -6.947 -3.150) 8.205 13.166 ( 11.685 8.270 13.165) 19.449 13.711 ( 12.799 -9.833 9.861) 18.914 14.006 ( -2.948 9.715 10.596) 14.674 14.439 ( -3.096 1.535 13.999) 14.419 14.916 ( 19.585 25.955 -5.337) 32.951 15.446 ( 9.661 31.018 -3.912) 32.723 16.371 ( 9.522 0.679 -6.582) 11.595 17.200 ( -14.394 26.011 -2.261) 29.814 17.408 ( 8.885 -24.124 1.089) 25.731 18.280 ( -17.000 -19.361 -3.508) 26.003 20.568 ( -0.205 -1.154 -0.888) 1.471 20.658 ( -2.538 -3.230 -1.147) 4.264 ======================= Grid point 339 (164/170) ======================= q-point: ( 0.45 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( 7.246 -0.713 2.736) 7.778 1.352 ( 1.412 -3.935 -1.060) 4.313 1.425 ( 2.534 3.396 1.167) 4.395 1.557 ( -1.804 6.337 -5.795) 8.775 1.768 ( 7.621 2.947 -4.608) 9.381 1.822 ( -2.676 -0.604 1.435) 3.096 2.024 ( 4.143 -1.222 0.391) 4.337 2.120 ( -7.435 0.843 0.881) 7.534 2.358 ( -0.805 6.417 2.400) 6.898 2.432 ( -4.679 4.172 -4.008) 7.440 2.606 ( 3.414 -1.537 4.127) 5.572 2.723 ( -4.888 0.609 -5.275) 7.217 2.847 ( 8.873 -6.147 1.974) 10.973 3.035 ( -11.915 -9.717 0.130) 15.375 3.207 ( 2.269 -8.368 2.941) 9.156 3.238 ( 1.321 -10.068 0.337) 10.160 3.719 ( 4.227 -2.393 0.071) 4.858 3.847 ( -7.076 -7.209 -2.882) 10.504 4.173 ( 0.361 2.170 1.549) 2.690 4.225 ( -4.535 1.880 -2.750) 5.627 4.524 ( 4.947 0.002 5.918) 7.713 4.667 ( -3.749 -0.686 -6.054) 7.153 4.919 ( 3.802 8.866 5.210) 10.964 5.028 ( -1.614 9.774 -5.684) 11.422 5.187 ( 3.637 4.394 3.914) 6.918 5.263 ( -2.125 4.562 0.003) 5.033 5.497 ( 5.550 -8.376 -6.368) 11.896 5.521 ( -6.554 -8.960 8.412) 13.928 6.482 ( 1.387 5.448 6.217) 8.381 6.555 ( 1.791 3.367 -7.510) 8.423 7.529 ( 3.085 12.281 1.819) 12.793 7.594 ( -1.830 10.870 -2.655) 11.338 8.068 ( 7.460 -4.853 -0.516) 8.915 8.184 ( -6.958 -7.073 -0.082) 9.922 8.911 ( 0.350 1.324 2.598) 2.937 8.951 ( -1.991 -0.441 -0.661) 2.143 9.636 ( 1.857 4.024 2.119) 4.913 9.735 ( -4.487 2.541 -4.818) 7.058 9.986 ( 1.903 -1.903 3.982) 4.806 10.098 ( -2.336 -5.889 -8.327) 10.463 10.458 ( 8.158 -15.270 7.747) 18.967 10.698 ( -8.258 -16.260 -10.981) 21.287 11.085 ( 0.540 3.073 0.428) 3.149 11.130 ( -4.052 3.327 -0.453) 5.263 11.731 ( 2.020 0.699 -1.062) 2.387 11.773 ( -4.774 -0.122 1.096) 4.900 11.984 ( 0.385 -7.449 4.361) 8.640 12.046 ( -1.396 -7.460 -4.511) 8.829 13.492 ( 10.615 8.610 12.430) 18.474 13.741 ( -4.623 4.525 -8.852) 10.964 14.225 ( 9.693 -3.951 10.869) 15.090 14.430 ( -11.167 -5.251 5.635) 13.566 15.199 ( 21.246 35.194 -4.429) 41.347 15.439 ( -7.868 36.667 -1.626) 37.537 16.513 ( 16.537 7.506 -3.414) 18.479 16.825 ( -22.635 16.287 -0.835) 27.898 17.689 ( 15.390 -21.454 4.575) 26.797 17.981 ( -14.805 -21.237 -4.768) 26.323 20.573 ( 1.250 -2.236 0.118) 2.565 20.607 ( -2.238 -3.014 -0.808) 3.840 ======================= Grid point 345 (165/170) ======================= q-point: ( 0.00 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 153 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( 6.123 5.557 -7.671) 11.279 1.330 ( -6.123 5.557 7.671) 11.279 1.465 ( 3.822 -5.216 -8.238) 10.473 1.465 ( -3.822 -5.216 8.238) 10.473 1.856 ( -0.793 1.062 -3.989) 4.203 1.856 ( 0.793 1.062 3.989) 4.203 1.970 ( -0.887 -0.903 -3.150) 3.395 1.970 ( 0.887 -0.903 3.150) 3.395 2.278 ( -1.159 -4.634 -2.734) 5.503 2.278 ( 1.159 -4.634 2.734) 5.503 2.421 ( -0.336 -4.430 -2.613) 5.155 2.421 ( 0.336 -4.430 2.613) 5.155 3.614 ( -3.612 5.815 0.185) 6.848 3.614 ( 3.612 5.815 -0.185) 6.848 3.749 ( 0.168 -0.080 -4.527) 4.531 3.749 ( -0.168 -0.080 4.527) 4.531 4.032 ( 2.548 10.052 -4.401) 11.265 4.032 ( -2.548 10.052 4.401) 11.265 4.332 ( -0.399 15.100 -7.538) 16.881 4.332 ( 0.399 15.100 7.538) 16.881 4.573 ( -0.803 -3.675 -3.979) 5.475 4.573 ( 0.803 -3.675 3.979) 5.475 4.620 ( 0.524 -6.041 -1.280) 6.197 4.620 ( -0.524 -6.041 1.280) 6.197 4.999 ( 0.872 -12.695 -1.841) 12.857 4.999 ( -0.872 -12.695 1.841) 12.857 5.564 ( -3.490 -1.145 -1.172) 3.856 5.564 ( 3.490 -1.145 1.172) 3.856 6.224 ( -2.216 -0.321 0.243) 2.253 6.224 ( 2.216 -0.321 -0.243) 2.253 7.396 ( 1.220 4.042 -0.729) 4.285 7.396 ( -1.220 4.042 0.729) 4.285 8.409 ( -2.745 6.530 -9.742) 12.045 8.409 ( 2.745 6.530 9.742) 12.045 8.573 ( -2.137 -7.067 -6.738) 9.996 8.573 ( 2.137 -7.067 6.738) 9.996 9.895 ( -1.795 0.096 -2.100) 2.764 9.895 ( 1.795 0.096 2.100) 2.764 10.116 ( -1.233 -1.713 -2.704) 3.430 10.116 ( 1.233 -1.713 2.704) 3.430 11.127 ( -0.568 1.769 -0.676) 1.977 11.127 ( 0.568 1.769 0.676) 1.977 11.673 ( 2.736 -2.412 -1.377) 3.899 11.673 ( -2.736 -2.412 1.377) 3.899 11.968 ( 1.376 0.950 -1.354) 2.151 11.968 ( -1.376 0.950 1.354) 2.151 12.199 ( 1.288 0.179 -1.560) 2.031 12.199 ( -1.288 0.179 1.560) 2.031 12.955 ( -1.640 0.739 -5.006) 5.320 12.955 ( 1.640 0.739 5.006) 5.320 13.655 ( -2.755 2.269 -5.201) 6.308 13.655 ( 2.755 2.269 5.201) 6.308 14.718 ( -5.378 8.284 -7.195) 12.220 14.718 ( 5.378 8.284 7.195) 12.220 15.636 ( 1.965 -13.097 -7.530) 15.234 15.636 ( -1.965 -13.097 7.530) 15.234 18.978 ( -1.022 3.955 -3.825) 5.596 18.978 ( 1.022 3.955 3.825) 5.596 20.731 ( -0.326 -0.242 -0.546) 0.681 20.731 ( 0.326 -0.242 0.546) 0.681 ======================= Grid point 347 (166/170) ======================= q-point: ( 0.09 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -6.210 2.696 1.779) 6.999 1.303 ( -7.061 -0.876 -2.609) 7.579 1.386 ( 6.342 4.325 -6.013) 9.752 1.498 ( 4.423 -7.019 -8.900) 12.167 1.853 ( 1.783 5.909 -1.537) 6.360 1.958 ( 0.456 2.189 5.765) 6.184 1.973 ( 4.976 -5.402 3.935) 8.332 2.012 ( -1.318 -3.474 2.666) 4.573 2.211 ( -2.679 -2.546 -0.764) 3.774 2.242 ( -1.196 -5.617 -3.450) 6.700 2.500 ( 3.262 -2.834 6.374) 7.700 2.508 ( 2.167 -3.734 8.398) 9.443 3.467 ( -11.258 13.549 -2.869) 17.848 3.563 ( -12.143 3.875 -4.403) 13.485 3.589 ( -0.685 -0.003 -10.902) 10.924 3.679 ( -9.682 -5.382 0.896) 11.114 4.001 ( -0.107 12.851 -2.546) 13.101 4.088 ( 5.947 6.382 -3.042) 9.239 4.267 ( -0.277 10.327 -4.427) 11.239 4.406 ( 0.371 -0.119 0.509) 0.641 4.566 ( 1.794 6.742 1.697) 7.180 4.626 ( 2.316 -1.383 3.775) 4.639 4.682 ( 4.401 -7.154 0.555) 8.417 4.721 ( 8.017 -0.901 3.192) 8.676 4.954 ( -5.065 -9.912 3.762) 11.750 4.998 ( -2.323 -11.983 2.090) 12.383 5.474 ( -5.932 3.208 0.242) 6.748 5.582 ( -2.803 -7.495 1.284) 8.104 6.237 ( 4.956 3.642 -1.589) 6.353 6.300 ( 7.927 -2.990 -2.624) 8.869 7.409 ( 2.002 5.918 1.218) 6.365 7.450 ( 5.456 1.854 -0.461) 5.781 8.253 ( -4.717 8.799 -5.810) 11.550 8.434 ( -5.017 -9.602 -3.385) 11.350 8.599 ( 3.928 5.017 10.504) 12.286 8.701 ( 3.041 -5.289 7.030) 9.308 9.814 ( -2.185 3.329 -5.495) 6.786 9.894 ( -0.393 -4.475 -4.039) 6.041 10.072 ( -1.167 2.610 -1.918) 3.443 10.155 ( 0.411 -5.196 1.325) 5.378 11.092 ( 0.726 4.553 -5.578) 7.236 11.152 ( 3.863 -1.295 -4.800) 6.296 11.622 ( -6.706 0.390 0.561) 6.741 11.694 ( -1.853 -6.490 1.818) 6.990 11.832 ( -9.560 7.747 -1.953) 12.459 11.944 ( -2.474 -2.593 -2.273) 4.244 12.222 ( -3.255 -0.114 7.204) 7.906 12.241 ( -1.738 -1.943 6.373) 6.885 12.752 ( -3.357 3.949 -13.900) 14.835 12.838 ( -5.043 -5.156 -10.105) 12.414 13.769 ( 1.293 9.628 21.037) 23.172 13.922 ( 5.101 -5.408 21.374) 22.630 14.634 ( 9.751 22.622 -12.448) 27.600 14.923 ( 13.911 -3.265 0.922) 14.319 15.690 ( 12.792 -6.496 -3.459) 14.758 15.832 ( 16.283 -17.512 3.713) 24.199 18.821 ( -12.204 10.118 -4.424) 16.459 18.942 ( -9.299 -2.628 1.432) 9.769 20.708 ( -1.366 0.804 -1.164) 1.967 20.730 ( -0.745 -1.381 -0.250) 1.589 ======================= Grid point 348 (167/170) ======================= q-point: ( 0.18 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.179 ( -2.054 1.493 -3.385) 4.232 1.196 ( -2.000 -0.861 -3.945) 4.506 1.438 ( 7.260 -0.691 -5.843) 9.345 1.471 ( 6.410 -3.670 -10.410) 12.764 1.849 ( -1.155 6.084 -0.387) 6.205 1.924 ( -4.627 -3.843 -6.084) 8.555 2.034 ( 3.074 0.078 1.667) 3.497 2.110 ( 3.902 -5.389 4.124) 7.828 2.217 ( -1.884 0.437 7.238) 7.492 2.232 ( 0.269 -2.386 4.004) 4.668 2.598 ( 0.887 0.455 7.333) 7.400 2.652 ( 1.345 -5.002 10.070) 11.324 3.221 ( -14.744 17.755 -2.251) 23.188 3.331 ( -8.510 4.337 -6.322) 11.454 3.393 ( -6.053 -2.187 -11.239) 12.952 3.528 ( -9.068 -10.724 -2.603) 14.283 4.000 ( 1.665 12.708 0.566) 12.829 4.125 ( 3.765 3.957 -5.655) 7.862 4.199 ( -3.223 3.522 -3.187) 5.740 4.339 ( -5.306 -6.972 -4.122) 9.683 4.607 ( -1.713 2.286 4.308) 5.169 4.681 ( 2.801 -2.822 -3.056) 5.015 4.764 ( 3.783 6.062 1.825) 7.375 4.881 ( 6.604 -0.956 3.991) 7.775 4.969 ( 0.547 -3.956 6.018) 7.223 5.016 ( 0.628 -8.509 5.146) 9.964 5.399 ( -4.564 2.995 2.032) 5.825 5.532 ( -3.591 -8.863 0.409) 9.571 6.323 ( 7.560 5.250 -2.304) 9.489 6.406 ( 8.788 -3.443 -3.141) 9.948 7.479 ( 4.588 7.180 1.323) 8.622 7.551 ( 7.271 -0.083 -0.532) 7.291 8.132 ( -3.778 9.047 -4.045) 10.606 8.319 ( -5.262 -9.818 -2.344) 11.383 8.769 ( 1.707 2.004 11.381) 11.682 8.814 ( 0.902 -2.445 7.723) 8.151 9.733 ( -0.513 3.980 -4.569) 6.081 9.829 ( -0.794 -5.280 -4.577) 7.033 10.024 ( -1.281 4.291 -3.202) 5.505 10.148 ( -1.012 -7.720 -1.787) 7.988 10.991 ( -0.375 7.059 -16.175) 17.652 11.117 ( 1.616 -5.335 -11.783) 13.034 11.455 ( -12.203 3.251 -0.264) 12.632 11.545 ( -14.504 -3.254 0.023) 14.864 11.757 ( -0.555 4.118 0.542) 4.190 11.872 ( -2.974 -4.302 -2.763) 5.915 12.188 ( -8.309 -1.222 2.268) 8.699 12.214 ( -8.396 -2.291 3.978) 9.569 12.710 ( 7.643 4.314 1.838) 8.967 12.813 ( 5.541 -5.985 8.169) 11.543 14.008 ( -2.344 9.360 22.255) 24.257 14.168 ( -2.605 -6.723 19.961) 21.223 14.794 ( 25.301 29.091 -11.704) 40.292 15.185 ( 21.119 -6.447 -4.293) 22.495 15.929 ( 19.499 1.134 -2.903) 19.746 16.197 ( 23.011 -21.164 2.902) 31.398 18.503 ( -20.319 14.558 -5.096) 25.510 18.718 ( -18.406 -8.098 -0.765) 20.123 20.663 ( -2.232 1.449 -1.528) 3.068 20.701 ( -1.971 -2.327 -0.888) 3.176 ======================= Grid point 349 (168/170) ======================= q-point: ( 0.27 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( 2.236 0.882 -5.366) 5.880 1.148 ( 4.093 -0.836 -6.150) 7.434 1.473 ( 6.578 -2.021 -7.752) 10.366 1.500 ( 8.179 -3.490 -6.892) 11.251 1.791 ( -0.585 3.290 -5.135) 6.127 1.830 ( -0.586 -0.880 -3.035) 3.214 2.064 ( 0.791 4.502 -1.356) 4.768 2.183 ( -0.175 -4.866 4.389) 6.556 2.287 ( 0.296 1.828 9.159) 9.344 2.331 ( 3.577 -3.442 5.474) 7.390 2.682 ( -1.273 2.520 7.861) 8.352 2.762 ( -0.922 -5.502 9.636) 11.134 2.972 ( -12.644 16.369 -2.174) 20.798 3.154 ( -4.460 2.970 -7.052) 8.856 3.187 ( -7.984 -2.891 -5.711) 10.233 3.321 ( -10.731 -13.497 -5.365) 18.059 3.987 ( -3.164 9.817 -8.468) 13.346 4.075 ( -9.920 -0.604 -3.624) 10.578 4.104 ( 1.003 4.579 3.863) 6.074 4.263 ( -0.293 -9.495 2.275) 9.768 4.594 ( -2.766 3.516 -0.798) 4.544 4.688 ( 2.872 -4.711 -3.416) 6.489 4.832 ( 3.857 9.483 1.496) 10.346 4.998 ( 3.585 -4.915 1.191) 6.199 5.076 ( 5.464 0.642 4.789) 7.294 5.122 ( 2.763 -3.643 7.647) 8.910 5.374 ( -2.540 2.573 3.631) 5.124 5.487 ( -1.899 -6.888 -0.830) 7.193 6.419 ( 6.781 5.793 -1.549) 9.052 6.506 ( 7.534 -3.143 -3.132) 8.743 7.573 ( 5.171 7.706 1.110) 9.347 7.658 ( 6.586 -0.894 -0.822) 6.697 8.043 ( -2.584 7.897 -3.010) 8.837 8.215 ( -4.843 -9.439 -1.728) 10.749 8.882 ( -1.645 0.659 8.747) 8.925 8.897 ( -0.352 -0.908 7.156) 7.222 9.705 ( 1.061 3.898 -1.652) 4.364 9.786 ( -0.476 -2.744 -1.798) 3.315 9.979 ( 0.685 1.531 -2.833) 3.292 10.089 ( -1.788 -8.358 -4.418) 9.622 10.716 ( -6.282 9.800 -22.117) 24.993 10.929 ( -4.791 -11.515 -17.032) 21.110 11.280 ( -10.019 3.696 1.762) 10.824 11.350 ( -9.206 -1.831 0.313) 9.391 11.756 ( -1.689 1.357 1.768) 2.796 11.818 ( -0.638 -2.818 -0.892) 3.024 12.040 ( -9.160 1.363 -0.604) 9.280 12.108 ( -6.671 -4.618 -0.292) 8.119 12.971 ( 11.980 7.005 13.615) 19.442 13.123 ( 12.633 -8.457 17.544) 23.214 14.153 ( -5.783 9.172 16.791) 19.987 14.303 ( -5.223 -5.497 17.297) 18.886 15.128 ( 29.419 28.225 -10.444) 42.086 15.511 ( 27.072 -4.458 -7.495) 28.442 16.203 ( 16.692 8.377 -2.741) 18.876 16.589 ( 20.973 -24.721 2.086) 32.486 18.078 ( -24.860 17.350 -4.854) 30.702 18.357 ( -23.090 -12.141 -2.395) 26.198 20.608 ( -2.432 1.458 -1.369) 3.149 20.652 ( -2.685 -2.837 -1.107) 4.060 ======================= Grid point 350 (169/170) ======================= q-point: ( 0.36 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( 6.380 1.310 -3.925) 7.605 1.195 ( 7.970 -2.005 -3.428) 8.905 1.486 ( 3.419 2.424 -4.495) 6.146 1.570 ( 7.050 -3.954 -3.205) 8.695 1.771 ( 4.389 1.892 -5.619) 7.376 1.798 ( 1.150 -1.781 -4.069) 4.588 2.063 ( 0.473 7.703 0.209) 7.720 2.206 ( -2.477 -5.058 3.554) 6.660 2.391 ( 1.230 2.734 5.962) 6.673 2.436 ( 3.026 -2.598 2.935) 4.952 2.688 ( -7.817 6.284 2.470) 10.329 2.781 ( -3.911 5.139 1.640) 6.663 2.817 ( -5.291 -2.037 1.200) 5.795 3.002 ( -8.091 -8.618 -1.761) 11.951 3.076 ( -1.380 -0.566 0.402) 1.545 3.117 ( -4.321 -6.328 -4.764) 9.023 3.809 ( -7.756 3.645 -5.016) 9.930 3.870 ( -10.345 -3.809 -2.089) 11.220 4.175 ( 1.569 4.048 3.066) 5.315 4.304 ( -0.448 -7.949 3.652) 8.760 4.519 ( 0.032 9.680 -6.008) 11.393 4.680 ( 0.689 -6.078 -4.624) 7.668 4.943 ( 4.569 7.710 6.056) 10.817 5.079 ( 3.696 -5.120 4.733) 7.892 5.199 ( 4.351 3.955 0.740) 5.927 5.241 ( 4.167 -0.291 4.043) 5.814 5.378 ( -2.556 -0.458 3.919) 4.702 5.438 ( -2.013 -4.613 -2.934) 5.826 6.505 ( 4.797 5.212 0.141) 7.085 6.574 ( 5.073 -1.814 -3.164) 6.248 7.660 ( 4.044 7.690 0.893) 8.734 7.735 ( 3.891 0.537 -1.084) 4.075 7.989 ( -0.466 4.554 -1.917) 4.963 8.125 ( -4.330 -8.498 -1.278) 9.623 8.923 ( -1.966 1.458 5.119) 5.674 8.945 ( -1.693 -1.050 4.577) 4.992 9.715 ( 0.574 4.890 -0.473) 4.946 9.764 ( -1.113 -0.213 0.488) 1.234 9.998 ( 0.252 -3.684 -1.512) 3.990 10.030 ( 3.741 -7.166 -1.392) 8.203 10.383 ( -6.894 10.533 -17.390) 21.468 10.645 ( -7.537 -15.488 -15.121) 22.920 11.175 ( -5.202 3.799 1.472) 6.608 11.237 ( -5.493 -1.586 0.064) 5.718 11.737 ( -2.666 1.249 1.387) 3.255 11.800 ( -3.664 -4.152 1.078) 5.641 11.927 ( -2.405 3.147 -0.875) 4.056 12.010 ( -3.236 -5.022 -2.419) 6.445 13.335 ( 12.855 9.278 14.461) 21.458 13.520 ( 13.588 -9.880 13.606) 21.618 14.195 ( -7.460 9.533 11.434) 16.651 14.361 ( -8.464 -7.281 13.059) 17.181 15.499 ( 30.360 29.932 -10.254) 43.850 15.885 ( 28.672 0.693 -7.478) 29.639 16.360 ( 5.351 12.550 -2.615) 13.891 16.868 ( 8.647 -30.324 1.407) 31.565 17.647 ( -20.496 19.403 -2.606) 28.344 17.965 ( -20.869 -14.692 -2.460) 25.640 20.563 ( -1.627 0.736 -0.782) 1.949 20.597 ( -2.506 -2.723 -0.892) 3.806 ======================= Grid point 351 (170/170) ======================= q-point: ( 0.45 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.16e-06 1.16e-06 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 2.72e-04 3.36e-05 3.36e-05 3.36e-05 3.36e-05 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: 297 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 5.396 0.075 -1.061) 5.500 1.275 ( 2.275 -3.582 -1.488) 4.496 1.539 ( 5.289 7.549 3.942) 10.024 1.639 ( 2.110 0.737 -1.846) 2.899 1.757 ( 0.167 -3.268 -2.436) 4.079 1.781 ( 1.871 -2.621 -4.935) 5.893 2.093 ( 3.417 6.783 -0.072) 7.595 2.166 ( -5.887 1.169 1.807) 6.268 2.440 ( -0.215 2.049 1.926) 2.820 2.463 ( -0.442 -0.640 -1.563) 1.746 2.584 ( -1.875 1.408 1.281) 2.672 2.669 ( -7.653 -5.611 -2.797) 9.893 2.813 ( 2.370 1.866 2.040) 3.642 2.884 ( -4.872 -5.383 -0.669) 7.292 3.104 ( 1.457 -2.372 2.010) 3.434 3.110 ( 1.937 -3.184 0.567) 3.770 3.676 ( -3.584 -1.314 -0.448) 3.844 3.710 ( -5.974 -5.293 -2.087) 8.250 4.225 ( 2.228 4.074 1.328) 4.829 4.284 ( -3.897 0.142 0.149) 3.903 4.525 ( 4.475 2.492 -0.316) 5.131 4.611 ( -2.692 -4.639 -4.241) 6.837 5.091 ( 3.347 7.991 8.261) 11.971 5.193 ( 0.731 2.695 -0.870) 2.925 5.225 ( 4.019 2.710 1.013) 4.952 5.327 ( -0.307 1.996 1.395) 2.455 5.353 ( 2.408 -6.153 -7.625) 10.089 5.378 ( -4.794 -4.935 4.895) 8.444 6.571 ( 1.819 3.297 1.794) 4.171 6.597 ( 1.753 0.606 -2.838) 3.390 7.721 ( 2.260 7.035 1.048) 7.463 7.753 ( 0.138 4.540 -1.334) 4.734 7.994 ( 2.520 -1.639 -0.415) 3.034 8.049 ( -3.829 -6.273 -0.593) 7.373 8.940 ( -0.701 1.208 2.216) 2.620 8.950 ( -1.040 0.041 0.955) 1.413 9.714 ( 0.949 2.881 -0.315) 3.049 9.745 ( -2.280 -0.820 -0.064) 2.424 10.001 ( 2.680 3.781 2.245) 5.149 10.118 ( -2.017 5.936 -5.806) 8.545 10.186 ( 4.093 -9.418 2.121) 10.485 10.382 ( -7.510 -15.491 -10.721) 20.281 11.142 ( -0.782 2.558 1.193) 2.928 11.169 ( -2.729 0.258 -0.450) 2.778 11.713 ( -0.985 -0.916 0.660) 1.498 11.735 ( -3.206 -2.763 -0.252) 4.240 11.927 ( 0.778 0.384 0.973) 1.303 11.955 ( -0.872 -2.468 -2.025) 3.309 13.655 ( 9.559 7.878 9.192) 15.425 13.768 ( 4.078 -2.721 0.801) 4.968 14.204 ( -1.145 2.726 6.840) 7.452 14.307 ( -8.800 -6.742 3.373) 11.588 15.875 ( 26.668 32.909 -6.558) 42.862 16.139 ( -4.107 32.339 0.414) 32.601 16.425 ( 19.544 -14.494 -5.040) 24.848 16.778 ( -21.179 -23.096 2.037) 31.403 17.502 ( 3.780 4.348 0.744) 5.809 17.665 ( -13.336 -11.373 -1.652) 17.604 20.543 ( -0.101 -0.554 -0.107) 0.574 20.557 ( -1.478 -1.893 -0.455) 2.445 =================== 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 3/35640 10.0 104.856 94.453 141.701 0.000 13.275 0.000 3/35640 20.0 25.655 30.062 36.456 0.000 4.299 0.000 3/35640 30.0 13.928 16.972 19.308 0.000 2.268 0.000 3/35640 40.0 9.574 11.746 12.895 0.000 1.478 0.000 3/35640 50.0 7.343 9.031 9.636 0.000 1.079 0.000 3/35640 60.0 5.979 7.368 7.681 0.000 0.845 0.000 3/35640 70.0 5.050 6.236 6.382 0.000 0.693 0.000 3/35640 80.0 4.374 5.409 5.459 0.000 0.586 0.000 3/35640 90.0 3.858 4.778 4.771 0.000 0.508 0.000 3/35640 100.0 3.452 4.280 4.240 0.000 0.449 0.000 3/35640 110.0 3.127 3.879 3.819 0.000 0.403 0.000 3/35640 120.0 2.860 3.550 3.477 0.000 0.365 0.000 3/35640 130.0 2.639 3.275 3.195 0.000 0.335 0.000 3/35640 140.0 2.452 3.043 2.958 0.000 0.310 0.000 3/35640 150.0 2.293 2.844 2.756 0.000 0.288 0.000 3/35640 160.0 2.155 2.672 2.582 0.000 0.270 0.000 3/35640 170.0 2.035 2.522 2.430 0.000 0.254 0.000 3/35640 180.0 1.929 2.389 2.296 0.000 0.240 0.000 3/35640 190.0 1.835 2.272 2.177 0.000 0.227 0.000 3/35640 200.0 1.750 2.166 2.071 0.000 0.216 0.000 3/35640 210.0 1.674 2.070 1.975 0.000 0.206 0.000 3/35640 220.0 1.605 1.984 1.888 0.000 0.197 0.000 3/35640 230.0 1.542 1.905 1.808 0.000 0.189 0.000 3/35640 240.0 1.484 1.832 1.736 0.000 0.181 0.000 3/35640 250.0 1.430 1.765 1.669 0.000 0.175 0.000 3/35640 260.0 1.381 1.703 1.607 0.000 0.168 0.000 3/35640 270.0 1.335 1.645 1.550 0.000 0.162 0.000 3/35640 280.0 1.292 1.591 1.497 0.000 0.157 0.000 3/35640 290.0 1.252 1.541 1.448 0.000 0.152 0.000 3/35640 300.0 1.214 1.494 1.401 0.000 0.147 0.000 3/35640 310.0 1.178 1.450 1.358 0.000 0.142 0.000 3/35640 320.0 1.145 1.408 1.317 0.000 0.138 0.000 3/35640 330.0 1.113 1.369 1.279 0.000 0.134 0.000 3/35640 340.0 1.083 1.332 1.243 0.000 0.131 0.000 3/35640 350.0 1.055 1.297 1.209 0.000 0.127 0.000 3/35640 360.0 1.028 1.263 1.176 0.000 0.124 0.000 3/35640 370.0 1.003 1.231 1.146 0.000 0.120 0.000 3/35640 380.0 0.978 1.201 1.117 0.000 0.117 0.000 3/35640 390.0 0.955 1.173 1.089 0.000 0.115 0.000 3/35640 400.0 0.933 1.145 1.063 0.000 0.112 0.000 3/35640 410.0 0.912 1.119 1.038 0.000 0.109 0.000 3/35640 420.0 0.892 1.094 1.014 0.000 0.107 0.000 3/35640 430.0 0.873 1.070 0.991 0.000 0.104 0.000 3/35640 440.0 0.854 1.047 0.969 0.000 0.102 0.000 3/35640 450.0 0.836 1.025 0.948 0.000 0.100 0.000 3/35640 460.0 0.819 1.004 0.928 0.000 0.098 0.000 3/35640 470.0 0.803 0.984 0.909 0.000 0.096 0.000 3/35640 480.0 0.787 0.965 0.891 0.000 0.094 0.000 3/35640 490.0 0.772 0.946 0.873 0.000 0.092 0.000 3/35640 500.0 0.758 0.928 0.856 0.000 0.090 0.000 3/35640 510.0 0.743 0.911 0.840 0.000 0.089 0.000 3/35640 520.0 0.730 0.894 0.824 0.000 0.087 0.000 3/35640 530.0 0.717 0.878 0.809 0.000 0.085 0.000 3/35640 540.0 0.704 0.862 0.794 0.000 0.084 0.000 3/35640 550.0 0.692 0.847 0.780 0.000 0.082 0.000 3/35640 560.0 0.680 0.833 0.766 0.000 0.081 0.000 3/35640 570.0 0.669 0.819 0.753 0.000 0.080 0.000 3/35640 580.0 0.658 0.805 0.740 0.000 0.078 0.000 3/35640 590.0 0.647 0.792 0.728 0.000 0.077 0.000 3/35640 600.0 0.637 0.779 0.716 0.000 0.076 0.000 3/35640 610.0 0.627 0.767 0.705 0.000 0.075 0.000 3/35640 620.0 0.617 0.755 0.694 0.000 0.073 0.000 3/35640 630.0 0.608 0.744 0.683 0.000 0.072 0.000 3/35640 640.0 0.599 0.732 0.672 0.000 0.071 0.000 3/35640 650.0 0.590 0.721 0.662 0.000 0.070 0.000 3/35640 660.0 0.581 0.711 0.652 0.000 0.069 0.000 3/35640 670.0 0.573 0.701 0.643 0.000 0.068 0.000 3/35640 680.0 0.565 0.691 0.633 0.000 0.067 0.000 3/35640 690.0 0.557 0.681 0.624 0.000 0.066 0.000 3/35640 700.0 0.549 0.671 0.616 0.000 0.065 0.000 3/35640 710.0 0.542 0.662 0.607 0.000 0.064 0.000 3/35640 720.0 0.534 0.653 0.599 0.000 0.063 0.000 3/35640 730.0 0.527 0.645 0.591 0.000 0.063 0.000 3/35640 740.0 0.520 0.636 0.583 0.000 0.062 0.000 3/35640 750.0 0.514 0.628 0.575 0.000 0.061 0.000 3/35640 760.0 0.507 0.620 0.568 0.000 0.060 0.000 3/35640 770.0 0.501 0.612 0.560 0.000 0.059 0.000 3/35640 780.0 0.494 0.604 0.553 0.000 0.059 0.000 3/35640 790.0 0.488 0.597 0.546 0.000 0.058 0.000 3/35640 800.0 0.482 0.590 0.540 0.000 0.057 0.000 3/35640 810.0 0.477 0.582 0.533 0.000 0.057 0.000 3/35640 820.0 0.471 0.575 0.527 0.000 0.056 0.000 3/35640 830.0 0.465 0.569 0.520 0.000 0.055 0.000 3/35640 840.0 0.460 0.562 0.514 0.000 0.055 0.000 3/35640 850.0 0.455 0.556 0.508 0.000 0.054 0.000 3/35640 860.0 0.449 0.549 0.502 0.000 0.053 0.000 3/35640 870.0 0.444 0.543 0.497 0.000 0.053 0.000 3/35640 880.0 0.439 0.537 0.491 0.000 0.052 0.000 3/35640 890.0 0.435 0.531 0.486 0.000 0.052 0.000 3/35640 900.0 0.430 0.525 0.480 0.000 0.051 0.000 3/35640 910.0 0.425 0.520 0.475 0.000 0.050 0.000 3/35640 920.0 0.421 0.514 0.470 0.000 0.050 0.000 3/35640 930.0 0.416 0.509 0.465 0.000 0.049 0.000 3/35640 940.0 0.412 0.503 0.460 0.000 0.049 0.000 3/35640 950.0 0.408 0.498 0.455 0.000 0.048 0.000 3/35640 960.0 0.404 0.493 0.451 0.000 0.048 0.000 3/35640 970.0 0.399 0.488 0.446 0.000 0.047 0.000 3/35640 980.0 0.395 0.483 0.441 0.000 0.047 0.000 3/35640 990.0 0.392 0.478 0.437 0.000 0.046 0.000 3/35640 1000.0 0.388 0.474 0.433 0.000 0.046 0.000 3/35640 Thermal conductivity related properties were written into "kappa-m1196.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 23:35:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|